USER MOD reduce.3.24.130724 H: found=0, std=0, add=613, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 614 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 HIS : no HD1:sc= -1.25! K(o=-0.49!,f=-4.3) USER MOD Set 1.2: A 298 SER OG : rot -82:sc= 0.766 USER MOD Set 2.1: A 269 ASN : amide:sc= 0 X(o=-0.011,f=0.041) USER MOD Set 2.2: A 320 LYS NZ :NH3+ -122:sc= -0.0105 (180deg=-0.151) USER MOD Single : A 263 THR OG1 : rot 180:sc= 0 USER MOD Single : A 268 TYR OH : rot 180:sc= 0 USER MOD Single : A 271 LYS NZ :NH3+ 174:sc= -0.701 (180deg=-0.797) USER MOD Single : A 273 THR OG1 : rot 180:sc= 0 USER MOD Single : A 274 SER OG : rot 30:sc= 0.025 USER MOD Single : A 276 MET CE :methyl -159:sc= -0.417 (180deg=-2.52!) USER MOD Single : A 277 GLN : amide:sc= -0.584 K(o=-0.58,f=-4.9!) USER MOD Single : A 280 CYS SG : rot 22:sc= -1.07! USER MOD Single : A 283 GLN : amide:sc= -5.51! K(o=-5.5!,f=-4.1) USER MOD Single : A 289 LYS NZ :NH3+ -159:sc= -0.0992 (180deg=-0.606) USER MOD Single : A 314 SER OG : rot 180:sc= 0 USER MOD Single : A 315 LYS NZ :NH3+ -154:sc= -0.108 (180deg=-0.536) USER MOD Single : A 317 GLN : amide:sc= -0.609 K(o=-0.61,f=0) USER MOD Single : A 322 LYS NZ :NH3+ 161:sc= 1.21 (180deg=1.16) USER MOD Single : A 325 SER OG : rot 180:sc= 0 USER MOD Single : A 327 THR OG1 : rot 180:sc= 0 USER MOD Single : A 329 THR OG1 : rot 180:sc= 0 USER MOD Single : A 330 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 331 THR OG1 : rot 163:sc= 0.00571 USER MOD Single : A 332 SER OG : rot 180:sc= 0 USER MOD Single : A 334 SER OG : rot -131:sc= -3.59! USER MOD Single : A 335 MET CE :methyl 146:sc= -0.142 (180deg=-1.32) USER MOD Single : A 336 LYS NZ :NH3+ -151:sc= 1.1 (180deg=0.384) USER MOD Single : A 340 GLN : amide:sc= 0.808 K(o=0.81,f=-2.9!) USER MOD Single : A 342 THR OG1 : rot -18:sc= 0.365 USER MOD ----------------------------------------------------------------- ATOM 66 N GLU A 260 8.460 14.990 0.089 1.00 0.00 N ATOM 67 CA GLU A 260 8.531 14.484 1.454 1.00 0.00 C ATOM 68 C GLU A 260 7.323 13.608 1.773 1.00 0.00 C ATOM 69 O GLU A 260 7.455 12.551 2.389 1.00 0.00 O ATOM 70 CB GLU A 260 8.611 15.643 2.449 1.00 0.00 C ATOM 71 CG GLU A 260 7.425 16.590 2.377 1.00 0.00 C ATOM 72 CD GLU A 260 7.482 17.678 3.432 1.00 0.00 C ATOM 73 OE1 GLU A 260 8.484 18.423 3.462 1.00 0.00 O ATOM 74 OE2 GLU A 260 6.525 17.785 4.227 1.00 0.00 O ATOM 0 HA GLU A 260 9.432 13.877 1.542 1.00 0.00 H new ATOM 0 HB2 GLU A 260 8.682 15.239 3.459 1.00 0.00 H new ATOM 0 HB3 GLU A 260 9.526 16.206 2.265 1.00 0.00 H new ATOM 0 HG2 GLU A 260 7.391 17.049 1.389 1.00 0.00 H new ATOM 0 HG3 GLU A 260 6.503 16.021 2.497 1.00 0.00 H new ATOM 81 N GLU A 261 6.145 14.058 1.350 1.00 0.00 N ATOM 82 CA GLU A 261 4.913 13.316 1.592 1.00 0.00 C ATOM 83 C GLU A 261 4.463 12.584 0.331 1.00 0.00 C ATOM 84 O GLU A 261 4.677 13.040 -0.792 1.00 0.00 O ATOM 85 CB GLU A 261 3.808 14.261 2.069 1.00 0.00 C ATOM 86 CG GLU A 261 4.013 14.770 3.486 1.00 0.00 C ATOM 87 CD GLU A 261 2.759 15.393 4.068 1.00 0.00 C ATOM 88 OE1 GLU A 261 1.863 15.766 3.282 1.00 0.00 O ATOM 89 OE2 GLU A 261 2.674 15.509 5.308 1.00 0.00 O ATOM 0 H GLU A 261 6.018 14.932 0.839 1.00 0.00 H new ATOM 0 HA GLU A 261 5.110 12.578 2.369 1.00 0.00 H new ATOM 0 HB2 GLU A 261 3.752 15.112 1.391 1.00 0.00 H new ATOM 0 HB3 GLU A 261 2.850 13.744 2.012 1.00 0.00 H new ATOM 0 HG2 GLU A 261 4.333 13.945 4.122 1.00 0.00 H new ATOM 0 HG3 GLU A 261 4.816 15.507 3.491 1.00 0.00 H new ATOM 96 N PRO A 262 3.823 11.420 0.520 1.00 0.00 N ATOM 97 CA PRO A 262 3.328 10.600 -0.589 1.00 0.00 C ATOM 98 C PRO A 262 2.147 11.245 -1.306 1.00 0.00 C ATOM 99 O PRO A 262 1.429 12.063 -0.731 1.00 0.00 O ATOM 100 CB PRO A 262 2.893 9.302 0.096 1.00 0.00 C ATOM 101 CG PRO A 262 2.582 9.699 1.498 1.00 0.00 C ATOM 102 CD PRO A 262 3.532 10.816 1.831 1.00 0.00 C ATOM 0 HA PRO A 262 4.085 10.459 -1.360 1.00 0.00 H new ATOM 0 HB2 PRO A 262 2.022 8.868 -0.395 1.00 0.00 H new ATOM 0 HB3 PRO A 262 3.684 8.553 0.063 1.00 0.00 H new ATOM 0 HG2 PRO A 262 1.546 10.026 1.591 1.00 0.00 H new ATOM 0 HG3 PRO A 262 2.713 8.859 2.180 1.00 0.00 H new ATOM 0 HD2 PRO A 262 3.081 11.536 2.514 1.00 0.00 H new ATOM 0 HD3 PRO A 262 4.437 10.444 2.312 1.00 0.00 H new ATOM 110 N THR A 263 1.951 10.873 -2.567 1.00 0.00 N ATOM 111 CA THR A 263 0.858 11.416 -3.363 1.00 0.00 C ATOM 112 C THR A 263 -0.273 10.403 -3.509 1.00 0.00 C ATOM 113 O THR A 263 -0.041 9.247 -3.863 1.00 0.00 O ATOM 114 CB THR A 263 1.338 11.836 -4.765 1.00 0.00 C ATOM 115 OG1 THR A 263 2.458 12.722 -4.654 1.00 0.00 O ATOM 116 CG2 THR A 263 0.220 12.519 -5.538 1.00 0.00 C ATOM 0 H THR A 263 2.536 10.197 -3.059 1.00 0.00 H new ATOM 0 HA THR A 263 0.490 12.295 -2.834 1.00 0.00 H new ATOM 0 HB THR A 263 1.637 10.938 -5.307 1.00 0.00 H new ATOM 0 HG1 THR A 263 2.758 12.983 -5.549 1.00 0.00 H new ATOM 0 HG21 THR A 263 0.583 12.806 -6.525 1.00 0.00 H new ATOM 0 HG22 THR A 263 -0.620 11.833 -5.646 1.00 0.00 H new ATOM 0 HG23 THR A 263 -0.105 13.408 -4.998 1.00 0.00 H new ATOM 124 N ILE A 264 -1.495 10.845 -3.234 1.00 0.00 N ATOM 125 CA ILE A 264 -2.662 9.976 -3.337 1.00 0.00 C ATOM 126 C ILE A 264 -2.905 9.550 -4.781 1.00 0.00 C ATOM 127 O ILE A 264 -2.820 10.362 -5.701 1.00 0.00 O ATOM 128 CB ILE A 264 -3.928 10.668 -2.798 1.00 0.00 C ATOM 129 CG1 ILE A 264 -3.723 11.092 -1.342 1.00 0.00 C ATOM 130 CG2 ILE A 264 -5.130 9.744 -2.922 1.00 0.00 C ATOM 131 CD1 ILE A 264 -4.747 12.093 -0.854 1.00 0.00 C ATOM 0 H ILE A 264 -1.703 11.799 -2.938 1.00 0.00 H new ATOM 0 HA ILE A 264 -2.453 9.094 -2.731 1.00 0.00 H new ATOM 0 HB ILE A 264 -4.118 11.561 -3.394 1.00 0.00 H new ATOM 0 HG12 ILE A 264 -3.760 10.208 -0.706 1.00 0.00 H new ATOM 0 HG13 ILE A 264 -2.727 11.521 -1.234 1.00 0.00 H new ATOM 0 HG21 ILE A 264 -6.017 10.247 -2.537 1.00 0.00 H new ATOM 0 HG22 ILE A 264 -5.285 9.487 -3.970 1.00 0.00 H new ATOM 0 HG23 ILE A 264 -4.951 8.835 -2.348 1.00 0.00 H new ATOM 0 HD11 ILE A 264 -4.540 12.348 0.185 1.00 0.00 H new ATOM 0 HD12 ILE A 264 -4.696 12.994 -1.466 1.00 0.00 H new ATOM 0 HD13 ILE A 264 -5.744 11.660 -0.930 1.00 0.00 H new ATOM 143 N GLY A 265 -3.209 8.270 -4.971 1.00 0.00 N ATOM 144 CA GLY A 265 -3.462 7.758 -6.305 1.00 0.00 C ATOM 145 C GLY A 265 -2.205 7.237 -6.974 1.00 0.00 C ATOM 146 O GLY A 265 -2.276 6.428 -7.899 1.00 0.00 O ATOM 0 H GLY A 265 -3.285 7.578 -4.225 1.00 0.00 H new ATOM 0 HA2 GLY A 265 -4.199 6.957 -6.250 1.00 0.00 H new ATOM 0 HA3 GLY A 265 -3.895 8.548 -6.918 1.00 0.00 H new ATOM 150 N ASP A 266 -1.052 7.703 -6.507 1.00 0.00 N ATOM 151 CA ASP A 266 0.227 7.280 -7.066 1.00 0.00 C ATOM 152 C ASP A 266 0.676 5.957 -6.454 1.00 0.00 C ATOM 153 O ASP A 266 0.248 5.592 -5.359 1.00 0.00 O ATOM 154 CB ASP A 266 1.291 8.353 -6.831 1.00 0.00 C ATOM 155 CG ASP A 266 1.208 9.481 -7.841 1.00 0.00 C ATOM 156 OD1 ASP A 266 0.192 10.206 -7.838 1.00 0.00 O ATOM 157 OD2 ASP A 266 2.160 9.638 -8.635 1.00 0.00 O ATOM 0 H ASP A 266 -0.977 8.374 -5.742 1.00 0.00 H new ATOM 0 HA ASP A 266 0.098 7.138 -8.139 1.00 0.00 H new ATOM 0 HB2 ASP A 266 1.177 8.760 -5.826 1.00 0.00 H new ATOM 0 HB3 ASP A 266 2.280 7.897 -6.880 1.00 0.00 H new ATOM 162 N ILE A 267 1.541 5.244 -7.168 1.00 0.00 N ATOM 163 CA ILE A 267 2.048 3.962 -6.694 1.00 0.00 C ATOM 164 C ILE A 267 3.488 4.087 -6.209 1.00 0.00 C ATOM 165 O ILE A 267 4.288 4.823 -6.787 1.00 0.00 O ATOM 166 CB ILE A 267 1.981 2.888 -7.796 1.00 0.00 C ATOM 167 CG1 ILE A 267 0.531 2.658 -8.226 1.00 0.00 C ATOM 168 CG2 ILE A 267 2.608 1.590 -7.310 1.00 0.00 C ATOM 169 CD1 ILE A 267 0.400 1.917 -9.538 1.00 0.00 C ATOM 0 H ILE A 267 1.905 5.532 -8.076 1.00 0.00 H new ATOM 0 HA ILE A 267 1.412 3.658 -5.863 1.00 0.00 H new ATOM 0 HB ILE A 267 2.545 3.239 -8.660 1.00 0.00 H new ATOM 0 HG12 ILE A 267 0.015 2.096 -7.448 1.00 0.00 H new ATOM 0 HG13 ILE A 267 0.028 3.622 -8.310 1.00 0.00 H new ATOM 0 HG21 ILE A 267 2.553 0.841 -8.100 1.00 0.00 H new ATOM 0 HG22 ILE A 267 3.652 1.766 -7.049 1.00 0.00 H new ATOM 0 HG23 ILE A 267 2.069 1.232 -6.433 1.00 0.00 H new ATOM 0 HD11 ILE A 267 -0.655 1.790 -9.780 1.00 0.00 H new ATOM 0 HD12 ILE A 267 0.887 2.488 -10.328 1.00 0.00 H new ATOM 0 HD13 ILE A 267 0.873 0.939 -9.452 1.00 0.00 H new ATOM 181 N TYR A 268 3.812 3.361 -5.144 1.00 0.00 N ATOM 182 CA TYR A 268 5.156 3.390 -4.580 1.00 0.00 C ATOM 183 C TYR A 268 5.607 1.991 -4.174 1.00 0.00 C ATOM 184 O TYR A 268 4.791 1.083 -4.023 1.00 0.00 O ATOM 185 CB TYR A 268 5.204 4.325 -3.370 1.00 0.00 C ATOM 186 CG TYR A 268 5.108 5.790 -3.731 1.00 0.00 C ATOM 187 CD1 TYR A 268 3.901 6.349 -4.132 1.00 0.00 C ATOM 188 CD2 TYR A 268 6.224 6.614 -3.671 1.00 0.00 C ATOM 189 CE1 TYR A 268 3.809 7.687 -4.464 1.00 0.00 C ATOM 190 CE2 TYR A 268 6.141 7.954 -4.000 1.00 0.00 C ATOM 191 CZ TYR A 268 4.932 8.485 -4.396 1.00 0.00 C ATOM 192 OH TYR A 268 4.844 9.818 -4.725 1.00 0.00 O ATOM 0 H TYR A 268 3.162 2.746 -4.655 1.00 0.00 H new ATOM 0 HA TYR A 268 5.836 3.763 -5.346 1.00 0.00 H new ATOM 0 HB2 TYR A 268 4.387 4.072 -2.694 1.00 0.00 H new ATOM 0 HB3 TYR A 268 6.133 4.154 -2.826 1.00 0.00 H new ATOM 0 HD1 TYR A 268 3.020 5.727 -4.185 1.00 0.00 H new ATOM 0 HD2 TYR A 268 7.173 6.201 -3.362 1.00 0.00 H new ATOM 0 HE1 TYR A 268 2.863 8.106 -4.775 1.00 0.00 H new ATOM 0 HE2 TYR A 268 7.018 8.581 -3.947 1.00 0.00 H new ATOM 0 HH TYR A 268 5.723 10.239 -4.623 1.00 0.00 H new ATOM 202 N ASN A 269 6.914 1.825 -3.998 1.00 0.00 N ATOM 203 CA ASN A 269 7.476 0.536 -3.609 1.00 0.00 C ATOM 204 C ASN A 269 7.618 0.440 -2.093 1.00 0.00 C ATOM 205 O ASN A 269 7.958 1.417 -1.428 1.00 0.00 O ATOM 206 CB ASN A 269 8.838 0.328 -4.275 1.00 0.00 C ATOM 207 CG ASN A 269 8.845 0.767 -5.726 1.00 0.00 C ATOM 208 OD1 ASN A 269 9.131 1.923 -6.036 1.00 0.00 O ATOM 209 ND2 ASN A 269 8.529 -0.159 -6.625 1.00 0.00 N ATOM 0 H ASN A 269 7.604 2.567 -4.118 1.00 0.00 H new ATOM 0 HA ASN A 269 6.793 -0.246 -3.942 1.00 0.00 H new ATOM 0 HB2 ASN A 269 9.597 0.886 -3.726 1.00 0.00 H new ATOM 0 HB3 ASN A 269 9.111 -0.726 -4.216 1.00 0.00 H new ATOM 0 HD21 ASN A 269 8.517 0.077 -7.617 1.00 0.00 H new ATOM 0 HD22 ASN A 269 8.299 -1.106 -6.323 1.00 0.00 H new ATOM 216 N GLY A 270 7.355 -0.747 -1.554 1.00 0.00 N ATOM 217 CA GLY A 270 7.460 -0.950 -0.121 1.00 0.00 C ATOM 218 C GLY A 270 7.897 -2.357 0.235 1.00 0.00 C ATOM 219 O GLY A 270 8.185 -3.168 -0.646 1.00 0.00 O ATOM 0 H GLY A 270 7.071 -1.571 -2.084 1.00 0.00 H new ATOM 0 HA2 GLY A 270 8.172 -0.236 0.293 1.00 0.00 H new ATOM 0 HA3 GLY A 270 6.496 -0.744 0.344 1.00 0.00 H new ATOM 223 N LYS A 271 7.950 -2.648 1.530 1.00 0.00 N ATOM 224 CA LYS A 271 8.356 -3.967 2.002 1.00 0.00 C ATOM 225 C LYS A 271 7.673 -4.306 3.323 1.00 0.00 C ATOM 226 O LYS A 271 7.509 -3.446 4.188 1.00 0.00 O ATOM 227 CB LYS A 271 9.876 -4.024 2.173 1.00 0.00 C ATOM 228 CG LYS A 271 10.369 -5.314 2.806 1.00 0.00 C ATOM 229 CD LYS A 271 11.838 -5.224 3.183 1.00 0.00 C ATOM 230 CE LYS A 271 12.044 -4.369 4.424 1.00 0.00 C ATOM 231 NZ LYS A 271 11.873 -5.157 5.675 1.00 0.00 N ATOM 0 H LYS A 271 7.717 -1.988 2.272 1.00 0.00 H new ATOM 0 HA LYS A 271 8.052 -4.702 1.257 1.00 0.00 H new ATOM 0 HB2 LYS A 271 10.348 -3.904 1.198 1.00 0.00 H new ATOM 0 HB3 LYS A 271 10.196 -3.182 2.787 1.00 0.00 H new ATOM 0 HG2 LYS A 271 9.777 -5.534 3.695 1.00 0.00 H new ATOM 0 HG3 LYS A 271 10.221 -6.141 2.112 1.00 0.00 H new ATOM 0 HD2 LYS A 271 12.231 -6.225 3.360 1.00 0.00 H new ATOM 0 HD3 LYS A 271 12.403 -4.802 2.352 1.00 0.00 H new ATOM 0 HE2 LYS A 271 13.043 -3.933 4.403 1.00 0.00 H new ATOM 0 HE3 LYS A 271 11.335 -3.541 4.416 1.00 0.00 H new ATOM 0 HZ1 LYS A 271 12.120 -4.566 6.494 1.00 0.00 H new ATOM 0 HZ2 LYS A 271 10.884 -5.467 5.758 1.00 0.00 H new ATOM 0 HZ3 LYS A 271 12.495 -5.990 5.649 1.00 0.00 H new ATOM 245 N VAL A 272 7.277 -5.566 3.472 1.00 0.00 N ATOM 246 CA VAL A 272 6.613 -6.020 4.689 1.00 0.00 C ATOM 247 C VAL A 272 7.589 -6.075 5.859 1.00 0.00 C ATOM 248 O VAL A 272 8.640 -6.711 5.776 1.00 0.00 O ATOM 249 CB VAL A 272 5.979 -7.411 4.497 1.00 0.00 C ATOM 250 CG1 VAL A 272 5.671 -8.048 5.844 1.00 0.00 C ATOM 251 CG2 VAL A 272 4.723 -7.310 3.646 1.00 0.00 C ATOM 0 H VAL A 272 7.404 -6.291 2.766 1.00 0.00 H new ATOM 0 HA VAL A 272 5.827 -5.298 4.909 1.00 0.00 H new ATOM 0 HB VAL A 272 6.693 -8.048 3.976 1.00 0.00 H new ATOM 0 HG11 VAL A 272 5.224 -9.030 5.688 1.00 0.00 H new ATOM 0 HG12 VAL A 272 6.593 -8.156 6.415 1.00 0.00 H new ATOM 0 HG13 VAL A 272 4.975 -7.415 6.395 1.00 0.00 H new ATOM 0 HG21 VAL A 272 4.288 -8.301 3.520 1.00 0.00 H new ATOM 0 HG22 VAL A 272 4.002 -6.657 4.138 1.00 0.00 H new ATOM 0 HG23 VAL A 272 4.978 -6.899 2.669 1.00 0.00 H new ATOM 261 N THR A 273 7.234 -5.405 6.951 1.00 0.00 N ATOM 262 CA THR A 273 8.078 -5.377 8.139 1.00 0.00 C ATOM 263 C THR A 273 7.491 -6.238 9.251 1.00 0.00 C ATOM 264 O THR A 273 8.224 -6.837 10.038 1.00 0.00 O ATOM 265 CB THR A 273 8.264 -3.940 8.662 1.00 0.00 C ATOM 266 OG1 THR A 273 7.011 -3.420 9.122 1.00 0.00 O ATOM 267 CG2 THR A 273 8.824 -3.036 7.574 1.00 0.00 C ATOM 0 H THR A 273 6.367 -4.874 7.037 1.00 0.00 H new ATOM 0 HA THR A 273 9.048 -5.778 7.847 1.00 0.00 H new ATOM 0 HB THR A 273 8.972 -3.968 9.490 1.00 0.00 H new ATOM 0 HG1 THR A 273 7.138 -2.507 9.454 1.00 0.00 H new ATOM 0 HG21 THR A 273 8.947 -2.027 7.967 1.00 0.00 H new ATOM 0 HG22 THR A 273 9.791 -3.418 7.246 1.00 0.00 H new ATOM 0 HG23 THR A 273 8.136 -3.015 6.729 1.00 0.00 H new ATOM 275 N SER A 274 6.164 -6.297 9.310 1.00 0.00 N ATOM 276 CA SER A 274 5.478 -7.084 10.328 1.00 0.00 C ATOM 277 C SER A 274 4.184 -7.675 9.778 1.00 0.00 C ATOM 278 O SER A 274 3.320 -6.951 9.282 1.00 0.00 O ATOM 279 CB SER A 274 5.176 -6.218 11.553 1.00 0.00 C ATOM 280 OG SER A 274 6.246 -6.259 12.482 1.00 0.00 O ATOM 0 H SER A 274 5.543 -5.809 8.665 1.00 0.00 H new ATOM 0 HA SER A 274 6.134 -7.903 10.623 1.00 0.00 H new ATOM 0 HB2 SER A 274 5.001 -5.189 11.240 1.00 0.00 H new ATOM 0 HB3 SER A 274 4.261 -6.566 12.032 1.00 0.00 H new ATOM 0 HG SER A 274 7.089 -6.406 12.004 1.00 0.00 H new ATOM 286 N ILE A 275 4.058 -8.995 9.870 1.00 0.00 N ATOM 287 CA ILE A 275 2.870 -9.684 9.382 1.00 0.00 C ATOM 288 C ILE A 275 1.871 -9.921 10.509 1.00 0.00 C ATOM 289 O ILE A 275 2.083 -10.773 11.372 1.00 0.00 O ATOM 290 CB ILE A 275 3.228 -11.035 8.736 1.00 0.00 C ATOM 291 CG1 ILE A 275 3.955 -10.814 7.409 1.00 0.00 C ATOM 292 CG2 ILE A 275 1.974 -11.871 8.527 1.00 0.00 C ATOM 293 CD1 ILE A 275 5.420 -10.472 7.571 1.00 0.00 C ATOM 0 H ILE A 275 4.764 -9.608 10.278 1.00 0.00 H new ATOM 0 HA ILE A 275 2.418 -9.039 8.628 1.00 0.00 H new ATOM 0 HB ILE A 275 3.894 -11.577 9.407 1.00 0.00 H new ATOM 0 HG12 ILE A 275 3.866 -11.714 6.801 1.00 0.00 H new ATOM 0 HG13 ILE A 275 3.461 -10.010 6.863 1.00 0.00 H new ATOM 0 HG21 ILE A 275 2.243 -12.823 8.070 1.00 0.00 H new ATOM 0 HG22 ILE A 275 1.494 -12.053 9.488 1.00 0.00 H new ATOM 0 HG23 ILE A 275 1.285 -11.336 7.873 1.00 0.00 H new ATOM 0 HD11 ILE A 275 5.871 -10.329 6.589 1.00 0.00 H new ATOM 0 HD12 ILE A 275 5.517 -9.555 8.152 1.00 0.00 H new ATOM 0 HD13 ILE A 275 5.928 -11.285 8.089 1.00 0.00 H new ATOM 305 N MET A 276 0.780 -9.162 10.495 1.00 0.00 N ATOM 306 CA MET A 276 -0.255 -9.291 11.515 1.00 0.00 C ATOM 307 C MET A 276 -1.304 -10.317 11.098 1.00 0.00 C ATOM 308 O MET A 276 -1.548 -10.520 9.909 1.00 0.00 O ATOM 309 CB MET A 276 -0.921 -7.938 11.771 1.00 0.00 C ATOM 310 CG MET A 276 0.067 -6.818 12.053 1.00 0.00 C ATOM 311 SD MET A 276 0.984 -7.071 13.585 1.00 0.00 S ATOM 312 CE MET A 276 2.072 -5.648 13.567 1.00 0.00 C ATOM 0 H MET A 276 0.590 -8.451 9.789 1.00 0.00 H new ATOM 0 HA MET A 276 0.218 -9.634 12.435 1.00 0.00 H new ATOM 0 HB2 MET A 276 -1.524 -7.669 10.904 1.00 0.00 H new ATOM 0 HB3 MET A 276 -1.602 -8.032 12.617 1.00 0.00 H new ATOM 0 HG2 MET A 276 0.769 -6.740 11.223 1.00 0.00 H new ATOM 0 HG3 MET A 276 -0.469 -5.871 12.107 1.00 0.00 H new ATOM 0 HE1 MET A 276 2.930 -5.838 14.212 1.00 0.00 H new ATOM 0 HE2 MET A 276 2.416 -5.466 12.549 1.00 0.00 H new ATOM 0 HE3 MET A 276 1.533 -4.773 13.930 1.00 0.00 H new ATOM 322 N GLN A 277 -1.920 -10.961 12.084 1.00 0.00 N ATOM 323 CA GLN A 277 -2.942 -11.966 11.817 1.00 0.00 C ATOM 324 C GLN A 277 -4.015 -11.418 10.882 1.00 0.00 C ATOM 325 O GLN A 277 -4.683 -12.173 10.176 1.00 0.00 O ATOM 326 CB GLN A 277 -3.581 -12.435 13.126 1.00 0.00 C ATOM 327 CG GLN A 277 -4.773 -13.356 12.926 1.00 0.00 C ATOM 328 CD GLN A 277 -4.369 -14.742 12.464 1.00 0.00 C ATOM 329 OE1 GLN A 277 -3.413 -14.901 11.704 1.00 0.00 O ATOM 330 NE2 GLN A 277 -5.096 -15.754 12.922 1.00 0.00 N ATOM 0 H GLN A 277 -1.729 -10.805 13.074 1.00 0.00 H new ATOM 0 HA GLN A 277 -2.461 -12.815 11.330 1.00 0.00 H new ATOM 0 HB2 GLN A 277 -2.829 -12.952 13.723 1.00 0.00 H new ATOM 0 HB3 GLN A 277 -3.898 -11.563 13.698 1.00 0.00 H new ATOM 0 HG2 GLN A 277 -5.326 -13.436 13.862 1.00 0.00 H new ATOM 0 HG3 GLN A 277 -5.449 -12.915 12.193 1.00 0.00 H new ATOM 0 HE21 GLN A 277 -5.880 -15.576 13.550 1.00 0.00 H new ATOM 0 HE22 GLN A 277 -4.871 -16.710 12.646 1.00 0.00 H new ATOM 339 N PHE A 278 -4.175 -10.098 10.883 1.00 0.00 N ATOM 340 CA PHE A 278 -5.168 -9.448 10.036 1.00 0.00 C ATOM 341 C PHE A 278 -4.535 -8.948 8.741 1.00 0.00 C ATOM 342 O PHE A 278 -4.903 -9.380 7.650 1.00 0.00 O ATOM 343 CB PHE A 278 -5.821 -8.282 10.782 1.00 0.00 C ATOM 344 CG PHE A 278 -4.914 -7.630 11.786 1.00 0.00 C ATOM 345 CD1 PHE A 278 -4.683 -8.223 13.017 1.00 0.00 C ATOM 346 CD2 PHE A 278 -4.294 -6.425 11.500 1.00 0.00 C ATOM 347 CE1 PHE A 278 -3.849 -7.626 13.944 1.00 0.00 C ATOM 348 CE2 PHE A 278 -3.459 -5.824 12.422 1.00 0.00 C ATOM 349 CZ PHE A 278 -3.237 -6.424 13.646 1.00 0.00 C ATOM 0 H PHE A 278 -3.630 -9.458 11.461 1.00 0.00 H new ATOM 0 HA PHE A 278 -5.933 -10.183 9.785 1.00 0.00 H new ATOM 0 HB2 PHE A 278 -6.146 -7.534 10.058 1.00 0.00 H new ATOM 0 HB3 PHE A 278 -6.715 -8.642 11.292 1.00 0.00 H new ATOM 0 HD1 PHE A 278 -5.160 -9.162 13.255 1.00 0.00 H new ATOM 0 HD2 PHE A 278 -4.465 -5.950 10.545 1.00 0.00 H new ATOM 0 HE1 PHE A 278 -3.676 -8.099 14.900 1.00 0.00 H new ATOM 0 HE2 PHE A 278 -2.980 -4.885 12.186 1.00 0.00 H new ATOM 0 HZ PHE A 278 -2.586 -5.954 14.369 1.00 0.00 H new ATOM 359 N GLY A 279 -3.579 -8.033 8.872 1.00 0.00 N ATOM 360 CA GLY A 279 -2.910 -7.487 7.706 1.00 0.00 C ATOM 361 C GLY A 279 -1.400 -7.539 7.827 1.00 0.00 C ATOM 362 O GLY A 279 -0.859 -8.323 8.609 1.00 0.00 O ATOM 0 H GLY A 279 -3.256 -7.660 9.765 1.00 0.00 H new ATOM 0 HA2 GLY A 279 -3.220 -8.042 6.820 1.00 0.00 H new ATOM 0 HA3 GLY A 279 -3.224 -6.453 7.561 1.00 0.00 H new ATOM 366 N CYS A 280 -0.717 -6.704 7.051 1.00 0.00 N ATOM 367 CA CYS A 280 0.741 -6.660 7.073 1.00 0.00 C ATOM 368 C CYS A 280 1.244 -5.232 6.889 1.00 0.00 C ATOM 369 O CYS A 280 0.773 -4.504 6.015 1.00 0.00 O ATOM 370 CB CYS A 280 1.316 -7.561 5.980 1.00 0.00 C ATOM 371 SG CYS A 280 1.007 -6.972 4.299 1.00 0.00 S ATOM 0 H CYS A 280 -1.149 -6.049 6.399 1.00 0.00 H new ATOM 0 HA CYS A 280 1.076 -7.022 8.045 1.00 0.00 H new ATOM 0 HB2 CYS A 280 2.392 -7.653 6.129 1.00 0.00 H new ATOM 0 HB3 CYS A 280 0.892 -8.560 6.087 1.00 0.00 H new ATOM 0 HG CYS A 280 0.779 -5.692 4.323 1.00 0.00 H new ATOM 377 N PHE A 281 2.204 -4.836 7.719 1.00 0.00 N ATOM 378 CA PHE A 281 2.770 -3.494 7.650 1.00 0.00 C ATOM 379 C PHE A 281 3.807 -3.398 6.535 1.00 0.00 C ATOM 380 O PHE A 281 4.766 -4.169 6.496 1.00 0.00 O ATOM 381 CB PHE A 281 3.407 -3.116 8.988 1.00 0.00 C ATOM 382 CG PHE A 281 2.411 -2.677 10.023 1.00 0.00 C ATOM 383 CD1 PHE A 281 1.610 -3.604 10.671 1.00 0.00 C ATOM 384 CD2 PHE A 281 2.275 -1.337 10.349 1.00 0.00 C ATOM 385 CE1 PHE A 281 0.692 -3.203 11.623 1.00 0.00 C ATOM 386 CE2 PHE A 281 1.359 -0.930 11.301 1.00 0.00 C ATOM 387 CZ PHE A 281 0.568 -1.864 11.939 1.00 0.00 C ATOM 0 H PHE A 281 2.606 -5.426 8.447 1.00 0.00 H new ATOM 0 HA PHE A 281 1.961 -2.797 7.431 1.00 0.00 H new ATOM 0 HB2 PHE A 281 3.964 -3.971 9.371 1.00 0.00 H new ATOM 0 HB3 PHE A 281 4.127 -2.314 8.825 1.00 0.00 H new ATOM 0 HD1 PHE A 281 1.704 -4.652 10.429 1.00 0.00 H new ATOM 0 HD2 PHE A 281 2.892 -0.602 9.853 1.00 0.00 H new ATOM 0 HE1 PHE A 281 0.072 -3.935 12.119 1.00 0.00 H new ATOM 0 HE2 PHE A 281 1.262 0.118 11.545 1.00 0.00 H new ATOM 0 HZ PHE A 281 -0.147 -1.548 12.684 1.00 0.00 H new ATOM 397 N VAL A 282 3.608 -2.446 5.629 1.00 0.00 N ATOM 398 CA VAL A 282 4.525 -2.247 4.513 1.00 0.00 C ATOM 399 C VAL A 282 5.183 -0.874 4.580 1.00 0.00 C ATOM 400 O VAL A 282 4.502 0.151 4.589 1.00 0.00 O ATOM 401 CB VAL A 282 3.803 -2.394 3.161 1.00 0.00 C ATOM 402 CG1 VAL A 282 4.754 -2.092 2.013 1.00 0.00 C ATOM 403 CG2 VAL A 282 3.212 -3.788 3.021 1.00 0.00 C ATOM 0 H VAL A 282 2.819 -1.800 5.646 1.00 0.00 H new ATOM 0 HA VAL A 282 5.292 -3.017 4.592 1.00 0.00 H new ATOM 0 HB VAL A 282 2.986 -1.673 3.125 1.00 0.00 H new ATOM 0 HG11 VAL A 282 4.227 -2.201 1.065 1.00 0.00 H new ATOM 0 HG12 VAL A 282 5.125 -1.071 2.107 1.00 0.00 H new ATOM 0 HG13 VAL A 282 5.593 -2.787 2.043 1.00 0.00 H new ATOM 0 HG21 VAL A 282 2.706 -3.874 2.060 1.00 0.00 H new ATOM 0 HG22 VAL A 282 4.010 -4.529 3.078 1.00 0.00 H new ATOM 0 HG23 VAL A 282 2.497 -3.962 3.825 1.00 0.00 H new ATOM 413 N GLN A 283 6.511 -0.861 4.628 1.00 0.00 N ATOM 414 CA GLN A 283 7.261 0.387 4.694 1.00 0.00 C ATOM 415 C GLN A 283 7.582 0.904 3.295 1.00 0.00 C ATOM 416 O GLN A 283 8.125 0.177 2.463 1.00 0.00 O ATOM 417 CB GLN A 283 8.554 0.189 5.487 1.00 0.00 C ATOM 418 CG GLN A 283 9.286 1.486 5.791 1.00 0.00 C ATOM 419 CD GLN A 283 8.721 2.205 7.000 1.00 0.00 C ATOM 420 OE1 GLN A 283 8.645 1.642 8.092 1.00 0.00 O ATOM 421 NE2 GLN A 283 8.321 3.457 6.810 1.00 0.00 N ATOM 0 H GLN A 283 7.090 -1.701 4.622 1.00 0.00 H new ATOM 0 HA GLN A 283 6.642 1.127 5.202 1.00 0.00 H new ATOM 0 HB2 GLN A 283 8.322 -0.316 6.425 1.00 0.00 H new ATOM 0 HB3 GLN A 283 9.217 -0.470 4.926 1.00 0.00 H new ATOM 0 HG2 GLN A 283 10.341 1.272 5.961 1.00 0.00 H new ATOM 0 HG3 GLN A 283 9.229 2.143 4.923 1.00 0.00 H new ATOM 0 HE21 GLN A 283 8.403 3.884 5.887 1.00 0.00 H new ATOM 0 HE22 GLN A 283 7.932 3.992 7.587 1.00 0.00 H new ATOM 430 N LEU A 284 7.244 2.164 3.044 1.00 0.00 N ATOM 431 CA LEU A 284 7.497 2.779 1.745 1.00 0.00 C ATOM 432 C LEU A 284 8.975 3.118 1.581 1.00 0.00 C ATOM 433 O LEU A 284 9.671 3.389 2.559 1.00 0.00 O ATOM 434 CB LEU A 284 6.651 4.044 1.585 1.00 0.00 C ATOM 435 CG LEU A 284 5.136 3.839 1.561 1.00 0.00 C ATOM 436 CD1 LEU A 284 4.416 5.160 1.781 1.00 0.00 C ATOM 437 CD2 LEU A 284 4.704 3.206 0.247 1.00 0.00 C ATOM 0 H LEU A 284 6.794 2.779 3.722 1.00 0.00 H new ATOM 0 HA LEU A 284 7.220 2.063 0.971 1.00 0.00 H new ATOM 0 HB2 LEU A 284 6.893 4.724 2.402 1.00 0.00 H new ATOM 0 HB3 LEU A 284 6.945 4.539 0.660 1.00 0.00 H new ATOM 0 HG LEU A 284 4.867 3.162 2.372 1.00 0.00 H new ATOM 0 HD11 LEU A 284 3.339 4.995 1.761 1.00 0.00 H new ATOM 0 HD12 LEU A 284 4.702 5.573 2.748 1.00 0.00 H new ATOM 0 HD13 LEU A 284 4.691 5.860 0.992 1.00 0.00 H new ATOM 0 HD21 LEU A 284 3.623 3.068 0.248 1.00 0.00 H new ATOM 0 HD22 LEU A 284 4.986 3.857 -0.581 1.00 0.00 H new ATOM 0 HD23 LEU A 284 5.193 2.239 0.131 1.00 0.00 H new ATOM 449 N GLU A 285 9.446 3.102 0.338 1.00 0.00 N ATOM 450 CA GLU A 285 10.841 3.409 0.047 1.00 0.00 C ATOM 451 C GLU A 285 10.952 4.635 -0.855 1.00 0.00 C ATOM 452 O GLU A 285 9.974 5.057 -1.471 1.00 0.00 O ATOM 453 CB GLU A 285 11.523 2.211 -0.617 1.00 0.00 C ATOM 454 CG GLU A 285 11.589 0.979 0.271 1.00 0.00 C ATOM 455 CD GLU A 285 12.157 -0.229 -0.449 1.00 0.00 C ATOM 456 OE1 GLU A 285 11.467 -0.769 -1.338 1.00 0.00 O ATOM 457 OE2 GLU A 285 13.292 -0.633 -0.121 1.00 0.00 O ATOM 0 H GLU A 285 8.882 2.880 -0.483 1.00 0.00 H new ATOM 0 HA GLU A 285 11.342 3.626 0.990 1.00 0.00 H new ATOM 0 HB2 GLU A 285 10.987 1.960 -1.533 1.00 0.00 H new ATOM 0 HB3 GLU A 285 12.535 2.494 -0.907 1.00 0.00 H new ATOM 0 HG2 GLU A 285 12.202 1.198 1.145 1.00 0.00 H new ATOM 0 HG3 GLU A 285 10.589 0.744 0.634 1.00 0.00 H new ATOM 464 N GLY A 286 12.152 5.203 -0.928 1.00 0.00 N ATOM 465 CA GLY A 286 12.369 6.375 -1.756 1.00 0.00 C ATOM 466 C GLY A 286 12.095 7.668 -1.014 1.00 0.00 C ATOM 467 O GLY A 286 13.019 8.420 -0.699 1.00 0.00 O ATOM 0 H GLY A 286 12.978 4.872 -0.429 1.00 0.00 H new ATOM 0 HA2 GLY A 286 13.398 6.377 -2.115 1.00 0.00 H new ATOM 0 HA3 GLY A 286 11.725 6.320 -2.634 1.00 0.00 H new ATOM 471 N LEU A 287 10.823 7.930 -0.734 1.00 0.00 N ATOM 472 CA LEU A 287 10.429 9.143 -0.025 1.00 0.00 C ATOM 473 C LEU A 287 11.397 9.445 1.115 1.00 0.00 C ATOM 474 O LEU A 287 11.890 8.536 1.781 1.00 0.00 O ATOM 475 CB LEU A 287 9.008 8.999 0.522 1.00 0.00 C ATOM 476 CG LEU A 287 7.910 8.767 -0.517 1.00 0.00 C ATOM 477 CD1 LEU A 287 6.667 8.187 0.141 1.00 0.00 C ATOM 478 CD2 LEU A 287 7.577 10.064 -1.239 1.00 0.00 C ATOM 0 H LEU A 287 10.047 7.319 -0.987 1.00 0.00 H new ATOM 0 HA LEU A 287 10.457 9.973 -0.731 1.00 0.00 H new ATOM 0 HB2 LEU A 287 8.994 8.169 1.228 1.00 0.00 H new ATOM 0 HB3 LEU A 287 8.764 9.900 1.085 1.00 0.00 H new ATOM 0 HG LEU A 287 8.276 8.049 -1.251 1.00 0.00 H new ATOM 0 HD11 LEU A 287 5.896 8.029 -0.613 1.00 0.00 H new ATOM 0 HD12 LEU A 287 6.915 7.236 0.612 1.00 0.00 H new ATOM 0 HD13 LEU A 287 6.298 8.881 0.897 1.00 0.00 H new ATOM 0 HD21 LEU A 287 6.794 9.880 -1.975 1.00 0.00 H new ATOM 0 HD22 LEU A 287 7.230 10.804 -0.517 1.00 0.00 H new ATOM 0 HD23 LEU A 287 8.468 10.439 -1.743 1.00 0.00 H new ATOM 490 N ARG A 288 11.661 10.729 1.334 1.00 0.00 N ATOM 491 CA ARG A 288 12.569 11.152 2.394 1.00 0.00 C ATOM 492 C ARG A 288 11.980 10.846 3.768 1.00 0.00 C ATOM 493 O ARG A 288 12.644 10.263 4.625 1.00 0.00 O ATOM 494 CB ARG A 288 12.864 12.648 2.275 1.00 0.00 C ATOM 495 CG ARG A 288 14.044 12.967 1.371 1.00 0.00 C ATOM 496 CD ARG A 288 15.368 12.763 2.091 1.00 0.00 C ATOM 497 NE ARG A 288 15.811 11.372 2.039 1.00 0.00 N ATOM 498 CZ ARG A 288 16.144 10.749 0.915 1.00 0.00 C ATOM 499 NH1 ARG A 288 16.086 11.389 -0.245 1.00 0.00 N ATOM 500 NH2 ARG A 288 16.538 9.482 0.949 1.00 0.00 N ATOM 0 H ARG A 288 11.259 11.494 0.792 1.00 0.00 H new ATOM 0 HA ARG A 288 13.500 10.596 2.285 1.00 0.00 H new ATOM 0 HB2 ARG A 288 11.978 13.155 1.894 1.00 0.00 H new ATOM 0 HB3 ARG A 288 13.059 13.051 3.269 1.00 0.00 H new ATOM 0 HG2 ARG A 288 14.008 12.332 0.486 1.00 0.00 H new ATOM 0 HG3 ARG A 288 13.971 13.998 1.026 1.00 0.00 H new ATOM 0 HD2 ARG A 288 16.128 13.402 1.641 1.00 0.00 H new ATOM 0 HD3 ARG A 288 15.266 13.072 3.131 1.00 0.00 H new ATOM 0 HE ARG A 288 15.868 10.851 2.914 1.00 0.00 H new ATOM 0 HH11 ARG A 288 15.785 12.363 -0.276 1.00 0.00 H new ATOM 0 HH12 ARG A 288 16.343 10.907 -1.107 1.00 0.00 H new ATOM 0 HH21 ARG A 288 16.585 8.986 1.839 1.00 0.00 H new ATOM 0 HH22 ARG A 288 16.794 9.004 0.085 1.00 0.00 H new ATOM 514 N LYS A 289 10.728 11.245 3.971 1.00 0.00 N ATOM 515 CA LYS A 289 10.048 11.014 5.240 1.00 0.00 C ATOM 516 C LYS A 289 9.596 9.562 5.358 1.00 0.00 C ATOM 517 O LYS A 289 8.610 9.156 4.744 1.00 0.00 O ATOM 518 CB LYS A 289 8.842 11.946 5.373 1.00 0.00 C ATOM 519 CG LYS A 289 8.450 12.232 6.812 1.00 0.00 C ATOM 520 CD LYS A 289 7.534 13.441 6.911 1.00 0.00 C ATOM 521 CE LYS A 289 8.304 14.740 6.732 1.00 0.00 C ATOM 522 NZ LYS A 289 9.344 14.917 7.783 1.00 0.00 N ATOM 0 H LYS A 289 10.164 11.730 3.273 1.00 0.00 H new ATOM 0 HA LYS A 289 10.753 11.224 6.045 1.00 0.00 H new ATOM 0 HB2 LYS A 289 9.064 12.888 4.872 1.00 0.00 H new ATOM 0 HB3 LYS A 289 7.992 11.502 4.855 1.00 0.00 H new ATOM 0 HG2 LYS A 289 7.950 11.360 7.234 1.00 0.00 H new ATOM 0 HG3 LYS A 289 9.347 12.404 7.407 1.00 0.00 H new ATOM 0 HD2 LYS A 289 6.755 13.371 6.152 1.00 0.00 H new ATOM 0 HD3 LYS A 289 7.036 13.443 7.880 1.00 0.00 H new ATOM 0 HE2 LYS A 289 8.775 14.750 5.749 1.00 0.00 H new ATOM 0 HE3 LYS A 289 7.611 15.580 6.762 1.00 0.00 H new ATOM 0 HZ1 LYS A 289 9.596 15.923 7.856 1.00 0.00 H new ATOM 0 HZ2 LYS A 289 8.974 14.585 8.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 289 10.189 14.366 7.531 1.00 0.00 H new ATOM 536 N ARG A 290 10.324 8.783 6.153 1.00 0.00 N ATOM 537 CA ARG A 290 9.997 7.377 6.352 1.00 0.00 C ATOM 538 C ARG A 290 8.518 7.204 6.686 1.00 0.00 C ATOM 539 O ARG A 290 8.051 7.655 7.731 1.00 0.00 O ATOM 540 CB ARG A 290 10.856 6.785 7.472 1.00 0.00 C ATOM 541 CG ARG A 290 11.128 5.298 7.310 1.00 0.00 C ATOM 542 CD ARG A 290 12.091 4.790 8.370 1.00 0.00 C ATOM 543 NE ARG A 290 11.401 4.409 9.600 1.00 0.00 N ATOM 544 CZ ARG A 290 12.021 4.202 10.756 1.00 0.00 C ATOM 545 NH1 ARG A 290 13.337 4.337 10.841 1.00 0.00 N ATOM 546 NH2 ARG A 290 11.324 3.858 11.832 1.00 0.00 N ATOM 0 H ARG A 290 11.144 9.103 6.669 1.00 0.00 H new ATOM 0 HA ARG A 290 10.206 6.847 5.423 1.00 0.00 H new ATOM 0 HB2 ARG A 290 11.806 7.318 7.510 1.00 0.00 H new ATOM 0 HB3 ARG A 290 10.359 6.953 8.427 1.00 0.00 H new ATOM 0 HG2 ARG A 290 10.190 4.746 7.374 1.00 0.00 H new ATOM 0 HG3 ARG A 290 11.542 5.108 6.320 1.00 0.00 H new ATOM 0 HD2 ARG A 290 12.638 3.932 7.981 1.00 0.00 H new ATOM 0 HD3 ARG A 290 12.827 5.563 8.592 1.00 0.00 H new ATOM 0 HE ARG A 290 10.388 4.296 9.569 1.00 0.00 H new ATOM 0 HH11 ARG A 290 13.877 4.601 10.017 1.00 0.00 H new ATOM 0 HH12 ARG A 290 13.810 4.177 11.731 1.00 0.00 H new ATOM 0 HH21 ARG A 290 10.311 3.752 11.771 1.00 0.00 H new ATOM 0 HH22 ARG A 290 11.801 3.699 12.719 1.00 0.00 H new ATOM 560 N TRP A 291 7.788 6.549 5.790 1.00 0.00 N ATOM 561 CA TRP A 291 6.362 6.317 5.990 1.00 0.00 C ATOM 562 C TRP A 291 6.061 4.825 6.086 1.00 0.00 C ATOM 563 O TRP A 291 6.494 4.040 5.243 1.00 0.00 O ATOM 564 CB TRP A 291 5.559 6.938 4.846 1.00 0.00 C ATOM 565 CG TRP A 291 5.409 8.425 4.965 1.00 0.00 C ATOM 566 CD1 TRP A 291 5.763 9.361 4.036 1.00 0.00 C ATOM 567 CD2 TRP A 291 4.866 9.145 6.077 1.00 0.00 C ATOM 568 NE1 TRP A 291 5.474 10.621 4.504 1.00 0.00 N ATOM 569 CE2 TRP A 291 4.922 10.515 5.753 1.00 0.00 C ATOM 570 CE3 TRP A 291 4.337 8.767 7.314 1.00 0.00 C ATOM 571 CZ2 TRP A 291 4.470 11.504 6.623 1.00 0.00 C ATOM 572 CZ3 TRP A 291 3.889 9.750 8.175 1.00 0.00 C ATOM 573 CH2 TRP A 291 3.957 11.105 7.827 1.00 0.00 C ATOM 0 H TRP A 291 8.159 6.170 4.919 1.00 0.00 H new ATOM 0 HA TRP A 291 6.071 6.789 6.928 1.00 0.00 H new ATOM 0 HB2 TRP A 291 6.047 6.704 3.900 1.00 0.00 H new ATOM 0 HB3 TRP A 291 4.570 6.481 4.816 1.00 0.00 H new ATOM 0 HD1 TRP A 291 6.205 9.144 3.075 1.00 0.00 H new ATOM 0 HE1 TRP A 291 5.643 11.493 4.003 1.00 0.00 H new ATOM 0 HE3 TRP A 291 4.279 7.725 7.592 1.00 0.00 H new ATOM 0 HZ2 TRP A 291 4.523 12.549 6.357 1.00 0.00 H new ATOM 0 HZ3 TRP A 291 3.479 9.469 9.134 1.00 0.00 H new ATOM 0 HH2 TRP A 291 3.598 11.849 8.522 1.00 0.00 H new ATOM 584 N GLU A 292 5.317 4.442 7.119 1.00 0.00 N ATOM 585 CA GLU A 292 4.960 3.043 7.325 1.00 0.00 C ATOM 586 C GLU A 292 3.444 2.868 7.359 1.00 0.00 C ATOM 587 O GLU A 292 2.768 3.390 8.244 1.00 0.00 O ATOM 588 CB GLU A 292 5.574 2.522 8.626 1.00 0.00 C ATOM 589 CG GLU A 292 5.470 1.015 8.788 1.00 0.00 C ATOM 590 CD GLU A 292 5.828 0.553 10.187 1.00 0.00 C ATOM 591 OE1 GLU A 292 7.018 0.644 10.555 1.00 0.00 O ATOM 592 OE2 GLU A 292 4.919 0.100 10.913 1.00 0.00 O ATOM 0 H GLU A 292 4.950 5.080 7.825 1.00 0.00 H new ATOM 0 HA GLU A 292 5.357 2.467 6.489 1.00 0.00 H new ATOM 0 HB2 GLU A 292 6.624 2.811 8.663 1.00 0.00 H new ATOM 0 HB3 GLU A 292 5.080 3.004 9.470 1.00 0.00 H new ATOM 0 HG2 GLU A 292 4.454 0.697 8.553 1.00 0.00 H new ATOM 0 HG3 GLU A 292 6.130 0.530 8.069 1.00 0.00 H new ATOM 599 N GLY A 293 2.918 2.128 6.387 1.00 0.00 N ATOM 600 CA GLY A 293 1.486 1.898 6.323 1.00 0.00 C ATOM 601 C GLY A 293 1.118 0.455 6.609 1.00 0.00 C ATOM 602 O GLY A 293 1.993 -0.400 6.752 1.00 0.00 O ATOM 0 H GLY A 293 3.457 1.684 5.644 1.00 0.00 H new ATOM 0 HA2 GLY A 293 0.984 2.547 7.041 1.00 0.00 H new ATOM 0 HA3 GLY A 293 1.120 2.174 5.334 1.00 0.00 H new ATOM 606 N LEU A 294 -0.179 0.183 6.695 1.00 0.00 N ATOM 607 CA LEU A 294 -0.662 -1.166 6.968 1.00 0.00 C ATOM 608 C LEU A 294 -1.672 -1.607 5.913 1.00 0.00 C ATOM 609 O LEU A 294 -2.494 -0.813 5.456 1.00 0.00 O ATOM 610 CB LEU A 294 -1.298 -1.230 8.357 1.00 0.00 C ATOM 611 CG LEU A 294 -2.021 -2.532 8.705 1.00 0.00 C ATOM 612 CD1 LEU A 294 -1.020 -3.637 9.003 1.00 0.00 C ATOM 613 CD2 LEU A 294 -2.955 -2.323 9.888 1.00 0.00 C ATOM 0 H LEU A 294 -0.916 0.879 6.580 1.00 0.00 H new ATOM 0 HA LEU A 294 0.191 -1.844 6.934 1.00 0.00 H new ATOM 0 HB2 LEU A 294 -0.518 -1.061 9.100 1.00 0.00 H new ATOM 0 HB3 LEU A 294 -2.008 -0.408 8.448 1.00 0.00 H new ATOM 0 HG LEU A 294 -2.618 -2.834 7.844 1.00 0.00 H new ATOM 0 HD11 LEU A 294 -1.554 -4.555 9.248 1.00 0.00 H new ATOM 0 HD12 LEU A 294 -0.392 -3.805 8.128 1.00 0.00 H new ATOM 0 HD13 LEU A 294 -0.395 -3.344 9.847 1.00 0.00 H new ATOM 0 HD21 LEU A 294 -3.461 -3.260 10.122 1.00 0.00 H new ATOM 0 HD22 LEU A 294 -2.379 -1.996 10.753 1.00 0.00 H new ATOM 0 HD23 LEU A 294 -3.695 -1.563 9.637 1.00 0.00 H new ATOM 625 N VAL A 295 -1.605 -2.878 5.532 1.00 0.00 N ATOM 626 CA VAL A 295 -2.515 -3.426 4.533 1.00 0.00 C ATOM 627 C VAL A 295 -3.498 -4.405 5.165 1.00 0.00 C ATOM 628 O VAL A 295 -3.120 -5.501 5.580 1.00 0.00 O ATOM 629 CB VAL A 295 -1.747 -4.142 3.406 1.00 0.00 C ATOM 630 CG1 VAL A 295 -2.660 -4.398 2.217 1.00 0.00 C ATOM 631 CG2 VAL A 295 -0.532 -3.327 2.990 1.00 0.00 C ATOM 0 H VAL A 295 -0.930 -3.548 5.900 1.00 0.00 H new ATOM 0 HA VAL A 295 -3.065 -2.585 4.110 1.00 0.00 H new ATOM 0 HB VAL A 295 -1.400 -5.105 3.780 1.00 0.00 H new ATOM 0 HG11 VAL A 295 -2.100 -4.904 1.431 1.00 0.00 H new ATOM 0 HG12 VAL A 295 -3.496 -5.024 2.528 1.00 0.00 H new ATOM 0 HG13 VAL A 295 -3.039 -3.449 1.838 1.00 0.00 H new ATOM 0 HG21 VAL A 295 -0.001 -3.847 2.193 1.00 0.00 H new ATOM 0 HG22 VAL A 295 -0.855 -2.349 2.633 1.00 0.00 H new ATOM 0 HG23 VAL A 295 0.131 -3.200 3.846 1.00 0.00 H new ATOM 641 N HIS A 296 -4.764 -4.003 5.234 1.00 0.00 N ATOM 642 CA HIS A 296 -5.803 -4.846 5.814 1.00 0.00 C ATOM 643 C HIS A 296 -5.975 -6.130 5.007 1.00 0.00 C ATOM 644 O HIS A 296 -5.556 -6.208 3.852 1.00 0.00 O ATOM 645 CB HIS A 296 -7.129 -4.087 5.876 1.00 0.00 C ATOM 646 CG HIS A 296 -8.137 -4.716 6.788 1.00 0.00 C ATOM 647 ND1 HIS A 296 -9.205 -5.459 6.332 1.00 0.00 N ATOM 648 CD2 HIS A 296 -8.234 -4.710 8.138 1.00 0.00 C ATOM 649 CE1 HIS A 296 -9.916 -5.882 7.362 1.00 0.00 C ATOM 650 NE2 HIS A 296 -9.348 -5.441 8.470 1.00 0.00 N ATOM 0 H HIS A 296 -5.094 -3.099 4.896 1.00 0.00 H new ATOM 0 HA HIS A 296 -5.498 -5.112 6.826 1.00 0.00 H new ATOM 0 HB2 HIS A 296 -6.939 -3.066 6.207 1.00 0.00 H new ATOM 0 HB3 HIS A 296 -7.549 -4.023 4.872 1.00 0.00 H new ATOM 0 HD2 HIS A 296 -7.560 -4.221 8.826 1.00 0.00 H new ATOM 0 HE1 HIS A 296 -10.810 -6.486 7.307 1.00 0.00 H new ATOM 0 HE2 HIS A 296 -9.682 -5.615 9.418 1.00 0.00 H new ATOM 658 N ILE A 297 -6.591 -7.132 5.624 1.00 0.00 N ATOM 659 CA ILE A 297 -6.818 -8.411 4.963 1.00 0.00 C ATOM 660 C ILE A 297 -7.660 -8.237 3.703 1.00 0.00 C ATOM 661 O ILE A 297 -7.667 -9.100 2.825 1.00 0.00 O ATOM 662 CB ILE A 297 -7.518 -9.413 5.900 1.00 0.00 C ATOM 663 CG1 ILE A 297 -7.565 -10.800 5.256 1.00 0.00 C ATOM 664 CG2 ILE A 297 -8.922 -8.932 6.236 1.00 0.00 C ATOM 665 CD1 ILE A 297 -7.868 -11.912 6.236 1.00 0.00 C ATOM 0 H ILE A 297 -6.942 -7.083 6.581 1.00 0.00 H new ATOM 0 HA ILE A 297 -5.838 -8.804 4.691 1.00 0.00 H new ATOM 0 HB ILE A 297 -6.947 -9.482 6.826 1.00 0.00 H new ATOM 0 HG12 ILE A 297 -8.322 -10.802 4.472 1.00 0.00 H new ATOM 0 HG13 ILE A 297 -6.607 -11.001 4.776 1.00 0.00 H new ATOM 0 HG21 ILE A 297 -9.404 -9.651 6.899 1.00 0.00 H new ATOM 0 HG22 ILE A 297 -8.866 -7.963 6.731 1.00 0.00 H new ATOM 0 HG23 ILE A 297 -9.504 -8.838 5.319 1.00 0.00 H new ATOM 0 HD11 ILE A 297 -7.886 -12.866 5.709 1.00 0.00 H new ATOM 0 HD12 ILE A 297 -7.098 -11.937 7.007 1.00 0.00 H new ATOM 0 HD13 ILE A 297 -8.839 -11.735 6.698 1.00 0.00 H new ATOM 677 N SER A 298 -8.366 -7.114 3.620 1.00 0.00 N ATOM 678 CA SER A 298 -9.213 -6.827 2.468 1.00 0.00 C ATOM 679 C SER A 298 -8.391 -6.248 1.321 1.00 0.00 C ATOM 680 O SER A 298 -8.855 -6.182 0.183 1.00 0.00 O ATOM 681 CB SER A 298 -10.325 -5.852 2.857 1.00 0.00 C ATOM 682 OG SER A 298 -9.792 -4.676 3.441 1.00 0.00 O ATOM 0 H SER A 298 -8.368 -6.388 4.337 1.00 0.00 H new ATOM 0 HA SER A 298 -9.661 -7.763 2.134 1.00 0.00 H new ATOM 0 HB2 SER A 298 -10.909 -5.591 1.974 1.00 0.00 H new ATOM 0 HB3 SER A 298 -11.006 -6.334 3.559 1.00 0.00 H new ATOM 0 HG SER A 298 -9.606 -4.837 4.390 1.00 0.00 H new ATOM 688 N GLU A 299 -7.167 -5.829 1.630 1.00 0.00 N ATOM 689 CA GLU A 299 -6.281 -5.254 0.625 1.00 0.00 C ATOM 690 C GLU A 299 -5.185 -6.243 0.236 1.00 0.00 C ATOM 691 O GLU A 299 -4.021 -5.870 0.085 1.00 0.00 O ATOM 692 CB GLU A 299 -5.653 -3.960 1.146 1.00 0.00 C ATOM 693 CG GLU A 299 -6.637 -2.807 1.254 1.00 0.00 C ATOM 694 CD GLU A 299 -6.275 -1.833 2.358 1.00 0.00 C ATOM 695 OE1 GLU A 299 -5.067 -1.588 2.560 1.00 0.00 O ATOM 696 OE2 GLU A 299 -7.198 -1.315 3.021 1.00 0.00 O ATOM 0 H GLU A 299 -6.767 -5.877 2.567 1.00 0.00 H new ATOM 0 HA GLU A 299 -6.876 -5.030 -0.260 1.00 0.00 H new ATOM 0 HB2 GLU A 299 -5.216 -4.147 2.127 1.00 0.00 H new ATOM 0 HB3 GLU A 299 -4.837 -3.670 0.484 1.00 0.00 H new ATOM 0 HG2 GLU A 299 -6.674 -2.275 0.303 1.00 0.00 H new ATOM 0 HG3 GLU A 299 -7.636 -3.203 1.437 1.00 0.00 H new ATOM 703 N LEU A 300 -5.566 -7.506 0.076 1.00 0.00 N ATOM 704 CA LEU A 300 -4.617 -8.550 -0.294 1.00 0.00 C ATOM 705 C LEU A 300 -5.144 -9.374 -1.465 1.00 0.00 C ATOM 706 O LEU A 300 -4.443 -9.584 -2.454 1.00 0.00 O ATOM 707 CB LEU A 300 -4.339 -9.461 0.902 1.00 0.00 C ATOM 708 CG LEU A 300 -3.808 -8.774 2.161 1.00 0.00 C ATOM 709 CD1 LEU A 300 -3.635 -9.782 3.287 1.00 0.00 C ATOM 710 CD2 LEU A 300 -2.493 -8.067 1.868 1.00 0.00 C ATOM 0 H LEU A 300 -6.525 -7.831 0.197 1.00 0.00 H new ATOM 0 HA LEU A 300 -3.687 -8.070 -0.600 1.00 0.00 H new ATOM 0 HB2 LEU A 300 -5.261 -9.982 1.158 1.00 0.00 H new ATOM 0 HB3 LEU A 300 -3.619 -10.220 0.595 1.00 0.00 H new ATOM 0 HG LEU A 300 -4.536 -8.027 2.479 1.00 0.00 H new ATOM 0 HD11 LEU A 300 -3.256 -9.275 4.174 1.00 0.00 H new ATOM 0 HD12 LEU A 300 -4.597 -10.242 3.514 1.00 0.00 H new ATOM 0 HD13 LEU A 300 -2.928 -10.553 2.980 1.00 0.00 H new ATOM 0 HD21 LEU A 300 -2.130 -7.584 2.775 1.00 0.00 H new ATOM 0 HD22 LEU A 300 -1.757 -8.794 1.525 1.00 0.00 H new ATOM 0 HD23 LEU A 300 -2.649 -7.316 1.094 1.00 0.00 H new ATOM 856 N VAL A 309 -2.661 -13.897 6.374 1.00 0.00 N ATOM 857 CA VAL A 309 -1.698 -13.036 5.698 1.00 0.00 C ATOM 858 C VAL A 309 -0.330 -13.703 5.613 1.00 0.00 C ATOM 859 O VAL A 309 0.429 -13.467 4.674 1.00 0.00 O ATOM 860 CB VAL A 309 -1.554 -11.682 6.417 1.00 0.00 C ATOM 861 CG1 VAL A 309 -0.696 -10.730 5.596 1.00 0.00 C ATOM 862 CG2 VAL A 309 -2.922 -11.077 6.692 1.00 0.00 C ATOM 0 HA VAL A 309 -2.078 -12.865 4.691 1.00 0.00 H new ATOM 0 HB VAL A 309 -1.057 -11.849 7.373 1.00 0.00 H new ATOM 0 HG11 VAL A 309 -0.605 -9.778 6.120 1.00 0.00 H new ATOM 0 HG12 VAL A 309 0.295 -11.163 5.455 1.00 0.00 H new ATOM 0 HG13 VAL A 309 -1.162 -10.566 4.624 1.00 0.00 H new ATOM 0 HG21 VAL A 309 -2.801 -10.121 7.201 1.00 0.00 H new ATOM 0 HG22 VAL A 309 -3.448 -10.923 5.750 1.00 0.00 H new ATOM 0 HG23 VAL A 309 -3.499 -11.753 7.323 1.00 0.00 H new ATOM 872 N ALA A 310 -0.022 -14.537 6.601 1.00 0.00 N ATOM 873 CA ALA A 310 1.254 -15.241 6.637 1.00 0.00 C ATOM 874 C ALA A 310 1.678 -15.681 5.240 1.00 0.00 C ATOM 875 O ALA A 310 2.733 -15.282 4.746 1.00 0.00 O ATOM 876 CB ALA A 310 1.168 -16.441 7.567 1.00 0.00 C ATOM 0 H ALA A 310 -0.639 -14.742 7.387 1.00 0.00 H new ATOM 0 HA ALA A 310 2.010 -14.554 7.018 1.00 0.00 H new ATOM 0 HB1 ALA A 310 2.128 -16.957 7.584 1.00 0.00 H new ATOM 0 HB2 ALA A 310 0.919 -16.104 8.573 1.00 0.00 H new ATOM 0 HB3 ALA A 310 0.396 -17.123 7.211 1.00 0.00 H new ATOM 882 N ASP A 311 0.849 -16.505 4.607 1.00 0.00 N ATOM 883 CA ASP A 311 1.139 -16.999 3.266 1.00 0.00 C ATOM 884 C ASP A 311 1.016 -15.881 2.237 1.00 0.00 C ATOM 885 O ASP A 311 1.679 -15.902 1.199 1.00 0.00 O ATOM 886 CB ASP A 311 0.192 -18.146 2.907 1.00 0.00 C ATOM 887 CG ASP A 311 0.677 -19.483 3.433 1.00 0.00 C ATOM 888 OD1 ASP A 311 1.215 -19.518 4.559 1.00 0.00 O ATOM 889 OD2 ASP A 311 0.520 -20.494 2.717 1.00 0.00 O ATOM 0 H ASP A 311 -0.028 -16.844 5.001 1.00 0.00 H new ATOM 0 HA ASP A 311 2.165 -17.367 3.255 1.00 0.00 H new ATOM 0 HB2 ASP A 311 -0.798 -17.937 3.313 1.00 0.00 H new ATOM 0 HB3 ASP A 311 0.087 -18.201 1.823 1.00 0.00 H new ATOM 894 N VAL A 312 0.163 -14.904 2.530 1.00 0.00 N ATOM 895 CA VAL A 312 -0.047 -13.777 1.630 1.00 0.00 C ATOM 896 C VAL A 312 1.241 -12.987 1.428 1.00 0.00 C ATOM 897 O VAL A 312 1.578 -12.603 0.308 1.00 0.00 O ATOM 898 CB VAL A 312 -1.139 -12.829 2.162 1.00 0.00 C ATOM 899 CG1 VAL A 312 -1.271 -11.609 1.265 1.00 0.00 C ATOM 900 CG2 VAL A 312 -2.468 -13.561 2.280 1.00 0.00 C ATOM 0 H VAL A 312 -0.394 -14.871 3.384 1.00 0.00 H new ATOM 0 HA VAL A 312 -0.369 -14.191 0.675 1.00 0.00 H new ATOM 0 HB VAL A 312 -0.848 -12.489 3.156 1.00 0.00 H new ATOM 0 HG11 VAL A 312 -2.047 -10.951 1.657 1.00 0.00 H new ATOM 0 HG12 VAL A 312 -0.322 -11.074 1.237 1.00 0.00 H new ATOM 0 HG13 VAL A 312 -1.539 -11.926 0.257 1.00 0.00 H new ATOM 0 HG21 VAL A 312 -3.228 -12.877 2.657 1.00 0.00 H new ATOM 0 HG22 VAL A 312 -2.768 -13.931 1.300 1.00 0.00 H new ATOM 0 HG23 VAL A 312 -2.362 -14.400 2.968 1.00 0.00 H new ATOM 910 N VAL A 313 1.959 -12.748 2.521 1.00 0.00 N ATOM 911 CA VAL A 313 3.213 -12.006 2.464 1.00 0.00 C ATOM 912 C VAL A 313 4.218 -12.546 3.475 1.00 0.00 C ATOM 913 O VAL A 313 3.841 -13.166 4.469 1.00 0.00 O ATOM 914 CB VAL A 313 2.989 -10.505 2.731 1.00 0.00 C ATOM 915 CG1 VAL A 313 2.117 -9.894 1.644 1.00 0.00 C ATOM 916 CG2 VAL A 313 2.369 -10.295 4.104 1.00 0.00 C ATOM 0 H VAL A 313 1.694 -13.057 3.456 1.00 0.00 H new ATOM 0 HA VAL A 313 3.611 -12.134 1.457 1.00 0.00 H new ATOM 0 HB VAL A 313 3.956 -10.002 2.714 1.00 0.00 H new ATOM 0 HG11 VAL A 313 1.969 -8.834 1.849 1.00 0.00 H new ATOM 0 HG12 VAL A 313 2.605 -10.012 0.677 1.00 0.00 H new ATOM 0 HG13 VAL A 313 1.151 -10.398 1.627 1.00 0.00 H new ATOM 0 HG21 VAL A 313 2.218 -9.229 4.276 1.00 0.00 H new ATOM 0 HG22 VAL A 313 1.410 -10.810 4.153 1.00 0.00 H new ATOM 0 HG23 VAL A 313 3.035 -10.695 4.869 1.00 0.00 H new ATOM 926 N SER A 314 5.499 -12.305 3.215 1.00 0.00 N ATOM 927 CA SER A 314 6.560 -12.771 4.100 1.00 0.00 C ATOM 928 C SER A 314 7.223 -11.598 4.817 1.00 0.00 C ATOM 929 O SER A 314 6.966 -10.436 4.501 1.00 0.00 O ATOM 930 CB SER A 314 7.606 -13.557 3.308 1.00 0.00 C ATOM 931 OG SER A 314 8.400 -14.357 4.167 1.00 0.00 O ATOM 0 H SER A 314 5.827 -11.790 2.398 1.00 0.00 H new ATOM 0 HA SER A 314 6.114 -13.427 4.848 1.00 0.00 H new ATOM 0 HB2 SER A 314 7.110 -14.190 2.572 1.00 0.00 H new ATOM 0 HB3 SER A 314 8.244 -12.866 2.756 1.00 0.00 H new ATOM 0 HG SER A 314 9.060 -14.851 3.637 1.00 0.00 H new ATOM 937 N LYS A 315 8.078 -11.911 5.784 1.00 0.00 N ATOM 938 CA LYS A 315 8.780 -10.886 6.547 1.00 0.00 C ATOM 939 C LYS A 315 9.999 -10.379 5.782 1.00 0.00 C ATOM 940 O LYS A 315 10.879 -11.155 5.413 1.00 0.00 O ATOM 941 CB LYS A 315 9.212 -11.438 7.907 1.00 0.00 C ATOM 942 CG LYS A 315 9.991 -10.442 8.748 1.00 0.00 C ATOM 943 CD LYS A 315 10.171 -10.937 10.174 1.00 0.00 C ATOM 944 CE LYS A 315 11.449 -10.396 10.795 1.00 0.00 C ATOM 945 NZ LYS A 315 12.664 -10.922 10.112 1.00 0.00 N ATOM 0 H LYS A 315 8.302 -12.868 6.058 1.00 0.00 H new ATOM 0 HA LYS A 315 8.096 -10.052 6.702 1.00 0.00 H new ATOM 0 HB2 LYS A 315 8.327 -11.753 8.459 1.00 0.00 H new ATOM 0 HB3 LYS A 315 9.824 -12.326 7.751 1.00 0.00 H new ATOM 0 HG2 LYS A 315 10.968 -10.268 8.296 1.00 0.00 H new ATOM 0 HG3 LYS A 315 9.469 -9.485 8.757 1.00 0.00 H new ATOM 0 HD2 LYS A 315 9.315 -10.632 10.777 1.00 0.00 H new ATOM 0 HD3 LYS A 315 10.195 -12.027 10.182 1.00 0.00 H new ATOM 0 HE2 LYS A 315 11.446 -9.307 10.742 1.00 0.00 H new ATOM 0 HE3 LYS A 315 11.481 -10.664 11.851 1.00 0.00 H new ATOM 0 HZ1 LYS A 315 13.465 -10.915 10.775 1.00 0.00 H new ATOM 0 HZ2 LYS A 315 12.488 -11.896 9.792 1.00 0.00 H new ATOM 0 HZ3 LYS A 315 12.888 -10.323 9.292 1.00 0.00 H new ATOM 959 N GLY A 316 10.044 -9.071 5.549 1.00 0.00 N ATOM 960 CA GLY A 316 11.160 -8.483 4.831 1.00 0.00 C ATOM 961 C GLY A 316 11.085 -8.733 3.338 1.00 0.00 C ATOM 962 O GLY A 316 12.107 -8.740 2.652 1.00 0.00 O ATOM 0 H GLY A 316 9.328 -8.408 5.845 1.00 0.00 H new ATOM 0 HA2 GLY A 316 11.182 -7.409 5.016 1.00 0.00 H new ATOM 0 HA3 GLY A 316 12.093 -8.892 5.218 1.00 0.00 H new ATOM 966 N GLN A 317 9.873 -8.939 2.834 1.00 0.00 N ATOM 967 CA GLN A 317 9.670 -9.193 1.413 1.00 0.00 C ATOM 968 C GLN A 317 9.270 -7.915 0.683 1.00 0.00 C ATOM 969 O GLN A 317 8.417 -7.161 1.153 1.00 0.00 O ATOM 970 CB GLN A 317 8.597 -10.265 1.213 1.00 0.00 C ATOM 971 CG GLN A 317 8.439 -10.705 -0.234 1.00 0.00 C ATOM 972 CD GLN A 317 7.145 -11.457 -0.477 1.00 0.00 C ATOM 973 OE1 GLN A 317 7.108 -12.686 -0.418 1.00 0.00 O ATOM 974 NE2 GLN A 317 6.075 -10.721 -0.751 1.00 0.00 N ATOM 0 H GLN A 317 9.017 -8.935 3.388 1.00 0.00 H new ATOM 0 HA GLN A 317 10.612 -9.549 0.995 1.00 0.00 H new ATOM 0 HB2 GLN A 317 8.845 -11.134 1.823 1.00 0.00 H new ATOM 0 HB3 GLN A 317 7.642 -9.883 1.574 1.00 0.00 H new ATOM 0 HG2 GLN A 317 8.473 -9.829 -0.882 1.00 0.00 H new ATOM 0 HG3 GLN A 317 9.281 -11.339 -0.511 1.00 0.00 H new ATOM 0 HE21 GLN A 317 6.151 -9.705 -0.790 1.00 0.00 H new ATOM 0 HE22 GLN A 317 5.176 -11.172 -0.923 1.00 0.00 H new ATOM 983 N ARG A 318 9.891 -7.677 -0.467 1.00 0.00 N ATOM 984 CA ARG A 318 9.601 -6.489 -1.261 1.00 0.00 C ATOM 985 C ARG A 318 8.248 -6.616 -1.955 1.00 0.00 C ATOM 986 O ARG A 318 7.965 -7.620 -2.609 1.00 0.00 O ATOM 987 CB ARG A 318 10.700 -6.264 -2.301 1.00 0.00 C ATOM 988 CG ARG A 318 10.837 -7.402 -3.299 1.00 0.00 C ATOM 989 CD ARG A 318 12.129 -7.294 -4.094 1.00 0.00 C ATOM 990 NE ARG A 318 12.114 -8.145 -5.281 1.00 0.00 N ATOM 991 CZ ARG A 318 12.940 -7.986 -6.309 1.00 0.00 C ATOM 992 NH1 ARG A 318 13.842 -7.014 -6.295 1.00 0.00 N ATOM 993 NH2 ARG A 318 12.866 -8.801 -7.353 1.00 0.00 N ATOM 0 H ARG A 318 10.599 -8.291 -0.870 1.00 0.00 H new ATOM 0 HA ARG A 318 9.566 -5.632 -0.588 1.00 0.00 H new ATOM 0 HB2 ARG A 318 10.493 -5.341 -2.842 1.00 0.00 H new ATOM 0 HB3 ARG A 318 11.652 -6.126 -1.788 1.00 0.00 H new ATOM 0 HG2 ARG A 318 10.812 -8.355 -2.771 1.00 0.00 H new ATOM 0 HG3 ARG A 318 9.987 -7.393 -3.981 1.00 0.00 H new ATOM 0 HD2 ARG A 318 12.285 -6.258 -4.393 1.00 0.00 H new ATOM 0 HD3 ARG A 318 12.970 -7.573 -3.459 1.00 0.00 H new ATOM 0 HE ARG A 318 11.432 -8.903 -5.323 1.00 0.00 H new ATOM 0 HH11 ARG A 318 13.903 -6.386 -5.493 1.00 0.00 H new ATOM 0 HH12 ARG A 318 14.475 -6.894 -7.086 1.00 0.00 H new ATOM 0 HH21 ARG A 318 12.174 -9.551 -7.367 1.00 0.00 H new ATOM 0 HH22 ARG A 318 13.501 -8.678 -8.142 1.00 0.00 H new ATOM 1007 N VAL A 319 7.414 -5.591 -1.806 1.00 0.00 N ATOM 1008 CA VAL A 319 6.091 -5.587 -2.419 1.00 0.00 C ATOM 1009 C VAL A 319 5.745 -4.208 -2.970 1.00 0.00 C ATOM 1010 O VAL A 319 6.322 -3.200 -2.561 1.00 0.00 O ATOM 1011 CB VAL A 319 5.006 -6.012 -1.412 1.00 0.00 C ATOM 1012 CG1 VAL A 319 5.194 -7.466 -1.007 1.00 0.00 C ATOM 1013 CG2 VAL A 319 5.025 -5.104 -0.192 1.00 0.00 C ATOM 0 H VAL A 319 7.631 -4.753 -1.266 1.00 0.00 H new ATOM 0 HA VAL A 319 6.119 -6.306 -3.238 1.00 0.00 H new ATOM 0 HB VAL A 319 4.032 -5.916 -1.892 1.00 0.00 H new ATOM 0 HG11 VAL A 319 4.418 -7.749 -0.295 1.00 0.00 H new ATOM 0 HG12 VAL A 319 5.125 -8.101 -1.890 1.00 0.00 H new ATOM 0 HG13 VAL A 319 6.173 -7.591 -0.545 1.00 0.00 H new ATOM 0 HG21 VAL A 319 4.252 -5.419 0.508 1.00 0.00 H new ATOM 0 HG22 VAL A 319 6.000 -5.165 0.292 1.00 0.00 H new ATOM 0 HG23 VAL A 319 4.837 -4.076 -0.501 1.00 0.00 H new ATOM 1023 N LYS A 320 4.798 -4.170 -3.901 1.00 0.00 N ATOM 1024 CA LYS A 320 4.372 -2.915 -4.509 1.00 0.00 C ATOM 1025 C LYS A 320 2.985 -2.515 -4.015 1.00 0.00 C ATOM 1026 O LYS A 320 2.037 -3.297 -4.094 1.00 0.00 O ATOM 1027 CB LYS A 320 4.365 -3.039 -6.034 1.00 0.00 C ATOM 1028 CG LYS A 320 5.696 -3.488 -6.613 1.00 0.00 C ATOM 1029 CD LYS A 320 5.601 -3.722 -8.112 1.00 0.00 C ATOM 1030 CE LYS A 320 6.957 -3.581 -8.785 1.00 0.00 C ATOM 1031 NZ LYS A 320 7.402 -2.161 -8.844 1.00 0.00 N ATOM 0 H LYS A 320 4.310 -4.995 -4.251 1.00 0.00 H new ATOM 0 HA LYS A 320 5.081 -2.140 -4.217 1.00 0.00 H new ATOM 0 HB2 LYS A 320 3.592 -3.748 -6.329 1.00 0.00 H new ATOM 0 HB3 LYS A 320 4.096 -2.076 -6.467 1.00 0.00 H new ATOM 0 HG2 LYS A 320 6.456 -2.734 -6.409 1.00 0.00 H new ATOM 0 HG3 LYS A 320 6.017 -4.406 -6.120 1.00 0.00 H new ATOM 0 HD2 LYS A 320 5.202 -4.718 -8.301 1.00 0.00 H new ATOM 0 HD3 LYS A 320 4.901 -3.010 -8.549 1.00 0.00 H new ATOM 0 HE2 LYS A 320 7.695 -4.171 -8.241 1.00 0.00 H new ATOM 0 HE3 LYS A 320 6.905 -3.988 -9.795 1.00 0.00 H new ATOM 0 HZ1 LYS A 320 7.568 -1.890 -9.834 1.00 0.00 H new ATOM 0 HZ2 LYS A 320 6.666 -1.549 -8.436 1.00 0.00 H new ATOM 0 HZ3 LYS A 320 8.283 -2.051 -8.303 1.00 0.00 H new ATOM 1045 N VAL A 321 2.873 -1.292 -3.507 1.00 0.00 N ATOM 1046 CA VAL A 321 1.601 -0.787 -3.003 1.00 0.00 C ATOM 1047 C VAL A 321 1.298 0.598 -3.564 1.00 0.00 C ATOM 1048 O VAL A 321 2.153 1.229 -4.186 1.00 0.00 O ATOM 1049 CB VAL A 321 1.595 -0.717 -1.464 1.00 0.00 C ATOM 1050 CG1 VAL A 321 1.793 -2.102 -0.866 1.00 0.00 C ATOM 1051 CG2 VAL A 321 2.666 0.244 -0.970 1.00 0.00 C ATOM 0 H VAL A 321 3.648 -0.632 -3.433 1.00 0.00 H new ATOM 0 HA VAL A 321 0.831 -1.485 -3.331 1.00 0.00 H new ATOM 0 HB VAL A 321 0.625 -0.342 -1.138 1.00 0.00 H new ATOM 0 HG11 VAL A 321 1.786 -2.033 0.222 1.00 0.00 H new ATOM 0 HG12 VAL A 321 0.987 -2.758 -1.193 1.00 0.00 H new ATOM 0 HG13 VAL A 321 2.749 -2.508 -1.198 1.00 0.00 H new ATOM 0 HG21 VAL A 321 2.647 0.281 0.119 1.00 0.00 H new ATOM 0 HG22 VAL A 321 3.645 -0.099 -1.305 1.00 0.00 H new ATOM 0 HG23 VAL A 321 2.474 1.240 -1.370 1.00 0.00 H new ATOM 1061 N LYS A 322 0.075 1.066 -3.341 1.00 0.00 N ATOM 1062 CA LYS A 322 -0.342 2.378 -3.822 1.00 0.00 C ATOM 1063 C LYS A 322 -0.856 3.241 -2.674 1.00 0.00 C ATOM 1064 O LYS A 322 -1.487 2.741 -1.742 1.00 0.00 O ATOM 1065 CB LYS A 322 -1.429 2.230 -4.889 1.00 0.00 C ATOM 1066 CG LYS A 322 -1.985 3.556 -5.379 1.00 0.00 C ATOM 1067 CD LYS A 322 -3.364 3.389 -5.996 1.00 0.00 C ATOM 1068 CE LYS A 322 -3.274 3.005 -7.465 1.00 0.00 C ATOM 1069 NZ LYS A 322 -4.565 2.467 -7.977 1.00 0.00 N ATOM 0 H LYS A 322 -0.645 0.556 -2.830 1.00 0.00 H new ATOM 0 HA LYS A 322 0.526 2.869 -4.261 1.00 0.00 H new ATOM 0 HB2 LYS A 322 -1.021 1.681 -5.738 1.00 0.00 H new ATOM 0 HB3 LYS A 322 -2.245 1.631 -4.484 1.00 0.00 H new ATOM 0 HG2 LYS A 322 -2.040 4.258 -4.547 1.00 0.00 H new ATOM 0 HG3 LYS A 322 -1.306 3.987 -6.115 1.00 0.00 H new ATOM 0 HD2 LYS A 322 -3.917 2.623 -5.452 1.00 0.00 H new ATOM 0 HD3 LYS A 322 -3.924 4.319 -5.895 1.00 0.00 H new ATOM 0 HE2 LYS A 322 -2.986 3.877 -8.052 1.00 0.00 H new ATOM 0 HE3 LYS A 322 -2.491 2.259 -7.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 322 -4.575 2.518 -9.016 1.00 0.00 H new ATOM 0 HZ2 LYS A 322 -4.671 1.476 -7.678 1.00 0.00 H new ATOM 0 HZ3 LYS A 322 -5.352 3.030 -7.595 1.00 0.00 H new ATOM 1083 N VAL A 323 -0.583 4.540 -2.747 1.00 0.00 N ATOM 1084 CA VAL A 323 -1.020 5.472 -1.715 1.00 0.00 C ATOM 1085 C VAL A 323 -2.509 5.775 -1.843 1.00 0.00 C ATOM 1086 O VAL A 323 -2.927 6.530 -2.723 1.00 0.00 O ATOM 1087 CB VAL A 323 -0.231 6.793 -1.782 1.00 0.00 C ATOM 1088 CG1 VAL A 323 -0.726 7.766 -0.723 1.00 0.00 C ATOM 1089 CG2 VAL A 323 1.259 6.532 -1.623 1.00 0.00 C ATOM 0 H VAL A 323 -0.061 4.970 -3.510 1.00 0.00 H new ATOM 0 HA VAL A 323 -0.831 4.993 -0.755 1.00 0.00 H new ATOM 0 HB VAL A 323 -0.395 7.244 -2.760 1.00 0.00 H new ATOM 0 HG11 VAL A 323 -0.156 8.693 -0.786 1.00 0.00 H new ATOM 0 HG12 VAL A 323 -1.783 7.977 -0.888 1.00 0.00 H new ATOM 0 HG13 VAL A 323 -0.594 7.326 0.265 1.00 0.00 H new ATOM 0 HG21 VAL A 323 1.801 7.476 -1.673 1.00 0.00 H new ATOM 0 HG22 VAL A 323 1.444 6.058 -0.659 1.00 0.00 H new ATOM 0 HG23 VAL A 323 1.601 5.875 -2.423 1.00 0.00 H new ATOM 1099 N LEU A 324 -3.305 5.184 -0.960 1.00 0.00 N ATOM 1100 CA LEU A 324 -4.749 5.390 -0.973 1.00 0.00 C ATOM 1101 C LEU A 324 -5.103 6.788 -0.475 1.00 0.00 C ATOM 1102 O LEU A 324 -5.701 7.583 -1.201 1.00 0.00 O ATOM 1103 CB LEU A 324 -5.443 4.337 -0.107 1.00 0.00 C ATOM 1104 CG LEU A 324 -5.383 2.899 -0.622 1.00 0.00 C ATOM 1105 CD1 LEU A 324 -5.766 1.921 0.477 1.00 0.00 C ATOM 1106 CD2 LEU A 324 -6.291 2.727 -1.831 1.00 0.00 C ATOM 0 H LEU A 324 -2.975 4.558 -0.225 1.00 0.00 H new ATOM 0 HA LEU A 324 -5.096 5.291 -2.001 1.00 0.00 H new ATOM 0 HB2 LEU A 324 -4.999 4.364 0.888 1.00 0.00 H new ATOM 0 HB3 LEU A 324 -6.490 4.619 0.003 1.00 0.00 H new ATOM 0 HG LEU A 324 -4.359 2.686 -0.928 1.00 0.00 H new ATOM 0 HD11 LEU A 324 -5.717 0.903 0.091 1.00 0.00 H new ATOM 0 HD12 LEU A 324 -5.075 2.025 1.314 1.00 0.00 H new ATOM 0 HD13 LEU A 324 -6.780 2.133 0.815 1.00 0.00 H new ATOM 0 HD21 LEU A 324 -6.236 1.697 -2.184 1.00 0.00 H new ATOM 0 HD22 LEU A 324 -7.318 2.960 -1.551 1.00 0.00 H new ATOM 0 HD23 LEU A 324 -5.970 3.401 -2.626 1.00 0.00 H new ATOM 1118 N SER A 325 -4.729 7.081 0.766 1.00 0.00 N ATOM 1119 CA SER A 325 -5.009 8.383 1.361 1.00 0.00 C ATOM 1120 C SER A 325 -4.013 8.696 2.474 1.00 0.00 C ATOM 1121 O SER A 325 -3.591 7.807 3.214 1.00 0.00 O ATOM 1122 CB SER A 325 -6.435 8.419 1.913 1.00 0.00 C ATOM 1123 OG SER A 325 -6.821 9.742 2.243 1.00 0.00 O ATOM 0 H SER A 325 -4.232 6.435 1.379 1.00 0.00 H new ATOM 0 HA SER A 325 -4.909 9.140 0.583 1.00 0.00 H new ATOM 0 HB2 SER A 325 -7.124 8.009 1.175 1.00 0.00 H new ATOM 0 HB3 SER A 325 -6.502 7.786 2.798 1.00 0.00 H new ATOM 0 HG SER A 325 -7.737 9.738 2.592 1.00 0.00 H new ATOM 1129 N PHE A 326 -3.641 9.967 2.586 1.00 0.00 N ATOM 1130 CA PHE A 326 -2.694 10.400 3.607 1.00 0.00 C ATOM 1131 C PHE A 326 -3.293 11.507 4.470 1.00 0.00 C ATOM 1132 O PHE A 326 -3.787 12.512 3.957 1.00 0.00 O ATOM 1133 CB PHE A 326 -1.398 10.889 2.957 1.00 0.00 C ATOM 1134 CG PHE A 326 -0.445 11.528 3.926 1.00 0.00 C ATOM 1135 CD1 PHE A 326 -0.701 12.789 4.440 1.00 0.00 C ATOM 1136 CD2 PHE A 326 0.706 10.868 4.323 1.00 0.00 C ATOM 1137 CE1 PHE A 326 0.174 13.379 5.331 1.00 0.00 C ATOM 1138 CE2 PHE A 326 1.586 11.453 5.214 1.00 0.00 C ATOM 1139 CZ PHE A 326 1.318 12.710 5.720 1.00 0.00 C ATOM 0 H PHE A 326 -3.981 10.715 1.982 1.00 0.00 H new ATOM 0 HA PHE A 326 -2.471 9.546 4.246 1.00 0.00 H new ATOM 0 HB2 PHE A 326 -0.903 10.046 2.475 1.00 0.00 H new ATOM 0 HB3 PHE A 326 -1.642 11.606 2.173 1.00 0.00 H new ATOM 0 HD1 PHE A 326 -1.595 13.316 4.141 1.00 0.00 H new ATOM 0 HD2 PHE A 326 0.919 9.884 3.932 1.00 0.00 H new ATOM 0 HE1 PHE A 326 -0.036 14.363 5.723 1.00 0.00 H new ATOM 0 HE2 PHE A 326 2.481 10.928 5.514 1.00 0.00 H new ATOM 0 HZ PHE A 326 2.002 13.169 6.419 1.00 0.00 H new ATOM 1149 N THR A 327 -3.245 11.316 5.784 1.00 0.00 N ATOM 1150 CA THR A 327 -3.784 12.296 6.719 1.00 0.00 C ATOM 1151 C THR A 327 -3.016 12.279 8.036 1.00 0.00 C ATOM 1152 O THR A 327 -3.091 11.316 8.798 1.00 0.00 O ATOM 1153 CB THR A 327 -5.275 12.039 7.005 1.00 0.00 C ATOM 1154 OG1 THR A 327 -5.749 12.957 7.996 1.00 0.00 O ATOM 1155 CG2 THR A 327 -5.497 10.612 7.481 1.00 0.00 C ATOM 0 H THR A 327 -2.838 10.491 6.225 1.00 0.00 H new ATOM 0 HA THR A 327 -3.675 13.274 6.250 1.00 0.00 H new ATOM 0 HB THR A 327 -5.830 12.186 6.079 1.00 0.00 H new ATOM 0 HG1 THR A 327 -6.698 12.788 8.171 1.00 0.00 H new ATOM 0 HG21 THR A 327 -6.558 10.455 7.677 1.00 0.00 H new ATOM 0 HG22 THR A 327 -5.163 9.916 6.712 1.00 0.00 H new ATOM 0 HG23 THR A 327 -4.930 10.441 8.396 1.00 0.00 H new ATOM 1163 N GLY A 328 -2.276 13.353 8.298 1.00 0.00 N ATOM 1164 CA GLY A 328 -1.505 13.441 9.524 1.00 0.00 C ATOM 1165 C GLY A 328 -0.599 12.243 9.727 1.00 0.00 C ATOM 1166 O GLY A 328 0.298 11.989 8.922 1.00 0.00 O ATOM 0 H GLY A 328 -2.197 14.163 7.683 1.00 0.00 H new ATOM 0 HA2 GLY A 328 -0.903 14.349 9.506 1.00 0.00 H new ATOM 0 HA3 GLY A 328 -2.185 13.526 10.372 1.00 0.00 H new ATOM 1170 N THR A 329 -0.830 11.504 10.808 1.00 0.00 N ATOM 1171 CA THR A 329 -0.026 10.328 11.116 1.00 0.00 C ATOM 1172 C THR A 329 -0.731 9.049 10.676 1.00 0.00 C ATOM 1173 O THR A 329 -0.667 8.027 11.359 1.00 0.00 O ATOM 1174 CB THR A 329 0.284 10.238 12.622 1.00 0.00 C ATOM 1175 OG1 THR A 329 -0.934 10.124 13.367 1.00 0.00 O ATOM 1176 CG2 THR A 329 1.058 11.461 13.089 1.00 0.00 C ATOM 0 H THR A 329 -1.568 11.700 11.485 1.00 0.00 H new ATOM 0 HA THR A 329 0.909 10.432 10.566 1.00 0.00 H new ATOM 0 HB THR A 329 0.897 9.353 12.792 1.00 0.00 H new ATOM 0 HG1 THR A 329 -0.728 10.066 14.323 1.00 0.00 H new ATOM 0 HG21 THR A 329 1.265 11.375 14.156 1.00 0.00 H new ATOM 0 HG22 THR A 329 1.998 11.528 12.541 1.00 0.00 H new ATOM 0 HG23 THR A 329 0.466 12.358 12.906 1.00 0.00 H new ATOM 1184 N LYS A 330 -1.403 9.113 9.532 1.00 0.00 N ATOM 1185 CA LYS A 330 -2.119 7.960 8.999 1.00 0.00 C ATOM 1186 C LYS A 330 -1.857 7.800 7.505 1.00 0.00 C ATOM 1187 O LYS A 330 -2.268 8.636 6.698 1.00 0.00 O ATOM 1188 CB LYS A 330 -3.622 8.106 9.251 1.00 0.00 C ATOM 1189 CG LYS A 330 -4.010 7.955 10.712 1.00 0.00 C ATOM 1190 CD LYS A 330 -5.365 8.581 10.996 1.00 0.00 C ATOM 1191 CE LYS A 330 -6.502 7.695 10.508 1.00 0.00 C ATOM 1192 NZ LYS A 330 -7.833 8.237 10.896 1.00 0.00 N ATOM 0 H LYS A 330 -1.467 9.952 8.955 1.00 0.00 H new ATOM 0 HA LYS A 330 -1.755 7.069 9.511 1.00 0.00 H new ATOM 0 HB2 LYS A 330 -3.948 9.084 8.896 1.00 0.00 H new ATOM 0 HB3 LYS A 330 -4.155 7.359 8.663 1.00 0.00 H new ATOM 0 HG2 LYS A 330 -4.034 6.898 10.976 1.00 0.00 H new ATOM 0 HG3 LYS A 330 -3.253 8.423 11.341 1.00 0.00 H new ATOM 0 HD2 LYS A 330 -5.470 8.753 12.067 1.00 0.00 H new ATOM 0 HD3 LYS A 330 -5.426 9.554 10.510 1.00 0.00 H new ATOM 0 HE2 LYS A 330 -6.450 7.602 9.423 1.00 0.00 H new ATOM 0 HE3 LYS A 330 -6.384 6.693 10.920 1.00 0.00 H new ATOM 0 HZ1 LYS A 330 -8.581 7.605 10.545 1.00 0.00 H new ATOM 0 HZ2 LYS A 330 -7.893 8.302 11.932 1.00 0.00 H new ATOM 0 HZ3 LYS A 330 -7.957 9.183 10.482 1.00 0.00 H new ATOM 1206 N THR A 331 -1.172 6.721 7.141 1.00 0.00 N ATOM 1207 CA THR A 331 -0.856 6.451 5.744 1.00 0.00 C ATOM 1208 C THR A 331 -1.417 5.104 5.303 1.00 0.00 C ATOM 1209 O THR A 331 -0.997 4.055 5.792 1.00 0.00 O ATOM 1210 CB THR A 331 0.665 6.465 5.500 1.00 0.00 C ATOM 1211 OG1 THR A 331 1.261 7.575 6.179 1.00 0.00 O ATOM 1212 CG2 THR A 331 0.973 6.549 4.012 1.00 0.00 C ATOM 0 H THR A 331 -0.825 6.019 7.795 1.00 0.00 H new ATOM 0 HA THR A 331 -1.319 7.244 5.157 1.00 0.00 H new ATOM 0 HB THR A 331 1.082 5.536 5.890 1.00 0.00 H new ATOM 0 HG1 THR A 331 2.228 7.434 6.250 1.00 0.00 H new ATOM 0 HG21 THR A 331 2.053 6.558 3.864 1.00 0.00 H new ATOM 0 HG22 THR A 331 0.544 5.686 3.502 1.00 0.00 H new ATOM 0 HG23 THR A 331 0.543 7.463 3.603 1.00 0.00 H new ATOM 1220 N SER A 332 -2.370 5.140 4.377 1.00 0.00 N ATOM 1221 CA SER A 332 -2.992 3.921 3.872 1.00 0.00 C ATOM 1222 C SER A 332 -2.259 3.409 2.636 1.00 0.00 C ATOM 1223 O SER A 332 -1.646 4.182 1.898 1.00 0.00 O ATOM 1224 CB SER A 332 -4.463 4.175 3.539 1.00 0.00 C ATOM 1225 OG SER A 332 -5.209 4.464 4.708 1.00 0.00 O ATOM 0 H SER A 332 -2.728 6.000 3.961 1.00 0.00 H new ATOM 0 HA SER A 332 -2.929 3.161 4.650 1.00 0.00 H new ATOM 0 HB2 SER A 332 -4.542 5.007 2.839 1.00 0.00 H new ATOM 0 HB3 SER A 332 -4.883 3.300 3.043 1.00 0.00 H new ATOM 0 HG SER A 332 -6.145 4.624 4.467 1.00 0.00 H new ATOM 1231 N LEU A 333 -2.327 2.101 2.415 1.00 0.00 N ATOM 1232 CA LEU A 333 -1.671 1.484 1.268 1.00 0.00 C ATOM 1233 C LEU A 333 -2.452 0.266 0.784 1.00 0.00 C ATOM 1234 O LEU A 333 -3.021 -0.477 1.583 1.00 0.00 O ATOM 1235 CB LEU A 333 -0.242 1.075 1.632 1.00 0.00 C ATOM 1236 CG LEU A 333 0.661 2.190 2.160 1.00 0.00 C ATOM 1237 CD1 LEU A 333 1.955 1.613 2.712 1.00 0.00 C ATOM 1238 CD2 LEU A 333 0.952 3.205 1.065 1.00 0.00 C ATOM 0 H LEU A 333 -2.830 1.447 3.015 1.00 0.00 H new ATOM 0 HA LEU A 333 -1.639 2.217 0.462 1.00 0.00 H new ATOM 0 HB2 LEU A 333 -0.291 0.288 2.384 1.00 0.00 H new ATOM 0 HB3 LEU A 333 0.227 0.643 0.748 1.00 0.00 H new ATOM 0 HG LEU A 333 0.140 2.700 2.970 1.00 0.00 H new ATOM 0 HD11 LEU A 333 2.585 2.422 3.083 1.00 0.00 H new ATOM 0 HD12 LEU A 333 1.728 0.926 3.527 1.00 0.00 H new ATOM 0 HD13 LEU A 333 2.481 1.077 1.922 1.00 0.00 H new ATOM 0 HD21 LEU A 333 1.596 3.991 1.459 1.00 0.00 H new ATOM 0 HD22 LEU A 333 1.452 2.709 0.233 1.00 0.00 H new ATOM 0 HD23 LEU A 333 0.017 3.643 0.717 1.00 0.00 H new ATOM 1250 N SER A 334 -2.474 0.068 -0.530 1.00 0.00 N ATOM 1251 CA SER A 334 -3.187 -1.059 -1.122 1.00 0.00 C ATOM 1252 C SER A 334 -2.232 -1.956 -1.904 1.00 0.00 C ATOM 1253 O SER A 334 -1.322 -1.474 -2.578 1.00 0.00 O ATOM 1254 CB SER A 334 -4.302 -0.558 -2.041 1.00 0.00 C ATOM 1255 OG SER A 334 -5.515 -0.392 -1.328 1.00 0.00 O ATOM 0 H SER A 334 -2.007 0.673 -1.205 1.00 0.00 H new ATOM 0 HA SER A 334 -3.627 -1.644 -0.314 1.00 0.00 H new ATOM 0 HB2 SER A 334 -4.008 0.390 -2.491 1.00 0.00 H new ATOM 0 HB3 SER A 334 -4.450 -1.265 -2.857 1.00 0.00 H new ATOM 0 HG SER A 334 -6.245 -0.826 -1.818 1.00 0.00 H new ATOM 1261 N MET A 335 -2.447 -3.264 -1.808 1.00 0.00 N ATOM 1262 CA MET A 335 -1.606 -4.229 -2.507 1.00 0.00 C ATOM 1263 C MET A 335 -2.334 -4.809 -3.716 1.00 0.00 C ATOM 1264 O MET A 335 -1.833 -4.757 -4.839 1.00 0.00 O ATOM 1265 CB MET A 335 -1.190 -5.355 -1.559 1.00 0.00 C ATOM 1266 CG MET A 335 -0.065 -4.969 -0.613 1.00 0.00 C ATOM 1267 SD MET A 335 0.508 -6.355 0.388 1.00 0.00 S ATOM 1268 CE MET A 335 1.182 -7.430 -0.876 1.00 0.00 C ATOM 0 H MET A 335 -3.196 -3.680 -1.254 1.00 0.00 H new ATOM 0 HA MET A 335 -0.714 -3.710 -2.857 1.00 0.00 H new ATOM 0 HB2 MET A 335 -2.056 -5.664 -0.974 1.00 0.00 H new ATOM 0 HB3 MET A 335 -0.879 -6.218 -2.148 1.00 0.00 H new ATOM 0 HG2 MET A 335 0.770 -4.573 -1.191 1.00 0.00 H new ATOM 0 HG3 MET A 335 -0.406 -4.168 0.043 1.00 0.00 H new ATOM 0 HE1 MET A 335 2.045 -7.963 -0.478 1.00 0.00 H new ATOM 0 HE2 MET A 335 0.423 -8.148 -1.185 1.00 0.00 H new ATOM 0 HE3 MET A 335 1.489 -6.834 -1.735 1.00 0.00 H new ATOM 1278 N LYS A 336 -3.519 -5.361 -3.478 1.00 0.00 N ATOM 1279 CA LYS A 336 -4.317 -5.950 -4.547 1.00 0.00 C ATOM 1280 C LYS A 336 -4.488 -4.969 -5.703 1.00 0.00 C ATOM 1281 O LYS A 336 -4.550 -5.369 -6.865 1.00 0.00 O ATOM 1282 CB LYS A 336 -5.689 -6.371 -4.015 1.00 0.00 C ATOM 1283 CG LYS A 336 -6.536 -5.207 -3.529 1.00 0.00 C ATOM 1284 CD LYS A 336 -8.001 -5.593 -3.415 1.00 0.00 C ATOM 1285 CE LYS A 336 -8.773 -4.604 -2.555 1.00 0.00 C ATOM 1286 NZ LYS A 336 -10.070 -5.168 -2.090 1.00 0.00 N ATOM 0 H LYS A 336 -3.948 -5.413 -2.554 1.00 0.00 H new ATOM 0 HA LYS A 336 -3.791 -6.831 -4.916 1.00 0.00 H new ATOM 0 HB2 LYS A 336 -6.228 -6.898 -4.802 1.00 0.00 H new ATOM 0 HB3 LYS A 336 -5.551 -7.076 -3.195 1.00 0.00 H new ATOM 0 HG2 LYS A 336 -6.171 -4.870 -2.559 1.00 0.00 H new ATOM 0 HG3 LYS A 336 -6.432 -4.368 -4.217 1.00 0.00 H new ATOM 0 HD2 LYS A 336 -8.445 -5.636 -4.409 1.00 0.00 H new ATOM 0 HD3 LYS A 336 -8.083 -6.591 -2.986 1.00 0.00 H new ATOM 0 HE2 LYS A 336 -8.169 -4.324 -1.692 1.00 0.00 H new ATOM 0 HE3 LYS A 336 -8.957 -3.693 -3.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 336 -10.755 -4.397 -1.955 1.00 0.00 H new ATOM 0 HZ2 LYS A 336 -10.434 -5.834 -2.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 336 -9.928 -5.667 -1.188 1.00 0.00 H new ATOM 1300 N ASP A 337 -4.561 -3.683 -5.375 1.00 0.00 N ATOM 1301 CA ASP A 337 -4.721 -2.645 -6.386 1.00 0.00 C ATOM 1302 C ASP A 337 -3.483 -2.553 -7.272 1.00 0.00 C ATOM 1303 O ASP A 337 -3.581 -2.280 -8.469 1.00 0.00 O ATOM 1304 CB ASP A 337 -4.990 -1.294 -5.722 1.00 0.00 C ATOM 1305 CG ASP A 337 -6.294 -1.277 -4.950 1.00 0.00 C ATOM 1306 OD1 ASP A 337 -6.366 -1.937 -3.893 1.00 0.00 O ATOM 1307 OD2 ASP A 337 -7.245 -0.605 -5.404 1.00 0.00 O ATOM 0 H ASP A 337 -4.512 -3.335 -4.417 1.00 0.00 H new ATOM 0 HA ASP A 337 -5.574 -2.910 -7.011 1.00 0.00 H new ATOM 0 HB2 ASP A 337 -4.168 -1.055 -5.047 1.00 0.00 H new ATOM 0 HB3 ASP A 337 -5.013 -0.516 -6.485 1.00 0.00 H new ATOM 1312 N VAL A 338 -2.317 -2.782 -6.676 1.00 0.00 N ATOM 1313 CA VAL A 338 -1.059 -2.725 -7.411 1.00 0.00 C ATOM 1314 C VAL A 338 -0.565 -4.123 -7.764 1.00 0.00 C ATOM 1315 O VAL A 338 -0.105 -4.867 -6.898 1.00 0.00 O ATOM 1316 CB VAL A 338 0.031 -1.996 -6.602 1.00 0.00 C ATOM 1317 CG1 VAL A 338 1.323 -1.913 -7.400 1.00 0.00 C ATOM 1318 CG2 VAL A 338 -0.444 -0.610 -6.196 1.00 0.00 C ATOM 0 H VAL A 338 -2.218 -3.009 -5.686 1.00 0.00 H new ATOM 0 HA VAL A 338 -1.253 -2.169 -8.328 1.00 0.00 H new ATOM 0 HB VAL A 338 0.228 -2.567 -5.695 1.00 0.00 H new ATOM 0 HG11 VAL A 338 2.081 -1.395 -6.812 1.00 0.00 H new ATOM 0 HG12 VAL A 338 1.671 -2.919 -7.635 1.00 0.00 H new ATOM 0 HG13 VAL A 338 1.145 -1.366 -8.325 1.00 0.00 H new ATOM 0 HG21 VAL A 338 0.339 -0.110 -5.625 1.00 0.00 H new ATOM 0 HG22 VAL A 338 -0.671 -0.027 -7.089 1.00 0.00 H new ATOM 0 HG23 VAL A 338 -1.341 -0.698 -5.582 1.00 0.00 H new ATOM 1328 N ASP A 339 -0.663 -4.473 -9.042 1.00 0.00 N ATOM 1329 CA ASP A 339 -0.224 -5.783 -9.511 1.00 0.00 C ATOM 1330 C ASP A 339 1.162 -6.118 -8.969 1.00 0.00 C ATOM 1331 O ASP A 339 2.088 -5.314 -9.066 1.00 0.00 O ATOM 1332 CB ASP A 339 -0.210 -5.822 -11.040 1.00 0.00 C ATOM 1333 CG ASP A 339 -0.370 -7.228 -11.585 1.00 0.00 C ATOM 1334 OD1 ASP A 339 -1.201 -7.984 -11.041 1.00 0.00 O ATOM 1335 OD2 ASP A 339 0.337 -7.571 -12.555 1.00 0.00 O ATOM 0 H ASP A 339 -1.042 -3.869 -9.771 1.00 0.00 H new ATOM 0 HA ASP A 339 -0.929 -6.529 -9.142 1.00 0.00 H new ATOM 0 HB2 ASP A 339 -1.013 -5.193 -11.424 1.00 0.00 H new ATOM 0 HB3 ASP A 339 0.727 -5.399 -11.403 1.00 0.00 H new ATOM 1340 N GLN A 340 1.295 -7.311 -8.397 1.00 0.00 N ATOM 1341 CA GLN A 340 2.567 -7.751 -7.838 1.00 0.00 C ATOM 1342 C GLN A 340 3.466 -8.335 -8.923 1.00 0.00 C ATOM 1343 O GLN A 340 4.150 -9.334 -8.705 1.00 0.00 O ATOM 1344 CB GLN A 340 2.334 -8.790 -6.740 1.00 0.00 C ATOM 1345 CG GLN A 340 1.713 -8.213 -5.478 1.00 0.00 C ATOM 1346 CD GLN A 340 2.499 -7.041 -4.924 1.00 0.00 C ATOM 1347 OE1 GLN A 340 3.682 -7.167 -4.606 1.00 0.00 O ATOM 1348 NE2 GLN A 340 1.845 -5.892 -4.805 1.00 0.00 N ATOM 0 H GLN A 340 0.538 -7.989 -8.309 1.00 0.00 H new ATOM 0 HA GLN A 340 3.065 -6.882 -7.407 1.00 0.00 H new ATOM 0 HB2 GLN A 340 1.686 -9.576 -7.127 1.00 0.00 H new ATOM 0 HB3 GLN A 340 3.285 -9.257 -6.486 1.00 0.00 H new ATOM 0 HG2 GLN A 340 0.694 -7.893 -5.693 1.00 0.00 H new ATOM 0 HG3 GLN A 340 1.649 -8.993 -4.720 1.00 0.00 H new ATOM 0 HE21 GLN A 340 0.865 -5.832 -5.081 1.00 0.00 H new ATOM 0 HE22 GLN A 340 2.323 -5.069 -4.438 1.00 0.00 H new ATOM 1357 N GLU A 341 3.459 -7.703 -10.093 1.00 0.00 N ATOM 1358 CA GLU A 341 4.274 -8.161 -11.212 1.00 0.00 C ATOM 1359 C GLU A 341 5.043 -7.000 -11.837 1.00 0.00 C ATOM 1360 O GLU A 341 6.274 -6.999 -11.865 1.00 0.00 O ATOM 1361 CB GLU A 341 3.395 -8.833 -12.270 1.00 0.00 C ATOM 1362 CG GLU A 341 4.170 -9.330 -13.478 1.00 0.00 C ATOM 1363 CD GLU A 341 5.045 -10.527 -13.159 1.00 0.00 C ATOM 1364 OE1 GLU A 341 6.211 -10.321 -12.763 1.00 0.00 O ATOM 1365 OE2 GLU A 341 4.562 -11.670 -13.304 1.00 0.00 O ATOM 0 H GLU A 341 2.899 -6.874 -10.290 1.00 0.00 H new ATOM 0 HA GLU A 341 4.993 -8.887 -10.832 1.00 0.00 H new ATOM 0 HB2 GLU A 341 2.871 -9.673 -11.814 1.00 0.00 H new ATOM 0 HB3 GLU A 341 2.635 -8.125 -12.602 1.00 0.00 H new ATOM 0 HG2 GLU A 341 3.470 -9.597 -14.269 1.00 0.00 H new ATOM 0 HG3 GLU A 341 4.792 -8.522 -13.863 1.00 0.00 H new ATOM 1372 N THR A 342 4.307 -6.013 -12.339 1.00 0.00 N ATOM 1373 CA THR A 342 4.918 -4.847 -12.964 1.00 0.00 C ATOM 1374 C THR A 342 4.583 -3.573 -12.198 1.00 0.00 C ATOM 1375 O THR A 342 5.183 -2.523 -12.426 1.00 0.00 O ATOM 1376 CB THR A 342 4.459 -4.689 -14.426 1.00 0.00 C ATOM 1377 OG1 THR A 342 5.037 -3.509 -14.996 1.00 0.00 O ATOM 1378 CG2 THR A 342 2.943 -4.610 -14.512 1.00 0.00 C ATOM 0 H THR A 342 3.287 -5.998 -12.325 1.00 0.00 H new ATOM 0 HA THR A 342 5.996 -5.006 -12.944 1.00 0.00 H new ATOM 0 HB THR A 342 4.793 -5.563 -14.985 1.00 0.00 H new ATOM 0 HG1 THR A 342 5.354 -2.921 -14.279 1.00 0.00 H new ATOM 0 HG21 THR A 342 2.643 -4.499 -15.554 1.00 0.00 H new ATOM 0 HG22 THR A 342 2.507 -5.522 -14.104 1.00 0.00 H new ATOM 0 HG23 THR A 342 2.590 -3.752 -13.939 1.00 0.00 H new ATOM 1386 N GLY A 343 3.620 -3.672 -11.287 1.00 0.00 N ATOM 1387 CA GLY A 343 3.222 -2.519 -10.500 1.00 0.00 C ATOM 1388 C GLY A 343 2.234 -1.631 -11.230 1.00 0.00 C ATOM 1389 O GLY A 343 2.199 -0.421 -11.012 1.00 0.00 O ATOM 0 H GLY A 343 3.108 -4.530 -11.080 1.00 0.00 H new ATOM 0 HA2 GLY A 343 2.778 -2.858 -9.564 1.00 0.00 H new ATOM 0 HA3 GLY A 343 4.106 -1.937 -10.241 1.00 0.00 H new ATOM 1393 N GLU A 344 1.431 -2.234 -12.101 1.00 0.00 N ATOM 1394 CA GLU A 344 0.440 -1.488 -12.868 1.00 0.00 C ATOM 1395 C GLU A 344 -0.762 -1.128 -11.999 1.00 0.00 C ATOM 1396 O GLU A 344 -1.040 -1.791 -11.000 1.00 0.00 O ATOM 1397 CB GLU A 344 -0.019 -2.303 -14.080 1.00 0.00 C ATOM 1398 CG GLU A 344 -1.063 -1.597 -14.928 1.00 0.00 C ATOM 1399 CD GLU A 344 -0.543 -0.313 -15.545 1.00 0.00 C ATOM 1400 OE1 GLU A 344 0.306 -0.395 -16.457 1.00 0.00 O ATOM 1401 OE2 GLU A 344 -0.986 0.773 -15.116 1.00 0.00 O ATOM 0 H GLU A 344 1.447 -3.236 -12.293 1.00 0.00 H new ATOM 0 HA GLU A 344 0.906 -0.565 -13.215 1.00 0.00 H new ATOM 0 HB2 GLU A 344 0.846 -2.533 -14.701 1.00 0.00 H new ATOM 0 HB3 GLU A 344 -0.426 -3.254 -13.735 1.00 0.00 H new ATOM 0 HG2 GLU A 344 -1.396 -2.267 -15.720 1.00 0.00 H new ATOM 0 HG3 GLU A 344 -1.934 -1.373 -14.313 1.00 0.00 H new ATOM 1408 N ASP A 345 -1.470 -0.073 -12.388 1.00 0.00 N ATOM 1409 CA ASP A 345 -2.643 0.376 -11.646 1.00 0.00 C ATOM 1410 C ASP A 345 -3.861 -0.476 -11.987 1.00 0.00 C ATOM 1411 O ASP A 345 -4.446 -0.339 -13.062 1.00 0.00 O ATOM 1412 CB ASP A 345 -2.932 1.847 -11.949 1.00 0.00 C ATOM 1413 CG ASP A 345 -4.405 2.184 -11.828 1.00 0.00 C ATOM 1414 OD1 ASP A 345 -4.856 2.476 -10.701 1.00 0.00 O ATOM 1415 OD2 ASP A 345 -5.108 2.154 -12.861 1.00 0.00 O ATOM 0 H ASP A 345 -1.252 0.487 -13.212 1.00 0.00 H new ATOM 0 HA ASP A 345 -2.433 0.267 -10.582 1.00 0.00 H new ATOM 0 HB2 ASP A 345 -2.361 2.475 -11.265 1.00 0.00 H new ATOM 0 HB3 ASP A 345 -2.590 2.081 -12.957 1.00 0.00 H new