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= -2.47! USER MOD Set 1.2: A 64 TYR OH : rot 180:sc= -0.973 USER MOD Single : A 10 SER OG : rot 34:sc= 0.123 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot -110:sc= 0.237 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=0.000303 USER MOD Single : A 33 ASN : amide:sc= 0 K(o=0,f=-1) USER MOD Single : A 34 SER OG : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 180:sc= -0.453 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 SER OG : rot -6:sc= 0.595 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 64.161 4.245 7.803 1.00 15.00 N ATOM 162 CA SER A 10 63.448 2.957 8.089 1.00 15.00 C ATOM 163 C SER A 10 63.665 1.963 6.944 1.00 15.00 C ATOM 164 O SER A 10 64.011 2.342 5.843 1.00 15.00 O ATOM 165 CB SER A 10 61.968 3.326 8.202 1.00 15.00 C ATOM 166 OG SER A 10 61.787 4.212 9.299 1.00 15.00 O ATOM 0 HA SER A 10 63.817 2.482 8.998 1.00 15.00 H new ATOM 0 HB2 SER A 10 61.627 3.796 7.280 1.00 15.00 H new ATOM 0 HB3 SER A 10 61.367 2.428 8.342 1.00 15.00 H new ATOM 0 HG SER A 10 62.572 4.792 9.384 1.00 15.00 H new ATOM 172 N LYS A 11 63.464 0.692 7.204 1.00 15.00 N ATOM 173 CA LYS A 11 63.673 -0.346 6.144 1.00 15.00 C ATOM 174 C LYS A 11 62.396 -0.524 5.314 1.00 15.00 C ATOM 175 O LYS A 11 61.316 -0.701 5.851 1.00 15.00 O ATOM 176 CB LYS A 11 64.001 -1.631 6.907 1.00 15.00 C ATOM 177 CG LYS A 11 64.567 -2.674 5.941 1.00 15.00 C ATOM 178 CD LYS A 11 64.953 -3.933 6.722 1.00 15.00 C ATOM 179 CE LYS A 11 65.825 -4.834 5.845 1.00 15.00 C ATOM 180 NZ LYS A 11 66.711 -5.559 6.798 1.00 15.00 N ATOM 0 H LYS A 11 63.163 0.328 8.108 1.00 15.00 H new ATOM 0 HA LYS A 11 64.466 -0.071 5.448 1.00 15.00 H new ATOM 0 HB2 LYS A 11 64.723 -1.422 7.696 1.00 15.00 H new ATOM 0 HB3 LYS A 11 63.104 -2.018 7.390 1.00 15.00 H new ATOM 0 HG2 LYS A 11 63.828 -2.918 5.178 1.00 15.00 H new ATOM 0 HG3 LYS A 11 65.438 -2.272 5.424 1.00 15.00 H new ATOM 0 HD2 LYS A 11 65.492 -3.659 7.629 1.00 15.00 H new ATOM 0 HD3 LYS A 11 64.057 -4.469 7.033 1.00 15.00 H new ATOM 0 HE2 LYS A 11 65.217 -5.528 5.265 1.00 15.00 H new ATOM 0 HE3 LYS A 11 66.407 -4.248 5.133 1.00 15.00 H new ATOM 0 HZ1 LYS A 11 67.340 -6.198 6.270 1.00 15.00 H new ATOM 0 HZ2 LYS A 11 67.283 -4.873 7.331 1.00 15.00 H new ATOM 0 HZ3 LYS A 11 66.130 -6.113 7.459 1.00 15.00 H new ATOM 194 N ILE A 12 62.516 -0.480 4.007 1.00 15.00 N ATOM 195 CA ILE A 12 61.308 -0.586 3.131 1.00 15.00 C ATOM 196 C ILE A 12 61.565 -1.597 2.006 1.00 15.00 C ATOM 197 O ILE A 12 62.687 -1.780 1.566 1.00 15.00 O ATOM 198 CB ILE A 12 61.086 0.826 2.559 1.00 15.00 C ATOM 199 CG1 ILE A 12 60.826 1.812 3.707 1.00 15.00 C ATOM 200 CG2 ILE A 12 59.872 0.821 1.619 1.00 15.00 C ATOM 201 CD1 ILE A 12 60.820 3.245 3.168 1.00 15.00 C ATOM 0 H ILE A 12 63.401 -0.375 3.510 1.00 15.00 H new ATOM 0 HA ILE A 12 60.432 -0.933 3.679 1.00 15.00 H new ATOM 0 HB ILE A 12 61.975 1.129 2.006 1.00 15.00 H new ATOM 0 HG12 ILE A 12 59.871 1.588 4.182 1.00 15.00 H new ATOM 0 HG13 ILE A 12 61.595 1.705 4.472 1.00 15.00 H new ATOM 0 HG21 ILE A 12 59.719 1.822 1.217 1.00 15.00 H new ATOM 0 HG22 ILE A 12 60.049 0.124 0.800 1.00 15.00 H new ATOM 0 HG23 ILE A 12 58.985 0.513 2.172 1.00 15.00 H new ATOM 0 HD11 ILE A 12 60.635 3.941 3.986 1.00 15.00 H new ATOM 0 HD12 ILE A 12 61.786 3.467 2.714 1.00 15.00 H new ATOM 0 HD13 ILE A 12 60.035 3.349 2.419 1.00 15.00 H new ATOM 213 N SER A 13 60.525 -2.249 1.546 1.00 15.00 N ATOM 214 CA SER A 13 60.657 -3.182 0.389 1.00 15.00 C ATOM 215 C SER A 13 59.845 -2.651 -0.794 1.00 15.00 C ATOM 216 O SER A 13 58.702 -2.261 -0.643 1.00 15.00 O ATOM 217 CB SER A 13 60.083 -4.510 0.882 1.00 15.00 C ATOM 218 OG SER A 13 60.271 -5.503 -0.117 1.00 15.00 O ATOM 0 H SER A 13 59.582 -2.172 1.928 1.00 15.00 H new ATOM 0 HA SER A 13 61.688 -3.289 0.052 1.00 15.00 H new ATOM 0 HB2 SER A 13 60.575 -4.811 1.807 1.00 15.00 H new ATOM 0 HB3 SER A 13 59.022 -4.400 1.106 1.00 15.00 H new ATOM 0 HG SER A 13 59.405 -5.743 -0.507 1.00 15.00 H new ATOM 224 N LEU A 14 60.430 -2.633 -1.965 1.00 15.00 N ATOM 225 CA LEU A 14 59.741 -2.045 -3.151 1.00 15.00 C ATOM 226 C LEU A 14 59.628 -3.084 -4.270 1.00 15.00 C ATOM 227 O LEU A 14 60.565 -3.809 -4.548 1.00 15.00 O ATOM 228 CB LEU A 14 60.639 -0.887 -3.586 1.00 15.00 C ATOM 229 CG LEU A 14 59.823 0.118 -4.398 1.00 15.00 C ATOM 230 CD1 LEU A 14 58.925 0.925 -3.458 1.00 15.00 C ATOM 231 CD2 LEU A 14 60.773 1.066 -5.133 1.00 15.00 C ATOM 0 H LEU A 14 61.362 -3.003 -2.150 1.00 15.00 H new ATOM 0 HA LEU A 14 58.727 -1.717 -2.922 1.00 15.00 H new ATOM 0 HB2 LEU A 14 61.069 -0.399 -2.711 1.00 15.00 H new ATOM 0 HB3 LEU A 14 61.470 -1.263 -4.183 1.00 15.00 H new ATOM 0 HG LEU A 14 59.205 -0.414 -5.122 1.00 15.00 H new ATOM 0 HD11 LEU A 14 58.343 1.642 -4.037 1.00 15.00 H new ATOM 0 HD12 LEU A 14 58.250 0.250 -2.932 1.00 15.00 H new ATOM 0 HD13 LEU A 14 59.542 1.458 -2.735 1.00 15.00 H new ATOM 0 HD21 LEU A 14 60.194 1.784 -5.713 1.00 15.00 H new ATOM 0 HD22 LEU A 14 61.389 1.598 -4.408 1.00 15.00 H new ATOM 0 HD23 LEU A 14 61.414 0.492 -5.802 1.00 15.00 H new ATOM 243 N ILE A 15 58.488 -3.157 -4.909 1.00 15.00 N ATOM 244 CA ILE A 15 58.312 -4.111 -6.048 1.00 15.00 C ATOM 245 C ILE A 15 58.225 -3.316 -7.355 1.00 15.00 C ATOM 246 O ILE A 15 57.360 -2.473 -7.515 1.00 15.00 O ATOM 247 CB ILE A 15 56.996 -4.854 -5.763 1.00 15.00 C ATOM 248 CG1 ILE A 15 57.101 -5.603 -4.428 1.00 15.00 C ATOM 249 CG2 ILE A 15 56.716 -5.867 -6.880 1.00 15.00 C ATOM 250 CD1 ILE A 15 55.710 -6.065 -3.986 1.00 15.00 C ATOM 0 H ILE A 15 57.666 -2.594 -4.690 1.00 15.00 H new ATOM 0 HA ILE A 15 59.140 -4.813 -6.146 1.00 15.00 H new ATOM 0 HB ILE A 15 56.186 -4.127 -5.715 1.00 15.00 H new ATOM 0 HG12 ILE A 15 57.764 -6.462 -4.533 1.00 15.00 H new ATOM 0 HG13 ILE A 15 57.538 -4.954 -3.669 1.00 15.00 H new ATOM 0 HG21 ILE A 15 55.782 -6.390 -6.672 1.00 15.00 H new ATOM 0 HG22 ILE A 15 56.634 -5.344 -7.833 1.00 15.00 H new ATOM 0 HG23 ILE A 15 57.532 -6.588 -6.930 1.00 15.00 H new ATOM 0 HD11 ILE A 15 55.788 -6.597 -3.038 1.00 15.00 H new ATOM 0 HD12 ILE A 15 55.060 -5.198 -3.864 1.00 15.00 H new ATOM 0 HD13 ILE A 15 55.290 -6.730 -4.741 1.00 15.00 H new ATOM 262 N SER A 16 59.112 -3.586 -8.284 1.00 15.00 N ATOM 263 CA SER A 16 59.209 -2.738 -9.513 1.00 15.00 C ATOM 264 C SER A 16 58.358 -3.319 -10.648 1.00 15.00 C ATOM 265 O SER A 16 57.843 -4.418 -10.553 1.00 15.00 O ATOM 266 CB SER A 16 60.691 -2.755 -9.891 1.00 15.00 C ATOM 267 OG SER A 16 61.385 -1.789 -9.113 1.00 15.00 O ATOM 0 H SER A 16 59.775 -4.360 -8.243 1.00 15.00 H new ATOM 0 HA SER A 16 58.840 -1.727 -9.337 1.00 15.00 H new ATOM 0 HB2 SER A 16 61.111 -3.746 -9.720 1.00 15.00 H new ATOM 0 HB3 SER A 16 60.810 -2.538 -10.952 1.00 15.00 H new ATOM 0 HG SER A 16 62.335 -1.798 -9.352 1.00 15.00 H new ATOM 273 N LYS A 17 58.216 -2.584 -11.726 1.00 15.00 N ATOM 274 CA LYS A 17 57.358 -3.052 -12.870 1.00 15.00 C ATOM 275 C LYS A 17 57.872 -4.381 -13.450 1.00 15.00 C ATOM 276 O LYS A 17 57.142 -5.083 -14.127 1.00 15.00 O ATOM 277 CB LYS A 17 57.450 -1.944 -13.924 1.00 15.00 C ATOM 278 CG LYS A 17 56.411 -2.192 -15.021 1.00 15.00 C ATOM 279 CD LYS A 17 55.021 -1.815 -14.503 1.00 15.00 C ATOM 280 CE LYS A 17 53.992 -1.996 -15.621 1.00 15.00 C ATOM 281 NZ LYS A 17 52.690 -1.613 -15.009 1.00 15.00 N ATOM 0 H LYS A 17 58.658 -1.676 -11.866 1.00 15.00 H new ATOM 0 HA LYS A 17 56.333 -3.233 -12.546 1.00 15.00 H new ATOM 0 HB2 LYS A 17 57.280 -0.972 -13.461 1.00 15.00 H new ATOM 0 HB3 LYS A 17 58.451 -1.920 -14.355 1.00 15.00 H new ATOM 0 HG2 LYS A 17 56.653 -1.603 -15.906 1.00 15.00 H new ATOM 0 HG3 LYS A 17 56.427 -3.240 -15.321 1.00 15.00 H new ATOM 0 HD2 LYS A 17 54.758 -2.439 -13.648 1.00 15.00 H new ATOM 0 HD3 LYS A 17 55.019 -0.782 -14.156 1.00 15.00 H new ATOM 0 HE2 LYS A 17 54.226 -1.366 -16.479 1.00 15.00 H new ATOM 0 HE3 LYS A 17 53.973 -3.026 -15.978 1.00 15.00 H new ATOM 0 HZ1 LYS A 17 51.932 -1.711 -15.715 1.00 15.00 H new ATOM 0 HZ2 LYS A 17 52.491 -2.234 -14.199 1.00 15.00 H new ATOM 0 HZ3 LYS A 17 52.736 -0.626 -14.685 1.00 15.00 H new ATOM 295 N ALA A 18 59.113 -4.731 -13.195 1.00 15.00 N ATOM 296 CA ALA A 18 59.672 -6.001 -13.760 1.00 15.00 C ATOM 297 C ALA A 18 59.443 -7.185 -12.805 1.00 15.00 C ATOM 298 O ALA A 18 60.077 -8.215 -12.935 1.00 15.00 O ATOM 299 CB ALA A 18 61.170 -5.735 -13.924 1.00 15.00 C ATOM 0 H ALA A 18 59.761 -4.192 -12.621 1.00 15.00 H new ATOM 0 HA ALA A 18 59.190 -6.267 -14.701 1.00 15.00 H new ATOM 0 HB1 ALA A 18 61.654 -6.621 -14.335 1.00 15.00 H new ATOM 0 HB2 ALA A 18 61.318 -4.894 -14.601 1.00 15.00 H new ATOM 0 HB3 ALA A 18 61.606 -5.500 -12.953 1.00 15.00 H new ATOM 305 N GLU A 19 58.544 -7.049 -11.847 1.00 15.00 N ATOM 306 CA GLU A 19 58.218 -8.181 -10.910 1.00 15.00 C ATOM 307 C GLU A 19 59.477 -8.659 -10.173 1.00 15.00 C ATOM 308 O GLU A 19 59.582 -9.810 -9.793 1.00 15.00 O ATOM 309 CB GLU A 19 57.633 -9.305 -11.779 1.00 15.00 C ATOM 310 CG GLU A 19 56.334 -8.826 -12.433 1.00 15.00 C ATOM 311 CD GLU A 19 55.712 -9.970 -13.237 1.00 15.00 C ATOM 312 OE1 GLU A 19 55.680 -11.079 -12.728 1.00 15.00 O ATOM 313 OE2 GLU A 19 55.278 -9.718 -14.349 1.00 15.00 O ATOM 0 H GLU A 19 58.018 -6.192 -11.675 1.00 15.00 H new ATOM 0 HA GLU A 19 57.509 -7.866 -10.144 1.00 15.00 H new ATOM 0 HB2 GLU A 19 58.351 -9.597 -12.545 1.00 15.00 H new ATOM 0 HB3 GLU A 19 57.441 -10.188 -11.169 1.00 15.00 H new ATOM 0 HG2 GLU A 19 55.636 -8.483 -11.670 1.00 15.00 H new ATOM 0 HG3 GLU A 19 56.535 -7.977 -13.086 1.00 15.00 H new ATOM 320 N ILE A 20 60.428 -7.777 -9.975 1.00 15.00 N ATOM 321 CA ILE A 20 61.606 -8.110 -9.116 1.00 15.00 C ATOM 322 C ILE A 20 61.457 -7.396 -7.767 1.00 15.00 C ATOM 323 O ILE A 20 60.909 -6.309 -7.693 1.00 15.00 O ATOM 324 CB ILE A 20 62.833 -7.590 -9.882 1.00 15.00 C ATOM 325 CG1 ILE A 20 62.950 -8.317 -11.227 1.00 15.00 C ATOM 326 CG2 ILE A 20 64.105 -7.847 -9.064 1.00 15.00 C ATOM 327 CD1 ILE A 20 63.952 -7.584 -12.120 1.00 15.00 C ATOM 0 H ILE A 20 60.438 -6.838 -10.373 1.00 15.00 H new ATOM 0 HA ILE A 20 61.696 -9.178 -8.915 1.00 15.00 H new ATOM 0 HB ILE A 20 62.716 -6.520 -10.051 1.00 15.00 H new ATOM 0 HG12 ILE A 20 63.273 -9.346 -11.069 1.00 15.00 H new ATOM 0 HG13 ILE A 20 61.976 -8.360 -11.715 1.00 15.00 H new ATOM 0 HG21 ILE A 20 64.971 -7.476 -9.612 1.00 15.00 H new ATOM 0 HG22 ILE A 20 64.033 -7.330 -8.107 1.00 15.00 H new ATOM 0 HG23 ILE A 20 64.216 -8.917 -8.891 1.00 15.00 H new ATOM 0 HD11 ILE A 20 64.034 -8.102 -13.076 1.00 15.00 H new ATOM 0 HD12 ILE A 20 63.610 -6.563 -12.289 1.00 15.00 H new ATOM 0 HD13 ILE A 20 64.927 -7.564 -11.633 1.00 15.00 H new ATOM 339 N ARG A 21 61.942 -7.996 -6.708 1.00 15.00 N ATOM 340 CA ARG A 21 61.779 -7.388 -5.353 1.00 15.00 C ATOM 341 C ARG A 21 63.111 -6.811 -4.859 1.00 15.00 C ATOM 342 O ARG A 21 64.089 -7.521 -4.717 1.00 15.00 O ATOM 343 CB ARG A 21 61.326 -8.541 -4.455 1.00 15.00 C ATOM 344 CG ARG A 21 60.911 -7.996 -3.088 1.00 15.00 C ATOM 345 CD ARG A 21 60.500 -9.157 -2.176 1.00 15.00 C ATOM 346 NE ARG A 21 59.997 -8.515 -0.919 1.00 15.00 N ATOM 347 CZ ARG A 21 59.255 -9.183 -0.055 1.00 15.00 C ATOM 348 NH1 ARG A 21 58.930 -10.440 -0.252 1.00 15.00 N ATOM 349 NH2 ARG A 21 58.838 -8.580 1.024 1.00 15.00 N ATOM 0 H ARG A 21 62.445 -8.883 -6.725 1.00 15.00 H new ATOM 0 HA ARG A 21 61.064 -6.565 -5.355 1.00 15.00 H new ATOM 0 HB2 ARG A 21 60.491 -9.068 -4.916 1.00 15.00 H new ATOM 0 HB3 ARG A 21 62.134 -9.264 -4.339 1.00 15.00 H new ATOM 0 HG2 ARG A 21 61.736 -7.443 -2.640 1.00 15.00 H new ATOM 0 HG3 ARG A 21 60.082 -7.297 -3.200 1.00 15.00 H new ATOM 0 HD2 ARG A 21 59.727 -9.768 -2.642 1.00 15.00 H new ATOM 0 HD3 ARG A 21 61.345 -9.814 -1.971 1.00 15.00 H new ATOM 0 HE ARG A 21 60.233 -7.541 -0.727 1.00 15.00 H new ATOM 0 HH11 ARG A 21 59.252 -10.925 -1.090 1.00 15.00 H new ATOM 0 HH12 ARG A 21 58.355 -10.932 0.433 1.00 15.00 H new ATOM 0 HH21 ARG A 21 59.086 -7.605 1.191 1.00 15.00 H new ATOM 0 HH22 ARG A 21 58.264 -9.084 1.700 1.00 15.00 H new ATOM 363 N TYR A 22 63.145 -5.526 -4.601 1.00 15.00 N ATOM 364 CA TYR A 22 64.381 -4.889 -4.050 1.00 15.00 C ATOM 365 C TYR A 22 64.135 -4.445 -2.606 1.00 15.00 C ATOM 366 O TYR A 22 63.095 -3.902 -2.294 1.00 15.00 O ATOM 367 CB TYR A 22 64.629 -3.666 -4.933 1.00 15.00 C ATOM 368 CG TYR A 22 65.044 -3.994 -6.347 1.00 15.00 C ATOM 369 CD1 TYR A 22 66.416 -4.143 -6.665 1.00 15.00 C ATOM 370 CD2 TYR A 22 64.062 -4.144 -7.358 1.00 15.00 C ATOM 371 CE1 TYR A 22 66.806 -4.439 -7.994 1.00 15.00 C ATOM 372 CE2 TYR A 22 64.452 -4.441 -8.685 1.00 15.00 C ATOM 373 CZ TYR A 22 65.824 -4.589 -9.005 1.00 15.00 C ATOM 374 OH TYR A 22 66.205 -4.877 -10.299 1.00 15.00 O ATOM 0 H TYR A 22 62.364 -4.887 -4.750 1.00 15.00 H new ATOM 0 HA TYR A 22 65.230 -5.573 -4.047 1.00 15.00 H new ATOM 0 HB2 TYR A 22 63.720 -3.065 -4.964 1.00 15.00 H new ATOM 0 HB3 TYR A 22 65.403 -3.051 -4.473 1.00 15.00 H new ATOM 0 HD1 TYR A 22 67.164 -4.031 -5.895 1.00 15.00 H new ATOM 0 HD2 TYR A 22 63.016 -4.032 -7.115 1.00 15.00 H new ATOM 0 HE1 TYR A 22 67.852 -4.550 -8.237 1.00 15.00 H new ATOM 0 HE2 TYR A 22 63.703 -4.555 -9.455 1.00 15.00 H new ATOM 0 HH TYR A 22 65.409 -4.948 -10.866 1.00 15.00 H new ATOM 384 N GLU A 23 65.078 -4.672 -1.728 1.00 15.00 N ATOM 385 CA GLU A 23 64.944 -4.158 -0.329 1.00 15.00 C ATOM 386 C GLU A 23 66.117 -3.235 0.002 1.00 15.00 C ATOM 387 O GLU A 23 67.244 -3.495 -0.375 1.00 15.00 O ATOM 388 CB GLU A 23 64.974 -5.405 0.556 1.00 15.00 C ATOM 389 CG GLU A 23 64.629 -5.022 1.997 1.00 15.00 C ATOM 390 CD GLU A 23 64.738 -6.256 2.894 1.00 15.00 C ATOM 391 OE1 GLU A 23 63.842 -6.462 3.696 1.00 15.00 O ATOM 392 OE2 GLU A 23 65.715 -6.974 2.764 1.00 15.00 O ATOM 0 H GLU A 23 65.935 -5.191 -1.918 1.00 15.00 H new ATOM 0 HA GLU A 23 64.031 -3.580 -0.183 1.00 15.00 H new ATOM 0 HB2 GLU A 23 64.263 -6.143 0.185 1.00 15.00 H new ATOM 0 HB3 GLU A 23 65.961 -5.866 0.518 1.00 15.00 H new ATOM 0 HG2 GLU A 23 65.305 -4.243 2.349 1.00 15.00 H new ATOM 0 HG3 GLU A 23 63.620 -4.613 2.044 1.00 15.00 H new ATOM 399 N GLY A 24 65.855 -2.163 0.708 1.00 15.00 N ATOM 400 CA GLY A 24 66.940 -1.200 1.063 1.00 15.00 C ATOM 401 C GLY A 24 66.429 -0.254 2.148 1.00 15.00 C ATOM 402 O GLY A 24 65.303 -0.372 2.596 1.00 15.00 O ATOM 0 H GLY A 24 64.929 -1.913 1.055 1.00 15.00 H new ATOM 0 HA2 GLY A 24 67.820 -1.738 1.416 1.00 15.00 H new ATOM 0 HA3 GLY A 24 67.244 -0.634 0.183 1.00 15.00 H new ATOM 406 N ILE A 25 67.239 0.683 2.576 1.00 15.00 N ATOM 407 CA ILE A 25 66.786 1.634 3.640 1.00 15.00 C ATOM 408 C ILE A 25 66.486 3.001 3.017 1.00 15.00 C ATOM 409 O ILE A 25 67.219 3.481 2.173 1.00 15.00 O ATOM 410 CB ILE A 25 67.947 1.736 4.646 1.00 15.00 C ATOM 411 CG1 ILE A 25 68.396 0.332 5.109 1.00 15.00 C ATOM 412 CG2 ILE A 25 67.493 2.551 5.864 1.00 15.00 C ATOM 413 CD1 ILE A 25 67.225 -0.433 5.744 1.00 15.00 C ATOM 0 H ILE A 25 68.190 0.831 2.237 1.00 15.00 H new ATOM 0 HA ILE A 25 65.875 1.292 4.131 1.00 15.00 H new ATOM 0 HB ILE A 25 68.789 2.228 4.158 1.00 15.00 H new ATOM 0 HG12 ILE A 25 68.785 -0.229 4.259 1.00 15.00 H new ATOM 0 HG13 ILE A 25 69.209 0.424 5.829 1.00 15.00 H new ATOM 0 HG21 ILE A 25 68.313 2.625 6.578 1.00 15.00 H new ATOM 0 HG22 ILE A 25 67.199 3.551 5.544 1.00 15.00 H new ATOM 0 HG23 ILE A 25 66.644 2.057 6.336 1.00 15.00 H new ATOM 0 HD11 ILE A 25 67.564 -1.419 6.062 1.00 15.00 H new ATOM 0 HD12 ILE A 25 66.855 0.120 6.607 1.00 15.00 H new ATOM 0 HD13 ILE A 25 66.424 -0.544 5.013 1.00 15.00 H new ATOM 425 N LEU A 26 65.412 3.626 3.433 1.00 15.00 N ATOM 426 CA LEU A 26 65.012 4.940 2.830 1.00 15.00 C ATOM 427 C LEU A 26 66.049 6.013 3.168 1.00 15.00 C ATOM 428 O LEU A 26 66.146 6.449 4.299 1.00 15.00 O ATOM 429 CB LEU A 26 63.663 5.278 3.473 1.00 15.00 C ATOM 430 CG LEU A 26 62.928 6.313 2.621 1.00 15.00 C ATOM 431 CD1 LEU A 26 62.337 5.635 1.382 1.00 15.00 C ATOM 432 CD2 LEU A 26 61.799 6.934 3.447 1.00 15.00 C ATOM 0 H LEU A 26 64.792 3.283 4.167 1.00 15.00 H new ATOM 0 HA LEU A 26 64.945 4.892 1.743 1.00 15.00 H new ATOM 0 HB2 LEU A 26 63.059 4.376 3.567 1.00 15.00 H new ATOM 0 HB3 LEU A 26 63.817 5.666 4.480 1.00 15.00 H new ATOM 0 HG LEU A 26 63.627 7.089 2.308 1.00 15.00 H new ATOM 0 HD11 LEU A 26 61.814 6.375 0.777 1.00 15.00 H new ATOM 0 HD12 LEU A 26 63.139 5.187 0.795 1.00 15.00 H new ATOM 0 HD13 LEU A 26 61.637 4.859 1.691 1.00 15.00 H new ATOM 0 HD21 LEU A 26 61.271 7.673 2.844 1.00 15.00 H new ATOM 0 HD22 LEU A 26 61.103 6.154 3.756 1.00 15.00 H new ATOM 0 HD23 LEU A 26 62.218 7.418 4.330 1.00 15.00 H new ATOM 444 N TYR A 27 66.815 6.439 2.194 1.00 15.00 N ATOM 445 CA TYR A 27 67.919 7.409 2.468 1.00 15.00 C ATOM 446 C TYR A 27 67.437 8.846 2.250 1.00 15.00 C ATOM 447 O TYR A 27 67.588 9.694 3.110 1.00 15.00 O ATOM 448 CB TYR A 27 69.018 7.053 1.465 1.00 15.00 C ATOM 449 CG TYR A 27 70.265 7.895 1.610 1.00 15.00 C ATOM 450 CD1 TYR A 27 70.989 7.881 2.826 1.00 15.00 C ATOM 451 CD2 TYR A 27 70.706 8.697 0.530 1.00 15.00 C ATOM 452 CE1 TYR A 27 72.156 8.672 2.963 1.00 15.00 C ATOM 453 CE2 TYR A 27 71.873 9.488 0.667 1.00 15.00 C ATOM 454 CZ TYR A 27 72.599 9.476 1.884 1.00 15.00 C ATOM 455 OH TYR A 27 73.735 10.246 2.017 1.00 15.00 O ATOM 0 H TYR A 27 66.723 6.156 1.219 1.00 15.00 H new ATOM 0 HA TYR A 27 68.271 7.349 3.498 1.00 15.00 H new ATOM 0 HB2 TYR A 27 69.283 6.003 1.586 1.00 15.00 H new ATOM 0 HB3 TYR A 27 68.627 7.169 0.454 1.00 15.00 H new ATOM 0 HD1 TYR A 27 70.652 7.268 3.649 1.00 15.00 H new ATOM 0 HD2 TYR A 27 70.153 8.706 -0.398 1.00 15.00 H new ATOM 0 HE1 TYR A 27 72.709 8.662 3.891 1.00 15.00 H new ATOM 0 HE2 TYR A 27 72.210 10.101 -0.156 1.00 15.00 H new ATOM 0 HH TYR A 27 73.898 10.735 1.183 1.00 15.00 H new ATOM 465 N THR A 28 66.859 9.124 1.106 1.00 15.00 N ATOM 466 CA THR A 28 66.393 10.516 0.816 1.00 15.00 C ATOM 467 C THR A 28 65.065 10.489 0.058 1.00 15.00 C ATOM 468 O THR A 28 64.850 9.656 -0.803 1.00 15.00 O ATOM 469 CB THR A 28 67.493 11.136 -0.052 1.00 15.00 C ATOM 470 OG1 THR A 28 67.856 10.225 -1.080 1.00 15.00 O ATOM 471 CG2 THR A 28 68.715 11.447 0.814 1.00 15.00 C ATOM 0 H THR A 28 66.690 8.447 0.362 1.00 15.00 H new ATOM 0 HA THR A 28 66.224 11.087 1.729 1.00 15.00 H new ATOM 0 HB THR A 28 67.124 12.059 -0.500 1.00 15.00 H new ATOM 0 HG1 THR A 28 68.437 10.677 -1.727 1.00 15.00 H new ATOM 0 HG21 THR A 28 69.497 11.888 0.195 1.00 15.00 H new ATOM 0 HG22 THR A 28 68.435 12.149 1.600 1.00 15.00 H new ATOM 0 HG23 THR A 28 69.085 10.526 1.265 1.00 15.00 H new ATOM 479 N ILE A 29 64.176 11.400 0.374 1.00 15.00 N ATOM 480 CA ILE A 29 62.837 11.421 -0.294 1.00 15.00 C ATOM 481 C ILE A 29 62.664 12.739 -1.062 1.00 15.00 C ATOM 482 O ILE A 29 62.793 13.812 -0.500 1.00 15.00 O ATOM 483 CB ILE A 29 61.811 11.319 0.848 1.00 15.00 C ATOM 484 CG1 ILE A 29 62.035 10.024 1.643 1.00 15.00 C ATOM 485 CG2 ILE A 29 60.391 11.307 0.271 1.00 15.00 C ATOM 486 CD1 ILE A 29 61.231 10.078 2.944 1.00 15.00 C ATOM 0 H ILE A 29 64.321 12.133 1.069 1.00 15.00 H new ATOM 0 HA ILE A 29 62.717 10.610 -1.012 1.00 15.00 H new ATOM 0 HB ILE A 29 61.936 12.179 1.507 1.00 15.00 H new ATOM 0 HG12 ILE A 29 61.729 9.163 1.049 1.00 15.00 H new ATOM 0 HG13 ILE A 29 63.095 9.899 1.863 1.00 15.00 H new ATOM 0 HG21 ILE A 29 59.669 11.235 1.084 1.00 15.00 H new ATOM 0 HG22 ILE A 29 60.218 12.227 -0.288 1.00 15.00 H new ATOM 0 HG23 ILE A 29 60.276 10.451 -0.394 1.00 15.00 H new ATOM 0 HD11 ILE A 29 61.390 9.159 3.508 1.00 15.00 H new ATOM 0 HD12 ILE A 29 61.559 10.930 3.539 1.00 15.00 H new ATOM 0 HD13 ILE A 29 60.171 10.183 2.713 1.00 15.00 H new ATOM 498 N ASP A 30 62.371 12.664 -2.338 1.00 15.00 N ATOM 499 CA ASP A 30 62.138 13.903 -3.139 1.00 15.00 C ATOM 500 C ASP A 30 60.668 13.984 -3.558 1.00 15.00 C ATOM 501 O ASP A 30 60.261 13.378 -4.533 1.00 15.00 O ATOM 502 CB ASP A 30 63.040 13.759 -4.366 1.00 15.00 C ATOM 503 CG ASP A 30 63.093 15.089 -5.120 1.00 15.00 C ATOM 504 OD1 ASP A 30 62.269 15.281 -5.999 1.00 15.00 O ATOM 505 OD2 ASP A 30 63.955 15.892 -4.806 1.00 15.00 O ATOM 0 H ASP A 30 62.283 11.792 -2.860 1.00 15.00 H new ATOM 0 HA ASP A 30 62.362 14.810 -2.577 1.00 15.00 H new ATOM 0 HB2 ASP A 30 64.043 13.462 -4.060 1.00 15.00 H new ATOM 0 HB3 ASP A 30 62.660 12.973 -5.019 1.00 15.00 H new ATOM 510 N THR A 31 59.874 14.726 -2.826 1.00 15.00 N ATOM 511 CA THR A 31 58.411 14.807 -3.138 1.00 15.00 C ATOM 512 C THR A 31 58.184 15.580 -4.441 1.00 15.00 C ATOM 513 O THR A 31 57.306 15.255 -5.217 1.00 15.00 O ATOM 514 CB THR A 31 57.782 15.552 -1.957 1.00 15.00 C ATOM 515 OG1 THR A 31 58.211 14.955 -0.741 1.00 15.00 O ATOM 516 CG2 THR A 31 56.258 15.478 -2.055 1.00 15.00 C ATOM 0 H THR A 31 60.175 15.280 -2.024 1.00 15.00 H new ATOM 0 HA THR A 31 57.971 13.819 -3.274 1.00 15.00 H new ATOM 0 HB THR A 31 58.093 16.597 -1.979 1.00 15.00 H new ATOM 0 HG1 THR A 31 57.811 15.431 0.016 1.00 15.00 H new ATOM 0 HG21 THR A 31 55.813 16.009 -1.213 1.00 15.00 H new ATOM 0 HG22 THR A 31 55.931 15.937 -2.988 1.00 15.00 H new ATOM 0 HG23 THR A 31 55.942 14.435 -2.034 1.00 15.00 H new ATOM 524 N GLU A 32 58.978 16.594 -4.689 1.00 15.00 N ATOM 525 CA GLU A 32 58.706 17.514 -5.845 1.00 15.00 C ATOM 526 C GLU A 32 58.697 16.744 -7.173 1.00 15.00 C ATOM 527 O GLU A 32 58.011 17.118 -8.107 1.00 15.00 O ATOM 528 CB GLU A 32 59.849 18.533 -5.833 1.00 15.00 C ATOM 529 CG GLU A 32 59.742 19.406 -4.580 1.00 15.00 C ATOM 530 CD GLU A 32 60.840 20.473 -4.606 1.00 15.00 C ATOM 531 OE1 GLU A 32 60.517 21.620 -4.863 1.00 15.00 O ATOM 532 OE2 GLU A 32 61.984 20.122 -4.370 1.00 15.00 O ATOM 0 H GLU A 32 59.806 16.827 -4.140 1.00 15.00 H new ATOM 0 HA GLU A 32 57.729 17.989 -5.752 1.00 15.00 H new ATOM 0 HB2 GLU A 32 60.810 18.018 -5.849 1.00 15.00 H new ATOM 0 HB3 GLU A 32 59.805 19.155 -6.727 1.00 15.00 H new ATOM 0 HG2 GLU A 32 58.761 19.879 -4.536 1.00 15.00 H new ATOM 0 HG3 GLU A 32 59.839 18.791 -3.686 1.00 15.00 H new ATOM 539 N ASN A 33 59.451 15.674 -7.261 1.00 15.00 N ATOM 540 CA ASN A 33 59.536 14.914 -8.550 1.00 15.00 C ATOM 541 C ASN A 33 58.960 13.495 -8.406 1.00 15.00 C ATOM 542 O ASN A 33 59.167 12.655 -9.262 1.00 15.00 O ATOM 543 CB ASN A 33 61.032 14.847 -8.868 1.00 15.00 C ATOM 544 CG ASN A 33 61.561 16.250 -9.182 1.00 15.00 C ATOM 545 OD1 ASN A 33 60.838 17.091 -9.684 1.00 15.00 O ATOM 546 ND2 ASN A 33 62.802 16.541 -8.906 1.00 15.00 N ATOM 0 H ASN A 33 60.011 15.294 -6.497 1.00 15.00 H new ATOM 0 HA ASN A 33 58.959 15.399 -9.338 1.00 15.00 H new ATOM 0 HB2 ASN A 33 61.574 14.425 -8.022 1.00 15.00 H new ATOM 0 HB3 ASN A 33 61.203 14.186 -9.717 1.00 15.00 H new ATOM 0 HD21 ASN A 33 63.165 17.472 -9.111 1.00 15.00 H new ATOM 0 HD22 ASN A 33 63.409 15.838 -8.485 1.00 15.00 H new ATOM 553 N SER A 34 58.235 13.218 -7.337 1.00 15.00 N ATOM 554 CA SER A 34 57.698 11.831 -7.097 1.00 15.00 C ATOM 555 C SER A 34 58.808 10.772 -7.239 1.00 15.00 C ATOM 556 O SER A 34 58.630 9.755 -7.887 1.00 15.00 O ATOM 557 CB SER A 34 56.613 11.628 -8.160 1.00 15.00 C ATOM 558 OG SER A 34 55.427 12.296 -7.752 1.00 15.00 O ATOM 0 H SER A 34 57.992 13.899 -6.617 1.00 15.00 H new ATOM 0 HA SER A 34 57.304 11.723 -6.087 1.00 15.00 H new ATOM 0 HB2 SER A 34 56.951 12.017 -9.121 1.00 15.00 H new ATOM 0 HB3 SER A 34 56.417 10.565 -8.298 1.00 15.00 H new ATOM 0 HG SER A 34 54.731 12.170 -8.430 1.00 15.00 H new ATOM 564 N THR A 35 59.949 11.007 -6.635 1.00 15.00 N ATOM 565 CA THR A 35 61.089 10.046 -6.767 1.00 15.00 C ATOM 566 C THR A 35 61.684 9.727 -5.392 1.00 15.00 C ATOM 567 O THR A 35 61.662 10.542 -4.489 1.00 15.00 O ATOM 568 CB THR A 35 62.121 10.766 -7.641 1.00 15.00 C ATOM 569 OG1 THR A 35 62.304 12.091 -7.163 1.00 15.00 O ATOM 570 CG2 THR A 35 61.640 10.807 -9.095 1.00 15.00 C ATOM 0 H THR A 35 60.140 11.824 -6.055 1.00 15.00 H new ATOM 0 HA THR A 35 60.774 9.098 -7.203 1.00 15.00 H new ATOM 0 HB THR A 35 63.067 10.227 -7.595 1.00 15.00 H new ATOM 0 HG1 THR A 35 62.965 12.552 -7.721 1.00 15.00 H new ATOM 0 HG21 THR A 35 62.380 11.321 -9.709 1.00 15.00 H new ATOM 0 HG22 THR A 35 61.507 9.790 -9.463 1.00 15.00 H new ATOM 0 HG23 THR A 35 60.691 11.340 -9.149 1.00 15.00 H new ATOM 578 N VAL A 36 62.217 8.540 -5.233 1.00 15.00 N ATOM 579 CA VAL A 36 62.823 8.147 -3.922 1.00 15.00 C ATOM 580 C VAL A 36 64.192 7.495 -4.159 1.00 15.00 C ATOM 581 O VAL A 36 64.368 6.733 -5.090 1.00 15.00 O ATOM 582 CB VAL A 36 61.836 7.142 -3.305 1.00 15.00 C ATOM 583 CG1 VAL A 36 62.352 6.674 -1.941 1.00 15.00 C ATOM 584 CG2 VAL A 36 60.468 7.808 -3.116 1.00 15.00 C ATOM 0 H VAL A 36 62.259 7.823 -5.958 1.00 15.00 H new ATOM 0 HA VAL A 36 62.985 9.001 -3.264 1.00 15.00 H new ATOM 0 HB VAL A 36 61.742 6.287 -3.974 1.00 15.00 H new ATOM 0 HG11 VAL A 36 61.648 5.962 -1.510 1.00 15.00 H new ATOM 0 HG12 VAL A 36 63.323 6.194 -2.064 1.00 15.00 H new ATOM 0 HG13 VAL A 36 62.453 7.532 -1.276 1.00 15.00 H new ATOM 0 HG21 VAL A 36 59.772 7.092 -2.679 1.00 15.00 H new ATOM 0 HG22 VAL A 36 60.570 8.667 -2.452 1.00 15.00 H new ATOM 0 HG23 VAL A 36 60.088 8.139 -4.082 1.00 15.00 H new ATOM 594 N ALA A 37 65.155 7.793 -3.321 1.00 15.00 N ATOM 595 CA ALA A 37 66.506 7.166 -3.463 1.00 15.00 C ATOM 596 C ALA A 37 66.773 6.226 -2.283 1.00 15.00 C ATOM 597 O ALA A 37 66.607 6.602 -1.135 1.00 15.00 O ATOM 598 CB ALA A 37 67.502 8.332 -3.462 1.00 15.00 C ATOM 0 H ALA A 37 65.063 8.446 -2.542 1.00 15.00 H new ATOM 0 HA ALA A 37 66.589 6.571 -4.373 1.00 15.00 H new ATOM 0 HB1 ALA A 37 68.516 7.945 -3.563 1.00 15.00 H new ATOM 0 HB2 ALA A 37 67.283 8.998 -4.297 1.00 15.00 H new ATOM 0 HB3 ALA A 37 67.416 8.883 -2.526 1.00 15.00 H new ATOM 604 N LEU A 38 67.189 5.015 -2.564 1.00 15.00 N ATOM 605 CA LEU A 38 67.449 4.026 -1.472 1.00 15.00 C ATOM 606 C LEU A 38 68.929 3.643 -1.463 1.00 15.00 C ATOM 607 O LEU A 38 69.528 3.437 -2.503 1.00 15.00 O ATOM 608 CB LEU A 38 66.591 2.800 -1.814 1.00 15.00 C ATOM 609 CG LEU A 38 65.103 3.171 -1.831 1.00 15.00 C ATOM 610 CD1 LEU A 38 64.288 1.963 -2.300 1.00 15.00 C ATOM 611 CD2 LEU A 38 64.652 3.567 -0.422 1.00 15.00 C ATOM 0 H LEU A 38 67.360 4.668 -3.508 1.00 15.00 H new ATOM 0 HA LEU A 38 67.205 4.429 -0.489 1.00 15.00 H new ATOM 0 HB2 LEU A 38 66.884 2.404 -2.786 1.00 15.00 H new ATOM 0 HB3 LEU A 38 66.766 2.011 -1.083 1.00 15.00 H new ATOM 0 HG LEU A 38 64.947 4.010 -2.509 1.00 15.00 H new ATOM 0 HD11 LEU A 38 63.229 2.222 -2.314 1.00 15.00 H new ATOM 0 HD12 LEU A 38 64.605 1.678 -3.303 1.00 15.00 H new ATOM 0 HD13 LEU A 38 64.449 1.128 -1.617 1.00 15.00 H new ATOM 0 HD21 LEU A 38 63.594 3.830 -0.439 1.00 15.00 H new ATOM 0 HD22 LEU A 38 64.807 2.730 0.258 1.00 15.00 H new ATOM 0 HD23 LEU A 38 65.233 4.424 -0.081 1.00 15.00 H new ATOM 623 N ALA A 39 69.519 3.545 -0.297 1.00 15.00 N ATOM 624 CA ALA A 39 70.959 3.158 -0.207 1.00 15.00 C ATOM 625 C ALA A 39 71.091 1.803 0.490 1.00 15.00 C ATOM 626 O ALA A 39 70.176 1.349 1.155 1.00 15.00 O ATOM 627 CB ALA A 39 71.615 4.259 0.627 1.00 15.00 C ATOM 0 H ALA A 39 69.063 3.717 0.599 1.00 15.00 H new ATOM 0 HA ALA A 39 71.426 3.061 -1.187 1.00 15.00 H new ATOM 0 HB1 ALA A 39 72.678 4.046 0.739 1.00 15.00 H new ATOM 0 HB2 ALA A 39 71.488 5.219 0.127 1.00 15.00 H new ATOM 0 HB3 ALA A 39 71.147 4.298 1.611 1.00 15.00 H new ATOM 633 N LYS A 40 72.228 1.152 0.341 1.00 15.00 N ATOM 634 CA LYS A 40 72.431 -0.212 0.945 1.00 15.00 C ATOM 635 C LYS A 40 71.278 -1.152 0.549 1.00 15.00 C ATOM 636 O LYS A 40 70.551 -1.651 1.390 1.00 15.00 O ATOM 637 CB LYS A 40 72.467 0.008 2.463 1.00 15.00 C ATOM 638 CG LYS A 40 73.702 0.833 2.832 1.00 15.00 C ATOM 639 CD LYS A 40 73.802 0.952 4.354 1.00 15.00 C ATOM 640 CE LYS A 40 74.951 1.893 4.720 1.00 15.00 C ATOM 641 NZ LYS A 40 75.271 1.575 6.139 1.00 15.00 N ATOM 0 H LYS A 40 73.030 1.511 -0.177 1.00 15.00 H new ATOM 0 HA LYS A 40 73.350 -0.680 0.592 1.00 15.00 H new ATOM 0 HB2 LYS A 40 71.563 0.523 2.788 1.00 15.00 H new ATOM 0 HB3 LYS A 40 72.490 -0.952 2.979 1.00 15.00 H new ATOM 0 HG2 LYS A 40 74.600 0.360 2.434 1.00 15.00 H new ATOM 0 HG3 LYS A 40 73.638 1.824 2.383 1.00 15.00 H new ATOM 0 HD2 LYS A 40 72.865 1.330 4.762 1.00 15.00 H new ATOM 0 HD3 LYS A 40 73.968 -0.031 4.796 1.00 15.00 H new ATOM 0 HE2 LYS A 40 75.814 1.731 4.075 1.00 15.00 H new ATOM 0 HE3 LYS A 40 74.658 2.937 4.606 1.00 15.00 H new ATOM 0 HZ1 LYS A 40 76.052 2.181 6.463 1.00 15.00 H new ATOM 0 HZ2 LYS A 40 74.432 1.745 6.730 1.00 15.00 H new ATOM 0 HZ3 LYS A 40 75.553 0.577 6.216 1.00 15.00 H new ATOM 655 N VAL A 41 71.116 -1.390 -0.730 1.00 15.00 N ATOM 656 CA VAL A 41 69.933 -2.169 -1.211 1.00 15.00 C ATOM 657 C VAL A 41 70.391 -3.405 -1.998 1.00 15.00 C ATOM 658 O VAL A 41 71.397 -3.378 -2.682 1.00 15.00 O ATOM 659 CB VAL A 41 69.145 -1.188 -2.100 1.00 15.00 C ATOM 660 CG1 VAL A 41 69.975 -0.786 -3.326 1.00 15.00 C ATOM 661 CG2 VAL A 41 67.840 -1.845 -2.564 1.00 15.00 C ATOM 0 H VAL A 41 71.753 -1.078 -1.463 1.00 15.00 H new ATOM 0 HA VAL A 41 69.318 -2.544 -0.393 1.00 15.00 H new ATOM 0 HB VAL A 41 68.921 -0.295 -1.517 1.00 15.00 H new ATOM 0 HG11 VAL A 41 69.402 -0.093 -3.942 1.00 15.00 H new ATOM 0 HG12 VAL A 41 70.897 -0.304 -2.999 1.00 15.00 H new ATOM 0 HG13 VAL A 41 70.217 -1.675 -3.909 1.00 15.00 H new ATOM 0 HG21 VAL A 41 67.285 -1.148 -3.192 1.00 15.00 H new ATOM 0 HG22 VAL A 41 68.069 -2.745 -3.134 1.00 15.00 H new ATOM 0 HG23 VAL A 41 67.237 -2.109 -1.695 1.00 15.00 H new ATOM 671 N ARG A 42 69.653 -4.482 -1.898 1.00 15.00 N ATOM 672 CA ARG A 42 70.012 -5.724 -2.646 1.00 15.00 C ATOM 673 C ARG A 42 68.774 -6.289 -3.347 1.00 15.00 C ATOM 674 O ARG A 42 67.663 -6.137 -2.874 1.00 15.00 O ATOM 675 CB ARG A 42 70.516 -6.698 -1.581 1.00 15.00 C ATOM 676 CG ARG A 42 71.846 -6.195 -1.016 1.00 15.00 C ATOM 677 CD ARG A 42 72.375 -7.199 0.014 1.00 15.00 C ATOM 678 NE ARG A 42 72.766 -8.411 -0.777 1.00 15.00 N ATOM 679 CZ ARG A 42 72.937 -9.585 -0.198 1.00 15.00 C ATOM 680 NH1 ARG A 42 72.782 -9.746 1.096 1.00 15.00 N ATOM 681 NH2 ARG A 42 73.272 -10.611 -0.931 1.00 15.00 N ATOM 0 H ARG A 42 68.811 -4.554 -1.326 1.00 15.00 H new ATOM 0 HA ARG A 42 70.761 -5.542 -3.416 1.00 15.00 H new ATOM 0 HB2 ARG A 42 69.781 -6.791 -0.781 1.00 15.00 H new ATOM 0 HB3 ARG A 42 70.644 -7.691 -2.013 1.00 15.00 H new ATOM 0 HG2 ARG A 42 72.570 -6.067 -1.821 1.00 15.00 H new ATOM 0 HG3 ARG A 42 71.710 -5.218 -0.551 1.00 15.00 H new ATOM 0 HD2 ARG A 42 73.228 -6.792 0.557 1.00 15.00 H new ATOM 0 HD3 ARG A 42 71.612 -7.442 0.754 1.00 15.00 H new ATOM 0 HE ARG A 42 72.903 -8.327 -1.784 1.00 15.00 H new ATOM 0 HH11 ARG A 42 72.523 -8.952 1.681 1.00 15.00 H new ATOM 0 HH12 ARG A 42 72.921 -10.665 1.516 1.00 15.00 H new ATOM 0 HH21 ARG A 42 73.398 -10.500 -1.937 1.00 15.00 H new ATOM 0 HH22 ARG A 42 73.408 -11.525 -0.498 1.00 15.00 H new ATOM 695 N SER A 43 68.962 -6.939 -4.470 1.00 15.00 N ATOM 696 CA SER A 43 67.810 -7.571 -5.181 1.00 15.00 C ATOM 697 C SER A 43 67.735 -9.059 -4.820 1.00 15.00 C ATOM 698 O SER A 43 68.710 -9.780 -4.933 1.00 15.00 O ATOM 699 CB SER A 43 68.113 -7.377 -6.670 1.00 15.00 C ATOM 700 OG SER A 43 69.136 -8.280 -7.072 1.00 15.00 O ATOM 0 H SER A 43 69.867 -7.059 -4.925 1.00 15.00 H new ATOM 0 HA SER A 43 66.850 -7.132 -4.909 1.00 15.00 H new ATOM 0 HB2 SER A 43 67.212 -7.547 -7.260 1.00 15.00 H new ATOM 0 HB3 SER A 43 68.427 -6.350 -6.856 1.00 15.00 H new ATOM 0 HG SER A 43 69.480 -8.755 -6.287 1.00 15.00 H new ATOM 706 N PHE A 44 66.586 -9.521 -4.387 1.00 15.00 N ATOM 707 CA PHE A 44 66.482 -10.928 -3.881 1.00 15.00 C ATOM 708 C PHE A 44 66.651 -11.927 -5.028 1.00 15.00 C ATOM 709 O PHE A 44 67.295 -12.948 -4.879 1.00 15.00 O ATOM 710 CB PHE A 44 65.080 -11.044 -3.280 1.00 15.00 C ATOM 711 CG PHE A 44 64.907 -10.275 -1.993 1.00 15.00 C ATOM 712 CD1 PHE A 44 65.631 -10.654 -0.837 1.00 15.00 C ATOM 713 CD2 PHE A 44 64.018 -9.175 -1.941 1.00 15.00 C ATOM 714 CE1 PHE A 44 65.467 -9.933 0.370 1.00 15.00 C ATOM 715 CE2 PHE A 44 63.854 -8.453 -0.735 1.00 15.00 C ATOM 716 CZ PHE A 44 64.578 -8.833 0.421 1.00 15.00 C ATOM 0 H PHE A 44 65.718 -8.987 -4.362 1.00 15.00 H new ATOM 0 HA PHE A 44 67.259 -11.150 -3.149 1.00 15.00 H new ATOM 0 HB2 PHE A 44 64.352 -10.686 -4.008 1.00 15.00 H new ATOM 0 HB3 PHE A 44 64.858 -12.095 -3.097 1.00 15.00 H new ATOM 0 HD1 PHE A 44 66.309 -11.494 -0.876 1.00 15.00 H new ATOM 0 HD2 PHE A 44 63.464 -8.886 -2.822 1.00 15.00 H new ATOM 0 HE1 PHE A 44 66.020 -10.222 1.251 1.00 15.00 H new ATOM 0 HE2 PHE A 44 63.177 -7.612 -0.696 1.00 15.00 H new ATOM 0 HZ PHE A 44 64.452 -8.283 1.342 1.00 15.00 H new ATOM 984 N PHE A 62 74.209 -2.923 -3.982 1.00 15.00 N ATOM 985 CA PHE A 62 74.380 -1.591 -4.633 1.00 15.00 C ATOM 986 C PHE A 62 74.372 -0.483 -3.577 1.00 15.00 C ATOM 987 O PHE A 62 73.521 -0.456 -2.706 1.00 15.00 O ATOM 988 CB PHE A 62 73.180 -1.453 -5.568 1.00 15.00 C ATOM 989 CG PHE A 62 73.157 -2.483 -6.672 1.00 15.00 C ATOM 990 CD1 PHE A 62 73.939 -2.291 -7.837 1.00 15.00 C ATOM 991 CD2 PHE A 62 72.353 -3.642 -6.542 1.00 15.00 C ATOM 992 CE1 PHE A 62 73.917 -3.257 -8.873 1.00 15.00 C ATOM 993 CE2 PHE A 62 72.331 -4.608 -7.577 1.00 15.00 C ATOM 994 CZ PHE A 62 73.113 -4.416 -8.743 1.00 15.00 C ATOM 0 HA PHE A 62 75.325 -1.509 -5.170 1.00 15.00 H new ATOM 0 HB2 PHE A 62 72.263 -1.536 -4.985 1.00 15.00 H new ATOM 0 HB3 PHE A 62 73.187 -0.457 -6.011 1.00 15.00 H new ATOM 0 HD1 PHE A 62 74.552 -1.408 -7.936 1.00 15.00 H new ATOM 0 HD2 PHE A 62 71.757 -3.789 -5.654 1.00 15.00 H new ATOM 0 HE1 PHE A 62 74.513 -3.110 -9.762 1.00 15.00 H new ATOM 0 HE2 PHE A 62 71.718 -5.492 -7.478 1.00 15.00 H new ATOM 0 HZ PHE A 62 73.096 -5.153 -9.532 1.00 15.00 H new ATOM 1004 N GLU A 63 75.312 0.427 -3.654 1.00 15.00 N ATOM 1005 CA GLU A 63 75.398 1.517 -2.631 1.00 15.00 C ATOM 1006 C GLU A 63 74.208 2.475 -2.761 1.00 15.00 C ATOM 1007 O GLU A 63 73.610 2.864 -1.774 1.00 15.00 O ATOM 1008 CB GLU A 63 76.709 2.253 -2.927 1.00 15.00 C ATOM 1009 CG GLU A 63 77.022 3.223 -1.786 1.00 15.00 C ATOM 1010 CD GLU A 63 77.458 2.439 -0.545 1.00 15.00 C ATOM 1011 OE1 GLU A 63 77.034 2.803 0.539 1.00 15.00 O ATOM 1012 OE2 GLU A 63 78.210 1.491 -0.700 1.00 15.00 O ATOM 0 H GLU A 63 76.025 0.462 -4.382 1.00 15.00 H new ATOM 0 HA GLU A 63 75.375 1.119 -1.617 1.00 15.00 H new ATOM 0 HB2 GLU A 63 77.522 1.536 -3.042 1.00 15.00 H new ATOM 0 HB3 GLU A 63 76.628 2.797 -3.868 1.00 15.00 H new ATOM 0 HG2 GLU A 63 77.811 3.912 -2.088 1.00 15.00 H new ATOM 0 HG3 GLU A 63 76.143 3.825 -1.557 1.00 15.00 H new ATOM 1019 N TYR A 64 73.862 2.854 -3.968 1.00 15.00 N ATOM 1020 CA TYR A 64 72.764 3.852 -4.159 1.00 15.00 C ATOM 1021 C TYR A 64 72.039 3.608 -5.487 1.00 15.00 C ATOM 1022 O TYR A 64 72.641 3.625 -6.545 1.00 15.00 O ATOM 1023 CB TYR A 64 73.473 5.207 -4.178 1.00 15.00 C ATOM 1024 CG TYR A 64 72.542 6.385 -4.007 1.00 15.00 C ATOM 1025 CD1 TYR A 64 71.589 6.692 -5.010 1.00 15.00 C ATOM 1026 CD2 TYR A 64 72.627 7.190 -2.843 1.00 15.00 C ATOM 1027 CE1 TYR A 64 70.724 7.800 -4.848 1.00 15.00 C ATOM 1028 CE2 TYR A 64 71.759 8.297 -2.684 1.00 15.00 C ATOM 1029 CZ TYR A 64 70.809 8.603 -3.686 1.00 15.00 C ATOM 1030 OH TYR A 64 69.965 9.684 -3.530 1.00 15.00 O ATOM 0 H TYR A 64 74.293 2.515 -4.828 1.00 15.00 H new ATOM 0 HA TYR A 64 72.009 3.790 -3.376 1.00 15.00 H new ATOM 0 HB2 TYR A 64 74.219 5.227 -3.384 1.00 15.00 H new ATOM 0 HB3 TYR A 64 74.009 5.313 -5.121 1.00 15.00 H new ATOM 0 HD1 TYR A 64 71.523 6.080 -5.898 1.00 15.00 H new ATOM 0 HD2 TYR A 64 73.354 6.959 -2.078 1.00 15.00 H new ATOM 0 HE1 TYR A 64 69.998 8.033 -5.613 1.00 15.00 H new ATOM 0 HE2 TYR A 64 71.822 8.909 -1.796 1.00 15.00 H new ATOM 0 HH TYR A 64 70.155 10.127 -2.677 1.00 15.00 H new ATOM 1040 N ILE A 65 70.747 3.383 -5.434 1.00 15.00 N ATOM 1041 CA ILE A 65 69.940 3.269 -6.693 1.00 15.00 C ATOM 1042 C ILE A 65 68.697 4.165 -6.590 1.00 15.00 C ATOM 1043 O ILE A 65 68.155 4.363 -5.518 1.00 15.00 O ATOM 1044 CB ILE A 65 69.548 1.784 -6.807 1.00 15.00 C ATOM 1045 CG1 ILE A 65 70.820 0.925 -6.896 1.00 15.00 C ATOM 1046 CG2 ILE A 65 68.703 1.558 -8.071 1.00 15.00 C ATOM 1047 CD1 ILE A 65 70.461 -0.563 -6.813 1.00 15.00 C ATOM 0 H ILE A 65 70.215 3.273 -4.571 1.00 15.00 H new ATOM 0 HA ILE A 65 70.496 3.591 -7.573 1.00 15.00 H new ATOM 0 HB ILE A 65 68.968 1.502 -5.928 1.00 15.00 H new ATOM 0 HG12 ILE A 65 71.341 1.129 -7.832 1.00 15.00 H new ATOM 0 HG13 ILE A 65 71.502 1.188 -6.087 1.00 15.00 H new ATOM 0 HG21 ILE A 65 68.431 0.505 -8.143 1.00 15.00 H new ATOM 0 HG22 ILE A 65 67.799 2.164 -8.017 1.00 15.00 H new ATOM 0 HG23 ILE A 65 69.280 1.845 -8.950 1.00 15.00 H new ATOM 0 HD11 ILE A 65 71.370 -1.161 -6.877 1.00 15.00 H new ATOM 0 HD12 ILE A 65 69.961 -0.764 -5.866 1.00 15.00 H new ATOM 0 HD13 ILE A 65 69.797 -0.824 -7.637 1.00 15.00 H new ATOM 1059 N ILE A 66 68.250 4.703 -7.700 1.00 15.00 N ATOM 1060 CA ILE A 66 67.068 5.623 -7.678 1.00 15.00 C ATOM 1061 C ILE A 66 65.871 4.952 -8.367 1.00 15.00 C ATOM 1062 O ILE A 66 66.012 4.326 -9.401 1.00 15.00 O ATOM 1063 CB ILE A 66 67.512 6.875 -8.453 1.00 15.00 C ATOM 1064 CG1 ILE A 66 68.717 7.519 -7.757 1.00 15.00 C ATOM 1065 CG2 ILE A 66 66.366 7.894 -8.502 1.00 15.00 C ATOM 1066 CD1 ILE A 66 69.355 8.550 -8.689 1.00 15.00 C ATOM 0 H ILE A 66 68.654 4.544 -8.623 1.00 15.00 H new ATOM 0 HA ILE A 66 66.755 5.872 -6.664 1.00 15.00 H new ATOM 0 HB ILE A 66 67.785 6.580 -9.466 1.00 15.00 H new ATOM 0 HG12 ILE A 66 68.402 7.998 -6.830 1.00 15.00 H new ATOM 0 HG13 ILE A 66 69.447 6.755 -7.489 1.00 15.00 H new ATOM 0 HG21 ILE A 66 66.688 8.778 -9.052 1.00 15.00 H new ATOM 0 HG22 ILE A 66 65.505 7.450 -9.001 1.00 15.00 H new ATOM 0 HG23 ILE A 66 66.089 8.180 -7.487 1.00 15.00 H new ATOM 0 HD11 ILE A 66 70.211 9.007 -8.194 1.00 15.00 H new ATOM 0 HD12 ILE A 66 69.685 8.058 -9.604 1.00 15.00 H new ATOM 0 HD13 ILE A 66 68.624 9.320 -8.934 1.00 15.00 H new ATOM 1078 N PHE A 67 64.699 5.085 -7.795 1.00 15.00 N ATOM 1079 CA PHE A 67 63.468 4.541 -8.445 1.00 15.00 C ATOM 1080 C PHE A 67 62.391 5.626 -8.514 1.00 15.00 C ATOM 1081 O PHE A 67 62.283 6.456 -7.630 1.00 15.00 O ATOM 1082 CB PHE A 67 63.017 3.392 -7.543 1.00 15.00 C ATOM 1083 CG PHE A 67 63.967 2.218 -7.538 1.00 15.00 C ATOM 1084 CD1 PHE A 67 64.078 1.393 -8.684 1.00 15.00 C ATOM 1085 CD2 PHE A 67 64.745 1.941 -6.389 1.00 15.00 C ATOM 1086 CE1 PHE A 67 64.968 0.292 -8.680 1.00 15.00 C ATOM 1087 CE2 PHE A 67 65.636 0.839 -6.384 1.00 15.00 C ATOM 1088 CZ PHE A 67 65.746 0.014 -7.530 1.00 15.00 C ATOM 0 H PHE A 67 64.543 5.550 -6.901 1.00 15.00 H new ATOM 0 HA PHE A 67 63.651 4.206 -9.466 1.00 15.00 H new ATOM 0 HB2 PHE A 67 62.906 3.763 -6.524 1.00 15.00 H new ATOM 0 HB3 PHE A 67 62.034 3.051 -7.867 1.00 15.00 H new ATOM 0 HD1 PHE A 67 63.484 1.604 -9.561 1.00 15.00 H new ATOM 0 HD2 PHE A 67 64.660 2.570 -5.515 1.00 15.00 H new ATOM 0 HE1 PHE A 67 65.054 -0.336 -9.554 1.00 15.00 H new ATOM 0 HE2 PHE A 67 66.231 0.628 -5.507 1.00 15.00 H new ATOM 0 HZ PHE A 67 66.423 -0.827 -7.527 1.00 15.00 H new ATOM 1098 N ARG A 68 61.596 5.624 -9.556 1.00 15.00 N ATOM 1099 CA ARG A 68 60.521 6.655 -9.692 1.00 15.00 C ATOM 1100 C ARG A 68 59.146 6.015 -9.482 1.00 15.00 C ATOM 1101 O ARG A 68 58.955 4.840 -9.734 1.00 15.00 O ATOM 1102 CB ARG A 68 60.653 7.187 -11.121 1.00 15.00 C ATOM 1103 CG ARG A 68 61.976 7.941 -11.269 1.00 15.00 C ATOM 1104 CD ARG A 68 62.052 8.574 -12.662 1.00 15.00 C ATOM 1105 NE ARG A 68 63.446 9.111 -12.781 1.00 15.00 N ATOM 1106 CZ ARG A 68 63.965 9.424 -13.953 1.00 15.00 C ATOM 1107 NH1 ARG A 68 63.283 9.287 -15.069 1.00 15.00 N ATOM 1108 NH2 ARG A 68 65.184 9.885 -14.006 1.00 15.00 N ATOM 0 H ARG A 68 61.646 4.950 -10.320 1.00 15.00 H new ATOM 0 HA ARG A 68 60.618 7.450 -8.953 1.00 15.00 H new ATOM 0 HB2 ARG A 68 60.612 6.362 -11.832 1.00 15.00 H new ATOM 0 HB3 ARG A 68 59.818 7.849 -11.352 1.00 15.00 H new ATOM 0 HG2 ARG A 68 62.055 8.712 -10.503 1.00 15.00 H new ATOM 0 HG3 ARG A 68 62.814 7.259 -11.122 1.00 15.00 H new ATOM 0 HD2 ARG A 68 61.847 7.838 -13.439 1.00 15.00 H new ATOM 0 HD3 ARG A 68 61.314 9.369 -12.773 1.00 15.00 H new ATOM 0 HE ARG A 68 64.006 9.237 -11.938 1.00 15.00 H new ATOM 0 HH11 ARG A 68 62.328 8.931 -15.042 1.00 15.00 H new ATOM 0 HH12 ARG A 68 63.709 9.537 -15.961 1.00 15.00 H new ATOM 0 HH21 ARG A 68 65.724 10.000 -13.148 1.00 15.00 H new ATOM 0 HH22 ARG A 68 65.598 10.131 -14.905 1.00 15.00 H new ATOM 1122 N GLY A 69 58.186 6.784 -9.021 1.00 15.00 N ATOM 1123 CA GLY A 69 56.818 6.228 -8.759 1.00 15.00 C ATOM 1124 C GLY A 69 56.234 5.598 -10.033 1.00 15.00 C ATOM 1125 O GLY A 69 55.402 4.711 -9.964 1.00 15.00 O ATOM 0 H GLY A 69 58.292 7.777 -8.814 1.00 15.00 H new ATOM 0 HA2 GLY A 69 56.870 5.480 -7.968 1.00 15.00 H new ATOM 0 HA3 GLY A 69 56.159 7.021 -8.405 1.00 15.00 H new ATOM 1129 N SER A 70 56.660 6.048 -11.190 1.00 15.00 N ATOM 1130 CA SER A 70 56.101 5.503 -12.471 1.00 15.00 C ATOM 1131 C SER A 70 56.479 4.026 -12.641 1.00 15.00 C ATOM 1132 O SER A 70 55.651 3.207 -12.996 1.00 15.00 O ATOM 1133 CB SER A 70 56.732 6.344 -13.582 1.00 15.00 C ATOM 1134 OG SER A 70 56.479 7.719 -13.330 1.00 15.00 O ATOM 0 H SER A 70 57.371 6.770 -11.303 1.00 15.00 H new ATOM 0 HA SER A 70 55.012 5.555 -12.489 1.00 15.00 H new ATOM 0 HB2 SER A 70 57.806 6.162 -13.627 1.00 15.00 H new ATOM 0 HB3 SER A 70 56.320 6.058 -14.550 1.00 15.00 H new ATOM 0 HG SER A 70 56.883 8.261 -14.039 1.00 15.00 H new ATOM 1140 N ASP A 71 57.721 3.683 -12.391 1.00 15.00 N ATOM 1141 CA ASP A 71 58.171 2.268 -12.597 1.00 15.00 C ATOM 1142 C ASP A 71 57.794 1.398 -11.389 1.00 15.00 C ATOM 1143 O ASP A 71 57.530 0.218 -11.526 1.00 15.00 O ATOM 1144 CB ASP A 71 59.698 2.337 -12.775 1.00 15.00 C ATOM 1145 CG ASP A 71 60.363 2.910 -11.517 1.00 15.00 C ATOM 1146 OD1 ASP A 71 60.638 4.097 -11.506 1.00 15.00 O ATOM 1147 OD2 ASP A 71 60.586 2.149 -10.590 1.00 15.00 O ATOM 0 H ASP A 71 58.442 4.321 -12.054 1.00 15.00 H new ATOM 0 HA ASP A 71 57.692 1.815 -13.465 1.00 15.00 H new ATOM 0 HB2 ASP A 71 60.091 1.341 -12.979 1.00 15.00 H new ATOM 0 HB3 ASP A 71 59.941 2.959 -13.637 1.00 15.00 H new ATOM 1152 N ILE A 72 57.767 1.976 -10.211 1.00 15.00 N ATOM 1153 CA ILE A 72 57.405 1.186 -8.985 1.00 15.00 C ATOM 1154 C ILE A 72 55.938 0.741 -9.067 1.00 15.00 C ATOM 1155 O ILE A 72 55.085 1.474 -9.534 1.00 15.00 O ATOM 1156 CB ILE A 72 57.619 2.137 -7.794 1.00 15.00 C ATOM 1157 CG1 ILE A 72 59.087 2.576 -7.735 1.00 15.00 C ATOM 1158 CG2 ILE A 72 57.264 1.421 -6.485 1.00 15.00 C ATOM 1159 CD1 ILE A 72 59.216 3.803 -6.829 1.00 15.00 C ATOM 0 H ILE A 72 57.979 2.959 -10.043 1.00 15.00 H new ATOM 0 HA ILE A 72 58.012 0.286 -8.884 1.00 15.00 H new ATOM 0 HB ILE A 72 56.978 3.009 -7.923 1.00 15.00 H new ATOM 0 HG12 ILE A 72 59.706 1.763 -7.355 1.00 15.00 H new ATOM 0 HG13 ILE A 72 59.448 2.810 -8.736 1.00 15.00 H new ATOM 0 HG21 ILE A 72 57.418 2.100 -5.646 1.00 15.00 H new ATOM 0 HG22 ILE A 72 56.220 1.109 -6.513 1.00 15.00 H new ATOM 0 HG23 ILE A 72 57.902 0.545 -6.365 1.00 15.00 H new ATOM 0 HD11 ILE A 72 60.259 4.116 -6.786 1.00 15.00 H new ATOM 0 HD12 ILE A 72 58.610 4.616 -7.229 1.00 15.00 H new ATOM 0 HD13 ILE A 72 58.871 3.552 -5.826 1.00 15.00 H new ATOM 1171 N LYS A 73 55.648 -0.455 -8.615 1.00 15.00 N ATOM 1172 CA LYS A 73 54.245 -0.966 -8.669 1.00 15.00 C ATOM 1173 C LYS A 73 53.638 -1.001 -7.263 1.00 15.00 C ATOM 1174 O LYS A 73 52.501 -0.615 -7.062 1.00 15.00 O ATOM 1175 CB LYS A 73 54.361 -2.381 -9.239 1.00 15.00 C ATOM 1176 CG LYS A 73 52.966 -2.916 -9.566 1.00 15.00 C ATOM 1177 CD LYS A 73 53.076 -4.361 -10.058 1.00 15.00 C ATOM 1178 CE LYS A 73 51.700 -4.852 -10.515 1.00 15.00 C ATOM 1179 NZ LYS A 73 51.752 -6.333 -10.367 1.00 15.00 N ATOM 0 H LYS A 73 56.326 -1.100 -8.210 1.00 15.00 H new ATOM 0 HA LYS A 73 53.598 -0.333 -9.277 1.00 15.00 H new ATOM 0 HB2 LYS A 73 54.979 -2.373 -10.137 1.00 15.00 H new ATOM 0 HB3 LYS A 73 54.853 -3.035 -8.519 1.00 15.00 H new ATOM 0 HG2 LYS A 73 52.330 -2.869 -8.682 1.00 15.00 H new ATOM 0 HG3 LYS A 73 52.497 -2.295 -10.329 1.00 15.00 H new ATOM 0 HD2 LYS A 73 53.788 -4.423 -10.881 1.00 15.00 H new ATOM 0 HD3 LYS A 73 53.455 -5.000 -9.260 1.00 15.00 H new ATOM 0 HE2 LYS A 73 50.905 -4.422 -9.906 1.00 15.00 H new ATOM 0 HE3 LYS A 73 51.501 -4.565 -11.548 1.00 15.00 H new ATOM 0 HZ1 LYS A 73 50.843 -6.743 -10.661 1.00 15.00 H new ATOM 0 HZ2 LYS A 73 52.514 -6.715 -10.963 1.00 15.00 H new ATOM 0 HZ3 LYS A 73 51.936 -6.576 -9.373 1.00 15.00 H new ATOM 1193 N ASP A 74 54.391 -1.461 -6.292 1.00 15.00 N ATOM 1194 CA ASP A 74 53.845 -1.572 -4.902 1.00 15.00 C ATOM 1195 C ASP A 74 54.914 -1.197 -3.869 1.00 15.00 C ATOM 1196 O ASP A 74 56.089 -1.430 -4.072 1.00 15.00 O ATOM 1197 CB ASP A 74 53.446 -3.040 -4.751 1.00 15.00 C ATOM 1198 CG ASP A 74 52.644 -3.224 -3.461 1.00 15.00 C ATOM 1199 OD1 ASP A 74 53.236 -3.618 -2.470 1.00 15.00 O ATOM 1200 OD2 ASP A 74 51.453 -2.967 -3.486 1.00 15.00 O ATOM 0 H ASP A 74 55.359 -1.764 -6.402 1.00 15.00 H new ATOM 0 HA ASP A 74 53.004 -0.898 -4.739 1.00 15.00 H new ATOM 0 HB2 ASP A 74 52.852 -3.356 -5.609 1.00 15.00 H new ATOM 0 HB3 ASP A 74 54.336 -3.669 -4.731 1.00 15.00 H new ATOM 1205 N LEU A 75 54.506 -0.619 -2.764 1.00 15.00 N ATOM 1206 CA LEU A 75 55.484 -0.231 -1.700 1.00 15.00 C ATOM 1207 C LEU A 75 54.986 -0.700 -0.327 1.00 15.00 C ATOM 1208 O LEU A 75 53.855 -0.447 0.048 1.00 15.00 O ATOM 1209 CB LEU A 75 55.541 1.297 -1.755 1.00 15.00 C ATOM 1210 CG LEU A 75 56.750 1.798 -0.961 1.00 15.00 C ATOM 1211 CD1 LEU A 75 57.156 3.183 -1.468 1.00 15.00 C ATOM 1212 CD2 LEU A 75 56.385 1.889 0.524 1.00 15.00 C ATOM 0 H LEU A 75 53.533 -0.399 -2.553 1.00 15.00 H new ATOM 0 HA LEU A 75 56.464 -0.683 -1.854 1.00 15.00 H new ATOM 0 HB2 LEU A 75 55.610 1.631 -2.790 1.00 15.00 H new ATOM 0 HB3 LEU A 75 54.624 1.720 -1.345 1.00 15.00 H new ATOM 0 HG LEU A 75 57.580 1.104 -1.091 1.00 15.00 H new ATOM 0 HD11 LEU A 75 58.017 3.540 -0.902 1.00 15.00 H new ATOM 0 HD12 LEU A 75 57.416 3.122 -2.525 1.00 15.00 H new ATOM 0 HD13 LEU A 75 56.325 3.876 -1.339 1.00 15.00 H new ATOM 0 HD21 LEU A 75 57.246 2.246 1.089 1.00 15.00 H new ATOM 0 HD22 LEU A 75 55.554 2.582 0.653 1.00 15.00 H new ATOM 0 HD23 LEU A 75 56.095 0.904 0.888 1.00 15.00 H new ATOM 1224 N THR A 76 55.823 -1.378 0.421 1.00 15.00 N ATOM 1225 CA THR A 76 55.420 -1.849 1.784 1.00 15.00 C ATOM 1226 C THR A 76 56.501 -1.495 2.812 1.00 15.00 C ATOM 1227 O THR A 76 57.682 -1.580 2.532 1.00 15.00 O ATOM 1228 CB THR A 76 55.280 -3.367 1.652 1.00 15.00 C ATOM 1229 OG1 THR A 76 54.462 -3.669 0.530 1.00 15.00 O ATOM 1230 CG2 THR A 76 54.639 -3.935 2.920 1.00 15.00 C ATOM 0 H THR A 76 56.773 -1.627 0.145 1.00 15.00 H new ATOM 0 HA THR A 76 54.496 -1.382 2.125 1.00 15.00 H new ATOM 0 HB THR A 76 56.265 -3.813 1.515 1.00 15.00 H new ATOM 0 HG1 THR A 76 54.372 -4.641 0.443 1.00 15.00 H new ATOM 0 HG21 THR A 76 54.540 -5.016 2.825 1.00 15.00 H new ATOM 0 HG22 THR A 76 55.267 -3.703 3.780 1.00 15.00 H new ATOM 0 HG23 THR A 76 53.653 -3.491 3.060 1.00 15.00 H new