USER MOD reduce.3.24.130724 H: found=0, std=0, add=590, rem=0, adj=15 USER MOD reduce.3.24.130724 removed 590 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 240 THR OG1 : rot -116:sc= 0.53 USER MOD Set 1.2: A 280 GLN : amide:sc= 0.379 X(o=0.91,f=0.8) USER MOD Single : A 239 THR OG1 : rot 140:sc= 0.168 USER MOD Single : A 242 TYR OH : rot 180:sc= 0 USER MOD Single : A 249 THR OG1 : rot -120:sc=-0.00812 USER MOD Single : A 251 THR OG1 : rot 180:sc= 0 USER MOD Single : A 253 THR OG1 : rot 180:sc= 0 USER MOD Single : A 257 ASN : amide:sc= -0.502 X(o=-0.5,f=-0.04) USER MOD Single : A 258 HIS : no HD1:sc= -6.71! C(o=-6.7!,f=-6.8!) USER MOD Single : A 260 TYR OH : rot 180:sc= 0 USER MOD Single : A 261 GLN : amide:sc= 0.433 K(o=0.43,f=-0.52) USER MOD Single : A 267 THR OG1 : rot 180:sc= -0.0133 USER MOD Single : A 269 THR OG1 : rot 180:sc= 0 USER MOD Single : A 272 GLN :FLIP amide:sc= -2.36! F(o=-3.1,f=-2.4!) USER MOD Single : A 274 GLN : amide:sc= 0 X(o=0,f=-0.18) USER MOD Single : A 275 GLN : amide:sc= -0.0479 K(o=-0.048,f=-1.5!) USER MOD Single : A 276 CYS SG : rot 121:sc= -0.0163 USER MOD Single : A 283 THR OG1 : rot 42:sc= 0.123 USER MOD Single : A 285 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 293 LYS NZ :NH3+ 171:sc= -1.75 (180deg=-1.95) USER MOD Single : A 294 SER OG : rot -155:sc= 0.82 USER MOD Single : A 296 ASN : amide:sc= -1.28 K(o=-1.3,f=-4.3!) USER MOD Single : A 297 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 301 ASN : amide:sc= -0.736 X(o=-0.74,f=-0.31) USER MOD Single : A 306 ASN : amide:sc= -0.175 X(o=-0.17,f=-0.022) USER MOD Single : A 308 LYS NZ :NH3+ 137:sc= 1.79 (180deg=0.51) USER MOD ----------------------------------------------------------------- ATOM 129 N ILE A 238 5.198 11.469 0.699 1.00 0.00 N ATOM 130 CA ILE A 238 5.120 10.067 1.089 1.00 0.00 C ATOM 131 C ILE A 238 4.697 9.192 -0.086 1.00 0.00 C ATOM 132 O ILE A 238 3.530 9.183 -0.480 1.00 0.00 O ATOM 133 CB ILE A 238 4.130 9.859 2.251 1.00 0.00 C ATOM 134 CG1 ILE A 238 4.454 10.815 3.401 1.00 0.00 C ATOM 135 CG2 ILE A 238 4.168 8.415 2.728 1.00 0.00 C ATOM 136 CD1 ILE A 238 3.772 10.447 4.701 1.00 0.00 C ATOM 0 HA ILE A 238 6.118 9.775 1.416 1.00 0.00 H new ATOM 0 HB ILE A 238 3.123 10.076 1.895 1.00 0.00 H new ATOM 0 HG12 ILE A 238 5.533 10.831 3.557 1.00 0.00 H new ATOM 0 HG13 ILE A 238 4.158 11.825 3.118 1.00 0.00 H new ATOM 0 HG21 ILE A 238 3.463 8.284 3.549 1.00 0.00 H new ATOM 0 HG22 ILE A 238 3.895 7.753 1.906 1.00 0.00 H new ATOM 0 HG23 ILE A 238 5.174 8.171 3.071 1.00 0.00 H new ATOM 0 HD11 ILE A 238 4.046 11.167 5.472 1.00 0.00 H new ATOM 0 HD12 ILE A 238 2.691 10.459 4.561 1.00 0.00 H new ATOM 0 HD13 ILE A 238 4.087 9.449 5.007 1.00 0.00 H new ATOM 148 N THR A 239 5.654 8.456 -0.643 1.00 0.00 N ATOM 149 CA THR A 239 5.381 7.577 -1.773 1.00 0.00 C ATOM 150 C THR A 239 5.187 6.136 -1.315 1.00 0.00 C ATOM 151 O THR A 239 5.647 5.198 -1.967 1.00 0.00 O ATOM 152 CB THR A 239 6.520 7.625 -2.810 1.00 0.00 C ATOM 153 OG1 THR A 239 7.721 7.090 -2.243 1.00 0.00 O ATOM 154 CG2 THR A 239 6.765 9.051 -3.278 1.00 0.00 C ATOM 0 H THR A 239 6.625 8.451 -0.330 1.00 0.00 H new ATOM 0 HA THR A 239 4.462 7.935 -2.237 1.00 0.00 H new ATOM 0 HB THR A 239 6.225 7.023 -3.670 1.00 0.00 H new ATOM 0 HG1 THR A 239 8.183 6.543 -2.912 1.00 0.00 H new ATOM 0 HG21 THR A 239 7.573 9.060 -4.009 1.00 0.00 H new ATOM 0 HG22 THR A 239 5.857 9.445 -3.735 1.00 0.00 H new ATOM 0 HG23 THR A 239 7.040 9.672 -2.425 1.00 0.00 H new ATOM 162 N THR A 240 4.502 5.965 -0.188 1.00 0.00 N ATOM 163 CA THR A 240 4.248 4.638 0.358 1.00 0.00 C ATOM 164 C THR A 240 2.825 4.527 0.893 1.00 0.00 C ATOM 165 O THR A 240 2.311 5.457 1.517 1.00 0.00 O ATOM 166 CB THR A 240 5.237 4.296 1.488 1.00 0.00 C ATOM 167 OG1 THR A 240 6.578 4.571 1.065 1.00 0.00 O ATOM 168 CG2 THR A 240 5.117 2.834 1.888 1.00 0.00 C ATOM 0 H THR A 240 4.113 6.730 0.364 1.00 0.00 H new ATOM 0 HA THR A 240 4.383 3.929 -0.459 1.00 0.00 H new ATOM 0 HB THR A 240 4.994 4.914 2.352 1.00 0.00 H new ATOM 0 HG1 THR A 240 7.091 3.737 1.042 1.00 0.00 H new ATOM 0 HG21 THR A 240 5.825 2.616 2.687 1.00 0.00 H new ATOM 0 HG22 THR A 240 4.104 2.634 2.236 1.00 0.00 H new ATOM 0 HG23 THR A 240 5.336 2.202 1.027 1.00 0.00 H new ATOM 176 N LEU A 241 2.192 3.385 0.648 1.00 0.00 N ATOM 177 CA LEU A 241 0.827 3.153 1.107 1.00 0.00 C ATOM 178 C LEU A 241 0.737 1.862 1.914 1.00 0.00 C ATOM 179 O LEU A 241 1.534 0.943 1.726 1.00 0.00 O ATOM 180 CB LEU A 241 -0.129 3.090 -0.086 1.00 0.00 C ATOM 181 CG LEU A 241 -0.506 4.432 -0.715 1.00 0.00 C ATOM 182 CD1 LEU A 241 -1.192 4.220 -2.055 1.00 0.00 C ATOM 183 CD2 LEU A 241 -1.401 5.229 0.224 1.00 0.00 C ATOM 0 H LEU A 241 2.602 2.605 0.134 1.00 0.00 H new ATOM 0 HA LEU A 241 0.540 3.984 1.751 1.00 0.00 H new ATOM 0 HB2 LEU A 241 0.323 2.465 -0.856 1.00 0.00 H new ATOM 0 HB3 LEU A 241 -1.044 2.591 0.233 1.00 0.00 H new ATOM 0 HG LEU A 241 0.408 5.001 -0.884 1.00 0.00 H new ATOM 0 HD11 LEU A 241 -1.453 5.186 -2.487 1.00 0.00 H new ATOM 0 HD12 LEU A 241 -0.518 3.691 -2.729 1.00 0.00 H new ATOM 0 HD13 LEU A 241 -2.098 3.631 -1.911 1.00 0.00 H new ATOM 0 HD21 LEU A 241 -1.659 6.181 -0.240 1.00 0.00 H new ATOM 0 HD22 LEU A 241 -2.312 4.665 0.425 1.00 0.00 H new ATOM 0 HD23 LEU A 241 -0.874 5.413 1.160 1.00 0.00 H new ATOM 195 N TYR A 242 -0.241 1.798 2.811 1.00 0.00 N ATOM 196 CA TYR A 242 -0.436 0.620 3.647 1.00 0.00 C ATOM 197 C TYR A 242 -1.643 -0.187 3.178 1.00 0.00 C ATOM 198 O TYR A 242 -2.631 0.372 2.701 1.00 0.00 O ATOM 199 CB TYR A 242 -0.619 1.031 5.109 1.00 0.00 C ATOM 200 CG TYR A 242 -1.461 0.062 5.909 1.00 0.00 C ATOM 201 CD1 TYR A 242 -2.846 0.061 5.802 1.00 0.00 C ATOM 202 CD2 TYR A 242 -0.870 -0.853 6.772 1.00 0.00 C ATOM 203 CE1 TYR A 242 -3.618 -0.822 6.532 1.00 0.00 C ATOM 204 CE2 TYR A 242 -1.634 -1.741 7.504 1.00 0.00 C ATOM 205 CZ TYR A 242 -3.008 -1.721 7.381 1.00 0.00 C ATOM 206 OH TYR A 242 -3.773 -2.603 8.109 1.00 0.00 O ATOM 0 H TYR A 242 -0.911 2.549 2.978 1.00 0.00 H new ATOM 0 HA TYR A 242 0.452 -0.006 3.561 1.00 0.00 H new ATOM 0 HB2 TYR A 242 0.361 1.121 5.578 1.00 0.00 H new ATOM 0 HB3 TYR A 242 -1.082 2.017 5.145 1.00 0.00 H new ATOM 0 HD1 TYR A 242 -3.327 0.762 5.137 1.00 0.00 H new ATOM 0 HD2 TYR A 242 0.205 -0.870 6.872 1.00 0.00 H new ATOM 0 HE1 TYR A 242 -4.694 -0.808 6.438 1.00 0.00 H new ATOM 0 HE2 TYR A 242 -1.158 -2.447 8.169 1.00 0.00 H new ATOM 0 HH TYR A 242 -3.189 -3.168 8.657 1.00 0.00 H new ATOM 216 N VAL A 243 -1.556 -1.506 3.319 1.00 0.00 N ATOM 217 CA VAL A 243 -2.641 -2.391 2.912 1.00 0.00 C ATOM 218 C VAL A 243 -2.794 -3.556 3.884 1.00 0.00 C ATOM 219 O VAL A 243 -1.854 -4.318 4.109 1.00 0.00 O ATOM 220 CB VAL A 243 -2.411 -2.947 1.494 1.00 0.00 C ATOM 221 CG1 VAL A 243 -3.496 -3.948 1.130 1.00 0.00 C ATOM 222 CG2 VAL A 243 -2.356 -1.814 0.481 1.00 0.00 C ATOM 0 H VAL A 243 -0.746 -1.985 3.712 1.00 0.00 H new ATOM 0 HA VAL A 243 -3.554 -1.795 2.917 1.00 0.00 H new ATOM 0 HB VAL A 243 -1.453 -3.466 1.477 1.00 0.00 H new ATOM 0 HG11 VAL A 243 -3.317 -4.330 0.125 1.00 0.00 H new ATOM 0 HG12 VAL A 243 -3.481 -4.775 1.840 1.00 0.00 H new ATOM 0 HG13 VAL A 243 -4.469 -3.458 1.164 1.00 0.00 H new ATOM 0 HG21 VAL A 243 -2.193 -2.224 -0.515 1.00 0.00 H new ATOM 0 HG22 VAL A 243 -3.297 -1.265 0.498 1.00 0.00 H new ATOM 0 HG23 VAL A 243 -1.538 -1.139 0.734 1.00 0.00 H new ATOM 232 N GLY A 244 -3.985 -3.688 4.459 1.00 0.00 N ATOM 233 CA GLY A 244 -4.240 -4.762 5.401 1.00 0.00 C ATOM 234 C GLY A 244 -5.278 -5.744 4.894 1.00 0.00 C ATOM 235 O GLY A 244 -5.896 -5.522 3.853 1.00 0.00 O ATOM 0 H GLY A 244 -4.778 -3.070 4.289 1.00 0.00 H new ATOM 0 HA2 GLY A 244 -3.310 -5.293 5.602 1.00 0.00 H new ATOM 0 HA3 GLY A 244 -4.577 -4.339 6.347 1.00 0.00 H new ATOM 239 N GLY A 245 -5.470 -6.834 5.631 1.00 0.00 N ATOM 240 CA GLY A 245 -6.439 -7.837 5.233 1.00 0.00 C ATOM 241 C GLY A 245 -5.974 -8.654 4.044 1.00 0.00 C ATOM 242 O GLY A 245 -6.770 -9.004 3.171 1.00 0.00 O ATOM 0 H GLY A 245 -4.971 -7.040 6.497 1.00 0.00 H new ATOM 0 HA2 GLY A 245 -6.634 -8.503 6.074 1.00 0.00 H new ATOM 0 HA3 GLY A 245 -7.382 -7.349 4.988 1.00 0.00 H new ATOM 246 N LEU A 246 -4.681 -8.957 4.006 1.00 0.00 N ATOM 247 CA LEU A 246 -4.110 -9.737 2.914 1.00 0.00 C ATOM 248 C LEU A 246 -4.576 -11.188 2.979 1.00 0.00 C ATOM 249 O LEU A 246 -5.243 -11.678 2.069 1.00 0.00 O ATOM 250 CB LEU A 246 -2.582 -9.677 2.963 1.00 0.00 C ATOM 251 CG LEU A 246 -1.957 -8.299 2.744 1.00 0.00 C ATOM 252 CD1 LEU A 246 -0.441 -8.404 2.685 1.00 0.00 C ATOM 253 CD2 LEU A 246 -2.500 -7.663 1.473 1.00 0.00 C ATOM 0 H LEU A 246 -4.008 -8.674 4.719 1.00 0.00 H new ATOM 0 HA LEU A 246 -4.454 -9.306 1.974 1.00 0.00 H new ATOM 0 HB2 LEU A 246 -2.255 -10.052 3.933 1.00 0.00 H new ATOM 0 HB3 LEU A 246 -2.187 -10.357 2.208 1.00 0.00 H new ATOM 0 HG LEU A 246 -2.224 -7.662 3.587 1.00 0.00 H new ATOM 0 HD11 LEU A 246 -0.013 -7.414 2.529 1.00 0.00 H new ATOM 0 HD12 LEU A 246 -0.068 -8.816 3.623 1.00 0.00 H new ATOM 0 HD13 LEU A 246 -0.153 -9.057 1.861 1.00 0.00 H new ATOM 0 HD21 LEU A 246 -2.044 -6.683 1.333 1.00 0.00 H new ATOM 0 HD22 LEU A 246 -2.264 -8.298 0.619 1.00 0.00 H new ATOM 0 HD23 LEU A 246 -3.581 -7.552 1.555 1.00 0.00 H new ATOM 265 N GLY A 247 -4.220 -11.871 4.063 1.00 0.00 N ATOM 266 CA GLY A 247 -4.612 -13.258 4.228 1.00 0.00 C ATOM 267 C GLY A 247 -4.052 -14.152 3.139 1.00 0.00 C ATOM 268 O GLY A 247 -3.740 -13.686 2.043 1.00 0.00 O ATOM 0 H GLY A 247 -3.667 -11.488 4.830 1.00 0.00 H new ATOM 0 HA2 GLY A 247 -4.270 -13.616 5.199 1.00 0.00 H new ATOM 0 HA3 GLY A 247 -5.700 -13.328 4.227 1.00 0.00 H new ATOM 272 N ASP A 248 -3.922 -15.439 3.441 1.00 0.00 N ATOM 273 CA ASP A 248 -3.395 -16.401 2.480 1.00 0.00 C ATOM 274 C ASP A 248 -4.067 -16.235 1.121 1.00 0.00 C ATOM 275 O ASP A 248 -3.462 -16.497 0.080 1.00 0.00 O ATOM 276 CB ASP A 248 -3.596 -17.828 2.991 1.00 0.00 C ATOM 277 CG ASP A 248 -2.756 -18.838 2.235 1.00 0.00 C ATOM 278 OD1 ASP A 248 -2.659 -18.720 0.995 1.00 0.00 O ATOM 279 OD2 ASP A 248 -2.195 -19.746 2.882 1.00 0.00 O ATOM 0 H ASP A 248 -4.174 -15.840 4.344 1.00 0.00 H new ATOM 0 HA ASP A 248 -2.328 -16.213 2.363 1.00 0.00 H new ATOM 0 HB2 ASP A 248 -3.343 -17.870 4.050 1.00 0.00 H new ATOM 0 HB3 ASP A 248 -4.649 -18.097 2.903 1.00 0.00 H new ATOM 284 N THR A 249 -5.322 -15.797 1.136 1.00 0.00 N ATOM 285 CA THR A 249 -6.077 -15.598 -0.094 1.00 0.00 C ATOM 286 C THR A 249 -5.373 -14.612 -1.018 1.00 0.00 C ATOM 287 O THR A 249 -5.290 -14.831 -2.227 1.00 0.00 O ATOM 288 CB THR A 249 -7.500 -15.085 0.197 1.00 0.00 C ATOM 289 OG1 THR A 249 -7.437 -13.848 0.916 1.00 0.00 O ATOM 290 CG2 THR A 249 -8.290 -16.106 1.002 1.00 0.00 C ATOM 0 H THR A 249 -5.837 -15.573 1.988 1.00 0.00 H new ATOM 0 HA THR A 249 -6.142 -16.569 -0.585 1.00 0.00 H new ATOM 0 HB THR A 249 -8.007 -14.926 -0.755 1.00 0.00 H new ATOM 0 HG1 THR A 249 -7.889 -13.948 1.780 1.00 0.00 H new ATOM 0 HG21 THR A 249 -9.291 -15.721 1.195 1.00 0.00 H new ATOM 0 HG22 THR A 249 -8.361 -17.037 0.439 1.00 0.00 H new ATOM 0 HG23 THR A 249 -7.784 -16.293 1.949 1.00 0.00 H new ATOM 298 N ILE A 250 -4.866 -13.527 -0.442 1.00 0.00 N ATOM 299 CA ILE A 250 -4.166 -12.509 -1.215 1.00 0.00 C ATOM 300 C ILE A 250 -2.656 -12.635 -1.052 1.00 0.00 C ATOM 301 O ILE A 250 -2.162 -12.961 0.028 1.00 0.00 O ATOM 302 CB ILE A 250 -4.600 -11.090 -0.800 1.00 0.00 C ATOM 303 CG1 ILE A 250 -6.120 -10.947 -0.901 1.00 0.00 C ATOM 304 CG2 ILE A 250 -3.905 -10.049 -1.666 1.00 0.00 C ATOM 305 CD1 ILE A 250 -6.651 -9.679 -0.271 1.00 0.00 C ATOM 0 H ILE A 250 -4.927 -13.331 0.557 1.00 0.00 H new ATOM 0 HA ILE A 250 -4.430 -12.670 -2.260 1.00 0.00 H new ATOM 0 HB ILE A 250 -4.307 -10.925 0.237 1.00 0.00 H new ATOM 0 HG12 ILE A 250 -6.410 -10.970 -1.951 1.00 0.00 H new ATOM 0 HG13 ILE A 250 -6.590 -11.806 -0.422 1.00 0.00 H new ATOM 0 HG21 ILE A 250 -4.222 -9.052 -1.361 1.00 0.00 H new ATOM 0 HG22 ILE A 250 -2.825 -10.139 -1.547 1.00 0.00 H new ATOM 0 HG23 ILE A 250 -4.170 -10.210 -2.711 1.00 0.00 H new ATOM 0 HD11 ILE A 250 -7.735 -9.645 -0.380 1.00 0.00 H new ATOM 0 HD12 ILE A 250 -6.392 -9.663 0.788 1.00 0.00 H new ATOM 0 HD13 ILE A 250 -6.209 -8.814 -0.766 1.00 0.00 H new ATOM 317 N THR A 251 -1.925 -12.373 -2.131 1.00 0.00 N ATOM 318 CA THR A 251 -0.470 -12.456 -2.107 1.00 0.00 C ATOM 319 C THR A 251 0.164 -11.122 -2.483 1.00 0.00 C ATOM 320 O THR A 251 -0.536 -10.135 -2.711 1.00 0.00 O ATOM 321 CB THR A 251 0.046 -13.545 -3.067 1.00 0.00 C ATOM 322 OG1 THR A 251 -0.159 -13.138 -4.425 1.00 0.00 O ATOM 323 CG2 THR A 251 -0.662 -14.868 -2.816 1.00 0.00 C ATOM 0 H THR A 251 -2.317 -12.101 -3.033 1.00 0.00 H new ATOM 0 HA THR A 251 -0.185 -12.715 -1.087 1.00 0.00 H new ATOM 0 HB THR A 251 1.112 -13.682 -2.886 1.00 0.00 H new ATOM 0 HG1 THR A 251 0.173 -13.835 -5.029 1.00 0.00 H new ATOM 0 HG21 THR A 251 -0.281 -15.621 -3.506 1.00 0.00 H new ATOM 0 HG22 THR A 251 -0.480 -15.189 -1.791 1.00 0.00 H new ATOM 0 HG23 THR A 251 -1.734 -14.743 -2.972 1.00 0.00 H new ATOM 331 N GLU A 252 1.491 -11.099 -2.547 1.00 0.00 N ATOM 332 CA GLU A 252 2.218 -9.884 -2.896 1.00 0.00 C ATOM 333 C GLU A 252 2.011 -9.529 -4.365 1.00 0.00 C ATOM 334 O GLU A 252 1.636 -8.404 -4.698 1.00 0.00 O ATOM 335 CB GLU A 252 3.711 -10.055 -2.607 1.00 0.00 C ATOM 336 CG GLU A 252 4.545 -8.840 -2.975 1.00 0.00 C ATOM 337 CD GLU A 252 5.989 -8.966 -2.528 1.00 0.00 C ATOM 338 OE1 GLU A 252 6.244 -9.701 -1.551 1.00 0.00 O ATOM 339 OE2 GLU A 252 6.862 -8.331 -3.154 1.00 0.00 O ATOM 0 H GLU A 252 2.085 -11.907 -2.362 1.00 0.00 H new ATOM 0 HA GLU A 252 1.828 -9.070 -2.285 1.00 0.00 H new ATOM 0 HB2 GLU A 252 3.845 -10.270 -1.547 1.00 0.00 H new ATOM 0 HB3 GLU A 252 4.082 -10.920 -3.157 1.00 0.00 H new ATOM 0 HG2 GLU A 252 4.514 -8.696 -4.055 1.00 0.00 H new ATOM 0 HG3 GLU A 252 4.105 -7.951 -2.523 1.00 0.00 H new ATOM 346 N THR A 253 2.258 -10.497 -5.242 1.00 0.00 N ATOM 347 CA THR A 253 2.101 -10.287 -6.676 1.00 0.00 C ATOM 348 C THR A 253 0.755 -9.645 -6.994 1.00 0.00 C ATOM 349 O THR A 253 0.693 -8.599 -7.639 1.00 0.00 O ATOM 350 CB THR A 253 2.221 -11.611 -7.454 1.00 0.00 C ATOM 351 OG1 THR A 253 3.503 -12.204 -7.217 1.00 0.00 O ATOM 352 CG2 THR A 253 2.031 -11.382 -8.946 1.00 0.00 C ATOM 0 H THR A 253 2.568 -11.434 -4.984 1.00 0.00 H new ATOM 0 HA THR A 253 2.903 -9.617 -6.987 1.00 0.00 H new ATOM 0 HB THR A 253 1.439 -12.284 -7.104 1.00 0.00 H new ATOM 0 HG1 THR A 253 3.571 -13.046 -7.714 1.00 0.00 H new ATOM 0 HG21 THR A 253 2.120 -12.331 -9.474 1.00 0.00 H new ATOM 0 HG22 THR A 253 1.043 -10.958 -9.126 1.00 0.00 H new ATOM 0 HG23 THR A 253 2.793 -10.692 -9.308 1.00 0.00 H new ATOM 360 N ASP A 254 -0.320 -10.277 -6.536 1.00 0.00 N ATOM 361 CA ASP A 254 -1.665 -9.766 -6.770 1.00 0.00 C ATOM 362 C ASP A 254 -1.703 -8.248 -6.624 1.00 0.00 C ATOM 363 O ASP A 254 -2.297 -7.549 -7.445 1.00 0.00 O ATOM 364 CB ASP A 254 -2.655 -10.409 -5.797 1.00 0.00 C ATOM 365 CG ASP A 254 -3.230 -11.707 -6.331 1.00 0.00 C ATOM 366 OD1 ASP A 254 -2.570 -12.345 -7.178 1.00 0.00 O ATOM 367 OD2 ASP A 254 -4.340 -12.084 -5.900 1.00 0.00 O ATOM 0 H ASP A 254 -0.286 -11.144 -6.000 1.00 0.00 H new ATOM 0 HA ASP A 254 -1.951 -10.022 -7.790 1.00 0.00 H new ATOM 0 HB2 ASP A 254 -2.155 -10.600 -4.847 1.00 0.00 H new ATOM 0 HB3 ASP A 254 -3.467 -9.711 -5.595 1.00 0.00 H new ATOM 372 N LEU A 255 -1.066 -7.745 -5.572 1.00 0.00 N ATOM 373 CA LEU A 255 -1.027 -6.309 -5.317 1.00 0.00 C ATOM 374 C LEU A 255 -0.057 -5.613 -6.267 1.00 0.00 C ATOM 375 O LEU A 255 -0.446 -4.724 -7.025 1.00 0.00 O ATOM 376 CB LEU A 255 -0.620 -6.040 -3.867 1.00 0.00 C ATOM 377 CG LEU A 255 -1.362 -6.846 -2.801 1.00 0.00 C ATOM 378 CD1 LEU A 255 -0.654 -6.737 -1.460 1.00 0.00 C ATOM 379 CD2 LEU A 255 -2.804 -6.374 -2.684 1.00 0.00 C ATOM 0 H LEU A 255 -0.570 -8.310 -4.882 1.00 0.00 H new ATOM 0 HA LEU A 255 -2.026 -5.907 -5.489 1.00 0.00 H new ATOM 0 HB2 LEU A 255 0.447 -6.239 -3.767 1.00 0.00 H new ATOM 0 HB3 LEU A 255 -0.767 -4.980 -3.660 1.00 0.00 H new ATOM 0 HG LEU A 255 -1.366 -7.894 -3.102 1.00 0.00 H new ATOM 0 HD11 LEU A 255 -1.197 -7.317 -0.714 1.00 0.00 H new ATOM 0 HD12 LEU A 255 0.361 -7.123 -1.552 1.00 0.00 H new ATOM 0 HD13 LEU A 255 -0.618 -5.692 -1.151 1.00 0.00 H new ATOM 0 HD21 LEU A 255 -3.317 -6.959 -1.921 1.00 0.00 H new ATOM 0 HD22 LEU A 255 -2.820 -5.320 -2.406 1.00 0.00 H new ATOM 0 HD23 LEU A 255 -3.308 -6.505 -3.641 1.00 0.00 H new ATOM 391 N ARG A 256 1.206 -6.024 -6.221 1.00 0.00 N ATOM 392 CA ARG A 256 2.231 -5.441 -7.079 1.00 0.00 C ATOM 393 C ARG A 256 1.661 -5.102 -8.453 1.00 0.00 C ATOM 394 O ARG A 256 1.952 -4.046 -9.012 1.00 0.00 O ATOM 395 CB ARG A 256 3.410 -6.404 -7.227 1.00 0.00 C ATOM 396 CG ARG A 256 4.561 -5.836 -8.041 1.00 0.00 C ATOM 397 CD ARG A 256 5.378 -6.939 -8.696 1.00 0.00 C ATOM 398 NE ARG A 256 6.347 -7.524 -7.773 1.00 0.00 N ATOM 399 CZ ARG A 256 7.524 -6.972 -7.497 1.00 0.00 C ATOM 400 NH1 ARG A 256 7.874 -5.828 -8.068 1.00 0.00 N ATOM 401 NH2 ARG A 256 8.352 -7.565 -6.646 1.00 0.00 N ATOM 0 H ARG A 256 1.544 -6.758 -5.599 1.00 0.00 H new ATOM 0 HA ARG A 256 2.580 -4.520 -6.612 1.00 0.00 H new ATOM 0 HB2 ARG A 256 3.775 -6.673 -6.236 1.00 0.00 H new ATOM 0 HB3 ARG A 256 3.061 -7.323 -7.699 1.00 0.00 H new ATOM 0 HG2 ARG A 256 4.170 -5.167 -8.808 1.00 0.00 H new ATOM 0 HG3 ARG A 256 5.205 -5.239 -7.395 1.00 0.00 H new ATOM 0 HD2 ARG A 256 4.709 -7.718 -9.061 1.00 0.00 H new ATOM 0 HD3 ARG A 256 5.901 -6.536 -9.563 1.00 0.00 H new ATOM 0 HE ARG A 256 6.107 -8.404 -7.316 1.00 0.00 H new ATOM 0 HH11 ARG A 256 7.239 -5.369 -8.721 1.00 0.00 H new ATOM 0 HH12 ARG A 256 8.778 -5.407 -7.854 1.00 0.00 H new ATOM 0 HH21 ARG A 256 8.085 -8.445 -6.204 1.00 0.00 H new ATOM 0 HH22 ARG A 256 9.255 -7.141 -6.434 1.00 0.00 H new ATOM 415 N ASN A 257 0.849 -6.006 -8.991 1.00 0.00 N ATOM 416 CA ASN A 257 0.240 -5.803 -10.300 1.00 0.00 C ATOM 417 C ASN A 257 -0.945 -4.846 -10.207 1.00 0.00 C ATOM 418 O ASN A 257 -1.139 -3.994 -11.075 1.00 0.00 O ATOM 419 CB ASN A 257 -0.216 -7.140 -10.887 1.00 0.00 C ATOM 420 CG ASN A 257 0.921 -7.902 -11.541 1.00 0.00 C ATOM 421 OD1 ASN A 257 1.554 -7.412 -12.476 1.00 0.00 O ATOM 422 ND2 ASN A 257 1.184 -9.108 -11.051 1.00 0.00 N ATOM 0 H ASN A 257 0.598 -6.886 -8.541 1.00 0.00 H new ATOM 0 HA ASN A 257 0.990 -5.362 -10.957 1.00 0.00 H new ATOM 0 HB2 ASN A 257 -0.652 -7.751 -10.097 1.00 0.00 H new ATOM 0 HB3 ASN A 257 -1.001 -6.962 -11.622 1.00 0.00 H new ATOM 0 HD21 ASN A 257 1.937 -9.668 -11.451 1.00 0.00 H new ATOM 0 HD22 ASN A 257 0.633 -9.474 -10.275 1.00 0.00 H new ATOM 429 N HIS A 258 -1.734 -4.991 -9.147 1.00 0.00 N ATOM 430 CA HIS A 258 -2.899 -4.139 -8.939 1.00 0.00 C ATOM 431 C HIS A 258 -2.490 -2.672 -8.848 1.00 0.00 C ATOM 432 O HIS A 258 -3.194 -1.789 -9.339 1.00 0.00 O ATOM 433 CB HIS A 258 -3.639 -4.554 -7.667 1.00 0.00 C ATOM 434 CG HIS A 258 -4.616 -3.528 -7.181 1.00 0.00 C ATOM 435 ND1 HIS A 258 -5.977 -3.633 -7.376 1.00 0.00 N ATOM 436 CD2 HIS A 258 -4.423 -2.372 -6.503 1.00 0.00 C ATOM 437 CE1 HIS A 258 -6.579 -2.585 -6.841 1.00 0.00 C ATOM 438 NE2 HIS A 258 -5.658 -1.805 -6.304 1.00 0.00 N ATOM 0 H HIS A 258 -1.588 -5.690 -8.419 1.00 0.00 H new ATOM 0 HA HIS A 258 -3.564 -4.260 -9.794 1.00 0.00 H new ATOM 0 HB2 HIS A 258 -4.168 -5.489 -7.853 1.00 0.00 H new ATOM 0 HB3 HIS A 258 -2.910 -4.751 -6.881 1.00 0.00 H new ATOM 0 HD2 HIS A 258 -3.474 -1.970 -6.179 1.00 0.00 H new ATOM 0 HE1 HIS A 258 -7.643 -2.398 -6.843 1.00 0.00 H new ATOM 0 HE2 HIS A 258 -5.835 -0.925 -5.820 1.00 0.00 H new ATOM 446 N PHE A 259 -1.348 -2.419 -8.217 1.00 0.00 N ATOM 447 CA PHE A 259 -0.846 -1.059 -8.061 1.00 0.00 C ATOM 448 C PHE A 259 0.049 -0.671 -9.234 1.00 0.00 C ATOM 449 O PHE A 259 0.008 0.463 -9.712 1.00 0.00 O ATOM 450 CB PHE A 259 -0.072 -0.926 -6.748 1.00 0.00 C ATOM 451 CG PHE A 259 -0.951 -0.925 -5.530 1.00 0.00 C ATOM 452 CD1 PHE A 259 -1.580 0.238 -5.115 1.00 0.00 C ATOM 453 CD2 PHE A 259 -1.149 -2.087 -4.802 1.00 0.00 C ATOM 454 CE1 PHE A 259 -2.389 0.241 -3.994 1.00 0.00 C ATOM 455 CE2 PHE A 259 -1.958 -2.089 -3.681 1.00 0.00 C ATOM 456 CZ PHE A 259 -2.579 -0.924 -3.277 1.00 0.00 C ATOM 0 H PHE A 259 -0.753 -3.138 -7.806 1.00 0.00 H new ATOM 0 HA PHE A 259 -1.701 -0.383 -8.041 1.00 0.00 H new ATOM 0 HB2 PHE A 259 0.641 -1.747 -6.671 1.00 0.00 H new ATOM 0 HB3 PHE A 259 0.507 -0.003 -6.769 1.00 0.00 H new ATOM 0 HD1 PHE A 259 -1.437 1.151 -5.673 1.00 0.00 H new ATOM 0 HD2 PHE A 259 -0.666 -3.001 -5.114 1.00 0.00 H new ATOM 0 HE1 PHE A 259 -2.872 1.154 -3.679 1.00 0.00 H new ATOM 0 HE2 PHE A 259 -2.104 -3.001 -3.122 1.00 0.00 H new ATOM 0 HZ PHE A 259 -3.212 -0.924 -2.402 1.00 0.00 H new ATOM 466 N TYR A 260 0.857 -1.620 -9.692 1.00 0.00 N ATOM 467 CA TYR A 260 1.765 -1.378 -10.807 1.00 0.00 C ATOM 468 C TYR A 260 1.056 -0.636 -11.936 1.00 0.00 C ATOM 469 O TYR A 260 1.697 -0.001 -12.773 1.00 0.00 O ATOM 470 CB TYR A 260 2.330 -2.701 -11.328 1.00 0.00 C ATOM 471 CG TYR A 260 2.592 -2.703 -12.817 1.00 0.00 C ATOM 472 CD1 TYR A 260 3.699 -2.052 -13.349 1.00 0.00 C ATOM 473 CD2 TYR A 260 1.733 -3.355 -13.693 1.00 0.00 C ATOM 474 CE1 TYR A 260 3.942 -2.050 -14.708 1.00 0.00 C ATOM 475 CE2 TYR A 260 1.969 -3.360 -15.054 1.00 0.00 C ATOM 476 CZ TYR A 260 3.075 -2.706 -15.557 1.00 0.00 C ATOM 477 OH TYR A 260 3.313 -2.707 -16.912 1.00 0.00 O ATOM 0 H TYR A 260 0.902 -2.564 -9.309 1.00 0.00 H new ATOM 0 HA TYR A 260 2.585 -0.757 -10.446 1.00 0.00 H new ATOM 0 HB2 TYR A 260 3.260 -2.921 -10.804 1.00 0.00 H new ATOM 0 HB3 TYR A 260 1.632 -3.504 -11.089 1.00 0.00 H new ATOM 0 HD1 TYR A 260 4.381 -1.539 -12.687 1.00 0.00 H new ATOM 0 HD2 TYR A 260 0.866 -3.867 -13.303 1.00 0.00 H new ATOM 0 HE1 TYR A 260 4.806 -1.538 -15.104 1.00 0.00 H new ATOM 0 HE2 TYR A 260 1.292 -3.873 -15.721 1.00 0.00 H new ATOM 0 HH TYR A 260 2.609 -3.214 -17.367 1.00 0.00 H new ATOM 487 N GLN A 261 -0.270 -0.721 -11.950 1.00 0.00 N ATOM 488 CA GLN A 261 -1.067 -0.058 -12.975 1.00 0.00 C ATOM 489 C GLN A 261 -1.022 1.457 -12.804 1.00 0.00 C ATOM 490 O GLN A 261 -0.881 2.198 -13.777 1.00 0.00 O ATOM 491 CB GLN A 261 -2.516 -0.546 -12.920 1.00 0.00 C ATOM 492 CG GLN A 261 -3.319 0.059 -11.781 1.00 0.00 C ATOM 493 CD GLN A 261 -4.762 -0.406 -11.772 1.00 0.00 C ATOM 494 OE1 GLN A 261 -5.432 -0.406 -12.805 1.00 0.00 O ATOM 495 NE2 GLN A 261 -5.248 -0.807 -10.603 1.00 0.00 N ATOM 0 H GLN A 261 -0.815 -1.242 -11.263 1.00 0.00 H new ATOM 0 HA GLN A 261 -0.643 -0.309 -13.947 1.00 0.00 H new ATOM 0 HB2 GLN A 261 -3.006 -0.310 -13.864 1.00 0.00 H new ATOM 0 HB3 GLN A 261 -2.521 -1.631 -12.821 1.00 0.00 H new ATOM 0 HG2 GLN A 261 -2.851 -0.203 -10.832 1.00 0.00 H new ATOM 0 HG3 GLN A 261 -3.292 1.146 -11.860 1.00 0.00 H new ATOM 0 HE21 GLN A 261 -4.657 -0.790 -9.772 1.00 0.00 H new ATOM 0 HE22 GLN A 261 -6.213 -1.132 -10.536 1.00 0.00 H new ATOM 504 N PHE A 262 -1.143 1.911 -11.561 1.00 0.00 N ATOM 505 CA PHE A 262 -1.117 3.338 -11.262 1.00 0.00 C ATOM 506 C PHE A 262 0.215 3.957 -11.676 1.00 0.00 C ATOM 507 O PHE A 262 0.257 5.048 -12.241 1.00 0.00 O ATOM 508 CB PHE A 262 -1.360 3.573 -9.770 1.00 0.00 C ATOM 509 CG PHE A 262 -2.745 3.202 -9.323 1.00 0.00 C ATOM 510 CD1 PHE A 262 -3.067 1.884 -9.043 1.00 0.00 C ATOM 511 CD2 PHE A 262 -3.725 4.172 -9.181 1.00 0.00 C ATOM 512 CE1 PHE A 262 -4.341 1.540 -8.632 1.00 0.00 C ATOM 513 CE2 PHE A 262 -5.000 3.834 -8.770 1.00 0.00 C ATOM 514 CZ PHE A 262 -5.308 2.516 -8.494 1.00 0.00 C ATOM 0 H PHE A 262 -1.260 1.311 -10.744 1.00 0.00 H new ATOM 0 HA PHE A 262 -1.913 3.817 -11.832 1.00 0.00 H new ATOM 0 HB2 PHE A 262 -0.635 2.996 -9.197 1.00 0.00 H new ATOM 0 HB3 PHE A 262 -1.183 4.624 -9.542 1.00 0.00 H new ATOM 0 HD1 PHE A 262 -2.314 1.117 -9.147 1.00 0.00 H new ATOM 0 HD2 PHE A 262 -3.489 5.204 -9.394 1.00 0.00 H new ATOM 0 HE1 PHE A 262 -4.580 0.509 -8.419 1.00 0.00 H new ATOM 0 HE2 PHE A 262 -5.755 4.599 -8.665 1.00 0.00 H new ATOM 0 HZ PHE A 262 -6.303 2.249 -8.171 1.00 0.00 H new ATOM 524 N GLY A 263 1.304 3.249 -11.387 1.00 0.00 N ATOM 525 CA GLY A 263 2.623 3.744 -11.735 1.00 0.00 C ATOM 526 C GLY A 263 3.727 2.792 -11.320 1.00 0.00 C ATOM 527 O GLY A 263 3.465 1.640 -10.974 1.00 0.00 O ATOM 0 H GLY A 263 1.296 2.343 -10.919 1.00 0.00 H new ATOM 0 HA2 GLY A 263 2.674 3.908 -12.811 1.00 0.00 H new ATOM 0 HA3 GLY A 263 2.783 4.711 -11.258 1.00 0.00 H new ATOM 531 N GLU A 264 4.966 3.272 -11.357 1.00 0.00 N ATOM 532 CA GLU A 264 6.114 2.454 -10.984 1.00 0.00 C ATOM 533 C GLU A 264 6.146 2.215 -9.477 1.00 0.00 C ATOM 534 O GLU A 264 6.034 3.153 -8.687 1.00 0.00 O ATOM 535 CB GLU A 264 7.414 3.124 -11.433 1.00 0.00 C ATOM 536 CG GLU A 264 8.664 2.369 -11.014 1.00 0.00 C ATOM 537 CD GLU A 264 9.931 2.970 -11.592 1.00 0.00 C ATOM 538 OE1 GLU A 264 10.036 4.214 -11.624 1.00 0.00 O ATOM 539 OE2 GLU A 264 10.816 2.196 -12.012 1.00 0.00 O ATOM 0 H GLU A 264 5.200 4.223 -11.641 1.00 0.00 H new ATOM 0 HA GLU A 264 6.019 1.491 -11.485 1.00 0.00 H new ATOM 0 HB2 GLU A 264 7.406 3.223 -12.519 1.00 0.00 H new ATOM 0 HB3 GLU A 264 7.454 4.133 -11.022 1.00 0.00 H new ATOM 0 HG2 GLU A 264 8.733 2.363 -9.926 1.00 0.00 H new ATOM 0 HG3 GLU A 264 8.581 1.330 -11.334 1.00 0.00 H new ATOM 546 N ILE A 265 6.298 0.954 -9.087 1.00 0.00 N ATOM 547 CA ILE A 265 6.344 0.592 -7.676 1.00 0.00 C ATOM 548 C ILE A 265 7.783 0.426 -7.198 1.00 0.00 C ATOM 549 O ILE A 265 8.480 -0.503 -7.607 1.00 0.00 O ATOM 550 CB ILE A 265 5.571 -0.711 -7.403 1.00 0.00 C ATOM 551 CG1 ILE A 265 4.131 -0.590 -7.905 1.00 0.00 C ATOM 552 CG2 ILE A 265 5.594 -1.040 -5.918 1.00 0.00 C ATOM 553 CD1 ILE A 265 3.399 -1.913 -7.967 1.00 0.00 C ATOM 0 H ILE A 265 6.391 0.166 -9.728 1.00 0.00 H new ATOM 0 HA ILE A 265 5.872 1.406 -7.126 1.00 0.00 H new ATOM 0 HB ILE A 265 6.057 -1.524 -7.943 1.00 0.00 H new ATOM 0 HG12 ILE A 265 3.583 0.089 -7.252 1.00 0.00 H new ATOM 0 HG13 ILE A 265 4.138 -0.141 -8.898 1.00 0.00 H new ATOM 0 HG21 ILE A 265 5.043 -1.964 -5.741 1.00 0.00 H new ATOM 0 HG22 ILE A 265 6.626 -1.164 -5.589 1.00 0.00 H new ATOM 0 HG23 ILE A 265 5.130 -0.228 -5.358 1.00 0.00 H new ATOM 0 HD11 ILE A 265 2.385 -1.751 -8.331 1.00 0.00 H new ATOM 0 HD12 ILE A 265 3.924 -2.588 -8.643 1.00 0.00 H new ATOM 0 HD13 ILE A 265 3.361 -2.355 -6.971 1.00 0.00 H new ATOM 565 N ARG A 266 8.221 1.331 -6.329 1.00 0.00 N ATOM 566 CA ARG A 266 9.576 1.284 -5.795 1.00 0.00 C ATOM 567 C ARG A 266 9.847 -0.055 -5.115 1.00 0.00 C ATOM 568 O ARG A 266 10.862 -0.702 -5.376 1.00 0.00 O ATOM 569 CB ARG A 266 9.795 2.426 -4.800 1.00 0.00 C ATOM 570 CG ARG A 266 10.357 3.688 -5.436 1.00 0.00 C ATOM 571 CD ARG A 266 11.255 4.445 -4.470 1.00 0.00 C ATOM 572 NE ARG A 266 12.651 4.032 -4.584 1.00 0.00 N ATOM 573 CZ ARG A 266 13.428 4.342 -5.616 1.00 0.00 C ATOM 574 NH1 ARG A 266 12.947 5.065 -6.618 1.00 0.00 N ATOM 575 NH2 ARG A 266 14.689 3.930 -5.646 1.00 0.00 N ATOM 0 H ARG A 266 7.657 2.106 -5.980 1.00 0.00 H new ATOM 0 HA ARG A 266 10.271 1.397 -6.627 1.00 0.00 H new ATOM 0 HB2 ARG A 266 8.847 2.663 -4.318 1.00 0.00 H new ATOM 0 HB3 ARG A 266 10.475 2.090 -4.017 1.00 0.00 H new ATOM 0 HG2 ARG A 266 10.922 3.426 -6.330 1.00 0.00 H new ATOM 0 HG3 ARG A 266 9.538 4.333 -5.754 1.00 0.00 H new ATOM 0 HD2 ARG A 266 11.176 5.515 -4.664 1.00 0.00 H new ATOM 0 HD3 ARG A 266 10.910 4.280 -3.449 1.00 0.00 H new ATOM 0 HE ARG A 266 13.052 3.475 -3.830 1.00 0.00 H new ATOM 0 HH11 ARG A 266 11.979 5.384 -6.597 1.00 0.00 H new ATOM 0 HH12 ARG A 266 13.545 5.302 -7.409 1.00 0.00 H new ATOM 0 HH21 ARG A 266 15.063 3.375 -4.876 1.00 0.00 H new ATOM 0 HH22 ARG A 266 15.285 4.169 -6.439 1.00 0.00 H new ATOM 589 N THR A 267 8.933 -0.465 -4.241 1.00 0.00 N ATOM 590 CA THR A 267 9.073 -1.725 -3.523 1.00 0.00 C ATOM 591 C THR A 267 7.760 -2.133 -2.866 1.00 0.00 C ATOM 592 O THR A 267 6.816 -1.345 -2.803 1.00 0.00 O ATOM 593 CB THR A 267 10.169 -1.638 -2.443 1.00 0.00 C ATOM 594 OG1 THR A 267 10.562 -2.953 -2.037 1.00 0.00 O ATOM 595 CG2 THR A 267 9.677 -0.854 -1.236 1.00 0.00 C ATOM 0 H THR A 267 8.087 0.058 -4.014 1.00 0.00 H new ATOM 0 HA THR A 267 9.357 -2.477 -4.259 1.00 0.00 H new ATOM 0 HB THR A 267 11.028 -1.119 -2.868 1.00 0.00 H new ATOM 0 HG1 THR A 267 11.260 -2.889 -1.352 1.00 0.00 H new ATOM 0 HG21 THR A 267 10.467 -0.806 -0.487 1.00 0.00 H new ATOM 0 HG22 THR A 267 9.406 0.156 -1.544 1.00 0.00 H new ATOM 0 HG23 THR A 267 8.804 -1.350 -0.811 1.00 0.00 H new ATOM 603 N ILE A 268 7.706 -3.368 -2.378 1.00 0.00 N ATOM 604 CA ILE A 268 6.508 -3.879 -1.724 1.00 0.00 C ATOM 605 C ILE A 268 6.865 -4.801 -0.563 1.00 0.00 C ATOM 606 O ILE A 268 7.376 -5.903 -0.765 1.00 0.00 O ATOM 607 CB ILE A 268 5.609 -4.643 -2.713 1.00 0.00 C ATOM 608 CG1 ILE A 268 5.098 -3.700 -3.805 1.00 0.00 C ATOM 609 CG2 ILE A 268 4.445 -5.292 -1.979 1.00 0.00 C ATOM 610 CD1 ILE A 268 4.295 -4.399 -4.880 1.00 0.00 C ATOM 0 H ILE A 268 8.478 -4.033 -2.423 1.00 0.00 H new ATOM 0 HA ILE A 268 5.964 -3.014 -1.344 1.00 0.00 H new ATOM 0 HB ILE A 268 6.199 -5.429 -3.184 1.00 0.00 H new ATOM 0 HG12 ILE A 268 4.481 -2.927 -3.347 1.00 0.00 H new ATOM 0 HG13 ILE A 268 5.948 -3.197 -4.267 1.00 0.00 H new ATOM 0 HG21 ILE A 268 3.819 -5.828 -2.692 1.00 0.00 H new ATOM 0 HG22 ILE A 268 4.828 -5.991 -1.235 1.00 0.00 H new ATOM 0 HG23 ILE A 268 3.853 -4.523 -1.483 1.00 0.00 H new ATOM 0 HD11 ILE A 268 3.965 -3.670 -5.620 1.00 0.00 H new ATOM 0 HD12 ILE A 268 4.915 -5.153 -5.365 1.00 0.00 H new ATOM 0 HD13 ILE A 268 3.425 -4.878 -4.431 1.00 0.00 H new ATOM 622 N THR A 269 6.593 -4.343 0.655 1.00 0.00 N ATOM 623 CA THR A 269 6.885 -5.126 1.849 1.00 0.00 C ATOM 624 C THR A 269 5.627 -5.799 2.386 1.00 0.00 C ATOM 625 O THR A 269 4.797 -5.160 3.033 1.00 0.00 O ATOM 626 CB THR A 269 7.499 -4.251 2.958 1.00 0.00 C ATOM 627 OG1 THR A 269 8.583 -3.480 2.429 1.00 0.00 O ATOM 628 CG2 THR A 269 7.997 -5.110 4.111 1.00 0.00 C ATOM 0 H THR A 269 6.171 -3.433 0.840 1.00 0.00 H new ATOM 0 HA THR A 269 7.606 -5.890 1.558 1.00 0.00 H new ATOM 0 HB THR A 269 6.725 -3.581 3.332 1.00 0.00 H new ATOM 0 HG1 THR A 269 8.967 -2.925 3.140 1.00 0.00 H new ATOM 0 HG21 THR A 269 8.426 -4.470 4.882 1.00 0.00 H new ATOM 0 HG22 THR A 269 7.164 -5.675 4.530 1.00 0.00 H new ATOM 0 HG23 THR A 269 8.758 -5.801 3.748 1.00 0.00 H new ATOM 636 N VAL A 270 5.492 -7.093 2.116 1.00 0.00 N ATOM 637 CA VAL A 270 4.335 -7.853 2.574 1.00 0.00 C ATOM 638 C VAL A 270 4.640 -8.586 3.876 1.00 0.00 C ATOM 639 O VAL A 270 5.337 -9.601 3.882 1.00 0.00 O ATOM 640 CB VAL A 270 3.881 -8.877 1.517 1.00 0.00 C ATOM 641 CG1 VAL A 270 2.605 -9.575 1.962 1.00 0.00 C ATOM 642 CG2 VAL A 270 3.685 -8.198 0.169 1.00 0.00 C ATOM 0 H VAL A 270 6.170 -7.637 1.582 1.00 0.00 H new ATOM 0 HA VAL A 270 3.532 -7.135 2.743 1.00 0.00 H new ATOM 0 HB VAL A 270 4.660 -9.632 1.409 1.00 0.00 H new ATOM 0 HG11 VAL A 270 2.300 -10.295 1.202 1.00 0.00 H new ATOM 0 HG12 VAL A 270 2.784 -10.095 2.903 1.00 0.00 H new ATOM 0 HG13 VAL A 270 1.815 -8.836 2.100 1.00 0.00 H new ATOM 0 HG21 VAL A 270 3.364 -8.936 -0.567 1.00 0.00 H new ATOM 0 HG22 VAL A 270 2.925 -7.422 0.260 1.00 0.00 H new ATOM 0 HG23 VAL A 270 4.625 -7.750 -0.153 1.00 0.00 H new ATOM 652 N VAL A 271 4.113 -8.065 4.980 1.00 0.00 N ATOM 653 CA VAL A 271 4.327 -8.670 6.289 1.00 0.00 C ATOM 654 C VAL A 271 3.210 -9.651 6.630 1.00 0.00 C ATOM 655 O VAL A 271 2.128 -9.249 7.056 1.00 0.00 O ATOM 656 CB VAL A 271 4.412 -7.601 7.394 1.00 0.00 C ATOM 657 CG1 VAL A 271 4.598 -8.254 8.755 1.00 0.00 C ATOM 658 CG2 VAL A 271 5.540 -6.623 7.104 1.00 0.00 C ATOM 0 H VAL A 271 3.535 -7.225 4.993 1.00 0.00 H new ATOM 0 HA VAL A 271 5.275 -9.206 6.239 1.00 0.00 H new ATOM 0 HB VAL A 271 3.475 -7.044 7.410 1.00 0.00 H new ATOM 0 HG11 VAL A 271 4.656 -7.483 9.524 1.00 0.00 H new ATOM 0 HG12 VAL A 271 3.753 -8.910 8.962 1.00 0.00 H new ATOM 0 HG13 VAL A 271 5.519 -8.837 8.756 1.00 0.00 H new ATOM 0 HG21 VAL A 271 5.585 -5.875 7.895 1.00 0.00 H new ATOM 0 HG22 VAL A 271 6.486 -7.162 7.060 1.00 0.00 H new ATOM 0 HG23 VAL A 271 5.358 -6.130 6.149 1.00 0.00 H new ATOM 668 N GLN A 272 3.482 -10.938 6.440 1.00 0.00 N ATOM 669 CA GLN A 272 2.500 -11.976 6.728 1.00 0.00 C ATOM 670 C GLN A 272 2.092 -11.947 8.197 1.00 0.00 C ATOM 671 O GLN A 272 0.928 -12.167 8.533 1.00 0.00 O ATOM 672 CB GLN A 272 3.062 -13.353 6.369 1.00 0.00 C ATOM 673 CG GLN A 272 2.126 -14.500 6.713 1.00 0.00 C ATOM 674 CD GLN A 272 2.246 -14.938 8.159 1.00 0.00 C ATOM 675 OE1 GLN A 272 3.192 -15.829 8.432 1.00 0.00 O flip ATOM 676 NE2 GLN A 272 1.497 -14.480 9.023 1.00 0.00 N flip ATOM 0 H GLN A 272 4.374 -11.286 6.088 1.00 0.00 H new ATOM 0 HA GLN A 272 1.616 -11.783 6.121 1.00 0.00 H new ATOM 0 HB2 GLN A 272 3.280 -13.380 5.301 1.00 0.00 H new ATOM 0 HB3 GLN A 272 4.008 -13.498 6.891 1.00 0.00 H new ATOM 0 HG2 GLN A 272 1.098 -14.197 6.513 1.00 0.00 H new ATOM 0 HG3 GLN A 272 2.341 -15.347 6.062 1.00 0.00 H new ATOM 0 HE21 GLN A 272 0.783 -13.797 8.769 1.00 0.00 H new ATOM 0 HE22 GLN A 272 1.590 -14.784 9.992 1.00 0.00 H new ATOM 685 N ARG A 273 3.058 -11.676 9.069 1.00 0.00 N ATOM 686 CA ARG A 273 2.800 -11.620 10.503 1.00 0.00 C ATOM 687 C ARG A 273 1.693 -10.618 10.817 1.00 0.00 C ATOM 688 O ARG A 273 0.893 -10.829 11.728 1.00 0.00 O ATOM 689 CB ARG A 273 4.075 -11.242 11.258 1.00 0.00 C ATOM 690 CG ARG A 273 3.855 -11.000 12.742 1.00 0.00 C ATOM 691 CD ARG A 273 5.169 -10.757 13.468 1.00 0.00 C ATOM 692 NE ARG A 273 5.708 -9.428 13.193 1.00 0.00 N ATOM 693 CZ ARG A 273 6.729 -8.898 13.857 1.00 0.00 C ATOM 694 NH1 ARG A 273 7.318 -9.580 14.830 1.00 0.00 N ATOM 695 NH2 ARG A 273 7.163 -7.682 13.549 1.00 0.00 N ATOM 0 H ARG A 273 4.027 -11.492 8.807 1.00 0.00 H new ATOM 0 HA ARG A 273 2.474 -12.608 10.827 1.00 0.00 H new ATOM 0 HB2 ARG A 273 4.810 -12.037 11.133 1.00 0.00 H new ATOM 0 HB3 ARG A 273 4.499 -10.343 10.811 1.00 0.00 H new ATOM 0 HG2 ARG A 273 3.199 -10.141 12.878 1.00 0.00 H new ATOM 0 HG3 ARG A 273 3.349 -11.860 13.181 1.00 0.00 H new ATOM 0 HD2 ARG A 273 5.017 -10.872 14.541 1.00 0.00 H new ATOM 0 HD3 ARG A 273 5.895 -11.512 13.167 1.00 0.00 H new ATOM 0 HE ARG A 273 5.277 -8.877 12.451 1.00 0.00 H new ATOM 0 HH11 ARG A 273 6.987 -10.514 15.070 1.00 0.00 H new ATOM 0 HH12 ARG A 273 8.102 -9.170 15.338 1.00 0.00 H new ATOM 0 HH21 ARG A 273 6.712 -7.154 12.802 1.00 0.00 H new ATOM 0 HH22 ARG A 273 7.947 -7.276 14.060 1.00 0.00 H new ATOM 709 N GLN A 274 1.656 -9.527 10.058 1.00 0.00 N ATOM 710 CA GLN A 274 0.649 -8.492 10.257 1.00 0.00 C ATOM 711 C GLN A 274 -0.399 -8.532 9.150 1.00 0.00 C ATOM 712 O GLN A 274 -1.292 -7.687 9.098 1.00 0.00 O ATOM 713 CB GLN A 274 1.308 -7.112 10.303 1.00 0.00 C ATOM 714 CG GLN A 274 2.129 -6.872 11.560 1.00 0.00 C ATOM 715 CD GLN A 274 2.961 -5.607 11.480 1.00 0.00 C ATOM 716 OE1 GLN A 274 2.525 -4.598 10.925 1.00 0.00 O ATOM 717 NE2 GLN A 274 4.166 -5.655 12.036 1.00 0.00 N ATOM 0 H GLN A 274 2.312 -9.337 9.300 1.00 0.00 H new ATOM 0 HA GLN A 274 0.152 -8.681 11.209 1.00 0.00 H new ATOM 0 HB2 GLN A 274 1.952 -6.997 9.431 1.00 0.00 H new ATOM 0 HB3 GLN A 274 0.535 -6.347 10.232 1.00 0.00 H new ATOM 0 HG2 GLN A 274 1.461 -6.810 12.419 1.00 0.00 H new ATOM 0 HG3 GLN A 274 2.786 -7.725 11.729 1.00 0.00 H new ATOM 0 HE21 GLN A 274 4.487 -6.513 12.485 1.00 0.00 H new ATOM 0 HE22 GLN A 274 4.771 -4.834 12.014 1.00 0.00 H new ATOM 726 N GLN A 275 -0.282 -9.518 8.267 1.00 0.00 N ATOM 727 CA GLN A 275 -1.219 -9.666 7.160 1.00 0.00 C ATOM 728 C GLN A 275 -1.442 -8.334 6.453 1.00 0.00 C ATOM 729 O GLN A 275 -2.580 -7.938 6.196 1.00 0.00 O ATOM 730 CB GLN A 275 -2.554 -10.219 7.664 1.00 0.00 C ATOM 731 CG GLN A 275 -2.442 -11.598 8.293 1.00 0.00 C ATOM 732 CD GLN A 275 -3.687 -11.990 9.064 1.00 0.00 C ATOM 733 OE1 GLN A 275 -4.498 -11.139 9.431 1.00 0.00 O ATOM 734 NE2 GLN A 275 -3.846 -13.284 9.316 1.00 0.00 N ATOM 0 H GLN A 275 0.452 -10.226 8.296 1.00 0.00 H new ATOM 0 HA GLN A 275 -0.789 -10.368 6.445 1.00 0.00 H new ATOM 0 HB2 GLN A 275 -2.971 -9.528 8.396 1.00 0.00 H new ATOM 0 HB3 GLN A 275 -3.257 -10.264 6.832 1.00 0.00 H new ATOM 0 HG2 GLN A 275 -2.255 -12.335 7.512 1.00 0.00 H new ATOM 0 HG3 GLN A 275 -1.583 -11.619 8.963 1.00 0.00 H new ATOM 0 HE21 GLN A 275 -3.149 -13.956 8.993 1.00 0.00 H new ATOM 0 HE22 GLN A 275 -4.665 -13.606 9.832 1.00 0.00 H new ATOM 743 N CYS A 276 -0.349 -7.646 6.141 1.00 0.00 N ATOM 744 CA CYS A 276 -0.425 -6.356 5.464 1.00 0.00 C ATOM 745 C CYS A 276 0.666 -6.232 4.406 1.00 0.00 C ATOM 746 O CYS A 276 1.480 -7.138 4.230 1.00 0.00 O ATOM 747 CB CYS A 276 -0.302 -5.217 6.477 1.00 0.00 C ATOM 748 SG CYS A 276 1.403 -4.757 6.867 1.00 0.00 S ATOM 0 H CYS A 276 0.600 -7.960 6.346 1.00 0.00 H new ATOM 0 HA CYS A 276 -1.394 -6.290 4.970 1.00 0.00 H new ATOM 0 HB2 CYS A 276 -0.823 -4.342 6.089 1.00 0.00 H new ATOM 0 HB3 CYS A 276 -0.808 -5.507 7.398 1.00 0.00 H new ATOM 0 HG CYS A 276 1.594 -3.506 6.569 1.00 0.00 H new ATOM 754 N ALA A 277 0.676 -5.104 3.703 1.00 0.00 N ATOM 755 CA ALA A 277 1.668 -4.861 2.662 1.00 0.00 C ATOM 756 C ALA A 277 1.874 -3.367 2.438 1.00 0.00 C ATOM 757 O ALA A 277 0.918 -2.591 2.443 1.00 0.00 O ATOM 758 CB ALA A 277 1.248 -5.538 1.366 1.00 0.00 C ATOM 0 H ALA A 277 0.009 -4.344 3.835 1.00 0.00 H new ATOM 0 HA ALA A 277 2.616 -5.286 2.991 1.00 0.00 H new ATOM 0 HB1 ALA A 277 1.997 -5.349 0.597 1.00 0.00 H new ATOM 0 HB2 ALA A 277 1.159 -6.612 1.529 1.00 0.00 H new ATOM 0 HB3 ALA A 277 0.287 -5.139 1.042 1.00 0.00 H new ATOM 764 N PHE A 278 3.127 -2.970 2.243 1.00 0.00 N ATOM 765 CA PHE A 278 3.459 -1.568 2.019 1.00 0.00 C ATOM 766 C PHE A 278 3.936 -1.344 0.587 1.00 0.00 C ATOM 767 O PHE A 278 5.024 -1.779 0.209 1.00 0.00 O ATOM 768 CB PHE A 278 4.537 -1.114 3.004 1.00 0.00 C ATOM 769 CG PHE A 278 4.011 -0.841 4.385 1.00 0.00 C ATOM 770 CD1 PHE A 278 3.524 0.412 4.720 1.00 0.00 C ATOM 771 CD2 PHE A 278 4.005 -1.838 5.347 1.00 0.00 C ATOM 772 CE1 PHE A 278 3.039 0.665 5.990 1.00 0.00 C ATOM 773 CE2 PHE A 278 3.521 -1.591 6.618 1.00 0.00 C ATOM 774 CZ PHE A 278 3.038 -0.337 6.940 1.00 0.00 C ATOM 0 H PHE A 278 3.929 -3.600 2.236 1.00 0.00 H new ATOM 0 HA PHE A 278 2.557 -0.977 2.180 1.00 0.00 H new ATOM 0 HB2 PHE A 278 5.310 -1.880 3.063 1.00 0.00 H new ATOM 0 HB3 PHE A 278 5.012 -0.211 2.620 1.00 0.00 H new ATOM 0 HD1 PHE A 278 3.523 1.200 3.981 1.00 0.00 H new ATOM 0 HD2 PHE A 278 4.383 -2.819 5.101 1.00 0.00 H new ATOM 0 HE1 PHE A 278 2.661 1.646 6.239 1.00 0.00 H new ATOM 0 HE2 PHE A 278 3.520 -2.377 7.359 1.00 0.00 H new ATOM 0 HZ PHE A 278 2.660 -0.141 7.933 1.00 0.00 H new ATOM 784 N ILE A 279 3.114 -0.663 -0.205 1.00 0.00 N ATOM 785 CA ILE A 279 3.451 -0.381 -1.594 1.00 0.00 C ATOM 786 C ILE A 279 4.148 0.969 -1.728 1.00 0.00 C ATOM 787 O ILE A 279 3.639 1.988 -1.262 1.00 0.00 O ATOM 788 CB ILE A 279 2.199 -0.391 -2.491 1.00 0.00 C ATOM 789 CG1 ILE A 279 1.210 -1.455 -2.011 1.00 0.00 C ATOM 790 CG2 ILE A 279 2.588 -0.637 -3.941 1.00 0.00 C ATOM 791 CD1 ILE A 279 1.627 -2.867 -2.358 1.00 0.00 C ATOM 0 H ILE A 279 2.210 -0.297 0.092 1.00 0.00 H new ATOM 0 HA ILE A 279 4.128 -1.171 -1.920 1.00 0.00 H new ATOM 0 HB ILE A 279 1.715 0.584 -2.426 1.00 0.00 H new ATOM 0 HG12 ILE A 279 1.097 -1.373 -0.930 1.00 0.00 H new ATOM 0 HG13 ILE A 279 0.232 -1.255 -2.450 1.00 0.00 H new ATOM 0 HG21 ILE A 279 1.692 -0.641 -4.562 1.00 0.00 H new ATOM 0 HG22 ILE A 279 3.259 0.154 -4.277 1.00 0.00 H new ATOM 0 HG23 ILE A 279 3.092 -1.600 -4.024 1.00 0.00 H new ATOM 0 HD11 ILE A 279 0.880 -3.569 -1.987 1.00 0.00 H new ATOM 0 HD12 ILE A 279 1.712 -2.966 -3.440 1.00 0.00 H new ATOM 0 HD13 ILE A 279 2.590 -3.086 -1.897 1.00 0.00 H new ATOM 803 N GLN A 280 5.313 0.967 -2.367 1.00 0.00 N ATOM 804 CA GLN A 280 6.078 2.192 -2.563 1.00 0.00 C ATOM 805 C GLN A 280 6.146 2.562 -4.041 1.00 0.00 C ATOM 806 O GLN A 280 6.262 1.691 -4.904 1.00 0.00 O ATOM 807 CB GLN A 280 7.491 2.032 -2.000 1.00 0.00 C ATOM 808 CG GLN A 280 8.188 3.353 -1.719 1.00 0.00 C ATOM 809 CD GLN A 280 9.252 3.235 -0.645 1.00 0.00 C ATOM 810 OE1 GLN A 280 9.009 3.547 0.522 1.00 0.00 O ATOM 811 NE2 GLN A 280 10.438 2.783 -1.033 1.00 0.00 N ATOM 0 H GLN A 280 5.748 0.131 -2.758 1.00 0.00 H new ATOM 0 HA GLN A 280 5.571 2.996 -2.029 1.00 0.00 H new ATOM 0 HB2 GLN A 280 7.442 1.453 -1.078 1.00 0.00 H new ATOM 0 HB3 GLN A 280 8.091 1.457 -2.705 1.00 0.00 H new ATOM 0 HG2 GLN A 280 8.644 3.721 -2.638 1.00 0.00 H new ATOM 0 HG3 GLN A 280 7.448 4.092 -1.412 1.00 0.00 H new ATOM 0 HE21 GLN A 280 10.595 2.536 -2.010 1.00 0.00 H new ATOM 0 HE22 GLN A 280 11.192 2.682 -0.354 1.00 0.00 H new ATOM 820 N PHE A 281 6.073 3.858 -4.326 1.00 0.00 N ATOM 821 CA PHE A 281 6.125 4.342 -5.701 1.00 0.00 C ATOM 822 C PHE A 281 7.291 5.308 -5.893 1.00 0.00 C ATOM 823 O PHE A 281 7.689 6.010 -4.964 1.00 0.00 O ATOM 824 CB PHE A 281 4.811 5.031 -6.071 1.00 0.00 C ATOM 825 CG PHE A 281 3.618 4.120 -6.010 1.00 0.00 C ATOM 826 CD1 PHE A 281 2.927 3.940 -4.823 1.00 0.00 C ATOM 827 CD2 PHE A 281 3.189 3.443 -7.140 1.00 0.00 C ATOM 828 CE1 PHE A 281 1.829 3.103 -4.764 1.00 0.00 C ATOM 829 CE2 PHE A 281 2.092 2.604 -7.087 1.00 0.00 C ATOM 830 CZ PHE A 281 1.412 2.433 -5.898 1.00 0.00 C ATOM 0 H PHE A 281 5.978 4.592 -3.624 1.00 0.00 H new ATOM 0 HA PHE A 281 6.274 3.484 -6.357 1.00 0.00 H new ATOM 0 HB2 PHE A 281 4.650 5.873 -5.398 1.00 0.00 H new ATOM 0 HB3 PHE A 281 4.895 5.439 -7.078 1.00 0.00 H new ATOM 0 HD1 PHE A 281 3.250 4.460 -3.933 1.00 0.00 H new ATOM 0 HD2 PHE A 281 3.718 3.572 -8.073 1.00 0.00 H new ATOM 0 HE1 PHE A 281 1.298 2.973 -3.833 1.00 0.00 H new ATOM 0 HE2 PHE A 281 1.767 2.083 -7.975 1.00 0.00 H new ATOM 0 HZ PHE A 281 0.555 1.777 -5.854 1.00 0.00 H new ATOM 840 N ALA A 282 7.834 5.337 -7.106 1.00 0.00 N ATOM 841 CA ALA A 282 8.952 6.217 -7.421 1.00 0.00 C ATOM 842 C ALA A 282 8.512 7.677 -7.444 1.00 0.00 C ATOM 843 O ALA A 282 9.282 8.574 -7.100 1.00 0.00 O ATOM 844 CB ALA A 282 9.569 5.828 -8.757 1.00 0.00 C ATOM 0 H ALA A 282 7.517 4.761 -7.886 1.00 0.00 H new ATOM 0 HA ALA A 282 9.703 6.104 -6.639 1.00 0.00 H new ATOM 0 HB1 ALA A 282 10.403 6.493 -8.980 1.00 0.00 H new ATOM 0 HB2 ALA A 282 9.928 4.800 -8.706 1.00 0.00 H new ATOM 0 HB3 ALA A 282 8.818 5.911 -9.543 1.00 0.00 H new ATOM 850 N THR A 283 7.269 7.909 -7.854 1.00 0.00 N ATOM 851 CA THR A 283 6.727 9.261 -7.924 1.00 0.00 C ATOM 852 C THR A 283 5.408 9.364 -7.168 1.00 0.00 C ATOM 853 O THR A 283 4.427 8.708 -7.520 1.00 0.00 O ATOM 854 CB THR A 283 6.506 9.702 -9.383 1.00 0.00 C ATOM 855 OG1 THR A 283 5.850 8.661 -10.115 1.00 0.00 O ATOM 856 CG2 THR A 283 7.829 10.044 -10.051 1.00 0.00 C ATOM 0 H THR A 283 6.618 7.178 -8.143 1.00 0.00 H new ATOM 0 HA THR A 283 7.460 9.921 -7.460 1.00 0.00 H new ATOM 0 HB THR A 283 5.879 10.593 -9.379 1.00 0.00 H new ATOM 0 HG1 THR A 283 5.139 8.271 -9.564 1.00 0.00 H new ATOM 0 HG21 THR A 283 7.648 10.353 -11.081 1.00 0.00 H new ATOM 0 HG22 THR A 283 8.311 10.857 -9.508 1.00 0.00 H new ATOM 0 HG23 THR A 283 8.477 9.168 -10.044 1.00 0.00 H new ATOM 864 N ARG A 284 5.390 10.191 -6.128 1.00 0.00 N ATOM 865 CA ARG A 284 4.190 10.380 -5.322 1.00 0.00 C ATOM 866 C ARG A 284 2.939 10.358 -6.196 1.00 0.00 C ATOM 867 O ARG A 284 1.877 9.912 -5.763 1.00 0.00 O ATOM 868 CB ARG A 284 4.266 11.702 -4.556 1.00 0.00 C ATOM 869 CG ARG A 284 2.992 12.044 -3.802 1.00 0.00 C ATOM 870 CD ARG A 284 2.809 11.153 -2.583 1.00 0.00 C ATOM 871 NE ARG A 284 1.596 11.485 -1.840 1.00 0.00 N ATOM 872 CZ ARG A 284 1.469 12.573 -1.088 1.00 0.00 C ATOM 873 NH1 ARG A 284 2.476 13.430 -0.982 1.00 0.00 N ATOM 874 NH2 ARG A 284 0.334 12.806 -0.442 1.00 0.00 N ATOM 0 H ARG A 284 6.193 10.741 -5.824 1.00 0.00 H new ATOM 0 HA ARG A 284 4.129 9.558 -4.609 1.00 0.00 H new ATOM 0 HB2 ARG A 284 5.095 11.655 -3.849 1.00 0.00 H new ATOM 0 HB3 ARG A 284 4.490 12.506 -5.257 1.00 0.00 H new ATOM 0 HG2 ARG A 284 3.022 13.088 -3.490 1.00 0.00 H new ATOM 0 HG3 ARG A 284 2.135 11.934 -4.466 1.00 0.00 H new ATOM 0 HD2 ARG A 284 2.767 10.111 -2.899 1.00 0.00 H new ATOM 0 HD3 ARG A 284 3.674 11.253 -1.928 1.00 0.00 H new ATOM 0 HE ARG A 284 0.803 10.847 -1.902 1.00 0.00 H new ATOM 0 HH11 ARG A 284 3.350 13.254 -1.478 1.00 0.00 H new ATOM 0 HH12 ARG A 284 2.377 14.265 -0.404 1.00 0.00 H new ATOM 0 HH21 ARG A 284 -0.443 12.150 -0.522 1.00 0.00 H new ATOM 0 HH22 ARG A 284 0.238 13.642 0.135 1.00 0.00 H new ATOM 888 N GLN A 285 3.074 10.843 -7.426 1.00 0.00 N ATOM 889 CA GLN A 285 1.954 10.880 -8.359 1.00 0.00 C ATOM 890 C GLN A 285 1.106 9.618 -8.241 1.00 0.00 C ATOM 891 O GLN A 285 -0.039 9.668 -7.791 1.00 0.00 O ATOM 892 CB GLN A 285 2.464 11.034 -9.793 1.00 0.00 C ATOM 893 CG GLN A 285 1.392 11.482 -10.774 1.00 0.00 C ATOM 894 CD GLN A 285 1.681 11.042 -12.196 1.00 0.00 C ATOM 895 OE1 GLN A 285 2.172 11.822 -13.012 1.00 0.00 O ATOM 896 NE2 GLN A 285 1.379 9.785 -12.499 1.00 0.00 N ATOM 0 H GLN A 285 3.947 11.215 -7.799 1.00 0.00 H new ATOM 0 HA GLN A 285 1.331 11.739 -8.108 1.00 0.00 H new ATOM 0 HB2 GLN A 285 3.280 11.756 -9.804 1.00 0.00 H new ATOM 0 HB3 GLN A 285 2.876 10.082 -10.128 1.00 0.00 H new ATOM 0 HG2 GLN A 285 0.428 11.079 -10.462 1.00 0.00 H new ATOM 0 HG3 GLN A 285 1.308 12.568 -10.744 1.00 0.00 H new ATOM 0 HE21 GLN A 285 0.973 9.173 -11.791 1.00 0.00 H new ATOM 0 HE22 GLN A 285 1.553 9.431 -13.440 1.00 0.00 H new ATOM 905 N ALA A 286 1.674 8.488 -8.649 1.00 0.00 N ATOM 906 CA ALA A 286 0.970 7.214 -8.587 1.00 0.00 C ATOM 907 C ALA A 286 0.480 6.925 -7.173 1.00 0.00 C ATOM 908 O ALA A 286 -0.676 6.554 -6.970 1.00 0.00 O ATOM 909 CB ALA A 286 1.871 6.089 -9.075 1.00 0.00 C ATOM 0 H ALA A 286 2.620 8.429 -9.026 1.00 0.00 H new ATOM 0 HA ALA A 286 0.099 7.277 -9.239 1.00 0.00 H new ATOM 0 HB1 ALA A 286 1.332 5.143 -9.023 1.00 0.00 H new ATOM 0 HB2 ALA A 286 2.168 6.282 -10.106 1.00 0.00 H new ATOM 0 HB3 ALA A 286 2.759 6.035 -8.446 1.00 0.00 H new ATOM 915 N ALA A 287 1.366 7.097 -6.198 1.00 0.00 N ATOM 916 CA ALA A 287 1.022 6.856 -4.802 1.00 0.00 C ATOM 917 C ALA A 287 -0.344 7.443 -4.463 1.00 0.00 C ATOM 918 O ALA A 287 -1.222 6.744 -3.959 1.00 0.00 O ATOM 919 CB ALA A 287 2.090 7.438 -3.887 1.00 0.00 C ATOM 0 H ALA A 287 2.327 7.402 -6.349 1.00 0.00 H new ATOM 0 HA ALA A 287 0.974 5.778 -4.647 1.00 0.00 H new ATOM 0 HB1 ALA A 287 1.820 7.251 -2.848 1.00 0.00 H new ATOM 0 HB2 ALA A 287 3.050 6.968 -4.103 1.00 0.00 H new ATOM 0 HB3 ALA A 287 2.166 8.512 -4.054 1.00 0.00 H new ATOM 925 N GLU A 288 -0.515 8.731 -4.744 1.00 0.00 N ATOM 926 CA GLU A 288 -1.775 9.412 -4.467 1.00 0.00 C ATOM 927 C GLU A 288 -2.937 8.707 -5.160 1.00 0.00 C ATOM 928 O GLU A 288 -3.870 8.236 -4.509 1.00 0.00 O ATOM 929 CB GLU A 288 -1.703 10.870 -4.923 1.00 0.00 C ATOM 930 CG GLU A 288 -1.199 11.820 -3.849 1.00 0.00 C ATOM 931 CD GLU A 288 -1.664 13.247 -4.067 1.00 0.00 C ATOM 932 OE1 GLU A 288 -2.852 13.438 -4.401 1.00 0.00 O ATOM 933 OE2 GLU A 288 -0.840 14.171 -3.904 1.00 0.00 O ATOM 0 H GLU A 288 0.202 9.323 -5.163 1.00 0.00 H new ATOM 0 HA GLU A 288 -1.945 9.384 -3.391 1.00 0.00 H new ATOM 0 HB2 GLU A 288 -1.049 10.938 -5.792 1.00 0.00 H new ATOM 0 HB3 GLU A 288 -2.694 11.191 -5.244 1.00 0.00 H new ATOM 0 HG2 GLU A 288 -1.542 11.475 -2.874 1.00 0.00 H new ATOM 0 HG3 GLU A 288 -0.109 11.796 -3.830 1.00 0.00 H new ATOM 940 N VAL A 289 -2.875 8.640 -6.486 1.00 0.00 N ATOM 941 CA VAL A 289 -3.921 7.993 -7.269 1.00 0.00 C ATOM 942 C VAL A 289 -4.322 6.657 -6.653 1.00 0.00 C ATOM 943 O VAL A 289 -5.491 6.431 -6.343 1.00 0.00 O ATOM 944 CB VAL A 289 -3.471 7.760 -8.723 1.00 0.00 C ATOM 945 CG1 VAL A 289 -4.638 7.281 -9.574 1.00 0.00 C ATOM 946 CG2 VAL A 289 -2.864 9.029 -9.303 1.00 0.00 C ATOM 0 H VAL A 289 -2.111 9.026 -7.041 1.00 0.00 H new ATOM 0 HA VAL A 289 -4.780 8.664 -7.265 1.00 0.00 H new ATOM 0 HB VAL A 289 -2.706 6.983 -8.727 1.00 0.00 H new ATOM 0 HG11 VAL A 289 -4.300 7.122 -10.598 1.00 0.00 H new ATOM 0 HG12 VAL A 289 -5.023 6.345 -9.169 1.00 0.00 H new ATOM 0 HG13 VAL A 289 -5.427 8.032 -9.565 1.00 0.00 H new ATOM 0 HG21 VAL A 289 -2.552 8.846 -10.331 1.00 0.00 H new ATOM 0 HG22 VAL A 289 -3.605 9.828 -9.286 1.00 0.00 H new ATOM 0 HG23 VAL A 289 -2.000 9.324 -8.708 1.00 0.00 H new ATOM 956 N ALA A 290 -3.344 5.775 -6.477 1.00 0.00 N ATOM 957 CA ALA A 290 -3.594 4.462 -5.895 1.00 0.00 C ATOM 958 C ALA A 290 -4.211 4.586 -4.506 1.00 0.00 C ATOM 959 O ALA A 290 -5.073 3.794 -4.127 1.00 0.00 O ATOM 960 CB ALA A 290 -2.304 3.658 -5.833 1.00 0.00 C ATOM 0 H ALA A 290 -2.371 5.946 -6.729 1.00 0.00 H new ATOM 0 HA ALA A 290 -4.305 3.938 -6.534 1.00 0.00 H new ATOM 0 HB1 ALA A 290 -2.506 2.680 -5.396 1.00 0.00 H new ATOM 0 HB2 ALA A 290 -1.906 3.531 -6.840 1.00 0.00 H new ATOM 0 HB3 ALA A 290 -1.575 4.186 -5.219 1.00 0.00 H new ATOM 966 N ALA A 291 -3.762 5.584 -3.752 1.00 0.00 N ATOM 967 CA ALA A 291 -4.271 5.812 -2.405 1.00 0.00 C ATOM 968 C ALA A 291 -5.794 5.887 -2.399 1.00 0.00 C ATOM 969 O ALA A 291 -6.463 5.037 -1.812 1.00 0.00 O ATOM 970 CB ALA A 291 -3.676 7.086 -1.824 1.00 0.00 C ATOM 0 H ALA A 291 -3.047 6.247 -4.051 1.00 0.00 H new ATOM 0 HA ALA A 291 -3.972 4.968 -1.783 1.00 0.00 H new ATOM 0 HB1 ALA A 291 -4.065 7.243 -0.818 1.00 0.00 H new ATOM 0 HB2 ALA A 291 -2.591 6.995 -1.783 1.00 0.00 H new ATOM 0 HB3 ALA A 291 -3.946 7.934 -2.454 1.00 0.00 H new ATOM 976 N GLU A 292 -6.334 6.909 -3.055 1.00 0.00 N ATOM 977 CA GLU A 292 -7.779 7.095 -3.122 1.00 0.00 C ATOM 978 C GLU A 292 -8.460 5.855 -3.696 1.00 0.00 C ATOM 979 O GLU A 292 -9.530 5.452 -3.237 1.00 0.00 O ATOM 980 CB GLU A 292 -8.119 8.318 -3.976 1.00 0.00 C ATOM 981 CG GLU A 292 -8.065 9.629 -3.210 1.00 0.00 C ATOM 982 CD GLU A 292 -9.359 9.931 -2.479 1.00 0.00 C ATOM 983 OE1 GLU A 292 -9.991 8.981 -1.973 1.00 0.00 O ATOM 984 OE2 GLU A 292 -9.738 11.119 -2.412 1.00 0.00 O ATOM 0 H GLU A 292 -5.793 7.620 -3.547 1.00 0.00 H new ATOM 0 HA GLU A 292 -8.147 7.255 -2.109 1.00 0.00 H new ATOM 0 HB2 GLU A 292 -7.426 8.369 -4.816 1.00 0.00 H new ATOM 0 HB3 GLU A 292 -9.118 8.192 -4.394 1.00 0.00 H new ATOM 0 HG2 GLU A 292 -7.246 9.592 -2.491 1.00 0.00 H new ATOM 0 HG3 GLU A 292 -7.845 10.441 -3.903 1.00 0.00 H new ATOM 991 N LYS A 293 -7.834 5.255 -4.702 1.00 0.00 N ATOM 992 CA LYS A 293 -8.377 4.061 -5.339 1.00 0.00 C ATOM 993 C LYS A 293 -8.144 2.828 -4.472 1.00 0.00 C ATOM 994 O LYS A 293 -8.514 1.715 -4.847 1.00 0.00 O ATOM 995 CB LYS A 293 -7.740 3.858 -6.716 1.00 0.00 C ATOM 996 CG LYS A 293 -8.322 4.757 -7.794 1.00 0.00 C ATOM 997 CD LYS A 293 -8.284 4.088 -9.157 1.00 0.00 C ATOM 998 CE LYS A 293 -8.405 5.106 -10.281 1.00 0.00 C ATOM 999 NZ LYS A 293 -7.277 6.077 -10.274 1.00 0.00 N ATOM 0 H LYS A 293 -6.949 5.576 -5.094 1.00 0.00 H new ATOM 0 HA LYS A 293 -9.451 4.200 -5.460 1.00 0.00 H new ATOM 0 HB2 LYS A 293 -6.668 4.041 -6.642 1.00 0.00 H new ATOM 0 HB3 LYS A 293 -7.866 2.817 -7.015 1.00 0.00 H new ATOM 0 HG2 LYS A 293 -9.351 5.011 -7.541 1.00 0.00 H new ATOM 0 HG3 LYS A 293 -7.763 5.692 -7.831 1.00 0.00 H new ATOM 0 HD2 LYS A 293 -7.352 3.534 -9.266 1.00 0.00 H new ATOM 0 HD3 LYS A 293 -9.096 3.364 -9.231 1.00 0.00 H new ATOM 0 HE2 LYS A 293 -8.432 4.587 -11.239 1.00 0.00 H new ATOM 0 HE3 LYS A 293 -9.348 5.644 -10.184 1.00 0.00 H new ATOM 0 HZ1 LYS A 293 -7.312 6.655 -11.138 1.00 0.00 H new ATOM 0 HZ2 LYS A 293 -7.355 6.694 -9.441 1.00 0.00 H new ATOM 0 HZ3 LYS A 293 -6.375 5.561 -10.239 1.00 0.00 H new ATOM 1013 N SER A 294 -7.529 3.033 -3.312 1.00 0.00 N ATOM 1014 CA SER A 294 -7.245 1.937 -2.393 1.00 0.00 C ATOM 1015 C SER A 294 -7.969 2.140 -1.065 1.00 0.00 C ATOM 1016 O SER A 294 -8.299 1.177 -0.373 1.00 0.00 O ATOM 1017 CB SER A 294 -5.738 1.823 -2.153 1.00 0.00 C ATOM 1018 OG SER A 294 -5.122 1.027 -3.150 1.00 0.00 O ATOM 0 H SER A 294 -7.218 3.948 -2.986 1.00 0.00 H new ATOM 0 HA SER A 294 -7.605 1.013 -2.846 1.00 0.00 H new ATOM 0 HB2 SER A 294 -5.291 2.817 -2.149 1.00 0.00 H new ATOM 0 HB3 SER A 294 -5.555 1.387 -1.171 1.00 0.00 H new ATOM 0 HG SER A 294 -4.298 0.635 -2.793 1.00 0.00 H new ATOM 1024 N PHE A 295 -8.212 3.399 -0.717 1.00 0.00 N ATOM 1025 CA PHE A 295 -8.896 3.729 0.528 1.00 0.00 C ATOM 1026 C PHE A 295 -10.237 3.007 0.620 1.00 0.00 C ATOM 1027 O PHE A 295 -11.196 3.367 -0.061 1.00 0.00 O ATOM 1028 CB PHE A 295 -9.110 5.241 0.631 1.00 0.00 C ATOM 1029 CG PHE A 295 -7.954 5.969 1.255 1.00 0.00 C ATOM 1030 CD1 PHE A 295 -6.651 5.566 1.011 1.00 0.00 C ATOM 1031 CD2 PHE A 295 -8.170 7.056 2.086 1.00 0.00 C ATOM 1032 CE1 PHE A 295 -5.585 6.234 1.584 1.00 0.00 C ATOM 1033 CE2 PHE A 295 -7.108 7.728 2.661 1.00 0.00 C ATOM 1034 CZ PHE A 295 -5.814 7.316 2.410 1.00 0.00 C ATOM 0 H PHE A 295 -7.946 4.207 -1.279 1.00 0.00 H new ATOM 0 HA PHE A 295 -8.269 3.400 1.357 1.00 0.00 H new ATOM 0 HB2 PHE A 295 -9.287 5.644 -0.366 1.00 0.00 H new ATOM 0 HB3 PHE A 295 -10.009 5.434 1.216 1.00 0.00 H new ATOM 0 HD1 PHE A 295 -6.466 4.720 0.366 1.00 0.00 H new ATOM 0 HD2 PHE A 295 -9.180 7.382 2.287 1.00 0.00 H new ATOM 0 HE1 PHE A 295 -4.574 5.910 1.386 1.00 0.00 H new ATOM 0 HE2 PHE A 295 -7.290 8.575 3.306 1.00 0.00 H new ATOM 0 HZ PHE A 295 -4.983 7.839 2.859 1.00 0.00 H new ATOM 1044 N ASN A 296 -10.294 1.984 1.467 1.00 0.00 N ATOM 1045 CA ASN A 296 -11.516 1.209 1.648 1.00 0.00 C ATOM 1046 C ASN A 296 -12.189 0.933 0.307 1.00 0.00 C ATOM 1047 O ASN A 296 -13.402 0.735 0.237 1.00 0.00 O ATOM 1048 CB ASN A 296 -12.483 1.952 2.573 1.00 0.00 C ATOM 1049 CG ASN A 296 -13.526 1.032 3.177 1.00 0.00 C ATOM 1050 OD1 ASN A 296 -13.274 -0.154 3.394 1.00 0.00 O ATOM 1051 ND2 ASN A 296 -14.706 1.576 3.452 1.00 0.00 N ATOM 0 H ASN A 296 -9.509 1.673 2.038 1.00 0.00 H new ATOM 0 HA ASN A 296 -11.248 0.255 2.103 1.00 0.00 H new ATOM 0 HB2 ASN A 296 -11.920 2.433 3.373 1.00 0.00 H new ATOM 0 HB3 ASN A 296 -12.981 2.744 2.013 1.00 0.00 H new ATOM 0 HD21 ASN A 296 -15.448 1.007 3.860 1.00 0.00 H new ATOM 0 HD22 ASN A 296 -14.871 2.563 3.256 1.00 0.00 H new ATOM 1058 N LYS A 297 -11.393 0.921 -0.757 1.00 0.00 N ATOM 1059 CA LYS A 297 -11.909 0.667 -2.097 1.00 0.00 C ATOM 1060 C LYS A 297 -11.187 -0.511 -2.744 1.00 0.00 C ATOM 1061 O LYS A 297 -11.746 -1.200 -3.598 1.00 0.00 O ATOM 1062 CB LYS A 297 -11.756 1.915 -2.969 1.00 0.00 C ATOM 1063 CG LYS A 297 -12.364 1.768 -4.353 1.00 0.00 C ATOM 1064 CD LYS A 297 -12.191 3.034 -5.176 1.00 0.00 C ATOM 1065 CE LYS A 297 -12.252 2.742 -6.667 1.00 0.00 C ATOM 1066 NZ LYS A 297 -13.636 2.422 -7.114 1.00 0.00 N ATOM 0 H LYS A 297 -10.387 1.084 -0.717 1.00 0.00 H new ATOM 0 HA LYS A 297 -12.967 0.419 -2.011 1.00 0.00 H new ATOM 0 HB2 LYS A 297 -12.223 2.760 -2.464 1.00 0.00 H new ATOM 0 HB3 LYS A 297 -10.696 2.150 -3.070 1.00 0.00 H new ATOM 0 HG2 LYS A 297 -11.896 0.930 -4.870 1.00 0.00 H new ATOM 0 HG3 LYS A 297 -13.425 1.534 -4.262 1.00 0.00 H new ATOM 0 HD2 LYS A 297 -12.969 3.750 -4.912 1.00 0.00 H new ATOM 0 HD3 LYS A 297 -11.235 3.499 -4.934 1.00 0.00 H new ATOM 0 HE2 LYS A 297 -11.882 3.604 -7.221 1.00 0.00 H new ATOM 0 HE3 LYS A 297 -11.593 1.906 -6.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 297 -13.635 2.229 -8.136 1.00 0.00 H new ATOM 0 HZ2 LYS A 297 -13.980 1.584 -6.604 1.00 0.00 H new ATOM 0 HZ3 LYS A 297 -14.261 3.229 -6.915 1.00 0.00 H new ATOM 1080 N LEU A 298 -9.945 -0.736 -2.331 1.00 0.00 N ATOM 1081 CA LEU A 298 -9.147 -1.832 -2.869 1.00 0.00 C ATOM 1082 C LEU A 298 -9.681 -3.180 -2.393 1.00 0.00 C ATOM 1083 O LEU A 298 -9.414 -3.600 -1.266 1.00 0.00 O ATOM 1084 CB LEU A 298 -7.683 -1.675 -2.455 1.00 0.00 C ATOM 1085 CG LEU A 298 -6.833 -2.945 -2.501 1.00 0.00 C ATOM 1086 CD1 LEU A 298 -6.374 -3.229 -3.923 1.00 0.00 C ATOM 1087 CD2 LEU A 298 -5.637 -2.820 -1.567 1.00 0.00 C ATOM 0 H LEU A 298 -9.469 -0.174 -1.625 1.00 0.00 H new ATOM 0 HA LEU A 298 -9.216 -1.799 -3.956 1.00 0.00 H new ATOM 0 HB2 LEU A 298 -7.221 -0.929 -3.102 1.00 0.00 H new ATOM 0 HB3 LEU A 298 -7.654 -1.279 -1.440 1.00 0.00 H new ATOM 0 HG LEU A 298 -7.445 -3.782 -2.165 1.00 0.00 H new ATOM 0 HD11 LEU A 298 -5.770 -4.136 -3.936 1.00 0.00 H new ATOM 0 HD12 LEU A 298 -7.244 -3.362 -4.566 1.00 0.00 H new ATOM 0 HD13 LEU A 298 -5.778 -2.392 -4.287 1.00 0.00 H new ATOM 0 HD21 LEU A 298 -5.043 -3.733 -1.612 1.00 0.00 H new ATOM 0 HD22 LEU A 298 -5.024 -1.972 -1.873 1.00 0.00 H new ATOM 0 HD23 LEU A 298 -5.987 -2.665 -0.546 1.00 0.00 H new ATOM 1099 N ILE A 299 -10.433 -3.852 -3.258 1.00 0.00 N ATOM 1100 CA ILE A 299 -11.000 -5.153 -2.926 1.00 0.00 C ATOM 1101 C ILE A 299 -10.513 -6.228 -3.892 1.00 0.00 C ATOM 1102 O ILE A 299 -11.024 -6.356 -5.004 1.00 0.00 O ATOM 1103 CB ILE A 299 -12.540 -5.118 -2.949 1.00 0.00 C ATOM 1104 CG1 ILE A 299 -13.055 -3.895 -2.187 1.00 0.00 C ATOM 1105 CG2 ILE A 299 -13.107 -6.398 -2.353 1.00 0.00 C ATOM 1106 CD1 ILE A 299 -14.537 -3.652 -2.366 1.00 0.00 C ATOM 0 H ILE A 299 -10.664 -3.517 -4.193 1.00 0.00 H new ATOM 0 HA ILE A 299 -10.665 -5.395 -1.918 1.00 0.00 H new ATOM 0 HB ILE A 299 -12.872 -5.044 -3.984 1.00 0.00 H new ATOM 0 HG12 ILE A 299 -12.841 -4.022 -1.126 1.00 0.00 H new ATOM 0 HG13 ILE A 299 -12.508 -3.013 -2.519 1.00 0.00 H new ATOM 0 HG21 ILE A 299 -14.196 -6.359 -2.376 1.00 0.00 H new ATOM 0 HG22 ILE A 299 -12.762 -7.254 -2.934 1.00 0.00 H new ATOM 0 HG23 ILE A 299 -12.769 -6.500 -1.322 1.00 0.00 H new ATOM 0 HD11 ILE A 299 -14.832 -2.770 -1.798 1.00 0.00 H new ATOM 0 HD12 ILE A 299 -14.755 -3.493 -3.422 1.00 0.00 H new ATOM 0 HD13 ILE A 299 -15.094 -4.518 -2.007 1.00 0.00 H new ATOM 1118 N VAL A 300 -9.522 -7.000 -3.458 1.00 0.00 N ATOM 1119 CA VAL A 300 -8.967 -8.067 -4.283 1.00 0.00 C ATOM 1120 C VAL A 300 -9.430 -9.435 -3.796 1.00 0.00 C ATOM 1121 O VAL A 300 -9.489 -9.691 -2.595 1.00 0.00 O ATOM 1122 CB VAL A 300 -7.427 -8.030 -4.286 1.00 0.00 C ATOM 1123 CG1 VAL A 300 -6.868 -9.144 -5.157 1.00 0.00 C ATOM 1124 CG2 VAL A 300 -6.928 -6.672 -4.757 1.00 0.00 C ATOM 0 H VAL A 300 -9.087 -6.907 -2.540 1.00 0.00 H new ATOM 0 HA VAL A 300 -9.329 -7.904 -5.298 1.00 0.00 H new ATOM 0 HB VAL A 300 -7.075 -8.187 -3.267 1.00 0.00 H new ATOM 0 HG11 VAL A 300 -5.779 -9.102 -5.147 1.00 0.00 H new ATOM 0 HG12 VAL A 300 -7.198 -10.108 -4.770 1.00 0.00 H new ATOM 0 HG13 VAL A 300 -7.226 -9.021 -6.179 1.00 0.00 H new ATOM 0 HG21 VAL A 300 -5.838 -6.663 -4.753 1.00 0.00 H new ATOM 0 HG22 VAL A 300 -7.289 -6.482 -5.768 1.00 0.00 H new ATOM 0 HG23 VAL A 300 -7.299 -5.896 -4.088 1.00 0.00 H new ATOM 1134 N ASN A 301 -9.759 -10.312 -4.740 1.00 0.00 N ATOM 1135 CA ASN A 301 -10.218 -11.656 -4.407 1.00 0.00 C ATOM 1136 C ASN A 301 -11.494 -11.604 -3.573 1.00 0.00 C ATOM 1137 O ASN A 301 -11.620 -12.302 -2.568 1.00 0.00 O ATOM 1138 CB ASN A 301 -9.129 -12.416 -3.648 1.00 0.00 C ATOM 1139 CG ASN A 301 -8.036 -12.931 -4.564 1.00 0.00 C ATOM 1140 OD1 ASN A 301 -8.314 -13.543 -5.596 1.00 0.00 O ATOM 1141 ND2 ASN A 301 -6.786 -12.683 -4.191 1.00 0.00 N ATOM 0 H ASN A 301 -9.716 -10.116 -5.740 1.00 0.00 H new ATOM 0 HA ASN A 301 -10.435 -12.180 -5.338 1.00 0.00 H new ATOM 0 HB2 ASN A 301 -8.690 -11.761 -2.896 1.00 0.00 H new ATOM 0 HB3 ASN A 301 -9.579 -13.255 -3.117 1.00 0.00 H new ATOM 0 HD21 ASN A 301 -6.008 -13.003 -4.768 1.00 0.00 H new ATOM 0 HD22 ASN A 301 -6.603 -12.172 -3.327 1.00 0.00 H new ATOM 1148 N GLY A 302 -12.440 -10.771 -3.998 1.00 0.00 N ATOM 1149 CA GLY A 302 -13.694 -10.643 -3.279 1.00 0.00 C ATOM 1150 C GLY A 302 -13.492 -10.468 -1.787 1.00 0.00 C ATOM 1151 O GLY A 302 -14.291 -10.951 -0.985 1.00 0.00 O ATOM 0 H GLY A 302 -12.360 -10.183 -4.827 1.00 0.00 H new ATOM 0 HA2 GLY A 302 -14.248 -9.790 -3.670 1.00 0.00 H new ATOM 0 HA3 GLY A 302 -14.304 -11.528 -3.458 1.00 0.00 H new ATOM 1155 N ARG A 303 -12.420 -9.777 -1.414 1.00 0.00 N ATOM 1156 CA ARG A 303 -12.114 -9.542 -0.008 1.00 0.00 C ATOM 1157 C ARG A 303 -11.652 -8.105 0.215 1.00 0.00 C ATOM 1158 O ARG A 303 -10.533 -7.739 -0.144 1.00 0.00 O ATOM 1159 CB ARG A 303 -11.035 -10.516 0.471 1.00 0.00 C ATOM 1160 CG ARG A 303 -10.646 -10.326 1.928 1.00 0.00 C ATOM 1161 CD ARG A 303 -9.234 -10.821 2.196 1.00 0.00 C ATOM 1162 NE ARG A 303 -9.054 -11.235 3.585 1.00 0.00 N ATOM 1163 CZ ARG A 303 -9.394 -12.433 4.045 1.00 0.00 C ATOM 1164 NH1 ARG A 303 -9.929 -13.332 3.230 1.00 0.00 N ATOM 1165 NH2 ARG A 303 -9.199 -12.735 5.322 1.00 0.00 N ATOM 0 H ARG A 303 -11.749 -9.370 -2.066 1.00 0.00 H new ATOM 0 HA ARG A 303 -13.024 -9.707 0.568 1.00 0.00 H new ATOM 0 HB2 ARG A 303 -11.390 -11.537 0.329 1.00 0.00 H new ATOM 0 HB3 ARG A 303 -10.148 -10.397 -0.151 1.00 0.00 H new ATOM 0 HG2 ARG A 303 -10.719 -9.271 2.191 1.00 0.00 H new ATOM 0 HG3 ARG A 303 -11.348 -10.862 2.566 1.00 0.00 H new ATOM 0 HD2 ARG A 303 -9.012 -11.660 1.536 1.00 0.00 H new ATOM 0 HD3 ARG A 303 -8.522 -10.031 1.958 1.00 0.00 H new ATOM 0 HE ARG A 303 -8.644 -10.567 4.238 1.00 0.00 H new ATOM 0 HH11 ARG A 303 -10.080 -13.104 2.247 1.00 0.00 H new ATOM 0 HH12 ARG A 303 -10.189 -14.252 3.586 1.00 0.00 H new ATOM 0 HH21 ARG A 303 -8.787 -12.046 5.952 1.00 0.00 H new ATOM 0 HH22 ARG A 303 -9.461 -13.656 5.674 1.00 0.00 H new ATOM 1179 N ARG A 304 -12.523 -7.295 0.809 1.00 0.00 N ATOM 1180 CA ARG A 304 -12.205 -5.898 1.079 1.00 0.00 C ATOM 1181 C ARG A 304 -10.862 -5.773 1.791 1.00 0.00 C ATOM 1182 O ARG A 304 -10.454 -6.669 2.532 1.00 0.00 O ATOM 1183 CB ARG A 304 -13.306 -5.257 1.927 1.00 0.00 C ATOM 1184 CG ARG A 304 -13.335 -3.740 1.842 1.00 0.00 C ATOM 1185 CD ARG A 304 -14.368 -3.149 2.787 1.00 0.00 C ATOM 1186 NE ARG A 304 -15.733 -3.452 2.364 1.00 0.00 N ATOM 1187 CZ ARG A 304 -16.377 -4.564 2.699 1.00 0.00 C ATOM 1188 NH1 ARG A 304 -15.782 -5.475 3.458 1.00 0.00 N ATOM 1189 NH2 ARG A 304 -17.617 -4.768 2.275 1.00 0.00 N ATOM 0 H ARG A 304 -13.454 -7.582 1.112 1.00 0.00 H new ATOM 0 HA ARG A 304 -12.140 -5.376 0.125 1.00 0.00 H new ATOM 0 HB2 ARG A 304 -14.272 -5.649 1.609 1.00 0.00 H new ATOM 0 HB3 ARG A 304 -13.169 -5.552 2.968 1.00 0.00 H new ATOM 0 HG2 ARG A 304 -12.349 -3.342 2.084 1.00 0.00 H new ATOM 0 HG3 ARG A 304 -13.560 -3.436 0.820 1.00 0.00 H new ATOM 0 HD2 ARG A 304 -14.205 -3.538 3.792 1.00 0.00 H new ATOM 0 HD3 ARG A 304 -14.236 -2.068 2.839 1.00 0.00 H new ATOM 0 HE ARG A 304 -16.218 -2.772 1.779 1.00 0.00 H new ATOM 0 HH11 ARG A 304 -14.828 -5.322 3.785 1.00 0.00 H new ATOM 0 HH12 ARG A 304 -16.278 -6.328 3.714 1.00 0.00 H new ATOM 0 HH21 ARG A 304 -18.077 -4.070 1.691 1.00 0.00 H new ATOM 0 HH22 ARG A 304 -18.110 -5.623 2.533 1.00 0.00 H new ATOM 1203 N LEU A 305 -10.178 -4.658 1.562 1.00 0.00 N ATOM 1204 CA LEU A 305 -8.880 -4.415 2.182 1.00 0.00 C ATOM 1205 C LEU A 305 -8.790 -2.990 2.719 1.00 0.00 C ATOM 1206 O LEU A 305 -9.220 -2.042 2.064 1.00 0.00 O ATOM 1207 CB LEU A 305 -7.757 -4.663 1.173 1.00 0.00 C ATOM 1208 CG LEU A 305 -7.813 -5.993 0.420 1.00 0.00 C ATOM 1209 CD1 LEU A 305 -6.607 -6.140 -0.495 1.00 0.00 C ATOM 1210 CD2 LEU A 305 -7.888 -7.157 1.398 1.00 0.00 C ATOM 0 H LEU A 305 -10.500 -3.907 0.951 1.00 0.00 H new ATOM 0 HA LEU A 305 -8.770 -5.106 3.018 1.00 0.00 H new ATOM 0 HB2 LEU A 305 -7.767 -3.854 0.442 1.00 0.00 H new ATOM 0 HB3 LEU A 305 -6.804 -4.606 1.699 1.00 0.00 H new ATOM 0 HG LEU A 305 -8.713 -6.003 -0.195 1.00 0.00 H new ATOM 0 HD11 LEU A 305 -6.664 -7.092 -1.022 1.00 0.00 H new ATOM 0 HD12 LEU A 305 -6.598 -5.325 -1.218 1.00 0.00 H new ATOM 0 HD13 LEU A 305 -5.694 -6.109 0.099 1.00 0.00 H new ATOM 0 HD21 LEU A 305 -7.927 -8.095 0.845 1.00 0.00 H new ATOM 0 HD22 LEU A 305 -7.007 -7.151 2.039 1.00 0.00 H new ATOM 0 HD23 LEU A 305 -8.784 -7.060 2.011 1.00 0.00 H new ATOM 1222 N ASN A 306 -8.227 -2.848 3.914 1.00 0.00 N ATOM 1223 CA ASN A 306 -8.079 -1.539 4.539 1.00 0.00 C ATOM 1224 C ASN A 306 -6.744 -0.903 4.161 1.00 0.00 C ATOM 1225 O ASN A 306 -5.681 -1.392 4.545 1.00 0.00 O ATOM 1226 CB ASN A 306 -8.186 -1.661 6.060 1.00 0.00 C ATOM 1227 CG ASN A 306 -8.740 -0.405 6.704 1.00 0.00 C ATOM 1228 OD1 ASN A 306 -8.108 0.188 7.579 1.00 0.00 O ATOM 1229 ND2 ASN A 306 -9.926 0.008 6.272 1.00 0.00 N ATOM 0 H ASN A 306 -7.866 -3.624 4.469 1.00 0.00 H new ATOM 0 HA ASN A 306 -8.882 -0.898 4.176 1.00 0.00 H new ATOM 0 HB2 ASN A 306 -8.827 -2.507 6.310 1.00 0.00 H new ATOM 0 HB3 ASN A 306 -7.201 -1.874 6.475 1.00 0.00 H new ATOM 0 HD21 ASN A 306 -10.349 0.848 6.667 1.00 0.00 H new ATOM 0 HD22 ASN A 306 -10.414 -0.515 5.545 1.00 0.00 H new ATOM 1236 N VAL A 307 -6.808 0.189 3.407 1.00 0.00 N ATOM 1237 CA VAL A 307 -5.605 0.893 2.978 1.00 0.00 C ATOM 1238 C VAL A 307 -5.507 2.265 3.636 1.00 0.00 C ATOM 1239 O VAL A 307 -6.515 2.945 3.833 1.00 0.00 O ATOM 1240 CB VAL A 307 -5.570 1.066 1.448 1.00 0.00 C ATOM 1241 CG1 VAL A 307 -4.247 1.674 1.009 1.00 0.00 C ATOM 1242 CG2 VAL A 307 -5.810 -0.267 0.756 1.00 0.00 C ATOM 0 H VAL A 307 -7.680 0.606 3.080 1.00 0.00 H new ATOM 0 HA VAL A 307 -4.755 0.284 3.286 1.00 0.00 H new ATOM 0 HB VAL A 307 -6.369 1.749 1.159 1.00 0.00 H new ATOM 0 HG11 VAL A 307 -4.241 1.789 -0.075 1.00 0.00 H new ATOM 0 HG12 VAL A 307 -4.122 2.650 1.478 1.00 0.00 H new ATOM 0 HG13 VAL A 307 -3.428 1.020 1.309 1.00 0.00 H new ATOM 0 HG21 VAL A 307 -5.782 -0.126 -0.325 1.00 0.00 H new ATOM 0 HG22 VAL A 307 -5.035 -0.974 1.050 1.00 0.00 H new ATOM 0 HG23 VAL A 307 -6.786 -0.657 1.046 1.00 0.00 H new ATOM 1252 N LYS A 308 -4.287 2.668 3.974 1.00 0.00 N ATOM 1253 CA LYS A 308 -4.055 3.960 4.609 1.00 0.00 C ATOM 1254 C LYS A 308 -2.678 4.506 4.244 1.00 0.00 C ATOM 1255 O LYS A 308 -1.796 3.758 3.822 1.00 0.00 O ATOM 1256 CB LYS A 308 -4.180 3.834 6.129 1.00 0.00 C ATOM 1257 CG LYS A 308 -2.923 3.309 6.801 1.00 0.00 C ATOM 1258 CD LYS A 308 -3.064 3.294 8.313 1.00 0.00 C ATOM 1259 CE LYS A 308 -4.030 2.212 8.773 1.00 0.00 C ATOM 1260 NZ LYS A 308 -3.324 0.946 9.111 1.00 0.00 N ATOM 0 H LYS A 308 -3.442 2.118 3.819 1.00 0.00 H new ATOM 0 HA LYS A 308 -4.810 4.657 4.245 1.00 0.00 H new ATOM 0 HB2 LYS A 308 -4.425 4.810 6.547 1.00 0.00 H new ATOM 0 HB3 LYS A 308 -5.012 3.169 6.363 1.00 0.00 H new ATOM 0 HG2 LYS A 308 -2.713 2.301 6.444 1.00 0.00 H new ATOM 0 HG3 LYS A 308 -2.073 3.930 6.520 1.00 0.00 H new ATOM 0 HD2 LYS A 308 -2.088 3.129 8.769 1.00 0.00 H new ATOM 0 HD3 LYS A 308 -3.416 4.267 8.656 1.00 0.00 H new ATOM 0 HE2 LYS A 308 -4.581 2.564 9.645 1.00 0.00 H new ATOM 0 HE3 LYS A 308 -4.762 2.021 7.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 308 -3.717 0.553 9.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 308 -3.451 0.261 8.339 1.00 0.00 H new ATOM 0 HZ3 LYS A 308 -2.310 1.138 9.241 1.00 0.00 H new ATOM 1274 N TRP A 309 -2.502 5.811 4.411 1.00 0.00 N ATOM 1275 CA TRP A 309 -1.231 6.456 4.101 1.00 0.00 C ATOM 1276 C TRP A 309 -0.142 6.007 5.068 1.00 0.00 C ATOM 1277 O TRP A 309 -0.325 6.043 6.284 1.00 0.00 O ATOM 1278 CB TRP A 309 -1.381 7.978 4.153 1.00 0.00 C ATOM 1279 CG TRP A 309 -1.800 8.579 2.845 1.00 0.00 C ATOM 1280 CD1 TRP A 309 -2.972 9.227 2.579 1.00 0.00 C ATOM 1281 CD2 TRP A 309 -1.050 8.585 1.626 1.00 0.00 C ATOM 1282 NE1 TRP A 309 -2.996 9.636 1.268 1.00 0.00 N ATOM 1283 CE2 TRP A 309 -1.828 9.255 0.662 1.00 0.00 C ATOM 1284 CE3 TRP A 309 0.204 8.091 1.255 1.00 0.00 C ATOM 1285 CZ2 TRP A 309 -1.392 9.441 -0.648 1.00 0.00 C ATOM 1286 CZ3 TRP A 309 0.635 8.277 -0.045 1.00 0.00 C ATOM 1287 CH2 TRP A 309 -0.161 8.947 -0.983 1.00 0.00 C ATOM 0 H TRP A 309 -3.222 6.444 4.759 1.00 0.00 H new ATOM 0 HA TRP A 309 -0.939 6.161 3.093 1.00 0.00 H new ATOM 0 HB2 TRP A 309 -2.115 8.238 4.916 1.00 0.00 H new ATOM 0 HB3 TRP A 309 -0.433 8.419 4.460 1.00 0.00 H new ATOM 0 HD1 TRP A 309 -3.764 9.394 3.294 1.00 0.00 H new ATOM 0 HE1 TRP A 309 -3.760 10.141 0.819 1.00 0.00 H new ATOM 0 HE3 TRP A 309 0.825 7.573 1.971 1.00 0.00 H new ATOM 0 HZ2 TRP A 309 -2.004 9.957 -1.373 1.00 0.00 H new ATOM 0 HZ3 TRP A 309 1.602 7.899 -0.343 1.00 0.00 H new ATOM 0 HH2 TRP A 309 0.205 9.076 -1.991 1.00 0.00 H new ATOM 1298 N GLY A 310 0.994 5.585 4.521 1.00 0.00 N ATOM 1299 CA GLY A 310 2.096 5.135 5.351 1.00 0.00 C ATOM 1300 C GLY A 310 2.894 6.286 5.929 1.00 0.00 C ATOM 1301 O GLY A 310 2.395 7.408 6.029 1.00 0.00 O ATOM 0 H GLY A 310 1.171 5.547 3.517 1.00 0.00 H new ATOM 0 HA2 GLY A 310 1.708 4.522 6.164 1.00 0.00 H new ATOM 0 HA3 GLY A 310 2.756 4.500 4.760 1.00 0.00 H new