USER MOD reduce.3.24.130724 H: found=0, std=0, add=414, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 416 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 28 THR OG1 : rot 170:sc= -1.94! USER MOD Set 1.2: A 64 TYR OH : rot 180:sc= -0.815 USER MOD Single : A 10 SER OG : rot 43:sc= 0.185 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 120:sc= 0.0602 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 ASN : amide:sc= 0.0271 K(o=0.027,f=-1) USER MOD Single : A 34 SER OG : rot -50:sc= 0.99 USER MOD Single : A 35 THR OG1 : rot 180:sc= -0.67 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 SER OG : rot 5:sc= 0.648 USER MOD Single : A 70 SER OG : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 161 N SER A 10 64.230 4.105 7.929 1.00 15.00 N ATOM 162 CA SER A 10 63.354 2.905 8.102 1.00 15.00 C ATOM 163 C SER A 10 63.597 1.895 6.975 1.00 15.00 C ATOM 164 O SER A 10 64.014 2.254 5.889 1.00 15.00 O ATOM 165 CB SER A 10 61.927 3.446 8.036 1.00 15.00 C ATOM 166 OG SER A 10 61.735 4.395 9.078 1.00 15.00 O ATOM 0 HA SER A 10 63.553 2.384 9.038 1.00 15.00 H new ATOM 0 HB2 SER A 10 61.747 3.911 7.067 1.00 15.00 H new ATOM 0 HB3 SER A 10 61.211 2.630 8.136 1.00 15.00 H new ATOM 0 HG SER A 10 62.518 4.982 9.134 1.00 15.00 H new ATOM 172 N LYS A 11 63.338 0.635 7.233 1.00 15.00 N ATOM 173 CA LYS A 11 63.527 -0.418 6.181 1.00 15.00 C ATOM 174 C LYS A 11 62.290 -0.487 5.279 1.00 15.00 C ATOM 175 O LYS A 11 61.170 -0.525 5.754 1.00 15.00 O ATOM 176 CB LYS A 11 63.691 -1.733 6.951 1.00 15.00 C ATOM 177 CG LYS A 11 64.984 -1.695 7.774 1.00 15.00 C ATOM 178 CD LYS A 11 64.847 -2.620 8.986 1.00 15.00 C ATOM 179 CE LYS A 11 64.911 -4.078 8.526 1.00 15.00 C ATOM 180 NZ LYS A 11 64.431 -4.871 9.692 1.00 15.00 N ATOM 0 H LYS A 11 63.002 0.288 8.131 1.00 15.00 H new ATOM 0 HA LYS A 11 64.385 -0.209 5.542 1.00 15.00 H new ATOM 0 HB2 LYS A 11 62.835 -1.890 7.608 1.00 15.00 H new ATOM 0 HB3 LYS A 11 63.716 -2.572 6.255 1.00 15.00 H new ATOM 0 HG2 LYS A 11 65.828 -2.007 7.159 1.00 15.00 H new ATOM 0 HG3 LYS A 11 65.188 -0.676 8.102 1.00 15.00 H new ATOM 0 HD2 LYS A 11 65.643 -2.418 9.702 1.00 15.00 H new ATOM 0 HD3 LYS A 11 63.903 -2.430 9.497 1.00 15.00 H new ATOM 0 HE2 LYS A 11 64.283 -4.244 7.651 1.00 15.00 H new ATOM 0 HE3 LYS A 11 65.926 -4.360 8.248 1.00 15.00 H new ATOM 0 HZ1 LYS A 11 64.446 -5.883 9.453 1.00 15.00 H new ATOM 0 HZ2 LYS A 11 65.052 -4.698 10.508 1.00 15.00 H new ATOM 0 HZ3 LYS A 11 63.459 -4.586 9.930 1.00 15.00 H new ATOM 194 N ILE A 12 62.486 -0.505 3.981 1.00 15.00 N ATOM 195 CA ILE A 12 61.323 -0.551 3.041 1.00 15.00 C ATOM 196 C ILE A 12 61.553 -1.623 1.970 1.00 15.00 C ATOM 197 O ILE A 12 62.671 -1.863 1.547 1.00 15.00 O ATOM 198 CB ILE A 12 61.248 0.850 2.406 1.00 15.00 C ATOM 199 CG1 ILE A 12 61.016 1.902 3.501 1.00 15.00 C ATOM 200 CG2 ILE A 12 60.086 0.905 1.404 1.00 15.00 C ATOM 201 CD1 ILE A 12 61.141 3.307 2.904 1.00 15.00 C ATOM 0 H ILE A 12 63.402 -0.490 3.533 1.00 15.00 H new ATOM 0 HA ILE A 12 60.394 -0.806 3.551 1.00 15.00 H new ATOM 0 HB ILE A 12 62.186 1.056 1.890 1.00 15.00 H new ATOM 0 HG12 ILE A 12 60.028 1.770 3.941 1.00 15.00 H new ATOM 0 HG13 ILE A 12 61.742 1.772 4.303 1.00 15.00 H new ATOM 0 HG21 ILE A 12 60.037 1.898 0.958 1.00 15.00 H new ATOM 0 HG22 ILE A 12 60.245 0.163 0.622 1.00 15.00 H new ATOM 0 HG23 ILE A 12 59.150 0.693 1.921 1.00 15.00 H new ATOM 0 HD11 ILE A 12 60.976 4.050 3.684 1.00 15.00 H new ATOM 0 HD12 ILE A 12 62.139 3.437 2.485 1.00 15.00 H new ATOM 0 HD13 ILE A 12 60.398 3.436 2.117 1.00 15.00 H new ATOM 213 N SER A 13 60.496 -2.265 1.537 1.00 15.00 N ATOM 214 CA SER A 13 60.599 -3.239 0.412 1.00 15.00 C ATOM 215 C SER A 13 59.800 -2.721 -0.786 1.00 15.00 C ATOM 216 O SER A 13 58.650 -2.345 -0.656 1.00 15.00 O ATOM 217 CB SER A 13 59.989 -4.533 0.948 1.00 15.00 C ATOM 218 OG SER A 13 60.152 -5.565 -0.017 1.00 15.00 O ATOM 0 H SER A 13 59.558 -2.153 1.921 1.00 15.00 H new ATOM 0 HA SER A 13 61.626 -3.389 0.078 1.00 15.00 H new ATOM 0 HB2 SER A 13 60.471 -4.815 1.884 1.00 15.00 H new ATOM 0 HB3 SER A 13 58.931 -4.387 1.166 1.00 15.00 H new ATOM 0 HG SER A 13 60.680 -6.294 0.370 1.00 15.00 H new ATOM 224 N LEU A 14 60.403 -2.700 -1.948 1.00 15.00 N ATOM 225 CA LEU A 14 59.730 -2.109 -3.143 1.00 15.00 C ATOM 226 C LEU A 14 59.619 -3.149 -4.260 1.00 15.00 C ATOM 227 O LEU A 14 60.556 -3.875 -4.535 1.00 15.00 O ATOM 228 CB LEU A 14 60.645 -0.961 -3.572 1.00 15.00 C ATOM 229 CG LEU A 14 59.847 0.050 -4.395 1.00 15.00 C ATOM 230 CD1 LEU A 14 58.928 0.849 -3.469 1.00 15.00 C ATOM 231 CD2 LEU A 14 60.813 1.005 -5.102 1.00 15.00 C ATOM 0 H LEU A 14 61.338 -3.069 -2.120 1.00 15.00 H new ATOM 0 HA LEU A 14 58.717 -1.772 -2.925 1.00 15.00 H new ATOM 0 HB2 LEU A 14 61.072 -0.475 -2.694 1.00 15.00 H new ATOM 0 HB3 LEU A 14 61.478 -1.347 -4.159 1.00 15.00 H new ATOM 0 HG LEU A 14 59.247 -0.477 -5.137 1.00 15.00 H new ATOM 0 HD11 LEU A 14 58.359 1.570 -4.055 1.00 15.00 H new ATOM 0 HD12 LEU A 14 58.242 0.170 -2.963 1.00 15.00 H new ATOM 0 HD13 LEU A 14 59.528 1.377 -2.728 1.00 15.00 H new ATOM 0 HD21 LEU A 14 60.246 1.727 -5.690 1.00 15.00 H new ATOM 0 HD22 LEU A 14 61.412 1.532 -4.359 1.00 15.00 H new ATOM 0 HD23 LEU A 14 61.469 0.437 -5.761 1.00 15.00 H new ATOM 243 N ILE A 15 58.480 -3.223 -4.902 1.00 15.00 N ATOM 244 CA ILE A 15 58.311 -4.167 -6.050 1.00 15.00 C ATOM 245 C ILE A 15 58.205 -3.360 -7.349 1.00 15.00 C ATOM 246 O ILE A 15 57.320 -2.535 -7.499 1.00 15.00 O ATOM 247 CB ILE A 15 57.006 -4.931 -5.763 1.00 15.00 C ATOM 248 CG1 ILE A 15 57.133 -5.696 -4.439 1.00 15.00 C ATOM 249 CG2 ILE A 15 56.732 -5.934 -6.891 1.00 15.00 C ATOM 250 CD1 ILE A 15 55.755 -6.194 -3.999 1.00 15.00 C ATOM 0 H ILE A 15 57.655 -2.667 -4.679 1.00 15.00 H new ATOM 0 HA ILE A 15 59.149 -4.856 -6.161 1.00 15.00 H new ATOM 0 HB ILE A 15 56.186 -4.216 -5.699 1.00 15.00 H new ATOM 0 HG12 ILE A 15 57.814 -6.539 -4.558 1.00 15.00 H new ATOM 0 HG13 ILE A 15 57.558 -5.048 -3.673 1.00 15.00 H new ATOM 0 HG21 ILE A 15 55.807 -6.472 -6.683 1.00 15.00 H new ATOM 0 HG22 ILE A 15 56.636 -5.401 -7.837 1.00 15.00 H new ATOM 0 HG23 ILE A 15 57.557 -6.643 -6.956 1.00 15.00 H new ATOM 0 HD11 ILE A 15 55.848 -6.737 -3.058 1.00 15.00 H new ATOM 0 HD12 ILE A 15 55.087 -5.343 -3.863 1.00 15.00 H new ATOM 0 HD13 ILE A 15 55.347 -6.857 -4.762 1.00 15.00 H new ATOM 262 N SER A 16 59.098 -3.599 -8.279 1.00 15.00 N ATOM 263 CA SER A 16 59.180 -2.729 -9.495 1.00 15.00 C ATOM 264 C SER A 16 58.331 -3.302 -10.636 1.00 15.00 C ATOM 265 O SER A 16 57.813 -4.399 -10.549 1.00 15.00 O ATOM 266 CB SER A 16 60.660 -2.725 -9.879 1.00 15.00 C ATOM 267 OG SER A 16 61.340 -1.739 -9.113 1.00 15.00 O ATOM 0 H SER A 16 59.775 -4.361 -8.248 1.00 15.00 H new ATOM 0 HA SER A 16 58.801 -1.725 -9.302 1.00 15.00 H new ATOM 0 HB2 SER A 16 61.097 -3.707 -9.699 1.00 15.00 H new ATOM 0 HB3 SER A 16 60.771 -2.516 -10.943 1.00 15.00 H new ATOM 0 HG SER A 16 62.290 -1.734 -9.355 1.00 15.00 H new ATOM 273 N LYS A 17 58.192 -2.558 -11.709 1.00 15.00 N ATOM 274 CA LYS A 17 57.341 -3.018 -12.860 1.00 15.00 C ATOM 275 C LYS A 17 57.857 -4.344 -13.445 1.00 15.00 C ATOM 276 O LYS A 17 57.131 -5.044 -14.129 1.00 15.00 O ATOM 277 CB LYS A 17 57.439 -1.905 -13.908 1.00 15.00 C ATOM 278 CG LYS A 17 56.402 -2.143 -15.007 1.00 15.00 C ATOM 279 CD LYS A 17 56.458 -0.999 -16.021 1.00 15.00 C ATOM 280 CE LYS A 17 57.680 -1.175 -16.925 1.00 15.00 C ATOM 281 NZ LYS A 17 57.939 0.178 -17.491 1.00 15.00 N ATOM 0 H LYS A 17 58.633 -1.647 -11.840 1.00 15.00 H new ATOM 0 HA LYS A 17 56.314 -3.199 -12.542 1.00 15.00 H new ATOM 0 HB2 LYS A 17 57.272 -0.935 -13.440 1.00 15.00 H new ATOM 0 HB3 LYS A 17 58.441 -1.883 -14.338 1.00 15.00 H new ATOM 0 HG2 LYS A 17 56.596 -3.093 -15.504 1.00 15.00 H new ATOM 0 HG3 LYS A 17 55.405 -2.209 -14.572 1.00 15.00 H new ATOM 0 HD2 LYS A 17 55.548 -0.986 -16.621 1.00 15.00 H new ATOM 0 HD3 LYS A 17 56.511 -0.042 -15.502 1.00 15.00 H new ATOM 0 HE2 LYS A 17 58.539 -1.538 -16.361 1.00 15.00 H new ATOM 0 HE3 LYS A 17 57.486 -1.902 -17.714 1.00 15.00 H new ATOM 0 HZ1 LYS A 17 58.764 0.138 -18.123 1.00 15.00 H new ATOM 0 HZ2 LYS A 17 57.107 0.495 -18.028 1.00 15.00 H new ATOM 0 HZ3 LYS A 17 58.127 0.848 -16.718 1.00 15.00 H new ATOM 295 N ALA A 18 59.097 -4.695 -13.187 1.00 15.00 N ATOM 296 CA ALA A 18 59.659 -5.963 -13.755 1.00 15.00 C ATOM 297 C ALA A 18 59.424 -7.150 -12.806 1.00 15.00 C ATOM 298 O ALA A 18 60.056 -8.180 -12.938 1.00 15.00 O ATOM 299 CB ALA A 18 61.158 -5.697 -13.909 1.00 15.00 C ATOM 0 H ALA A 18 59.743 -4.158 -12.608 1.00 15.00 H new ATOM 0 HA ALA A 18 59.182 -6.225 -14.700 1.00 15.00 H new ATOM 0 HB1 ALA A 18 61.644 -6.581 -14.321 1.00 15.00 H new ATOM 0 HB2 ALA A 18 61.311 -4.853 -14.581 1.00 15.00 H new ATOM 0 HB3 ALA A 18 61.589 -5.467 -12.934 1.00 15.00 H new ATOM 305 N GLU A 19 58.521 -7.018 -11.851 1.00 15.00 N ATOM 306 CA GLU A 19 58.190 -8.152 -10.920 1.00 15.00 C ATOM 307 C GLU A 19 59.444 -8.636 -10.181 1.00 15.00 C ATOM 308 O GLU A 19 59.546 -9.790 -9.804 1.00 15.00 O ATOM 309 CB GLU A 19 57.605 -9.270 -11.796 1.00 15.00 C ATOM 310 CG GLU A 19 56.294 -8.792 -12.426 1.00 15.00 C ATOM 311 CD GLU A 19 55.732 -9.886 -13.337 1.00 15.00 C ATOM 312 OE1 GLU A 19 54.540 -10.132 -13.268 1.00 15.00 O ATOM 313 OE2 GLU A 19 56.504 -10.459 -14.089 1.00 15.00 O ATOM 0 H GLU A 19 57.995 -6.162 -11.678 1.00 15.00 H new ATOM 0 HA GLU A 19 57.480 -7.839 -10.155 1.00 15.00 H new ATOM 0 HB2 GLU A 19 58.316 -9.546 -12.575 1.00 15.00 H new ATOM 0 HB3 GLU A 19 57.428 -10.162 -11.195 1.00 15.00 H new ATOM 0 HG2 GLU A 19 55.572 -8.548 -11.647 1.00 15.00 H new ATOM 0 HG3 GLU A 19 56.465 -7.881 -12.999 1.00 15.00 H new ATOM 320 N ILE A 20 60.397 -7.758 -9.975 1.00 15.00 N ATOM 321 CA ILE A 20 61.579 -8.102 -9.127 1.00 15.00 C ATOM 322 C ILE A 20 61.440 -7.407 -7.769 1.00 15.00 C ATOM 323 O ILE A 20 60.897 -6.319 -7.676 1.00 15.00 O ATOM 324 CB ILE A 20 62.803 -7.574 -9.893 1.00 15.00 C ATOM 325 CG1 ILE A 20 62.913 -8.280 -11.249 1.00 15.00 C ATOM 326 CG2 ILE A 20 64.078 -7.846 -9.087 1.00 15.00 C ATOM 327 CD1 ILE A 20 63.763 -7.433 -12.199 1.00 15.00 C ATOM 0 H ILE A 20 60.405 -6.814 -10.360 1.00 15.00 H new ATOM 0 HA ILE A 20 61.668 -9.172 -8.941 1.00 15.00 H new ATOM 0 HB ILE A 20 62.686 -6.501 -10.045 1.00 15.00 H new ATOM 0 HG12 ILE A 20 63.362 -9.265 -11.123 1.00 15.00 H new ATOM 0 HG13 ILE A 20 61.920 -8.434 -11.672 1.00 15.00 H new ATOM 0 HG21 ILE A 20 64.942 -7.470 -9.635 1.00 15.00 H new ATOM 0 HG22 ILE A 20 64.013 -7.343 -8.122 1.00 15.00 H new ATOM 0 HG23 ILE A 20 64.187 -8.919 -8.930 1.00 15.00 H new ATOM 0 HD11 ILE A 20 63.841 -7.935 -13.163 1.00 15.00 H new ATOM 0 HD12 ILE A 20 63.295 -6.458 -12.335 1.00 15.00 H new ATOM 0 HD13 ILE A 20 64.759 -7.302 -11.777 1.00 15.00 H new ATOM 339 N ARG A 21 61.927 -8.026 -6.720 1.00 15.00 N ATOM 340 CA ARG A 21 61.783 -7.432 -5.357 1.00 15.00 C ATOM 341 C ARG A 21 63.119 -6.854 -4.879 1.00 15.00 C ATOM 342 O ARG A 21 64.110 -7.557 -4.784 1.00 15.00 O ATOM 343 CB ARG A 21 61.351 -8.596 -4.463 1.00 15.00 C ATOM 344 CG ARG A 21 60.946 -8.064 -3.087 1.00 15.00 C ATOM 345 CD ARG A 21 60.610 -9.238 -2.162 1.00 15.00 C ATOM 346 NE ARG A 21 60.135 -8.615 -0.885 1.00 15.00 N ATOM 347 CZ ARG A 21 60.073 -9.306 0.238 1.00 15.00 C ATOM 348 NH1 ARG A 21 60.418 -10.573 0.287 1.00 15.00 N ATOM 349 NH2 ARG A 21 59.657 -8.718 1.325 1.00 15.00 N ATOM 0 H ARG A 21 62.419 -8.919 -6.751 1.00 15.00 H new ATOM 0 HA ARG A 21 61.064 -6.613 -5.340 1.00 15.00 H new ATOM 0 HB2 ARG A 21 60.515 -9.127 -4.919 1.00 15.00 H new ATOM 0 HB3 ARG A 21 62.167 -9.312 -4.362 1.00 15.00 H new ATOM 0 HG2 ARG A 21 61.757 -7.473 -2.661 1.00 15.00 H new ATOM 0 HG3 ARG A 21 60.084 -7.403 -3.180 1.00 15.00 H new ATOM 0 HD2 ARG A 21 59.840 -9.874 -2.599 1.00 15.00 H new ATOM 0 HD3 ARG A 21 61.484 -9.866 -1.991 1.00 15.00 H new ATOM 0 HE ARG A 21 59.853 -7.635 -0.883 1.00 15.00 H new ATOM 0 HH11 ARG A 21 60.743 -11.046 -0.556 1.00 15.00 H new ATOM 0 HH12 ARG A 21 60.360 -11.084 1.168 1.00 15.00 H new ATOM 0 HH21 ARG A 21 59.384 -7.735 1.301 1.00 15.00 H new ATOM 0 HH22 ARG A 21 59.604 -9.241 2.199 1.00 15.00 H new ATOM 363 N TYR A 22 63.145 -5.578 -4.579 1.00 15.00 N ATOM 364 CA TYR A 22 64.382 -4.946 -4.028 1.00 15.00 C ATOM 365 C TYR A 22 64.147 -4.528 -2.576 1.00 15.00 C ATOM 366 O TYR A 22 63.114 -3.976 -2.249 1.00 15.00 O ATOM 367 CB TYR A 22 64.619 -3.706 -4.892 1.00 15.00 C ATOM 368 CG TYR A 22 65.027 -4.011 -6.314 1.00 15.00 C ATOM 369 CD1 TYR A 22 66.399 -4.129 -6.647 1.00 15.00 C ATOM 370 CD2 TYR A 22 64.039 -4.169 -7.316 1.00 15.00 C ATOM 371 CE1 TYR A 22 66.781 -4.405 -7.983 1.00 15.00 C ATOM 372 CE2 TYR A 22 64.420 -4.445 -8.651 1.00 15.00 C ATOM 373 CZ TYR A 22 65.792 -4.563 -8.985 1.00 15.00 C ATOM 374 OH TYR A 22 66.164 -4.831 -10.286 1.00 15.00 O ATOM 0 H TYR A 22 62.355 -4.943 -4.694 1.00 15.00 H new ATOM 0 HA TYR A 22 65.233 -5.627 -4.045 1.00 15.00 H new ATOM 0 HB2 TYR A 22 63.708 -3.108 -4.908 1.00 15.00 H new ATOM 0 HB3 TYR A 22 65.393 -3.095 -4.427 1.00 15.00 H new ATOM 0 HD1 TYR A 22 67.153 -4.009 -5.883 1.00 15.00 H new ATOM 0 HD2 TYR A 22 62.993 -4.079 -7.061 1.00 15.00 H new ATOM 0 HE1 TYR A 22 67.827 -4.495 -8.238 1.00 15.00 H new ATOM 0 HE2 TYR A 22 63.666 -4.566 -9.414 1.00 15.00 H new ATOM 0 HH TYR A 22 65.363 -4.911 -10.845 1.00 15.00 H new ATOM 384 N GLU A 23 65.090 -4.784 -1.705 1.00 15.00 N ATOM 385 CA GLU A 23 64.978 -4.276 -0.302 1.00 15.00 C ATOM 386 C GLU A 23 66.130 -3.316 -0.006 1.00 15.00 C ATOM 387 O GLU A 23 67.252 -3.542 -0.417 1.00 15.00 O ATOM 388 CB GLU A 23 65.074 -5.521 0.582 1.00 15.00 C ATOM 389 CG GLU A 23 64.756 -5.147 2.030 1.00 15.00 C ATOM 390 CD GLU A 23 64.955 -6.369 2.930 1.00 15.00 C ATOM 391 OE1 GLU A 23 66.017 -6.479 3.519 1.00 15.00 O ATOM 392 OE2 GLU A 23 64.041 -7.173 3.014 1.00 15.00 O ATOM 0 H GLU A 23 65.933 -5.323 -1.904 1.00 15.00 H new ATOM 0 HA GLU A 23 64.051 -3.730 -0.129 1.00 15.00 H new ATOM 0 HB2 GLU A 23 64.378 -6.283 0.231 1.00 15.00 H new ATOM 0 HB3 GLU A 23 66.074 -5.949 0.518 1.00 15.00 H new ATOM 0 HG2 GLU A 23 65.403 -4.333 2.357 1.00 15.00 H new ATOM 0 HG3 GLU A 23 63.729 -4.789 2.107 1.00 15.00 H new ATOM 399 N GLY A 24 65.856 -2.251 0.705 1.00 15.00 N ATOM 400 CA GLY A 24 66.923 -1.259 1.031 1.00 15.00 C ATOM 401 C GLY A 24 66.418 -0.328 2.132 1.00 15.00 C ATOM 402 O GLY A 24 65.309 -0.479 2.613 1.00 15.00 O ATOM 0 H GLY A 24 64.933 -2.026 1.075 1.00 15.00 H new ATOM 0 HA2 GLY A 24 67.827 -1.773 1.358 1.00 15.00 H new ATOM 0 HA3 GLY A 24 67.186 -0.684 0.143 1.00 15.00 H new ATOM 406 N ILE A 25 67.214 0.631 2.539 1.00 15.00 N ATOM 407 CA ILE A 25 66.762 1.573 3.612 1.00 15.00 C ATOM 408 C ILE A 25 66.503 2.958 3.011 1.00 15.00 C ATOM 409 O ILE A 25 67.210 3.398 2.125 1.00 15.00 O ATOM 410 CB ILE A 25 67.904 1.640 4.641 1.00 15.00 C ATOM 411 CG1 ILE A 25 68.373 0.223 5.040 1.00 15.00 C ATOM 412 CG2 ILE A 25 67.414 2.383 5.889 1.00 15.00 C ATOM 413 CD1 ILE A 25 67.205 -0.597 5.604 1.00 15.00 C ATOM 0 H ILE A 25 68.152 0.802 2.177 1.00 15.00 H new ATOM 0 HA ILE A 25 65.836 1.236 4.078 1.00 15.00 H new ATOM 0 HB ILE A 25 68.746 2.168 4.193 1.00 15.00 H new ATOM 0 HG12 ILE A 25 68.794 -0.284 4.172 1.00 15.00 H new ATOM 0 HG13 ILE A 25 69.167 0.293 5.784 1.00 15.00 H new ATOM 0 HG21 ILE A 25 68.219 2.434 6.622 1.00 15.00 H new ATOM 0 HG22 ILE A 25 67.109 3.393 5.615 1.00 15.00 H new ATOM 0 HG23 ILE A 25 66.565 1.852 6.319 1.00 15.00 H new ATOM 0 HD11 ILE A 25 67.558 -1.591 5.878 1.00 15.00 H new ATOM 0 HD12 ILE A 25 66.803 -0.098 6.486 1.00 15.00 H new ATOM 0 HD13 ILE A 25 66.424 -0.685 4.849 1.00 15.00 H new ATOM 425 N LEU A 26 65.493 3.642 3.492 1.00 15.00 N ATOM 426 CA LEU A 26 65.154 4.991 2.932 1.00 15.00 C ATOM 427 C LEU A 26 66.278 5.985 3.232 1.00 15.00 C ATOM 428 O LEU A 26 66.537 6.305 4.377 1.00 15.00 O ATOM 429 CB LEU A 26 63.867 5.414 3.644 1.00 15.00 C ATOM 430 CG LEU A 26 63.199 6.549 2.865 1.00 15.00 C ATOM 431 CD1 LEU A 26 62.490 5.980 1.632 1.00 15.00 C ATOM 432 CD2 LEU A 26 62.176 7.248 3.763 1.00 15.00 C ATOM 0 H LEU A 26 64.887 3.325 4.249 1.00 15.00 H new ATOM 0 HA LEU A 26 65.029 4.963 1.850 1.00 15.00 H new ATOM 0 HB2 LEU A 26 63.188 4.565 3.724 1.00 15.00 H new ATOM 0 HB3 LEU A 26 64.091 5.739 4.660 1.00 15.00 H new ATOM 0 HG LEU A 26 63.957 7.265 2.547 1.00 15.00 H new ATOM 0 HD11 LEU A 26 62.015 6.790 1.079 1.00 15.00 H new ATOM 0 HD12 LEU A 26 63.218 5.481 0.992 1.00 15.00 H new ATOM 0 HD13 LEU A 26 61.732 5.263 1.947 1.00 15.00 H new ATOM 0 HD21 LEU A 26 61.699 8.057 3.210 1.00 15.00 H new ATOM 0 HD22 LEU A 26 61.420 6.530 4.080 1.00 15.00 H new ATOM 0 HD23 LEU A 26 62.680 7.656 4.640 1.00 15.00 H new ATOM 444 N TYR A 27 66.941 6.472 2.212 1.00 15.00 N ATOM 445 CA TYR A 27 68.062 7.433 2.428 1.00 15.00 C ATOM 446 C TYR A 27 67.574 8.873 2.240 1.00 15.00 C ATOM 447 O TYR A 27 67.777 9.717 3.093 1.00 15.00 O ATOM 448 CB TYR A 27 69.103 7.077 1.366 1.00 15.00 C ATOM 449 CG TYR A 27 70.379 7.875 1.486 1.00 15.00 C ATOM 450 CD1 TYR A 27 71.193 7.738 2.637 1.00 15.00 C ATOM 451 CD2 TYR A 27 70.760 8.762 0.450 1.00 15.00 C ATOM 452 CE1 TYR A 27 72.389 8.488 2.752 1.00 15.00 C ATOM 453 CE2 TYR A 27 71.956 9.513 0.566 1.00 15.00 C ATOM 454 CZ TYR A 27 72.771 9.375 1.716 1.00 15.00 C ATOM 455 OH TYR A 27 73.935 10.108 1.828 1.00 15.00 O ATOM 0 H TYR A 27 66.752 6.243 1.236 1.00 15.00 H new ATOM 0 HA TYR A 27 68.470 7.367 3.437 1.00 15.00 H new ATOM 0 HB2 TYR A 27 69.339 6.015 1.440 1.00 15.00 H new ATOM 0 HB3 TYR A 27 68.673 7.240 0.378 1.00 15.00 H new ATOM 0 HD1 TYR A 27 70.902 7.062 3.427 1.00 15.00 H new ATOM 0 HD2 TYR A 27 70.140 8.866 -0.428 1.00 15.00 H new ATOM 0 HE1 TYR A 27 73.010 8.384 3.630 1.00 15.00 H new ATOM 0 HE2 TYR A 27 72.246 10.191 -0.223 1.00 15.00 H new ATOM 0 HH TYR A 27 74.049 10.665 1.030 1.00 15.00 H new ATOM 465 N THR A 28 66.934 9.154 1.131 1.00 15.00 N ATOM 466 CA THR A 28 66.444 10.545 0.875 1.00 15.00 C ATOM 467 C THR A 28 65.110 10.515 0.125 1.00 15.00 C ATOM 468 O THR A 28 64.888 9.676 -0.728 1.00 15.00 O ATOM 469 CB THR A 28 67.527 11.202 0.016 1.00 15.00 C ATOM 470 OG1 THR A 28 67.903 10.320 -1.032 1.00 15.00 O ATOM 471 CG2 THR A 28 68.746 11.521 0.882 1.00 15.00 C ATOM 0 H THR A 28 66.730 8.481 0.392 1.00 15.00 H new ATOM 0 HA THR A 28 66.272 11.092 1.802 1.00 15.00 H new ATOM 0 HB THR A 28 67.138 12.126 -0.412 1.00 15.00 H new ATOM 0 HG1 THR A 28 68.473 10.796 -1.672 1.00 15.00 H new ATOM 0 HG21 THR A 28 69.516 11.989 0.268 1.00 15.00 H new ATOM 0 HG22 THR A 28 68.456 12.202 1.682 1.00 15.00 H new ATOM 0 HG23 THR A 28 69.137 10.600 1.314 1.00 15.00 H new ATOM 479 N ILE A 29 64.224 11.431 0.439 1.00 15.00 N ATOM 480 CA ILE A 29 62.887 11.462 -0.234 1.00 15.00 C ATOM 481 C ILE A 29 62.752 12.753 -1.052 1.00 15.00 C ATOM 482 O ILE A 29 62.918 13.842 -0.533 1.00 15.00 O ATOM 483 CB ILE A 29 61.854 11.433 0.907 1.00 15.00 C ATOM 484 CG1 ILE A 29 62.047 10.174 1.765 1.00 15.00 C ATOM 485 CG2 ILE A 29 60.437 11.423 0.322 1.00 15.00 C ATOM 486 CD1 ILE A 29 61.237 10.305 3.059 1.00 15.00 C ATOM 0 H ILE A 29 64.371 12.161 1.136 1.00 15.00 H new ATOM 0 HA ILE A 29 62.747 10.626 -0.919 1.00 15.00 H new ATOM 0 HB ILE A 29 61.994 12.319 1.526 1.00 15.00 H new ATOM 0 HG12 ILE A 29 61.727 9.292 1.211 1.00 15.00 H new ATOM 0 HG13 ILE A 29 63.103 10.038 1.997 1.00 15.00 H new ATOM 0 HG21 ILE A 29 59.709 11.402 1.133 1.00 15.00 H new ATOM 0 HG22 ILE A 29 60.285 12.319 -0.279 1.00 15.00 H new ATOM 0 HG23 ILE A 29 60.308 10.540 -0.304 1.00 15.00 H new ATOM 0 HD11 ILE A 29 61.375 9.411 3.667 1.00 15.00 H new ATOM 0 HD12 ILE A 29 61.578 11.178 3.615 1.00 15.00 H new ATOM 0 HD13 ILE A 29 60.180 10.420 2.817 1.00 15.00 H new ATOM 498 N ASP A 30 62.454 12.636 -2.324 1.00 15.00 N ATOM 499 CA ASP A 30 62.263 13.851 -3.174 1.00 15.00 C ATOM 500 C ASP A 30 60.796 13.967 -3.594 1.00 15.00 C ATOM 501 O ASP A 30 60.366 13.342 -4.545 1.00 15.00 O ATOM 502 CB ASP A 30 63.157 13.627 -4.395 1.00 15.00 C ATOM 503 CG ASP A 30 63.293 14.934 -5.178 1.00 15.00 C ATOM 504 OD1 ASP A 30 63.192 14.887 -6.393 1.00 15.00 O ATOM 505 OD2 ASP A 30 63.498 15.961 -4.551 1.00 15.00 O ATOM 0 H ASP A 30 62.335 11.747 -2.811 1.00 15.00 H new ATOM 0 HA ASP A 30 62.520 14.771 -2.649 1.00 15.00 H new ATOM 0 HB2 ASP A 30 64.140 13.276 -4.079 1.00 15.00 H new ATOM 0 HB3 ASP A 30 62.732 12.852 -5.033 1.00 15.00 H new ATOM 510 N THR A 31 60.029 14.761 -2.888 1.00 15.00 N ATOM 511 CA THR A 31 58.568 14.876 -3.198 1.00 15.00 C ATOM 512 C THR A 31 58.360 15.625 -4.518 1.00 15.00 C ATOM 513 O THR A 31 57.474 15.302 -5.287 1.00 15.00 O ATOM 514 CB THR A 31 57.965 15.668 -2.034 1.00 15.00 C ATOM 515 OG1 THR A 31 58.380 15.088 -0.805 1.00 15.00 O ATOM 516 CG2 THR A 31 56.438 15.632 -2.125 1.00 15.00 C ATOM 0 H THR A 31 60.351 15.336 -2.109 1.00 15.00 H new ATOM 0 HA THR A 31 58.099 13.898 -3.309 1.00 15.00 H new ATOM 0 HB THR A 31 58.305 16.702 -2.084 1.00 15.00 H new ATOM 0 HG1 THR A 31 57.997 15.594 -0.058 1.00 15.00 H new ATOM 0 HG21 THR A 31 56.011 16.196 -1.296 1.00 15.00 H new ATOM 0 HG22 THR A 31 56.119 16.076 -3.068 1.00 15.00 H new ATOM 0 HG23 THR A 31 56.095 14.599 -2.076 1.00 15.00 H new ATOM 524 N GLU A 32 59.176 16.614 -4.788 1.00 15.00 N ATOM 525 CA GLU A 32 58.930 17.511 -5.969 1.00 15.00 C ATOM 526 C GLU A 32 58.902 16.706 -7.275 1.00 15.00 C ATOM 527 O GLU A 32 58.232 17.077 -8.222 1.00 15.00 O ATOM 528 CB GLU A 32 60.100 18.499 -5.978 1.00 15.00 C ATOM 529 CG GLU A 32 59.821 19.616 -6.987 1.00 15.00 C ATOM 530 CD GLU A 32 61.039 20.537 -7.082 1.00 15.00 C ATOM 531 OE1 GLU A 32 61.415 20.874 -8.193 1.00 15.00 O ATOM 532 OE2 GLU A 32 61.574 20.889 -6.044 1.00 15.00 O ATOM 0 H GLU A 32 60.006 16.843 -4.241 1.00 15.00 H new ATOM 0 HA GLU A 32 57.967 18.015 -5.893 1.00 15.00 H new ATOM 0 HB2 GLU A 32 60.241 18.921 -4.983 1.00 15.00 H new ATOM 0 HB3 GLU A 32 61.024 17.982 -6.239 1.00 15.00 H new ATOM 0 HG2 GLU A 32 59.598 19.189 -7.965 1.00 15.00 H new ATOM 0 HG3 GLU A 32 58.944 20.186 -6.680 1.00 15.00 H new ATOM 539 N ASN A 33 59.622 15.612 -7.332 1.00 15.00 N ATOM 540 CA ASN A 33 59.693 14.817 -8.601 1.00 15.00 C ATOM 541 C ASN A 33 59.075 13.420 -8.425 1.00 15.00 C ATOM 542 O ASN A 33 59.265 12.553 -9.259 1.00 15.00 O ATOM 543 CB ASN A 33 61.188 14.702 -8.909 1.00 15.00 C ATOM 544 CG ASN A 33 61.754 16.082 -9.258 1.00 15.00 C ATOM 545 OD1 ASN A 33 61.058 16.926 -9.788 1.00 15.00 O ATOM 546 ND2 ASN A 33 63.002 16.346 -8.985 1.00 15.00 N ATOM 0 H ASN A 33 60.164 15.234 -6.555 1.00 15.00 H new ATOM 0 HA ASN A 33 59.135 15.297 -9.405 1.00 15.00 H new ATOM 0 HB2 ASN A 33 61.715 14.290 -8.049 1.00 15.00 H new ATOM 0 HB3 ASN A 33 61.346 14.014 -9.739 1.00 15.00 H new ATOM 0 HD21 ASN A 33 63.392 17.260 -9.216 1.00 15.00 H new ATOM 0 HD22 ASN A 33 63.587 15.639 -8.540 1.00 15.00 H new ATOM 553 N SER A 34 58.338 13.189 -7.354 1.00 15.00 N ATOM 554 CA SER A 34 57.760 11.825 -7.084 1.00 15.00 C ATOM 555 C SER A 34 58.840 10.731 -7.194 1.00 15.00 C ATOM 556 O SER A 34 58.640 9.708 -7.827 1.00 15.00 O ATOM 557 CB SER A 34 56.676 11.627 -8.148 1.00 15.00 C ATOM 558 OG SER A 34 56.120 10.326 -8.017 1.00 15.00 O ATOM 0 H SER A 34 58.112 13.893 -6.652 1.00 15.00 H new ATOM 0 HA SER A 34 57.357 11.754 -6.074 1.00 15.00 H new ATOM 0 HB2 SER A 34 55.897 12.381 -8.034 1.00 15.00 H new ATOM 0 HB3 SER A 34 57.100 11.755 -9.144 1.00 15.00 H new ATOM 0 HG SER A 34 56.841 9.663 -7.987 1.00 15.00 H new ATOM 564 N THR A 35 59.979 10.945 -6.579 1.00 15.00 N ATOM 565 CA THR A 35 61.095 9.953 -6.683 1.00 15.00 C ATOM 566 C THR A 35 61.670 9.642 -5.299 1.00 15.00 C ATOM 567 O THR A 35 61.681 10.480 -4.417 1.00 15.00 O ATOM 568 CB THR A 35 62.154 10.629 -7.560 1.00 15.00 C ATOM 569 OG1 THR A 35 62.359 11.962 -7.112 1.00 15.00 O ATOM 570 CG2 THR A 35 61.694 10.646 -9.023 1.00 15.00 C ATOM 0 H THR A 35 60.184 11.766 -6.009 1.00 15.00 H new ATOM 0 HA THR A 35 60.757 9.006 -7.105 1.00 15.00 H new ATOM 0 HB THR A 35 63.087 10.070 -7.487 1.00 15.00 H new ATOM 0 HG1 THR A 35 63.038 12.394 -7.671 1.00 15.00 H new ATOM 0 HG21 THR A 35 62.454 11.129 -9.638 1.00 15.00 H new ATOM 0 HG22 THR A 35 61.543 9.623 -9.369 1.00 15.00 H new ATOM 0 HG23 THR A 35 60.758 11.198 -9.104 1.00 15.00 H new ATOM 578 N VAL A 36 62.151 8.437 -5.109 1.00 15.00 N ATOM 579 CA VAL A 36 62.766 8.061 -3.798 1.00 15.00 C ATOM 580 C VAL A 36 64.140 7.424 -4.040 1.00 15.00 C ATOM 581 O VAL A 36 64.310 6.630 -4.949 1.00 15.00 O ATOM 582 CB VAL A 36 61.795 7.047 -3.170 1.00 15.00 C ATOM 583 CG1 VAL A 36 62.320 6.603 -1.800 1.00 15.00 C ATOM 584 CG2 VAL A 36 60.417 7.694 -2.986 1.00 15.00 C ATOM 0 H VAL A 36 62.144 7.695 -5.809 1.00 15.00 H new ATOM 0 HA VAL A 36 62.919 8.920 -3.145 1.00 15.00 H new ATOM 0 HB VAL A 36 61.713 6.184 -3.830 1.00 15.00 H new ATOM 0 HG11 VAL A 36 61.628 5.885 -1.360 1.00 15.00 H new ATOM 0 HG12 VAL A 36 63.299 6.138 -1.919 1.00 15.00 H new ATOM 0 HG13 VAL A 36 62.407 7.470 -1.145 1.00 15.00 H new ATOM 0 HG21 VAL A 36 59.733 6.972 -2.541 1.00 15.00 H new ATOM 0 HG22 VAL A 36 60.506 8.561 -2.331 1.00 15.00 H new ATOM 0 HG23 VAL A 36 60.031 8.010 -3.955 1.00 15.00 H new ATOM 594 N ALA A 37 65.116 7.768 -3.236 1.00 15.00 N ATOM 595 CA ALA A 37 66.475 7.163 -3.391 1.00 15.00 C ATOM 596 C ALA A 37 66.769 6.234 -2.212 1.00 15.00 C ATOM 597 O ALA A 37 66.636 6.620 -1.063 1.00 15.00 O ATOM 598 CB ALA A 37 67.449 8.347 -3.404 1.00 15.00 C ATOM 0 H ALA A 37 65.029 8.444 -2.477 1.00 15.00 H new ATOM 0 HA ALA A 37 66.560 6.566 -4.299 1.00 15.00 H new ATOM 0 HB1 ALA A 37 68.469 7.978 -3.515 1.00 15.00 H new ATOM 0 HB2 ALA A 37 67.209 9.007 -4.238 1.00 15.00 H new ATOM 0 HB3 ALA A 37 67.363 8.899 -2.468 1.00 15.00 H new ATOM 604 N LEU A 38 67.172 5.018 -2.492 1.00 15.00 N ATOM 605 CA LEU A 38 67.449 4.036 -1.400 1.00 15.00 C ATOM 606 C LEU A 38 68.926 3.644 -1.419 1.00 15.00 C ATOM 607 O LEU A 38 69.504 3.439 -2.470 1.00 15.00 O ATOM 608 CB LEU A 38 66.577 2.813 -1.713 1.00 15.00 C ATOM 609 CG LEU A 38 65.090 3.189 -1.698 1.00 15.00 C ATOM 610 CD1 LEU A 38 64.258 1.978 -2.123 1.00 15.00 C ATOM 611 CD2 LEU A 38 64.676 3.613 -0.285 1.00 15.00 C ATOM 0 H LEU A 38 67.321 4.663 -3.436 1.00 15.00 H new ATOM 0 HA LEU A 38 67.228 4.448 -0.415 1.00 15.00 H new ATOM 0 HB2 LEU A 38 66.845 2.409 -2.689 1.00 15.00 H new ATOM 0 HB3 LEU A 38 66.766 2.028 -0.981 1.00 15.00 H new ATOM 0 HG LEU A 38 64.921 4.016 -2.388 1.00 15.00 H new ATOM 0 HD11 LEU A 38 63.200 2.242 -2.113 1.00 15.00 H new ATOM 0 HD12 LEU A 38 64.547 1.673 -3.129 1.00 15.00 H new ATOM 0 HD13 LEU A 38 64.433 1.155 -1.430 1.00 15.00 H new ATOM 0 HD21 LEU A 38 63.619 3.879 -0.280 1.00 15.00 H new ATOM 0 HD22 LEU A 38 64.846 2.788 0.407 1.00 15.00 H new ATOM 0 HD23 LEU A 38 65.268 4.474 0.025 1.00 15.00 H new ATOM 623 N ALA A 39 69.536 3.539 -0.265 1.00 15.00 N ATOM 624 CA ALA A 39 70.971 3.131 -0.202 1.00 15.00 C ATOM 625 C ALA A 39 71.094 1.775 0.497 1.00 15.00 C ATOM 626 O ALA A 39 70.168 1.320 1.146 1.00 15.00 O ATOM 627 CB ALA A 39 71.662 4.223 0.616 1.00 15.00 C ATOM 0 H ALA A 39 69.099 3.719 0.639 1.00 15.00 H new ATOM 0 HA ALA A 39 71.418 3.026 -1.191 1.00 15.00 H new ATOM 0 HB1 ALA A 39 72.724 3.993 0.707 1.00 15.00 H new ATOM 0 HB2 ALA A 39 71.540 5.184 0.116 1.00 15.00 H new ATOM 0 HB3 ALA A 39 71.215 4.271 1.609 1.00 15.00 H new ATOM 633 N LYS A 40 72.233 1.125 0.368 1.00 15.00 N ATOM 634 CA LYS A 40 72.426 -0.240 0.973 1.00 15.00 C ATOM 635 C LYS A 40 71.283 -1.178 0.553 1.00 15.00 C ATOM 636 O LYS A 40 70.588 -1.742 1.381 1.00 15.00 O ATOM 637 CB LYS A 40 72.431 -0.022 2.493 1.00 15.00 C ATOM 638 CG LYS A 40 73.637 0.835 2.889 1.00 15.00 C ATOM 639 CD LYS A 40 74.921 0.017 2.732 1.00 15.00 C ATOM 640 CE LYS A 40 76.106 0.814 3.282 1.00 15.00 C ATOM 641 NZ LYS A 40 77.314 0.112 2.767 1.00 15.00 N ATOM 0 H LYS A 40 73.044 1.485 -0.135 1.00 15.00 H new ATOM 0 HA LYS A 40 73.352 -0.707 0.637 1.00 15.00 H new ATOM 0 HB2 LYS A 40 71.508 0.468 2.803 1.00 15.00 H new ATOM 0 HB3 LYS A 40 72.471 -0.982 3.007 1.00 15.00 H new ATOM 0 HG2 LYS A 40 73.683 1.727 2.264 1.00 15.00 H new ATOM 0 HG3 LYS A 40 73.533 1.173 3.920 1.00 15.00 H new ATOM 0 HD2 LYS A 40 74.828 -0.930 3.263 1.00 15.00 H new ATOM 0 HD3 LYS A 40 75.086 -0.222 1.681 1.00 15.00 H new ATOM 0 HE2 LYS A 40 76.077 1.850 2.943 1.00 15.00 H new ATOM 0 HE3 LYS A 40 76.096 0.835 4.372 1.00 15.00 H new ATOM 0 HZ1 LYS A 40 78.169 0.600 3.102 1.00 15.00 H new ATOM 0 HZ2 LYS A 40 77.318 -0.869 3.111 1.00 15.00 H new ATOM 0 HZ3 LYS A 40 77.300 0.114 1.727 1.00 15.00 H new ATOM 655 N VAL A 41 71.091 -1.345 -0.734 1.00 15.00 N ATOM 656 CA VAL A 41 69.918 -2.128 -1.230 1.00 15.00 C ATOM 657 C VAL A 41 70.392 -3.326 -2.066 1.00 15.00 C ATOM 658 O VAL A 41 71.421 -3.272 -2.713 1.00 15.00 O ATOM 659 CB VAL A 41 69.103 -1.131 -2.077 1.00 15.00 C ATOM 660 CG1 VAL A 41 69.903 -0.687 -3.307 1.00 15.00 C ATOM 661 CG2 VAL A 41 67.796 -1.790 -2.533 1.00 15.00 C ATOM 0 H VAL A 41 71.699 -0.971 -1.463 1.00 15.00 H new ATOM 0 HA VAL A 41 69.318 -2.543 -0.420 1.00 15.00 H new ATOM 0 HB VAL A 41 68.883 -0.256 -1.465 1.00 15.00 H new ATOM 0 HG11 VAL A 41 69.310 0.016 -3.892 1.00 15.00 H new ATOM 0 HG12 VAL A 41 70.826 -0.205 -2.986 1.00 15.00 H new ATOM 0 HG13 VAL A 41 70.142 -1.557 -3.919 1.00 15.00 H new ATOM 0 HG21 VAL A 41 67.222 -1.083 -3.132 1.00 15.00 H new ATOM 0 HG22 VAL A 41 68.023 -2.672 -3.132 1.00 15.00 H new ATOM 0 HG23 VAL A 41 67.213 -2.084 -1.660 1.00 15.00 H new ATOM 671 N ARG A 42 69.645 -4.400 -2.047 1.00 15.00 N ATOM 672 CA ARG A 42 70.024 -5.603 -2.851 1.00 15.00 C ATOM 673 C ARG A 42 68.778 -6.227 -3.490 1.00 15.00 C ATOM 674 O ARG A 42 67.690 -6.143 -2.951 1.00 15.00 O ATOM 675 CB ARG A 42 70.683 -6.573 -1.854 1.00 15.00 C ATOM 676 CG ARG A 42 69.703 -6.942 -0.730 1.00 15.00 C ATOM 677 CD ARG A 42 70.465 -7.639 0.402 1.00 15.00 C ATOM 678 NE ARG A 42 70.929 -8.944 -0.172 1.00 15.00 N ATOM 679 CZ ARG A 42 71.879 -9.651 0.409 1.00 15.00 C ATOM 680 NH1 ARG A 42 72.460 -9.248 1.517 1.00 15.00 N ATOM 681 NH2 ARG A 42 72.251 -10.781 -0.129 1.00 15.00 N ATOM 0 H ARG A 42 68.785 -4.497 -1.507 1.00 15.00 H new ATOM 0 HA ARG A 42 70.702 -5.355 -3.668 1.00 15.00 H new ATOM 0 HB2 ARG A 42 71.004 -7.475 -2.374 1.00 15.00 H new ATOM 0 HB3 ARG A 42 71.576 -6.115 -1.429 1.00 15.00 H new ATOM 0 HG2 ARG A 42 69.210 -6.046 -0.353 1.00 15.00 H new ATOM 0 HG3 ARG A 42 68.922 -7.597 -1.115 1.00 15.00 H new ATOM 0 HD2 ARG A 42 71.309 -7.035 0.737 1.00 15.00 H new ATOM 0 HD3 ARG A 42 69.823 -7.797 1.268 1.00 15.00 H new ATOM 0 HE ARG A 42 70.501 -9.292 -1.030 1.00 15.00 H new ATOM 0 HH11 ARG A 42 72.179 -8.368 1.949 1.00 15.00 H new ATOM 0 HH12 ARG A 42 73.192 -9.815 1.944 1.00 15.00 H new ATOM 0 HH21 ARG A 42 71.808 -11.107 -0.988 1.00 15.00 H new ATOM 0 HH22 ARG A 42 72.984 -11.338 0.310 1.00 15.00 H new ATOM 695 N SER A 43 68.936 -6.850 -4.633 1.00 15.00 N ATOM 696 CA SER A 43 67.777 -7.516 -5.301 1.00 15.00 C ATOM 697 C SER A 43 67.781 -9.012 -4.975 1.00 15.00 C ATOM 698 O SER A 43 68.799 -9.673 -5.083 1.00 15.00 O ATOM 699 CB SER A 43 67.997 -7.276 -6.797 1.00 15.00 C ATOM 700 OG SER A 43 69.053 -8.107 -7.264 1.00 15.00 O ATOM 0 H SER A 43 69.822 -6.925 -5.133 1.00 15.00 H new ATOM 0 HA SER A 43 66.815 -7.125 -4.970 1.00 15.00 H new ATOM 0 HB2 SER A 43 67.081 -7.490 -7.348 1.00 15.00 H new ATOM 0 HB3 SER A 43 68.239 -6.228 -6.976 1.00 15.00 H new ATOM 0 HG SER A 43 69.347 -8.699 -6.541 1.00 15.00 H new ATOM 706 N PHE A 44 66.652 -9.550 -4.579 1.00 15.00 N ATOM 707 CA PHE A 44 66.620 -10.976 -4.119 1.00 15.00 C ATOM 708 C PHE A 44 66.769 -11.928 -5.308 1.00 15.00 C ATOM 709 O PHE A 44 67.455 -12.930 -5.223 1.00 15.00 O ATOM 710 CB PHE A 44 65.251 -11.160 -3.459 1.00 15.00 C ATOM 711 CG PHE A 44 65.092 -10.381 -2.175 1.00 15.00 C ATOM 712 CD1 PHE A 44 65.805 -10.772 -1.016 1.00 15.00 C ATOM 713 CD2 PHE A 44 64.227 -9.260 -2.130 1.00 15.00 C ATOM 714 CE1 PHE A 44 65.654 -10.041 0.189 1.00 15.00 C ATOM 715 CE2 PHE A 44 64.076 -8.530 -0.926 1.00 15.00 C ATOM 716 CZ PHE A 44 64.790 -8.921 0.233 1.00 15.00 C ATOM 0 H PHE A 44 65.754 -9.066 -4.554 1.00 15.00 H new ATOM 0 HA PHE A 44 67.437 -11.196 -3.432 1.00 15.00 H new ATOM 0 HB2 PHE A 44 64.474 -10.853 -4.160 1.00 15.00 H new ATOM 0 HB3 PHE A 44 65.095 -12.219 -3.254 1.00 15.00 H new ATOM 0 HD1 PHE A 44 66.464 -11.627 -1.050 1.00 15.00 H new ATOM 0 HD2 PHE A 44 63.683 -8.962 -3.014 1.00 15.00 H new ATOM 0 HE1 PHE A 44 66.198 -10.339 1.073 1.00 15.00 H new ATOM 0 HE2 PHE A 44 63.417 -7.675 -0.892 1.00 15.00 H new ATOM 0 HZ PHE A 44 64.675 -8.364 1.151 1.00 15.00 H new ATOM 984 N PHE A 62 74.275 -2.803 -3.906 1.00 15.00 N ATOM 985 CA PHE A 62 74.336 -1.475 -4.587 1.00 15.00 C ATOM 986 C PHE A 62 74.332 -0.351 -3.548 1.00 15.00 C ATOM 987 O PHE A 62 73.481 -0.306 -2.679 1.00 15.00 O ATOM 988 CB PHE A 62 73.075 -1.415 -5.446 1.00 15.00 C ATOM 989 CG PHE A 62 73.068 -2.416 -6.578 1.00 15.00 C ATOM 990 CD1 PHE A 62 72.529 -3.710 -6.374 1.00 15.00 C ATOM 991 CD2 PHE A 62 73.599 -2.060 -7.842 1.00 15.00 C ATOM 992 CE1 PHE A 62 72.521 -4.648 -7.435 1.00 15.00 C ATOM 993 CE2 PHE A 62 73.591 -2.998 -8.902 1.00 15.00 C ATOM 994 CZ PHE A 62 73.052 -4.293 -8.699 1.00 15.00 C ATOM 0 HA PHE A 62 75.241 -1.355 -5.183 1.00 15.00 H new ATOM 0 HB2 PHE A 62 72.205 -1.589 -4.813 1.00 15.00 H new ATOM 0 HB3 PHE A 62 72.974 -0.411 -5.859 1.00 15.00 H new ATOM 0 HD1 PHE A 62 72.124 -3.981 -5.410 1.00 15.00 H new ATOM 0 HD2 PHE A 62 74.010 -1.073 -7.997 1.00 15.00 H new ATOM 0 HE1 PHE A 62 72.110 -5.635 -7.280 1.00 15.00 H new ATOM 0 HE2 PHE A 62 73.996 -2.727 -9.866 1.00 15.00 H new ATOM 0 HZ PHE A 62 73.046 -5.009 -9.508 1.00 15.00 H new ATOM 1004 N GLU A 63 75.279 0.552 -3.637 1.00 15.00 N ATOM 1005 CA GLU A 63 75.373 1.655 -2.628 1.00 15.00 C ATOM 1006 C GLU A 63 74.186 2.615 -2.763 1.00 15.00 C ATOM 1007 O GLU A 63 73.614 3.043 -1.776 1.00 15.00 O ATOM 1008 CB GLU A 63 76.685 2.382 -2.940 1.00 15.00 C ATOM 1009 CG GLU A 63 77.869 1.460 -2.637 1.00 15.00 C ATOM 1010 CD GLU A 63 78.013 1.286 -1.123 1.00 15.00 C ATOM 1011 OE1 GLU A 63 78.222 0.163 -0.693 1.00 15.00 O ATOM 1012 OE2 GLU A 63 77.912 2.278 -0.419 1.00 15.00 O ATOM 0 H GLU A 63 75.992 0.573 -4.366 1.00 15.00 H new ATOM 0 HA GLU A 63 75.353 1.270 -1.608 1.00 15.00 H new ATOM 0 HB2 GLU A 63 76.705 2.684 -3.987 1.00 15.00 H new ATOM 0 HB3 GLU A 63 76.758 3.292 -2.345 1.00 15.00 H new ATOM 0 HG2 GLU A 63 77.718 0.490 -3.111 1.00 15.00 H new ATOM 0 HG3 GLU A 63 78.785 1.879 -3.053 1.00 15.00 H new ATOM 1019 N TYR A 64 73.813 2.956 -3.973 1.00 15.00 N ATOM 1020 CA TYR A 64 72.710 3.945 -4.173 1.00 15.00 C ATOM 1021 C TYR A 64 71.976 3.676 -5.491 1.00 15.00 C ATOM 1022 O TYR A 64 72.571 3.678 -6.553 1.00 15.00 O ATOM 1023 CB TYR A 64 73.411 5.302 -4.221 1.00 15.00 C ATOM 1024 CG TYR A 64 72.476 6.482 -4.070 1.00 15.00 C ATOM 1025 CD1 TYR A 64 71.517 6.761 -5.075 1.00 15.00 C ATOM 1026 CD2 TYR A 64 72.564 7.311 -2.926 1.00 15.00 C ATOM 1027 CE1 TYR A 64 70.648 7.869 -4.934 1.00 15.00 C ATOM 1028 CE2 TYR A 64 71.693 8.419 -2.787 1.00 15.00 C ATOM 1029 CZ TYR A 64 70.735 8.698 -3.790 1.00 15.00 C ATOM 1030 OH TYR A 64 69.888 9.779 -3.655 1.00 15.00 O ATOM 0 H TYR A 64 74.226 2.591 -4.831 1.00 15.00 H new ATOM 0 HA TYR A 64 71.961 3.892 -3.383 1.00 15.00 H new ATOM 0 HB2 TYR A 64 74.160 5.341 -3.430 1.00 15.00 H new ATOM 0 HB3 TYR A 64 73.943 5.392 -5.168 1.00 15.00 H new ATOM 0 HD1 TYR A 64 71.449 6.129 -5.948 1.00 15.00 H new ATOM 0 HD2 TYR A 64 73.295 7.099 -2.160 1.00 15.00 H new ATOM 0 HE1 TYR A 64 69.917 8.082 -5.700 1.00 15.00 H new ATOM 0 HE2 TYR A 64 71.760 9.052 -1.914 1.00 15.00 H new ATOM 0 HH TYR A 64 70.080 10.241 -2.812 1.00 15.00 H new ATOM 1040 N ILE A 65 70.686 3.443 -5.424 1.00 15.00 N ATOM 1041 CA ILE A 65 69.869 3.319 -6.676 1.00 15.00 C ATOM 1042 C ILE A 65 68.620 4.206 -6.569 1.00 15.00 C ATOM 1043 O ILE A 65 68.084 4.408 -5.494 1.00 15.00 O ATOM 1044 CB ILE A 65 69.485 1.832 -6.780 1.00 15.00 C ATOM 1045 CG1 ILE A 65 70.757 0.983 -6.916 1.00 15.00 C ATOM 1046 CG2 ILE A 65 68.596 1.608 -8.013 1.00 15.00 C ATOM 1047 CD1 ILE A 65 70.416 -0.505 -6.759 1.00 15.00 C ATOM 0 H ILE A 65 70.162 3.333 -4.556 1.00 15.00 H new ATOM 0 HA ILE A 65 70.417 3.642 -7.561 1.00 15.00 H new ATOM 0 HB ILE A 65 68.940 1.541 -5.882 1.00 15.00 H new ATOM 0 HG12 ILE A 65 71.218 1.158 -7.888 1.00 15.00 H new ATOM 0 HG13 ILE A 65 71.484 1.279 -6.160 1.00 15.00 H new ATOM 0 HG21 ILE A 65 68.328 0.554 -8.081 1.00 15.00 H new ATOM 0 HG22 ILE A 65 67.690 2.208 -7.923 1.00 15.00 H new ATOM 0 HG23 ILE A 65 69.138 1.903 -8.911 1.00 15.00 H new ATOM 0 HD11 ILE A 65 71.325 -1.099 -6.857 1.00 15.00 H new ATOM 0 HD12 ILE A 65 69.975 -0.676 -5.777 1.00 15.00 H new ATOM 0 HD13 ILE A 65 69.705 -0.799 -7.532 1.00 15.00 H new ATOM 1059 N ILE A 66 68.160 4.733 -7.679 1.00 15.00 N ATOM 1060 CA ILE A 66 66.968 5.639 -7.657 1.00 15.00 C ATOM 1061 C ILE A 66 65.769 4.940 -8.309 1.00 15.00 C ATOM 1062 O ILE A 66 65.892 4.322 -9.351 1.00 15.00 O ATOM 1063 CB ILE A 66 67.383 6.879 -8.467 1.00 15.00 C ATOM 1064 CG1 ILE A 66 68.596 7.550 -7.811 1.00 15.00 C ATOM 1065 CG2 ILE A 66 66.226 7.885 -8.512 1.00 15.00 C ATOM 1066 CD1 ILE A 66 69.202 8.569 -8.779 1.00 15.00 C ATOM 0 H ILE A 66 68.561 4.574 -8.603 1.00 15.00 H new ATOM 0 HA ILE A 66 66.670 5.906 -6.643 1.00 15.00 H new ATOM 0 HB ILE A 66 67.638 6.565 -9.479 1.00 15.00 H new ATOM 0 HG12 ILE A 66 68.296 8.044 -6.887 1.00 15.00 H new ATOM 0 HG13 ILE A 66 69.340 6.799 -7.544 1.00 15.00 H new ATOM 0 HG21 ILE A 66 66.527 8.760 -9.087 1.00 15.00 H new ATOM 0 HG22 ILE A 66 65.359 7.422 -8.983 1.00 15.00 H new ATOM 0 HG23 ILE A 66 65.968 8.189 -7.497 1.00 15.00 H new ATOM 0 HD11 ILE A 66 70.064 9.046 -8.313 1.00 15.00 H new ATOM 0 HD12 ILE A 66 69.517 8.062 -9.691 1.00 15.00 H new ATOM 0 HD13 ILE A 66 68.457 9.326 -9.024 1.00 15.00 H new ATOM 1078 N PHE A 67 64.612 5.038 -7.700 1.00 15.00 N ATOM 1079 CA PHE A 67 63.375 4.467 -8.316 1.00 15.00 C ATOM 1080 C PHE A 67 62.293 5.546 -8.414 1.00 15.00 C ATOM 1081 O PHE A 67 62.135 6.356 -7.518 1.00 15.00 O ATOM 1082 CB PHE A 67 62.936 3.352 -7.366 1.00 15.00 C ATOM 1083 CG PHE A 67 63.878 2.171 -7.347 1.00 15.00 C ATOM 1084 CD1 PHE A 67 63.989 1.335 -8.485 1.00 15.00 C ATOM 1085 CD2 PHE A 67 64.647 1.898 -6.190 1.00 15.00 C ATOM 1086 CE1 PHE A 67 64.870 0.228 -8.466 1.00 15.00 C ATOM 1087 CE2 PHE A 67 65.530 0.791 -6.172 1.00 15.00 C ATOM 1088 CZ PHE A 67 65.641 -0.045 -7.311 1.00 15.00 C ATOM 0 H PHE A 67 64.472 5.492 -6.797 1.00 15.00 H new ATOM 0 HA PHE A 67 63.548 4.095 -9.326 1.00 15.00 H new ATOM 0 HB2 PHE A 67 62.853 3.757 -6.357 1.00 15.00 H new ATOM 0 HB3 PHE A 67 61.942 3.010 -7.655 1.00 15.00 H new ATOM 0 HD1 PHE A 67 63.401 1.542 -9.367 1.00 15.00 H new ATOM 0 HD2 PHE A 67 64.560 2.534 -5.321 1.00 15.00 H new ATOM 0 HE1 PHE A 67 64.954 -0.409 -9.334 1.00 15.00 H new ATOM 0 HE2 PHE A 67 66.119 0.584 -5.291 1.00 15.00 H new ATOM 0 HZ PHE A 67 66.314 -0.890 -7.298 1.00 15.00 H new ATOM 1098 N ARG A 68 61.551 5.561 -9.494 1.00 15.00 N ATOM 1099 CA ARG A 68 60.475 6.584 -9.661 1.00 15.00 C ATOM 1100 C ARG A 68 59.102 5.947 -9.424 1.00 15.00 C ATOM 1101 O ARG A 68 58.908 4.769 -9.657 1.00 15.00 O ATOM 1102 CB ARG A 68 60.597 7.065 -11.108 1.00 15.00 C ATOM 1103 CG ARG A 68 61.916 7.819 -11.291 1.00 15.00 C ATOM 1104 CD ARG A 68 62.114 8.149 -12.774 1.00 15.00 C ATOM 1105 NE ARG A 68 63.473 8.770 -12.856 1.00 15.00 N ATOM 1106 CZ ARG A 68 63.686 10.020 -12.490 1.00 15.00 C ATOM 1107 NH1 ARG A 68 62.720 10.776 -12.019 1.00 15.00 N ATOM 1108 NH2 ARG A 68 64.889 10.516 -12.593 1.00 15.00 N ATOM 0 H ARG A 68 61.646 4.905 -10.270 1.00 15.00 H new ATOM 0 HA ARG A 68 60.576 7.405 -8.951 1.00 15.00 H new ATOM 0 HB2 ARG A 68 60.555 6.215 -11.789 1.00 15.00 H new ATOM 0 HB3 ARG A 68 59.758 7.714 -11.358 1.00 15.00 H new ATOM 0 HG2 ARG A 68 61.908 8.736 -10.701 1.00 15.00 H new ATOM 0 HG3 ARG A 68 62.747 7.214 -10.928 1.00 15.00 H new ATOM 0 HD2 ARG A 68 62.053 7.251 -13.389 1.00 15.00 H new ATOM 0 HD3 ARG A 68 61.345 8.834 -13.132 1.00 15.00 H new ATOM 0 HE ARG A 68 64.254 8.213 -13.203 1.00 15.00 H new ATOM 0 HH11 ARG A 68 61.776 10.400 -11.928 1.00 15.00 H new ATOM 0 HH12 ARG A 68 62.914 11.739 -11.744 1.00 15.00 H new ATOM 0 HH21 ARG A 68 65.649 9.939 -12.953 1.00 15.00 H new ATOM 0 HH22 ARG A 68 65.069 11.481 -12.314 1.00 15.00 H new ATOM 1122 N GLY A 69 58.147 6.722 -8.961 1.00 15.00 N ATOM 1123 CA GLY A 69 56.777 6.173 -8.696 1.00 15.00 C ATOM 1124 C GLY A 69 56.189 5.541 -9.968 1.00 15.00 C ATOM 1125 O GLY A 69 55.351 4.661 -9.897 1.00 15.00 O ATOM 0 H GLY A 69 58.259 7.715 -8.755 1.00 15.00 H new ATOM 0 HA2 GLY A 69 56.826 5.427 -7.903 1.00 15.00 H new ATOM 0 HA3 GLY A 69 56.122 6.970 -8.344 1.00 15.00 H new ATOM 1129 N SER A 70 56.621 5.985 -11.128 1.00 15.00 N ATOM 1130 CA SER A 70 56.063 5.435 -12.406 1.00 15.00 C ATOM 1131 C SER A 70 56.426 3.952 -12.565 1.00 15.00 C ATOM 1132 O SER A 70 55.592 3.140 -12.921 1.00 15.00 O ATOM 1133 CB SER A 70 56.709 6.261 -13.521 1.00 15.00 C ATOM 1134 OG SER A 70 56.107 5.924 -14.764 1.00 15.00 O ATOM 0 H SER A 70 57.335 6.704 -11.243 1.00 15.00 H new ATOM 0 HA SER A 70 54.975 5.498 -12.428 1.00 15.00 H new ATOM 0 HB2 SER A 70 56.584 7.325 -13.320 1.00 15.00 H new ATOM 0 HB3 SER A 70 57.781 6.067 -13.559 1.00 15.00 H new ATOM 0 HG SER A 70 56.517 6.452 -15.480 1.00 15.00 H new ATOM 1140 N ASP A 71 57.662 3.597 -12.303 1.00 15.00 N ATOM 1141 CA ASP A 71 58.097 2.176 -12.499 1.00 15.00 C ATOM 1142 C ASP A 71 57.700 1.316 -11.292 1.00 15.00 C ATOM 1143 O ASP A 71 57.423 0.139 -11.426 1.00 15.00 O ATOM 1144 CB ASP A 71 59.627 2.226 -12.665 1.00 15.00 C ATOM 1145 CG ASP A 71 60.288 2.789 -11.400 1.00 15.00 C ATOM 1146 OD1 ASP A 71 60.470 2.029 -10.463 1.00 15.00 O ATOM 1147 OD2 ASP A 71 60.601 3.967 -11.393 1.00 15.00 O ATOM 0 H ASP A 71 58.387 4.228 -11.963 1.00 15.00 H new ATOM 0 HA ASP A 71 57.619 1.725 -13.369 1.00 15.00 H new ATOM 0 HB2 ASP A 71 60.009 1.226 -12.867 1.00 15.00 H new ATOM 0 HB3 ASP A 71 59.885 2.846 -13.524 1.00 15.00 H new ATOM 1152 N ILE A 72 57.670 1.898 -10.116 1.00 15.00 N ATOM 1153 CA ILE A 72 57.284 1.120 -8.893 1.00 15.00 C ATOM 1154 C ILE A 72 55.813 0.690 -8.991 1.00 15.00 C ATOM 1155 O ILE A 72 54.957 1.466 -9.374 1.00 15.00 O ATOM 1156 CB ILE A 72 57.493 2.075 -7.703 1.00 15.00 C ATOM 1157 CG1 ILE A 72 58.965 2.494 -7.624 1.00 15.00 C ATOM 1158 CG2 ILE A 72 57.106 1.374 -6.395 1.00 15.00 C ATOM 1159 CD1 ILE A 72 59.099 3.712 -6.708 1.00 15.00 C ATOM 0 H ILE A 72 57.896 2.879 -9.949 1.00 15.00 H new ATOM 0 HA ILE A 72 57.880 0.214 -8.781 1.00 15.00 H new ATOM 0 HB ILE A 72 56.866 2.955 -7.847 1.00 15.00 H new ATOM 0 HG12 ILE A 72 59.569 1.670 -7.243 1.00 15.00 H new ATOM 0 HG13 ILE A 72 59.341 2.731 -8.619 1.00 15.00 H new ATOM 0 HG21 ILE A 72 57.257 2.056 -5.558 1.00 15.00 H new ATOM 0 HG22 ILE A 72 56.058 1.078 -6.437 1.00 15.00 H new ATOM 0 HG23 ILE A 72 57.728 0.489 -6.258 1.00 15.00 H new ATOM 0 HD11 ILE A 72 60.146 4.011 -6.651 1.00 15.00 H new ATOM 0 HD12 ILE A 72 58.508 4.535 -7.109 1.00 15.00 H new ATOM 0 HD13 ILE A 72 58.739 3.459 -5.711 1.00 15.00 H new ATOM 1171 N LYS A 73 55.524 -0.541 -8.646 1.00 15.00 N ATOM 1172 CA LYS A 73 54.115 -1.033 -8.705 1.00 15.00 C ATOM 1173 C LYS A 73 53.526 -1.124 -7.295 1.00 15.00 C ATOM 1174 O LYS A 73 52.375 -0.795 -7.074 1.00 15.00 O ATOM 1175 CB LYS A 73 54.206 -2.422 -9.341 1.00 15.00 C ATOM 1176 CG LYS A 73 52.801 -2.925 -9.674 1.00 15.00 C ATOM 1177 CD LYS A 73 52.888 -4.342 -10.245 1.00 15.00 C ATOM 1178 CE LYS A 73 51.504 -4.785 -10.724 1.00 15.00 C ATOM 1179 NZ LYS A 73 51.576 -6.271 -10.786 1.00 15.00 N ATOM 0 H LYS A 73 56.207 -1.227 -8.325 1.00 15.00 H new ATOM 0 HA LYS A 73 53.468 -0.366 -9.275 1.00 15.00 H new ATOM 0 HB2 LYS A 73 54.812 -2.380 -10.246 1.00 15.00 H new ATOM 0 HB3 LYS A 73 54.699 -3.114 -8.659 1.00 15.00 H new ATOM 0 HG2 LYS A 73 52.180 -2.920 -8.778 1.00 15.00 H new ATOM 0 HG3 LYS A 73 52.326 -2.259 -10.395 1.00 15.00 H new ATOM 0 HD2 LYS A 73 53.597 -4.369 -11.073 1.00 15.00 H new ATOM 0 HD3 LYS A 73 53.259 -5.030 -9.485 1.00 15.00 H new ATOM 0 HE2 LYS A 73 50.724 -4.456 -10.037 1.00 15.00 H new ATOM 0 HE3 LYS A 73 51.269 -4.360 -11.700 1.00 15.00 H new ATOM 0 HZ1 LYS A 73 50.662 -6.650 -11.107 1.00 15.00 H new ATOM 0 HZ2 LYS A 73 52.322 -6.555 -11.453 1.00 15.00 H new ATOM 0 HZ3 LYS A 73 51.794 -6.648 -9.841 1.00 15.00 H new ATOM 1193 N ASP A 74 54.310 -1.569 -6.342 1.00 15.00 N ATOM 1194 CA ASP A 74 53.792 -1.715 -4.944 1.00 15.00 C ATOM 1195 C ASP A 74 54.862 -1.303 -3.928 1.00 15.00 C ATOM 1196 O ASP A 74 56.035 -1.560 -4.114 1.00 15.00 O ATOM 1197 CB ASP A 74 53.462 -3.201 -4.801 1.00 15.00 C ATOM 1198 CG ASP A 74 52.691 -3.432 -3.499 1.00 15.00 C ATOM 1199 OD1 ASP A 74 51.781 -2.664 -3.228 1.00 15.00 O ATOM 1200 OD2 ASP A 74 53.022 -4.371 -2.796 1.00 15.00 O ATOM 0 H ASP A 74 55.286 -1.837 -6.471 1.00 15.00 H new ATOM 0 HA ASP A 74 52.925 -1.081 -4.759 1.00 15.00 H new ATOM 0 HB2 ASP A 74 52.868 -3.536 -5.652 1.00 15.00 H new ATOM 0 HB3 ASP A 74 54.379 -3.789 -4.802 1.00 15.00 H new ATOM 1205 N LEU A 75 54.457 -0.666 -2.854 1.00 15.00 N ATOM 1206 CA LEU A 75 55.435 -0.247 -1.801 1.00 15.00 C ATOM 1207 C LEU A 75 54.942 -0.685 -0.418 1.00 15.00 C ATOM 1208 O LEU A 75 53.822 -0.400 -0.034 1.00 15.00 O ATOM 1209 CB LEU A 75 55.483 1.280 -1.894 1.00 15.00 C ATOM 1210 CG LEU A 75 56.692 1.808 -1.118 1.00 15.00 C ATOM 1211 CD1 LEU A 75 57.081 3.187 -1.655 1.00 15.00 C ATOM 1212 CD2 LEU A 75 56.336 1.925 0.367 1.00 15.00 C ATOM 0 H LEU A 75 53.487 -0.418 -2.662 1.00 15.00 H new ATOM 0 HA LEU A 75 56.417 -0.697 -1.945 1.00 15.00 H new ATOM 0 HB2 LEU A 75 55.546 1.588 -2.938 1.00 15.00 H new ATOM 0 HB3 LEU A 75 54.565 1.707 -1.490 1.00 15.00 H new ATOM 0 HG LEU A 75 57.528 1.119 -1.240 1.00 15.00 H new ATOM 0 HD11 LEU A 75 57.942 3.563 -1.102 1.00 15.00 H new ATOM 0 HD12 LEU A 75 57.335 3.107 -2.712 1.00 15.00 H new ATOM 0 HD13 LEU A 75 56.244 3.874 -1.534 1.00 15.00 H new ATOM 0 HD21 LEU A 75 57.197 2.301 0.919 1.00 15.00 H new ATOM 0 HD22 LEU A 75 55.499 2.613 0.487 1.00 15.00 H new ATOM 0 HD23 LEU A 75 56.058 0.944 0.753 1.00 15.00 H new ATOM 1224 N THR A 76 55.770 -1.377 0.329 1.00 15.00 N ATOM 1225 CA THR A 76 55.367 -1.820 1.701 1.00 15.00 C ATOM 1226 C THR A 76 56.445 -1.435 2.721 1.00 15.00 C ATOM 1227 O THR A 76 57.627 -1.558 2.459 1.00 15.00 O ATOM 1228 CB THR A 76 55.241 -3.341 1.602 1.00 15.00 C ATOM 1229 OG1 THR A 76 54.423 -3.675 0.489 1.00 15.00 O ATOM 1230 CG2 THR A 76 54.607 -3.887 2.883 1.00 15.00 C ATOM 0 H THR A 76 56.710 -1.654 0.046 1.00 15.00 H new ATOM 0 HA THR A 76 54.439 -1.353 2.031 1.00 15.00 H new ATOM 0 HB THR A 76 56.230 -3.780 1.473 1.00 15.00 H new ATOM 0 HG1 THR A 76 54.342 -4.649 0.423 1.00 15.00 H new ATOM 0 HG21 THR A 76 54.518 -4.971 2.811 1.00 15.00 H new ATOM 0 HG22 THR A 76 55.234 -3.630 3.737 1.00 15.00 H new ATOM 0 HG23 THR A 76 53.617 -3.449 3.014 1.00 15.00 H new