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 180:sc= -1.82! USER MOD Set 1.2: A 64 TYR OH : rot 180:sc= -0.785 USER MOD Single : A 10 SER OG : rot 46:sc= 0.208 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot -120:sc= -1.16 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= -1.09 K(o=-1.1,f=-8.4!) USER MOD Single : A 34 SER OG : rot -57:sc= 0.129 USER MOD Single : A 35 THR OG1 : rot 180:sc= -0.65 USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 SER OG : rot -2:sc= 0.627 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 64.117 4.206 7.883 1.00 15.00 N ATOM 162 CA SER A 10 63.288 2.972 8.051 1.00 15.00 C ATOM 163 C SER A 10 63.570 1.976 6.920 1.00 15.00 C ATOM 164 O SER A 10 63.877 2.361 5.808 1.00 15.00 O ATOM 165 CB SER A 10 61.841 3.458 7.986 1.00 15.00 C ATOM 166 OG SER A 10 61.620 4.413 9.015 1.00 15.00 O ATOM 0 HA SER A 10 63.507 2.455 8.986 1.00 15.00 H new ATOM 0 HB2 SER A 10 61.638 3.903 7.012 1.00 15.00 H new ATOM 0 HB3 SER A 10 61.157 2.617 8.101 1.00 15.00 H new ATOM 0 HG SER A 10 62.361 5.055 9.030 1.00 15.00 H new ATOM 172 N LYS A 11 63.468 0.701 7.207 1.00 15.00 N ATOM 173 CA LYS A 11 63.685 -0.339 6.150 1.00 15.00 C ATOM 174 C LYS A 11 62.410 -0.526 5.320 1.00 15.00 C ATOM 175 O LYS A 11 61.334 -0.734 5.855 1.00 15.00 O ATOM 176 CB LYS A 11 64.022 -1.622 6.914 1.00 15.00 C ATOM 177 CG LYS A 11 64.528 -2.686 5.937 1.00 15.00 C ATOM 178 CD LYS A 11 64.908 -3.949 6.714 1.00 15.00 C ATOM 179 CE LYS A 11 65.620 -4.931 5.781 1.00 15.00 C ATOM 180 NZ LYS A 11 66.533 -5.708 6.665 1.00 15.00 N ATOM 0 H LYS A 11 63.243 0.333 8.131 1.00 15.00 H new ATOM 0 HA LYS A 11 64.477 -0.060 5.456 1.00 15.00 H new ATOM 0 HB2 LYS A 11 64.781 -1.418 7.670 1.00 15.00 H new ATOM 0 HB3 LYS A 11 63.139 -1.987 7.439 1.00 15.00 H new ATOM 0 HG2 LYS A 11 63.757 -2.916 5.201 1.00 15.00 H new ATOM 0 HG3 LYS A 11 65.391 -2.310 5.387 1.00 15.00 H new ATOM 0 HD2 LYS A 11 65.557 -3.692 7.551 1.00 15.00 H new ATOM 0 HD3 LYS A 11 64.015 -4.413 7.133 1.00 15.00 H new ATOM 0 HE2 LYS A 11 64.908 -5.584 5.277 1.00 15.00 H new ATOM 0 HE3 LYS A 11 66.175 -4.406 5.004 1.00 15.00 H new ATOM 0 HZ1 LYS A 11 67.057 -6.404 6.097 1.00 15.00 H new ATOM 0 HZ2 LYS A 11 67.204 -5.061 7.126 1.00 15.00 H new ATOM 0 HZ3 LYS A 11 65.976 -6.203 7.390 1.00 15.00 H new ATOM 194 N ILE A 12 62.526 -0.456 4.014 1.00 15.00 N ATOM 195 CA ILE A 12 61.315 -0.542 3.139 1.00 15.00 C ATOM 196 C ILE A 12 61.551 -1.562 2.020 1.00 15.00 C ATOM 197 O ILE A 12 62.667 -1.763 1.573 1.00 15.00 O ATOM 198 CB ILE A 12 61.125 0.872 2.562 1.00 15.00 C ATOM 199 CG1 ILE A 12 60.898 1.871 3.706 1.00 15.00 C ATOM 200 CG2 ILE A 12 59.906 0.894 1.630 1.00 15.00 C ATOM 201 CD1 ILE A 12 60.945 3.301 3.159 1.00 15.00 C ATOM 0 H ILE A 12 63.409 -0.343 3.517 1.00 15.00 H new ATOM 0 HA ILE A 12 60.431 -0.869 3.687 1.00 15.00 H new ATOM 0 HB ILE A 12 62.019 1.149 2.003 1.00 15.00 H new ATOM 0 HG12 ILE A 12 59.934 1.684 4.179 1.00 15.00 H new ATOM 0 HG13 ILE A 12 61.661 1.740 4.473 1.00 15.00 H new ATOM 0 HG21 ILE A 12 59.776 1.897 1.224 1.00 15.00 H new ATOM 0 HG22 ILE A 12 60.060 0.189 0.813 1.00 15.00 H new ATOM 0 HG23 ILE A 12 59.015 0.611 2.190 1.00 15.00 H new ATOM 0 HD11 ILE A 12 60.784 4.007 3.973 1.00 15.00 H new ATOM 0 HD12 ILE A 12 61.919 3.486 2.706 1.00 15.00 H new ATOM 0 HD13 ILE A 12 60.166 3.429 2.408 1.00 15.00 H new ATOM 213 N SER A 13 60.499 -2.205 1.573 1.00 15.00 N ATOM 214 CA SER A 13 60.610 -3.144 0.419 1.00 15.00 C ATOM 215 C SER A 13 59.809 -2.598 -0.764 1.00 15.00 C ATOM 216 O SER A 13 58.693 -2.136 -0.606 1.00 15.00 O ATOM 217 CB SER A 13 60.010 -4.458 0.915 1.00 15.00 C ATOM 218 OG SER A 13 59.941 -5.378 -0.167 1.00 15.00 O ATOM 0 H SER A 13 59.561 -2.117 1.964 1.00 15.00 H new ATOM 0 HA SER A 13 61.638 -3.275 0.082 1.00 15.00 H new ATOM 0 HB2 SER A 13 60.620 -4.869 1.719 1.00 15.00 H new ATOM 0 HB3 SER A 13 59.015 -4.285 1.325 1.00 15.00 H new ATOM 0 HG SER A 13 59.008 -5.641 -0.314 1.00 15.00 H new ATOM 224 N LEU A 14 60.371 -2.651 -1.945 1.00 15.00 N ATOM 225 CA LEU A 14 59.693 -2.063 -3.138 1.00 15.00 C ATOM 226 C LEU A 14 59.601 -3.100 -4.260 1.00 15.00 C ATOM 227 O LEU A 14 60.545 -3.818 -4.528 1.00 15.00 O ATOM 228 CB LEU A 14 60.589 -0.897 -3.558 1.00 15.00 C ATOM 229 CG LEU A 14 59.769 0.117 -4.356 1.00 15.00 C ATOM 230 CD1 LEU A 14 58.839 0.877 -3.409 1.00 15.00 C ATOM 231 CD2 LEU A 14 60.714 1.104 -5.045 1.00 15.00 C ATOM 0 H LEU A 14 61.277 -3.080 -2.134 1.00 15.00 H new ATOM 0 HA LEU A 14 58.674 -1.742 -2.921 1.00 15.00 H new ATOM 0 HB2 LEU A 14 61.019 -0.420 -2.677 1.00 15.00 H new ATOM 0 HB3 LEU A 14 61.420 -1.263 -4.161 1.00 15.00 H new ATOM 0 HG LEU A 14 59.175 -0.404 -5.107 1.00 15.00 H new ATOM 0 HD11 LEU A 14 58.254 1.600 -3.977 1.00 15.00 H new ATOM 0 HD12 LEU A 14 58.168 0.174 -2.916 1.00 15.00 H new ATOM 0 HD13 LEU A 14 59.432 1.399 -2.658 1.00 15.00 H new ATOM 0 HD21 LEU A 14 60.132 1.828 -5.615 1.00 15.00 H new ATOM 0 HD22 LEU A 14 61.306 1.626 -4.293 1.00 15.00 H new ATOM 0 HD23 LEU A 14 61.378 0.562 -5.718 1.00 15.00 H new ATOM 243 N ILE A 15 58.469 -3.177 -4.914 1.00 15.00 N ATOM 244 CA ILE A 15 58.320 -4.119 -6.066 1.00 15.00 C ATOM 245 C ILE A 15 58.237 -3.310 -7.365 1.00 15.00 C ATOM 246 O ILE A 15 57.383 -2.454 -7.511 1.00 15.00 O ATOM 247 CB ILE A 15 57.010 -4.883 -5.806 1.00 15.00 C ATOM 248 CG1 ILE A 15 57.110 -5.648 -4.479 1.00 15.00 C ATOM 249 CG2 ILE A 15 56.757 -5.883 -6.941 1.00 15.00 C ATOM 250 CD1 ILE A 15 55.725 -6.161 -4.075 1.00 15.00 C ATOM 0 H ILE A 15 57.638 -2.626 -4.699 1.00 15.00 H new ATOM 0 HA ILE A 15 59.159 -4.808 -6.161 1.00 15.00 H new ATOM 0 HB ILE A 15 56.188 -4.168 -5.757 1.00 15.00 H new ATOM 0 HG12 ILE A 15 57.803 -6.483 -4.581 1.00 15.00 H new ATOM 0 HG13 ILE A 15 57.508 -4.996 -3.701 1.00 15.00 H new ATOM 0 HG21 ILE A 15 55.828 -6.421 -6.752 1.00 15.00 H new ATOM 0 HG22 ILE A 15 56.680 -5.347 -7.887 1.00 15.00 H new ATOM 0 HG23 ILE A 15 57.583 -6.592 -6.992 1.00 15.00 H new ATOM 0 HD11 ILE A 15 55.799 -6.704 -3.133 1.00 15.00 H new ATOM 0 HD12 ILE A 15 55.045 -5.317 -3.956 1.00 15.00 H new ATOM 0 HD13 ILE A 15 55.344 -6.828 -4.849 1.00 15.00 H new ATOM 262 N SER A 16 59.118 -3.582 -8.299 1.00 15.00 N ATOM 263 CA SER A 16 59.222 -2.719 -9.519 1.00 15.00 C ATOM 264 C SER A 16 58.366 -3.279 -10.661 1.00 15.00 C ATOM 265 O SER A 16 57.820 -4.361 -10.569 1.00 15.00 O ATOM 266 CB SER A 16 60.704 -2.748 -9.898 1.00 15.00 C ATOM 267 OG SER A 16 61.399 -1.760 -9.147 1.00 15.00 O ATOM 0 H SER A 16 59.770 -4.366 -8.269 1.00 15.00 H new ATOM 0 HA SER A 16 58.863 -1.707 -9.331 1.00 15.00 H new ATOM 0 HB2 SER A 16 61.123 -3.734 -9.699 1.00 15.00 H new ATOM 0 HB3 SER A 16 60.822 -2.561 -10.965 1.00 15.00 H new ATOM 0 HG SER A 16 62.349 -1.776 -9.386 1.00 15.00 H new ATOM 273 N LYS A 17 58.253 -2.540 -11.741 1.00 15.00 N ATOM 274 CA LYS A 17 57.399 -2.988 -12.895 1.00 15.00 C ATOM 275 C LYS A 17 57.882 -4.334 -13.463 1.00 15.00 C ATOM 276 O LYS A 17 57.140 -5.024 -14.137 1.00 15.00 O ATOM 277 CB LYS A 17 57.536 -1.889 -13.953 1.00 15.00 C ATOM 278 CG LYS A 17 56.509 -2.115 -15.065 1.00 15.00 C ATOM 279 CD LYS A 17 56.694 -1.058 -16.155 1.00 15.00 C ATOM 280 CE LYS A 17 55.602 -1.220 -17.215 1.00 15.00 C ATOM 281 NZ LYS A 17 55.538 0.098 -17.905 1.00 15.00 N ATOM 0 H LYS A 17 58.717 -1.642 -11.875 1.00 15.00 H new ATOM 0 HA LYS A 17 56.365 -3.138 -12.584 1.00 15.00 H new ATOM 0 HB2 LYS A 17 57.384 -0.911 -13.497 1.00 15.00 H new ATOM 0 HB3 LYS A 17 58.544 -1.894 -14.368 1.00 15.00 H new ATOM 0 HG2 LYS A 17 56.629 -3.113 -15.487 1.00 15.00 H new ATOM 0 HG3 LYS A 17 55.499 -2.060 -14.658 1.00 15.00 H new ATOM 0 HD2 LYS A 17 56.648 -0.060 -15.720 1.00 15.00 H new ATOM 0 HD3 LYS A 17 57.678 -1.161 -16.613 1.00 15.00 H new ATOM 0 HE2 LYS A 17 55.846 -2.020 -17.914 1.00 15.00 H new ATOM 0 HE3 LYS A 17 54.645 -1.475 -16.760 1.00 15.00 H new ATOM 0 HZ1 LYS A 17 54.810 0.066 -18.647 1.00 15.00 H new ATOM 0 HZ2 LYS A 17 55.298 0.839 -17.216 1.00 15.00 H new ATOM 0 HZ3 LYS A 17 56.461 0.310 -18.334 1.00 15.00 H new ATOM 295 N ALA A 18 59.114 -4.709 -13.198 1.00 15.00 N ATOM 296 CA ALA A 18 59.647 -5.995 -13.752 1.00 15.00 C ATOM 297 C ALA A 18 59.379 -7.170 -12.796 1.00 15.00 C ATOM 298 O ALA A 18 59.979 -8.219 -12.923 1.00 15.00 O ATOM 299 CB ALA A 18 61.153 -5.767 -13.901 1.00 15.00 C ATOM 0 H ALA A 18 59.771 -4.181 -12.623 1.00 15.00 H new ATOM 0 HA ALA A 18 59.167 -6.252 -14.696 1.00 15.00 H new ATOM 0 HB1 ALA A 18 61.619 -6.667 -14.303 1.00 15.00 H new ATOM 0 HB2 ALA A 18 61.329 -4.933 -14.580 1.00 15.00 H new ATOM 0 HB3 ALA A 18 61.585 -5.539 -12.926 1.00 15.00 H new ATOM 305 N GLU A 19 58.483 -7.003 -11.839 1.00 15.00 N ATOM 306 CA GLU A 19 58.129 -8.119 -10.894 1.00 15.00 C ATOM 307 C GLU A 19 59.375 -8.622 -10.155 1.00 15.00 C ATOM 308 O GLU A 19 59.460 -9.777 -9.781 1.00 15.00 O ATOM 309 CB GLU A 19 57.514 -9.235 -11.752 1.00 15.00 C ATOM 310 CG GLU A 19 56.229 -8.726 -12.414 1.00 15.00 C ATOM 311 CD GLU A 19 55.573 -9.865 -13.197 1.00 15.00 C ATOM 312 OE1 GLU A 19 54.585 -10.395 -12.717 1.00 15.00 O ATOM 313 OE2 GLU A 19 56.070 -10.187 -14.263 1.00 15.00 O ATOM 0 H GLU A 19 57.979 -6.132 -11.673 1.00 15.00 H new ATOM 0 HA GLU A 19 57.428 -7.780 -10.131 1.00 15.00 H new ATOM 0 HB2 GLU A 19 58.225 -9.556 -12.514 1.00 15.00 H new ATOM 0 HB3 GLU A 19 57.296 -10.105 -11.133 1.00 15.00 H new ATOM 0 HG2 GLU A 19 55.542 -8.348 -11.657 1.00 15.00 H new ATOM 0 HG3 GLU A 19 56.456 -7.895 -13.082 1.00 15.00 H new ATOM 320 N ILE A 20 60.341 -7.758 -9.947 1.00 15.00 N ATOM 321 CA ILE A 20 61.517 -8.123 -9.099 1.00 15.00 C ATOM 322 C ILE A 20 61.387 -7.426 -7.739 1.00 15.00 C ATOM 323 O ILE A 20 60.856 -6.333 -7.646 1.00 15.00 O ATOM 324 CB ILE A 20 62.751 -7.615 -9.863 1.00 15.00 C ATOM 325 CG1 ILE A 20 62.847 -8.320 -11.221 1.00 15.00 C ATOM 326 CG2 ILE A 20 64.020 -7.914 -9.056 1.00 15.00 C ATOM 327 CD1 ILE A 20 63.791 -7.540 -12.140 1.00 15.00 C ATOM 0 H ILE A 20 60.364 -6.813 -10.330 1.00 15.00 H new ATOM 0 HA ILE A 20 61.589 -9.195 -8.914 1.00 15.00 H new ATOM 0 HB ILE A 20 62.655 -6.540 -10.013 1.00 15.00 H new ATOM 0 HG12 ILE A 20 63.212 -9.338 -11.088 1.00 15.00 H new ATOM 0 HG13 ILE A 20 61.859 -8.392 -11.675 1.00 15.00 H new ATOM 0 HG21 ILE A 20 64.892 -7.552 -9.601 1.00 15.00 H new ATOM 0 HG22 ILE A 20 63.963 -7.413 -8.090 1.00 15.00 H new ATOM 0 HG23 ILE A 20 64.109 -8.990 -8.903 1.00 15.00 H new ATOM 0 HD11 ILE A 20 63.858 -8.043 -13.105 1.00 15.00 H new ATOM 0 HD12 ILE A 20 63.407 -6.530 -12.283 1.00 15.00 H new ATOM 0 HD13 ILE A 20 64.781 -7.491 -11.687 1.00 15.00 H new ATOM 339 N ARG A 21 61.869 -8.051 -6.692 1.00 15.00 N ATOM 340 CA ARG A 21 61.705 -7.475 -5.323 1.00 15.00 C ATOM 341 C ARG A 21 63.032 -6.892 -4.823 1.00 15.00 C ATOM 342 O ARG A 21 64.015 -7.597 -4.684 1.00 15.00 O ATOM 343 CB ARG A 21 61.275 -8.656 -4.452 1.00 15.00 C ATOM 344 CG ARG A 21 60.768 -8.146 -3.102 1.00 15.00 C ATOM 345 CD ARG A 21 60.259 -9.327 -2.272 1.00 15.00 C ATOM 346 NE ARG A 21 59.658 -8.715 -1.046 1.00 15.00 N ATOM 347 CZ ARG A 21 60.409 -8.264 -0.057 1.00 15.00 C ATOM 348 NH1 ARG A 21 61.721 -8.307 -0.113 1.00 15.00 N ATOM 349 NH2 ARG A 21 59.833 -7.759 0.999 1.00 15.00 N ATOM 0 H ARG A 21 62.371 -8.938 -6.728 1.00 15.00 H new ATOM 0 HA ARG A 21 60.979 -6.662 -5.302 1.00 15.00 H new ATOM 0 HB2 ARG A 21 60.492 -9.224 -4.954 1.00 15.00 H new ATOM 0 HB3 ARG A 21 62.115 -9.335 -4.303 1.00 15.00 H new ATOM 0 HG2 ARG A 21 61.569 -7.632 -2.571 1.00 15.00 H new ATOM 0 HG3 ARG A 21 59.968 -7.421 -3.252 1.00 15.00 H new ATOM 0 HD2 ARG A 21 59.520 -9.907 -2.825 1.00 15.00 H new ATOM 0 HD3 ARG A 21 61.071 -10.007 -2.015 1.00 15.00 H new ATOM 0 HE ARG A 21 58.643 -8.644 -0.972 1.00 15.00 H new ATOM 0 HH11 ARG A 21 62.184 -8.696 -0.935 1.00 15.00 H new ATOM 0 HH12 ARG A 21 62.277 -7.952 0.665 1.00 15.00 H new ATOM 0 HH21 ARG A 21 58.815 -7.716 1.053 1.00 15.00 H new ATOM 0 HH22 ARG A 21 60.400 -7.407 1.770 1.00 15.00 H new ATOM 363 N TYR A 22 63.058 -5.609 -4.554 1.00 15.00 N ATOM 364 CA TYR A 22 64.292 -4.968 -4.003 1.00 15.00 C ATOM 365 C TYR A 22 64.047 -4.532 -2.557 1.00 15.00 C ATOM 366 O TYR A 22 62.983 -4.052 -2.224 1.00 15.00 O ATOM 367 CB TYR A 22 64.531 -3.738 -4.880 1.00 15.00 C ATOM 368 CG TYR A 22 64.970 -4.060 -6.289 1.00 15.00 C ATOM 369 CD1 TYR A 22 66.348 -4.188 -6.588 1.00 15.00 C ATOM 370 CD2 TYR A 22 64.004 -4.223 -7.312 1.00 15.00 C ATOM 371 CE1 TYR A 22 66.761 -4.480 -7.911 1.00 15.00 C ATOM 372 CE2 TYR A 22 64.416 -4.515 -8.634 1.00 15.00 C ATOM 373 CZ TYR A 22 65.794 -4.643 -8.934 1.00 15.00 C ATOM 374 OH TYR A 22 66.196 -4.927 -10.224 1.00 15.00 O ATOM 0 H TYR A 22 62.272 -4.975 -4.694 1.00 15.00 H new ATOM 0 HA TYR A 22 65.144 -5.647 -4.006 1.00 15.00 H new ATOM 0 HB2 TYR A 22 63.613 -3.151 -4.922 1.00 15.00 H new ATOM 0 HB3 TYR A 22 65.289 -3.111 -4.409 1.00 15.00 H new ATOM 0 HD1 TYR A 22 67.084 -4.063 -5.808 1.00 15.00 H new ATOM 0 HD2 TYR A 22 62.953 -4.124 -7.083 1.00 15.00 H new ATOM 0 HE1 TYR A 22 67.812 -4.578 -8.140 1.00 15.00 H new ATOM 0 HE2 TYR A 22 63.680 -4.640 -9.414 1.00 15.00 H new ATOM 0 HH TYR A 22 65.409 -5.009 -10.802 1.00 15.00 H new ATOM 384 N GLU A 23 65.022 -4.696 -1.698 1.00 15.00 N ATOM 385 CA GLU A 23 64.891 -4.178 -0.300 1.00 15.00 C ATOM 386 C GLU A 23 66.079 -3.274 0.032 1.00 15.00 C ATOM 387 O GLU A 23 67.201 -3.553 -0.344 1.00 15.00 O ATOM 388 CB GLU A 23 64.896 -5.425 0.584 1.00 15.00 C ATOM 389 CG GLU A 23 64.540 -5.037 2.021 1.00 15.00 C ATOM 390 CD GLU A 23 64.484 -6.294 2.890 1.00 15.00 C ATOM 391 OE1 GLU A 23 65.387 -7.108 2.780 1.00 15.00 O ATOM 392 OE2 GLU A 23 63.541 -6.422 3.652 1.00 15.00 O ATOM 0 H GLU A 23 65.903 -5.166 -1.904 1.00 15.00 H new ATOM 0 HA GLU A 23 63.988 -3.584 -0.156 1.00 15.00 H new ATOM 0 HB2 GLU A 23 64.180 -6.154 0.205 1.00 15.00 H new ATOM 0 HB3 GLU A 23 65.877 -5.898 0.557 1.00 15.00 H new ATOM 0 HG2 GLU A 23 65.281 -4.342 2.416 1.00 15.00 H new ATOM 0 HG3 GLU A 23 63.579 -4.524 2.043 1.00 15.00 H new ATOM 399 N GLY A 24 65.834 -2.197 0.737 1.00 15.00 N ATOM 400 CA GLY A 24 66.936 -1.248 1.084 1.00 15.00 C ATOM 401 C GLY A 24 66.453 -0.299 2.180 1.00 15.00 C ATOM 402 O GLY A 24 65.333 -0.402 2.645 1.00 15.00 O ATOM 0 H GLY A 24 64.913 -1.934 1.088 1.00 15.00 H new ATOM 0 HA2 GLY A 24 67.813 -1.799 1.423 1.00 15.00 H new ATOM 0 HA3 GLY A 24 67.236 -0.682 0.202 1.00 15.00 H new ATOM 406 N ILE A 25 67.285 0.625 2.598 1.00 15.00 N ATOM 407 CA ILE A 25 66.871 1.573 3.681 1.00 15.00 C ATOM 408 C ILE A 25 66.621 2.962 3.085 1.00 15.00 C ATOM 409 O ILE A 25 67.413 3.463 2.308 1.00 15.00 O ATOM 410 CB ILE A 25 68.040 1.614 4.681 1.00 15.00 C ATOM 411 CG1 ILE A 25 68.434 0.187 5.123 1.00 15.00 C ATOM 412 CG2 ILE A 25 67.631 2.433 5.912 1.00 15.00 C ATOM 413 CD1 ILE A 25 67.238 -0.536 5.760 1.00 15.00 C ATOM 0 H ILE A 25 68.229 0.764 2.238 1.00 15.00 H new ATOM 0 HA ILE A 25 65.949 1.256 4.169 1.00 15.00 H new ATOM 0 HB ILE A 25 68.898 2.077 4.193 1.00 15.00 H new ATOM 0 HG12 ILE A 25 68.791 -0.379 4.263 1.00 15.00 H new ATOM 0 HG13 ILE A 25 69.257 0.236 5.836 1.00 15.00 H new ATOM 0 HG21 ILE A 25 68.459 2.462 6.621 1.00 15.00 H new ATOM 0 HG22 ILE A 25 67.379 3.448 5.606 1.00 15.00 H new ATOM 0 HG23 ILE A 25 66.764 1.971 6.385 1.00 15.00 H new ATOM 0 HD11 ILE A 25 67.539 -1.539 6.064 1.00 15.00 H new ATOM 0 HD12 ILE A 25 66.899 0.021 6.633 1.00 15.00 H new ATOM 0 HD13 ILE A 25 66.426 -0.604 5.036 1.00 15.00 H new ATOM 425 N LEU A 26 65.524 3.583 3.449 1.00 15.00 N ATOM 426 CA LEU A 26 65.163 4.914 2.855 1.00 15.00 C ATOM 427 C LEU A 26 66.237 5.957 3.184 1.00 15.00 C ATOM 428 O LEU A 26 66.433 6.307 4.332 1.00 15.00 O ATOM 429 CB LEU A 26 63.834 5.299 3.508 1.00 15.00 C ATOM 430 CG LEU A 26 63.155 6.393 2.683 1.00 15.00 C ATOM 431 CD1 LEU A 26 62.492 5.768 1.455 1.00 15.00 C ATOM 432 CD2 LEU A 26 62.092 7.085 3.538 1.00 15.00 C ATOM 0 H LEU A 26 64.859 3.225 4.135 1.00 15.00 H new ATOM 0 HA LEU A 26 65.087 4.866 1.769 1.00 15.00 H new ATOM 0 HB2 LEU A 26 63.185 4.426 3.577 1.00 15.00 H new ATOM 0 HB3 LEU A 26 64.005 5.650 4.525 1.00 15.00 H new ATOM 0 HG LEU A 26 63.898 7.123 2.362 1.00 15.00 H new ATOM 0 HD11 LEU A 26 62.008 6.547 0.867 1.00 15.00 H new ATOM 0 HD12 LEU A 26 63.248 5.271 0.847 1.00 15.00 H new ATOM 0 HD13 LEU A 26 61.747 5.039 1.775 1.00 15.00 H new ATOM 0 HD21 LEU A 26 61.606 7.866 2.953 1.00 15.00 H new ATOM 0 HD22 LEU A 26 61.349 6.354 3.856 1.00 15.00 H new ATOM 0 HD23 LEU A 26 62.563 7.529 4.415 1.00 15.00 H new ATOM 444 N TYR A 27 66.925 6.447 2.182 1.00 15.00 N ATOM 445 CA TYR A 27 68.014 7.440 2.426 1.00 15.00 C ATOM 446 C TYR A 27 67.486 8.867 2.246 1.00 15.00 C ATOM 447 O TYR A 27 67.650 9.708 3.112 1.00 15.00 O ATOM 448 CB TYR A 27 69.081 7.126 1.377 1.00 15.00 C ATOM 449 CG TYR A 27 70.325 7.972 1.514 1.00 15.00 C ATOM 450 CD1 TYR A 27 71.076 7.938 2.714 1.00 15.00 C ATOM 451 CD2 TYR A 27 70.739 8.801 0.443 1.00 15.00 C ATOM 452 CE1 TYR A 27 72.241 8.731 2.843 1.00 15.00 C ATOM 453 CE2 TYR A 27 71.905 9.595 0.573 1.00 15.00 C ATOM 454 CZ TYR A 27 72.655 9.561 1.773 1.00 15.00 C ATOM 455 OH TYR A 27 73.791 10.335 1.899 1.00 15.00 O ATOM 0 H TYR A 27 66.778 6.200 1.203 1.00 15.00 H new ATOM 0 HA TYR A 27 68.408 7.376 3.440 1.00 15.00 H new ATOM 0 HB2 TYR A 27 69.356 6.074 1.453 1.00 15.00 H new ATOM 0 HB3 TYR A 27 68.658 7.274 0.384 1.00 15.00 H new ATOM 0 HD1 TYR A 27 70.760 7.307 3.531 1.00 15.00 H new ATOM 0 HD2 TYR A 27 70.166 8.828 -0.472 1.00 15.00 H new ATOM 0 HE1 TYR A 27 72.814 8.703 3.758 1.00 15.00 H new ATOM 0 HE2 TYR A 27 72.222 10.227 -0.244 1.00 15.00 H new ATOM 0 HH TYR A 27 73.934 10.844 1.074 1.00 15.00 H new ATOM 465 N THR A 28 66.854 9.143 1.130 1.00 15.00 N ATOM 466 CA THR A 28 66.350 10.529 0.873 1.00 15.00 C ATOM 467 C THR A 28 65.032 10.489 0.096 1.00 15.00 C ATOM 468 O THR A 28 64.825 9.633 -0.745 1.00 15.00 O ATOM 469 CB THR A 28 67.443 11.203 0.038 1.00 15.00 C ATOM 470 OG1 THR A 28 67.835 10.337 -1.018 1.00 15.00 O ATOM 471 CG2 THR A 28 68.650 11.511 0.925 1.00 15.00 C ATOM 0 H THR A 28 66.666 8.470 0.387 1.00 15.00 H new ATOM 0 HA THR A 28 66.151 11.067 1.800 1.00 15.00 H new ATOM 0 HB THR A 28 67.058 12.133 -0.381 1.00 15.00 H new ATOM 0 HG1 THR A 28 68.533 10.769 -1.553 1.00 15.00 H new ATOM 0 HG21 THR A 28 69.427 11.990 0.329 1.00 15.00 H new ATOM 0 HG22 THR A 28 68.348 12.179 1.732 1.00 15.00 H new ATOM 0 HG23 THR A 28 69.037 10.584 1.347 1.00 15.00 H new ATOM 479 N ILE A 29 64.144 11.413 0.373 1.00 15.00 N ATOM 480 CA ILE A 29 62.825 11.442 -0.337 1.00 15.00 C ATOM 481 C ILE A 29 62.688 12.755 -1.119 1.00 15.00 C ATOM 482 O ILE A 29 62.854 13.829 -0.573 1.00 15.00 O ATOM 483 CB ILE A 29 61.760 11.358 0.771 1.00 15.00 C ATOM 484 CG1 ILE A 29 61.953 10.076 1.594 1.00 15.00 C ATOM 485 CG2 ILE A 29 60.361 11.339 0.144 1.00 15.00 C ATOM 486 CD1 ILE A 29 61.101 10.148 2.867 1.00 15.00 C ATOM 0 H ILE A 29 64.276 12.152 1.063 1.00 15.00 H new ATOM 0 HA ILE A 29 62.721 10.625 -1.052 1.00 15.00 H new ATOM 0 HB ILE A 29 61.864 12.227 1.421 1.00 15.00 H new ATOM 0 HG12 ILE A 29 61.668 9.206 1.003 1.00 15.00 H new ATOM 0 HG13 ILE A 29 63.004 9.954 1.854 1.00 15.00 H new ATOM 0 HG21 ILE A 29 59.610 11.279 0.932 1.00 15.00 H new ATOM 0 HG22 ILE A 29 60.209 12.250 -0.434 1.00 15.00 H new ATOM 0 HG23 ILE A 29 60.268 10.474 -0.512 1.00 15.00 H new ATOM 0 HD11 ILE A 29 61.239 9.237 3.450 1.00 15.00 H new ATOM 0 HD12 ILE A 29 61.407 11.009 3.461 1.00 15.00 H new ATOM 0 HD13 ILE A 29 60.050 10.249 2.596 1.00 15.00 H new ATOM 498 N ASP A 30 62.386 12.670 -2.392 1.00 15.00 N ATOM 499 CA ASP A 30 62.167 13.905 -3.205 1.00 15.00 C ATOM 500 C ASP A 30 60.696 14.003 -3.615 1.00 15.00 C ATOM 501 O ASP A 30 60.271 13.386 -4.575 1.00 15.00 O ATOM 502 CB ASP A 30 63.059 13.734 -4.437 1.00 15.00 C ATOM 503 CG ASP A 30 63.109 15.048 -5.218 1.00 15.00 C ATOM 504 OD1 ASP A 30 62.290 15.218 -6.106 1.00 15.00 O ATOM 505 OD2 ASP A 30 63.965 15.862 -4.914 1.00 15.00 O ATOM 0 H ASP A 30 62.282 11.794 -2.904 1.00 15.00 H new ATOM 0 HA ASP A 30 62.408 14.814 -2.655 1.00 15.00 H new ATOM 0 HB2 ASP A 30 64.064 13.441 -4.133 1.00 15.00 H new ATOM 0 HB3 ASP A 30 62.672 12.936 -5.071 1.00 15.00 H new ATOM 510 N THR A 31 59.920 14.772 -2.892 1.00 15.00 N ATOM 511 CA THR A 31 58.452 14.855 -3.180 1.00 15.00 C ATOM 512 C THR A 31 58.205 15.603 -4.493 1.00 15.00 C ATOM 513 O THR A 31 57.314 15.265 -5.249 1.00 15.00 O ATOM 514 CB THR A 31 57.847 15.625 -2.002 1.00 15.00 C ATOM 515 OG1 THR A 31 58.294 15.050 -0.783 1.00 15.00 O ATOM 516 CG2 THR A 31 56.320 15.554 -2.071 1.00 15.00 C ATOM 0 H THR A 31 60.239 15.348 -2.113 1.00 15.00 H new ATOM 0 HA THR A 31 58.005 13.867 -3.289 1.00 15.00 H new ATOM 0 HB THR A 31 58.162 16.667 -2.050 1.00 15.00 H new ATOM 0 HG1 THR A 31 57.909 15.543 -0.028 1.00 15.00 H new ATOM 0 HG21 THR A 31 55.892 16.102 -1.232 1.00 15.00 H new ATOM 0 HG22 THR A 31 55.977 15.996 -3.006 1.00 15.00 H new ATOM 0 HG23 THR A 31 56.002 14.513 -2.024 1.00 15.00 H new ATOM 524 N GLU A 32 58.995 16.613 -4.771 1.00 15.00 N ATOM 525 CA GLU A 32 58.701 17.516 -5.936 1.00 15.00 C ATOM 526 C GLU A 32 58.663 16.727 -7.252 1.00 15.00 C ATOM 527 O GLU A 32 57.966 17.096 -8.180 1.00 15.00 O ATOM 528 CB GLU A 32 59.844 18.534 -5.960 1.00 15.00 C ATOM 529 CG GLU A 32 59.762 19.427 -4.721 1.00 15.00 C ATOM 530 CD GLU A 32 60.850 20.500 -4.791 1.00 15.00 C ATOM 531 OE1 GLU A 32 60.516 21.636 -5.082 1.00 15.00 O ATOM 532 OE2 GLU A 32 61.999 20.166 -4.553 1.00 15.00 O ATOM 0 H GLU A 32 59.833 16.854 -4.242 1.00 15.00 H new ATOM 0 HA GLU A 32 57.727 17.994 -5.832 1.00 15.00 H new ATOM 0 HB2 GLU A 32 60.804 18.018 -5.986 1.00 15.00 H new ATOM 0 HB3 GLU A 32 59.785 19.141 -6.863 1.00 15.00 H new ATOM 0 HG2 GLU A 32 58.779 19.894 -4.661 1.00 15.00 H new ATOM 0 HG3 GLU A 32 59.885 18.828 -3.819 1.00 15.00 H new ATOM 539 N ASN A 33 59.405 15.650 -7.337 1.00 15.00 N ATOM 540 CA ASN A 33 59.465 14.872 -8.617 1.00 15.00 C ATOM 541 C ASN A 33 58.893 13.456 -8.444 1.00 15.00 C ATOM 542 O ASN A 33 59.084 12.605 -9.293 1.00 15.00 O ATOM 543 CB ASN A 33 60.953 14.804 -8.965 1.00 15.00 C ATOM 544 CG ASN A 33 61.467 16.202 -9.328 1.00 15.00 C ATOM 545 OD1 ASN A 33 60.973 17.195 -8.832 1.00 15.00 O ATOM 546 ND2 ASN A 33 62.450 16.319 -10.179 1.00 15.00 N ATOM 0 H ASN A 33 59.972 15.275 -6.577 1.00 15.00 H new ATOM 0 HA ASN A 33 58.871 15.345 -9.399 1.00 15.00 H new ATOM 0 HB2 ASN A 33 61.516 14.408 -8.120 1.00 15.00 H new ATOM 0 HB3 ASN A 33 61.110 14.121 -9.800 1.00 15.00 H new ATOM 0 HD21 ASN A 33 62.803 17.243 -10.427 1.00 15.00 H new ATOM 0 HD22 ASN A 33 62.865 15.486 -10.596 1.00 15.00 H new ATOM 553 N SER A 34 58.189 13.192 -7.359 1.00 15.00 N ATOM 554 CA SER A 34 57.663 11.807 -7.087 1.00 15.00 C ATOM 555 C SER A 34 58.774 10.750 -7.233 1.00 15.00 C ATOM 556 O SER A 34 58.593 9.729 -7.874 1.00 15.00 O ATOM 557 CB SER A 34 56.559 11.584 -8.126 1.00 15.00 C ATOM 558 OG SER A 34 55.806 10.431 -7.774 1.00 15.00 O ATOM 0 H SER A 34 57.955 13.883 -6.646 1.00 15.00 H new ATOM 0 HA SER A 34 57.289 11.713 -6.068 1.00 15.00 H new ATOM 0 HB2 SER A 34 55.908 12.457 -8.174 1.00 15.00 H new ATOM 0 HB3 SER A 34 56.996 11.458 -9.116 1.00 15.00 H new ATOM 0 HG SER A 34 56.403 9.656 -7.713 1.00 15.00 H new ATOM 564 N THR A 35 59.918 10.993 -6.639 1.00 15.00 N ATOM 565 CA THR A 35 61.058 10.030 -6.763 1.00 15.00 C ATOM 566 C THR A 35 61.656 9.724 -5.386 1.00 15.00 C ATOM 567 O THR A 35 61.632 10.551 -4.493 1.00 15.00 O ATOM 568 CB THR A 35 62.087 10.739 -7.647 1.00 15.00 C ATOM 569 OG1 THR A 35 62.296 12.057 -7.160 1.00 15.00 O ATOM 570 CG2 THR A 35 61.585 10.800 -9.094 1.00 15.00 C ATOM 0 H THR A 35 60.112 11.819 -6.072 1.00 15.00 H new ATOM 0 HA THR A 35 60.741 9.077 -7.188 1.00 15.00 H new ATOM 0 HB THR A 35 63.025 10.184 -7.621 1.00 15.00 H new ATOM 0 HG1 THR A 35 62.956 12.513 -7.723 1.00 15.00 H new ATOM 0 HG21 THR A 35 62.324 11.306 -9.715 1.00 15.00 H new ATOM 0 HG22 THR A 35 61.429 9.788 -9.468 1.00 15.00 H new ATOM 0 HG23 THR A 35 60.644 11.349 -9.130 1.00 15.00 H new ATOM 578 N VAL A 36 62.193 8.541 -5.214 1.00 15.00 N ATOM 579 CA VAL A 36 62.806 8.168 -3.900 1.00 15.00 C ATOM 580 C VAL A 36 64.174 7.514 -4.134 1.00 15.00 C ATOM 581 O VAL A 36 64.355 6.759 -5.071 1.00 15.00 O ATOM 582 CB VAL A 36 61.823 7.172 -3.263 1.00 15.00 C ATOM 583 CG1 VAL A 36 62.344 6.730 -1.891 1.00 15.00 C ATOM 584 CG2 VAL A 36 60.453 7.836 -3.083 1.00 15.00 C ATOM 0 H VAL A 36 62.234 7.815 -5.929 1.00 15.00 H new ATOM 0 HA VAL A 36 62.970 9.031 -3.255 1.00 15.00 H new ATOM 0 HB VAL A 36 61.729 6.305 -3.917 1.00 15.00 H new ATOM 0 HG11 VAL A 36 61.643 6.025 -1.445 1.00 15.00 H new ATOM 0 HG12 VAL A 36 63.316 6.251 -2.008 1.00 15.00 H new ATOM 0 HG13 VAL A 36 62.445 7.600 -1.242 1.00 15.00 H new ATOM 0 HG21 VAL A 36 59.761 7.125 -2.631 1.00 15.00 H new ATOM 0 HG22 VAL A 36 60.553 8.707 -2.435 1.00 15.00 H new ATOM 0 HG23 VAL A 36 60.070 8.148 -4.054 1.00 15.00 H new ATOM 594 N ALA A 37 65.132 7.802 -3.287 1.00 15.00 N ATOM 595 CA ALA A 37 66.485 7.180 -3.430 1.00 15.00 C ATOM 596 C ALA A 37 66.758 6.241 -2.253 1.00 15.00 C ATOM 597 O ALA A 37 66.600 6.615 -1.103 1.00 15.00 O ATOM 598 CB ALA A 37 67.473 8.351 -3.426 1.00 15.00 C ATOM 0 H ALA A 37 65.034 8.443 -2.500 1.00 15.00 H new ATOM 0 HA ALA A 37 66.570 6.586 -4.340 1.00 15.00 H new ATOM 0 HB1 ALA A 37 68.489 7.970 -3.528 1.00 15.00 H new ATOM 0 HB2 ALA A 37 67.250 9.018 -4.259 1.00 15.00 H new ATOM 0 HB3 ALA A 37 67.383 8.900 -2.488 1.00 15.00 H new ATOM 604 N LEU A 38 67.172 5.028 -2.537 1.00 15.00 N ATOM 605 CA LEU A 38 67.433 4.036 -1.452 1.00 15.00 C ATOM 606 C LEU A 38 68.912 3.647 -1.449 1.00 15.00 C ATOM 607 O LEU A 38 69.511 3.462 -2.492 1.00 15.00 O ATOM 608 CB LEU A 38 66.570 2.821 -1.803 1.00 15.00 C ATOM 609 CG LEU A 38 65.128 3.057 -1.349 1.00 15.00 C ATOM 610 CD1 LEU A 38 64.204 2.058 -2.050 1.00 15.00 C ATOM 611 CD2 LEU A 38 65.031 2.856 0.164 1.00 15.00 C ATOM 0 H LEU A 38 67.341 4.683 -3.482 1.00 15.00 H new ATOM 0 HA LEU A 38 67.196 4.433 -0.465 1.00 15.00 H new ATOM 0 HB2 LEU A 38 66.597 2.643 -2.878 1.00 15.00 H new ATOM 0 HB3 LEU A 38 66.970 1.929 -1.322 1.00 15.00 H new ATOM 0 HG LEU A 38 64.830 4.074 -1.603 1.00 15.00 H new ATOM 0 HD11 LEU A 38 63.176 2.225 -1.728 1.00 15.00 H new ATOM 0 HD12 LEU A 38 64.272 2.195 -3.129 1.00 15.00 H new ATOM 0 HD13 LEU A 38 64.504 1.042 -1.793 1.00 15.00 H new ATOM 0 HD21 LEU A 38 64.004 3.024 0.488 1.00 15.00 H new ATOM 0 HD22 LEU A 38 65.329 1.838 0.416 1.00 15.00 H new ATOM 0 HD23 LEU A 38 65.691 3.562 0.668 1.00 15.00 H new ATOM 623 N ALA A 39 69.501 3.525 -0.285 1.00 15.00 N ATOM 624 CA ALA A 39 70.944 3.140 -0.203 1.00 15.00 C ATOM 625 C ALA A 39 71.082 1.787 0.498 1.00 15.00 C ATOM 626 O ALA A 39 70.168 1.329 1.160 1.00 15.00 O ATOM 627 CB ALA A 39 71.603 4.245 0.623 1.00 15.00 C ATOM 0 H ALA A 39 69.043 3.676 0.614 1.00 15.00 H new ATOM 0 HA ALA A 39 71.406 3.040 -1.185 1.00 15.00 H new ATOM 0 HB1 ALA A 39 72.667 4.035 0.729 1.00 15.00 H new ATOM 0 HB2 ALA A 39 71.471 5.203 0.120 1.00 15.00 H new ATOM 0 HB3 ALA A 39 71.141 4.286 1.610 1.00 15.00 H new ATOM 633 N LYS A 40 72.224 1.144 0.355 1.00 15.00 N ATOM 634 CA LYS A 40 72.433 -0.218 0.963 1.00 15.00 C ATOM 635 C LYS A 40 71.289 -1.165 0.565 1.00 15.00 C ATOM 636 O LYS A 40 70.592 -1.707 1.407 1.00 15.00 O ATOM 637 CB LYS A 40 72.463 0.007 2.480 1.00 15.00 C ATOM 638 CG LYS A 40 73.693 0.837 2.853 1.00 15.00 C ATOM 639 CD LYS A 40 73.781 0.967 4.375 1.00 15.00 C ATOM 640 CE LYS A 40 74.939 1.899 4.742 1.00 15.00 C ATOM 641 NZ LYS A 40 74.580 2.449 6.079 1.00 15.00 N ATOM 0 H LYS A 40 73.026 1.507 -0.161 1.00 15.00 H new ATOM 0 HA LYS A 40 73.355 -0.683 0.614 1.00 15.00 H new ATOM 0 HB2 LYS A 40 71.556 0.520 2.800 1.00 15.00 H new ATOM 0 HB3 LYS A 40 72.487 -0.951 2.999 1.00 15.00 H new ATOM 0 HG2 LYS A 40 74.595 0.364 2.465 1.00 15.00 H new ATOM 0 HG3 LYS A 40 73.630 1.825 2.396 1.00 15.00 H new ATOM 0 HD2 LYS A 40 72.845 1.359 4.772 1.00 15.00 H new ATOM 0 HD3 LYS A 40 73.932 -0.014 4.826 1.00 15.00 H new ATOM 0 HE2 LYS A 40 75.885 1.358 4.778 1.00 15.00 H new ATOM 0 HE3 LYS A 40 75.054 2.694 4.006 1.00 15.00 H new ATOM 0 HZ1 LYS A 40 75.327 3.098 6.399 1.00 15.00 H new ATOM 0 HZ2 LYS A 40 73.679 2.964 6.012 1.00 15.00 H new ATOM 0 HZ3 LYS A 40 74.483 1.669 6.761 1.00 15.00 H new ATOM 655 N VAL A 41 71.096 -1.363 -0.717 1.00 15.00 N ATOM 656 CA VAL A 41 69.919 -2.151 -1.194 1.00 15.00 C ATOM 657 C VAL A 41 70.385 -3.363 -2.013 1.00 15.00 C ATOM 658 O VAL A 41 71.409 -3.321 -2.670 1.00 15.00 O ATOM 659 CB VAL A 41 69.100 -1.166 -2.051 1.00 15.00 C ATOM 660 CG1 VAL A 41 69.894 -0.745 -3.295 1.00 15.00 C ATOM 661 CG2 VAL A 41 67.788 -1.828 -2.487 1.00 15.00 C ATOM 0 H VAL A 41 71.706 -1.011 -1.455 1.00 15.00 H new ATOM 0 HA VAL A 41 69.323 -2.552 -0.374 1.00 15.00 H new ATOM 0 HB VAL A 41 68.886 -0.281 -1.452 1.00 15.00 H new ATOM 0 HG11 VAL A 41 69.300 -0.050 -3.888 1.00 15.00 H new ATOM 0 HG12 VAL A 41 70.821 -0.260 -2.988 1.00 15.00 H new ATOM 0 HG13 VAL A 41 70.126 -1.626 -3.894 1.00 15.00 H new ATOM 0 HG21 VAL A 41 67.211 -1.129 -3.093 1.00 15.00 H new ATOM 0 HG22 VAL A 41 68.008 -2.720 -3.073 1.00 15.00 H new ATOM 0 HG23 VAL A 41 67.210 -2.106 -1.606 1.00 15.00 H new ATOM 671 N ARG A 42 69.636 -4.435 -1.971 1.00 15.00 N ATOM 672 CA ARG A 42 69.995 -5.646 -2.773 1.00 15.00 C ATOM 673 C ARG A 42 68.736 -6.254 -3.403 1.00 15.00 C ATOM 674 O ARG A 42 67.642 -6.092 -2.895 1.00 15.00 O ATOM 675 CB ARG A 42 70.643 -6.622 -1.777 1.00 15.00 C ATOM 676 CG ARG A 42 69.667 -6.962 -0.641 1.00 15.00 C ATOM 677 CD ARG A 42 70.403 -7.759 0.440 1.00 15.00 C ATOM 678 NE ARG A 42 69.348 -8.129 1.437 1.00 15.00 N ATOM 679 CZ ARG A 42 68.876 -7.251 2.302 1.00 15.00 C ATOM 680 NH1 ARG A 42 69.294 -6.005 2.320 1.00 15.00 N ATOM 681 NH2 ARG A 42 67.967 -7.629 3.159 1.00 15.00 N ATOM 0 H ARG A 42 68.787 -4.525 -1.413 1.00 15.00 H new ATOM 0 HA ARG A 42 70.673 -5.411 -3.593 1.00 15.00 H new ATOM 0 HB2 ARG A 42 70.940 -7.534 -2.294 1.00 15.00 H new ATOM 0 HB3 ARG A 42 71.550 -6.180 -1.364 1.00 15.00 H new ATOM 0 HG2 ARG A 42 69.253 -6.047 -0.216 1.00 15.00 H new ATOM 0 HG3 ARG A 42 68.829 -7.541 -1.028 1.00 15.00 H new ATOM 0 HD2 ARG A 42 70.878 -8.646 0.021 1.00 15.00 H new ATOM 0 HD3 ARG A 42 71.190 -7.163 0.902 1.00 15.00 H new ATOM 0 HE ARG A 42 68.986 -9.082 1.448 1.00 15.00 H new ATOM 0 HH11 ARG A 42 70.001 -5.695 1.654 1.00 15.00 H new ATOM 0 HH12 ARG A 42 68.911 -5.348 3.000 1.00 15.00 H new ATOM 0 HH21 ARG A 42 67.631 -8.592 3.154 1.00 15.00 H new ATOM 0 HH22 ARG A 42 67.593 -6.961 3.833 1.00 15.00 H new ATOM 695 N SER A 43 68.891 -6.948 -4.504 1.00 15.00 N ATOM 696 CA SER A 43 67.717 -7.595 -5.163 1.00 15.00 C ATOM 697 C SER A 43 67.690 -9.090 -4.827 1.00 15.00 C ATOM 698 O SER A 43 68.693 -9.773 -4.936 1.00 15.00 O ATOM 699 CB SER A 43 67.936 -7.369 -6.662 1.00 15.00 C ATOM 700 OG SER A 43 68.963 -8.236 -7.130 1.00 15.00 O ATOM 0 H SER A 43 69.784 -7.094 -4.975 1.00 15.00 H new ATOM 0 HA SER A 43 66.765 -7.182 -4.830 1.00 15.00 H new ATOM 0 HB2 SER A 43 67.011 -7.557 -7.207 1.00 15.00 H new ATOM 0 HB3 SER A 43 68.210 -6.330 -6.847 1.00 15.00 H new ATOM 0 HG SER A 43 69.314 -8.762 -6.381 1.00 15.00 H new ATOM 706 N PHE A 44 66.552 -9.600 -4.420 1.00 15.00 N ATOM 707 CA PHE A 44 66.489 -11.022 -3.952 1.00 15.00 C ATOM 708 C PHE A 44 66.656 -11.984 -5.132 1.00 15.00 C ATOM 709 O PHE A 44 67.324 -12.996 -5.023 1.00 15.00 O ATOM 710 CB PHE A 44 65.103 -11.184 -3.321 1.00 15.00 C ATOM 711 CG PHE A 44 65.058 -10.797 -1.862 1.00 15.00 C ATOM 712 CD1 PHE A 44 65.459 -11.725 -0.871 1.00 15.00 C ATOM 713 CD2 PHE A 44 64.617 -9.506 -1.485 1.00 15.00 C ATOM 714 CE1 PHE A 44 65.418 -11.363 0.498 1.00 15.00 C ATOM 715 CE2 PHE A 44 64.576 -9.142 -0.117 1.00 15.00 C ATOM 716 CZ PHE A 44 64.976 -10.072 0.874 1.00 15.00 C ATOM 0 H PHE A 44 65.666 -9.095 -4.391 1.00 15.00 H new ATOM 0 HA PHE A 44 67.285 -11.249 -3.243 1.00 15.00 H new ATOM 0 HB2 PHE A 44 64.387 -10.574 -3.873 1.00 15.00 H new ATOM 0 HB3 PHE A 44 64.784 -12.221 -3.424 1.00 15.00 H new ATOM 0 HD1 PHE A 44 65.796 -12.710 -1.159 1.00 15.00 H new ATOM 0 HD2 PHE A 44 64.312 -8.798 -2.241 1.00 15.00 H new ATOM 0 HE1 PHE A 44 65.724 -12.071 1.254 1.00 15.00 H new ATOM 0 HE2 PHE A 44 64.240 -8.157 0.170 1.00 15.00 H new ATOM 0 HZ PHE A 44 64.944 -9.796 1.918 1.00 15.00 H new ATOM 984 N PHE A 62 74.264 -2.871 -3.882 1.00 15.00 N ATOM 985 CA PHE A 62 74.336 -1.545 -4.564 1.00 15.00 C ATOM 986 C PHE A 62 74.331 -0.419 -3.527 1.00 15.00 C ATOM 987 O PHE A 62 73.475 -0.369 -2.661 1.00 15.00 O ATOM 988 CB PHE A 62 73.082 -1.482 -5.432 1.00 15.00 C ATOM 989 CG PHE A 62 73.087 -2.476 -6.570 1.00 15.00 C ATOM 990 CD1 PHE A 62 72.545 -3.772 -6.380 1.00 15.00 C ATOM 991 CD2 PHE A 62 73.631 -2.113 -7.824 1.00 15.00 C ATOM 992 CE1 PHE A 62 72.549 -4.703 -7.447 1.00 15.00 C ATOM 993 CE2 PHE A 62 73.635 -3.044 -8.891 1.00 15.00 C ATOM 994 CZ PHE A 62 73.094 -4.339 -8.702 1.00 15.00 C ATOM 0 HA PHE A 62 75.246 -1.429 -5.153 1.00 15.00 H new ATOM 0 HB2 PHE A 62 72.207 -1.662 -4.807 1.00 15.00 H new ATOM 0 HB3 PHE A 62 72.982 -0.476 -5.839 1.00 15.00 H new ATOM 0 HD1 PHE A 62 72.129 -4.049 -5.422 1.00 15.00 H new ATOM 0 HD2 PHE A 62 74.044 -1.125 -7.968 1.00 15.00 H new ATOM 0 HE1 PHE A 62 72.136 -5.691 -7.303 1.00 15.00 H new ATOM 0 HE2 PHE A 62 74.050 -2.767 -9.849 1.00 15.00 H new ATOM 0 HZ PHE A 62 73.097 -5.049 -9.516 1.00 15.00 H new ATOM 1004 N GLU A 63 75.280 0.481 -3.612 1.00 15.00 N ATOM 1005 CA GLU A 63 75.373 1.585 -2.601 1.00 15.00 C ATOM 1006 C GLU A 63 74.191 2.549 -2.746 1.00 15.00 C ATOM 1007 O GLU A 63 73.603 2.966 -1.764 1.00 15.00 O ATOM 1008 CB GLU A 63 76.690 2.307 -2.906 1.00 15.00 C ATOM 1009 CG GLU A 63 77.869 1.376 -2.604 1.00 15.00 C ATOM 1010 CD GLU A 63 78.003 1.190 -1.091 1.00 15.00 C ATOM 1011 OE1 GLU A 63 77.905 2.177 -0.380 1.00 15.00 O ATOM 1012 OE2 GLU A 63 78.204 0.062 -0.670 1.00 15.00 O ATOM 0 H GLU A 63 75.996 0.500 -4.338 1.00 15.00 H new ATOM 0 HA GLU A 63 75.346 1.201 -1.581 1.00 15.00 H new ATOM 0 HB2 GLU A 63 76.714 2.614 -3.952 1.00 15.00 H new ATOM 0 HB3 GLU A 63 76.767 3.214 -2.306 1.00 15.00 H new ATOM 0 HG2 GLU A 63 77.716 0.411 -3.087 1.00 15.00 H new ATOM 0 HG3 GLU A 63 78.789 1.794 -3.012 1.00 15.00 H new ATOM 1019 N TYR A 64 73.841 2.906 -3.958 1.00 15.00 N ATOM 1020 CA TYR A 64 72.743 3.900 -4.165 1.00 15.00 C ATOM 1021 C TYR A 64 72.016 3.633 -5.487 1.00 15.00 C ATOM 1022 O TYR A 64 72.616 3.630 -6.545 1.00 15.00 O ATOM 1023 CB TYR A 64 73.452 5.255 -4.210 1.00 15.00 C ATOM 1024 CG TYR A 64 72.522 6.437 -4.054 1.00 15.00 C ATOM 1025 CD1 TYR A 64 71.562 6.723 -5.055 1.00 15.00 C ATOM 1026 CD2 TYR A 64 72.617 7.264 -2.908 1.00 15.00 C ATOM 1027 CE1 TYR A 64 70.698 7.835 -4.910 1.00 15.00 C ATOM 1028 CE2 TYR A 64 71.752 8.375 -2.764 1.00 15.00 C ATOM 1029 CZ TYR A 64 70.792 8.661 -3.765 1.00 15.00 C ATOM 1030 OH TYR A 64 69.950 9.744 -3.624 1.00 15.00 O ATOM 0 H TYR A 64 74.269 2.551 -4.813 1.00 15.00 H new ATOM 0 HA TYR A 64 71.989 3.851 -3.379 1.00 15.00 H new ATOM 0 HB2 TYR A 64 74.202 5.288 -3.420 1.00 15.00 H new ATOM 0 HB3 TYR A 64 73.983 5.345 -5.158 1.00 15.00 H new ATOM 0 HD1 TYR A 64 71.489 6.093 -5.929 1.00 15.00 H new ATOM 0 HD2 TYR A 64 73.349 7.047 -2.144 1.00 15.00 H new ATOM 0 HE1 TYR A 64 69.966 8.053 -5.674 1.00 15.00 H new ATOM 0 HE2 TYR A 64 71.824 9.005 -1.890 1.00 15.00 H new ATOM 0 HH TYR A 64 70.147 10.204 -2.781 1.00 15.00 H new ATOM 1040 N ILE A 65 70.724 3.408 -5.426 1.00 15.00 N ATOM 1041 CA ILE A 65 69.915 3.274 -6.681 1.00 15.00 C ATOM 1042 C ILE A 65 68.670 4.168 -6.588 1.00 15.00 C ATOM 1043 O ILE A 65 68.121 4.370 -5.519 1.00 15.00 O ATOM 1044 CB ILE A 65 69.527 1.785 -6.770 1.00 15.00 C ATOM 1045 CG1 ILE A 65 70.801 0.931 -6.862 1.00 15.00 C ATOM 1046 CG2 ILE A 65 68.669 1.540 -8.022 1.00 15.00 C ATOM 1047 CD1 ILE A 65 70.439 -0.538 -7.112 1.00 15.00 C ATOM 0 H ILE A 65 70.194 3.311 -4.560 1.00 15.00 H new ATOM 0 HA ILE A 65 70.467 3.585 -7.568 1.00 15.00 H new ATOM 0 HB ILE A 65 68.958 1.512 -5.881 1.00 15.00 H new ATOM 0 HG12 ILE A 65 71.436 1.299 -7.668 1.00 15.00 H new ATOM 0 HG13 ILE A 65 71.374 1.020 -5.939 1.00 15.00 H new ATOM 0 HG21 ILE A 65 68.399 0.485 -8.077 1.00 15.00 H new ATOM 0 HG22 ILE A 65 67.763 2.144 -7.966 1.00 15.00 H new ATOM 0 HG23 ILE A 65 69.235 1.817 -8.911 1.00 15.00 H new ATOM 0 HD11 ILE A 65 71.351 -1.132 -7.175 1.00 15.00 H new ATOM 0 HD12 ILE A 65 69.823 -0.906 -6.292 1.00 15.00 H new ATOM 0 HD13 ILE A 65 69.886 -0.622 -8.047 1.00 15.00 H new ATOM 1059 N ILE A 66 68.229 4.703 -7.702 1.00 15.00 N ATOM 1060 CA ILE A 66 67.050 5.624 -7.690 1.00 15.00 C ATOM 1061 C ILE A 66 65.846 4.941 -8.352 1.00 15.00 C ATOM 1062 O ILE A 66 65.975 4.297 -9.377 1.00 15.00 O ATOM 1063 CB ILE A 66 67.489 6.858 -8.497 1.00 15.00 C ATOM 1064 CG1 ILE A 66 68.700 7.517 -7.825 1.00 15.00 C ATOM 1065 CG2 ILE A 66 66.345 7.877 -8.563 1.00 15.00 C ATOM 1066 CD1 ILE A 66 69.338 8.519 -8.788 1.00 15.00 C ATOM 0 H ILE A 66 68.637 4.540 -8.622 1.00 15.00 H new ATOM 0 HA ILE A 66 66.747 5.895 -6.679 1.00 15.00 H new ATOM 0 HB ILE A 66 67.754 6.538 -9.505 1.00 15.00 H new ATOM 0 HG12 ILE A 66 68.391 8.023 -6.910 1.00 15.00 H new ATOM 0 HG13 ILE A 66 69.428 6.758 -7.539 1.00 15.00 H new ATOM 0 HG21 ILE A 66 66.665 8.747 -9.136 1.00 15.00 H new ATOM 0 HG22 ILE A 66 65.480 7.422 -9.046 1.00 15.00 H new ATOM 0 HG23 ILE A 66 66.075 8.187 -7.553 1.00 15.00 H new ATOM 0 HD11 ILE A 66 70.198 8.987 -8.309 1.00 15.00 H new ATOM 0 HD12 ILE A 66 69.662 8.001 -9.690 1.00 15.00 H new ATOM 0 HD13 ILE A 66 68.609 9.285 -9.052 1.00 15.00 H new ATOM 1078 N PHE A 67 64.681 5.082 -7.768 1.00 15.00 N ATOM 1079 CA PHE A 67 63.443 4.525 -8.394 1.00 15.00 C ATOM 1080 C PHE A 67 62.364 5.609 -8.466 1.00 15.00 C ATOM 1081 O PHE A 67 62.249 6.439 -7.583 1.00 15.00 O ATOM 1082 CB PHE A 67 63.004 3.392 -7.468 1.00 15.00 C ATOM 1083 CG PHE A 67 63.939 2.205 -7.482 1.00 15.00 C ATOM 1084 CD1 PHE A 67 64.025 1.385 -8.633 1.00 15.00 C ATOM 1085 CD2 PHE A 67 64.729 1.914 -6.344 1.00 15.00 C ATOM 1086 CE1 PHE A 67 64.901 0.273 -8.645 1.00 15.00 C ATOM 1087 CE2 PHE A 67 65.606 0.801 -6.357 1.00 15.00 C ATOM 1088 CZ PHE A 67 65.692 -0.020 -7.507 1.00 15.00 C ATOM 0 H PHE A 67 64.535 5.562 -6.880 1.00 15.00 H new ATOM 0 HA PHE A 67 63.614 4.172 -9.411 1.00 15.00 H new ATOM 0 HB2 PHE A 67 62.930 3.774 -6.450 1.00 15.00 H new ATOM 0 HB3 PHE A 67 62.007 3.062 -7.758 1.00 15.00 H new ATOM 0 HD1 PHE A 67 63.423 1.608 -9.501 1.00 15.00 H new ATOM 0 HD2 PHE A 67 64.663 2.540 -5.466 1.00 15.00 H new ATOM 0 HE1 PHE A 67 64.966 -0.353 -9.523 1.00 15.00 H new ATOM 0 HE2 PHE A 67 66.209 0.579 -5.489 1.00 15.00 H new ATOM 0 HZ PHE A 67 66.360 -0.869 -7.517 1.00 15.00 H new ATOM 1098 N ARG A 68 61.574 5.605 -9.513 1.00 15.00 N ATOM 1099 CA ARG A 68 60.499 6.636 -9.655 1.00 15.00 C ATOM 1100 C ARG A 68 59.124 5.992 -9.461 1.00 15.00 C ATOM 1101 O ARG A 68 58.939 4.817 -9.716 1.00 15.00 O ATOM 1102 CB ARG A 68 60.644 7.173 -11.081 1.00 15.00 C ATOM 1103 CG ARG A 68 61.972 7.923 -11.214 1.00 15.00 C ATOM 1104 CD ARG A 68 62.050 8.587 -12.594 1.00 15.00 C ATOM 1105 NE ARG A 68 62.111 7.458 -13.579 1.00 15.00 N ATOM 1106 CZ ARG A 68 61.853 7.647 -14.859 1.00 15.00 C ATOM 1107 NH1 ARG A 68 61.538 8.831 -15.331 1.00 15.00 N ATOM 1108 NH2 ARG A 68 61.915 6.631 -15.677 1.00 15.00 N ATOM 0 H ARG A 68 61.628 4.931 -10.276 1.00 15.00 H new ATOM 0 HA ARG A 68 60.588 7.429 -8.913 1.00 15.00 H new ATOM 0 HB2 ARG A 68 60.606 6.351 -11.796 1.00 15.00 H new ATOM 0 HB3 ARG A 68 59.814 7.839 -11.316 1.00 15.00 H new ATOM 0 HG2 ARG A 68 62.056 8.677 -10.431 1.00 15.00 H new ATOM 0 HG3 ARG A 68 62.806 7.233 -11.083 1.00 15.00 H new ATOM 0 HD2 ARG A 68 61.181 9.219 -12.775 1.00 15.00 H new ATOM 0 HD3 ARG A 68 62.930 9.225 -12.673 1.00 15.00 H new ATOM 0 HE ARG A 68 62.357 6.524 -13.252 1.00 15.00 H new ATOM 0 HH11 ARG A 68 61.488 9.633 -14.703 1.00 15.00 H new ATOM 0 HH12 ARG A 68 61.343 8.948 -16.325 1.00 15.00 H new ATOM 0 HH21 ARG A 68 62.160 5.706 -15.324 1.00 15.00 H new ATOM 0 HH22 ARG A 68 61.718 6.762 -16.669 1.00 15.00 H new ATOM 1122 N GLY A 69 58.155 6.757 -9.012 1.00 15.00 N ATOM 1123 CA GLY A 69 56.786 6.197 -8.765 1.00 15.00 C ATOM 1124 C GLY A 69 56.222 5.557 -10.044 1.00 15.00 C ATOM 1125 O GLY A 69 55.392 4.668 -9.981 1.00 15.00 O ATOM 0 H GLY A 69 58.255 7.751 -8.805 1.00 15.00 H new ATOM 0 HA2 GLY A 69 56.830 5.453 -7.969 1.00 15.00 H new ATOM 0 HA3 GLY A 69 56.119 6.989 -8.424 1.00 15.00 H new ATOM 1129 N SER A 70 56.665 6.001 -11.198 1.00 15.00 N ATOM 1130 CA SER A 70 56.129 5.442 -12.483 1.00 15.00 C ATOM 1131 C SER A 70 56.521 3.967 -12.640 1.00 15.00 C ATOM 1132 O SER A 70 55.701 3.138 -12.990 1.00 15.00 O ATOM 1133 CB SER A 70 56.767 6.282 -13.591 1.00 15.00 C ATOM 1134 OG SER A 70 56.501 7.658 -13.350 1.00 15.00 O ATOM 0 H SER A 70 57.374 6.726 -11.306 1.00 15.00 H new ATOM 0 HA SER A 70 55.040 5.484 -12.515 1.00 15.00 H new ATOM 0 HB2 SER A 70 57.843 6.108 -13.622 1.00 15.00 H new ATOM 0 HB3 SER A 70 56.368 5.987 -14.562 1.00 15.00 H new ATOM 0 HG SER A 70 56.910 8.199 -14.057 1.00 15.00 H new ATOM 1140 N ASP A 71 57.765 3.640 -12.383 1.00 15.00 N ATOM 1141 CA ASP A 71 58.231 2.228 -12.581 1.00 15.00 C ATOM 1142 C ASP A 71 57.859 1.357 -11.374 1.00 15.00 C ATOM 1143 O ASP A 71 57.616 0.172 -11.508 1.00 15.00 O ATOM 1144 CB ASP A 71 59.758 2.312 -12.754 1.00 15.00 C ATOM 1145 CG ASP A 71 60.412 2.898 -11.496 1.00 15.00 C ATOM 1146 OD1 ASP A 71 60.614 2.149 -10.555 1.00 15.00 O ATOM 1147 OD2 ASP A 71 60.700 4.082 -11.499 1.00 15.00 O ATOM 0 H ASP A 71 58.477 4.287 -12.045 1.00 15.00 H new ATOM 0 HA ASP A 71 57.759 1.767 -13.449 1.00 15.00 H new ATOM 0 HB2 ASP A 71 60.162 1.319 -12.952 1.00 15.00 H new ATOM 0 HB3 ASP A 71 59.998 2.932 -13.618 1.00 15.00 H new ATOM 1152 N ILE A 72 57.812 1.939 -10.198 1.00 15.00 N ATOM 1153 CA ILE A 72 57.452 1.147 -8.974 1.00 15.00 C ATOM 1154 C ILE A 72 55.995 0.672 -9.069 1.00 15.00 C ATOM 1155 O ILE A 72 55.131 1.388 -9.544 1.00 15.00 O ATOM 1156 CB ILE A 72 57.635 2.108 -7.784 1.00 15.00 C ATOM 1157 CG1 ILE A 72 59.095 2.567 -7.706 1.00 15.00 C ATOM 1158 CG2 ILE A 72 57.268 1.395 -6.477 1.00 15.00 C ATOM 1159 CD1 ILE A 72 59.194 3.798 -6.803 1.00 15.00 C ATOM 0 H ILE A 72 58.007 2.926 -10.032 1.00 15.00 H new ATOM 0 HA ILE A 72 58.075 0.259 -8.864 1.00 15.00 H new ATOM 0 HB ILE A 72 56.985 2.971 -7.927 1.00 15.00 H new ATOM 0 HG12 ILE A 72 59.720 1.764 -7.314 1.00 15.00 H new ATOM 0 HG13 ILE A 72 59.467 2.803 -8.703 1.00 15.00 H new ATOM 0 HG21 ILE A 72 57.400 2.080 -5.639 1.00 15.00 H new ATOM 0 HG22 ILE A 72 56.229 1.069 -6.520 1.00 15.00 H new ATOM 0 HG23 ILE A 72 57.915 0.528 -6.342 1.00 15.00 H new ATOM 0 HD11 ILE A 72 60.232 4.125 -6.747 1.00 15.00 H new ATOM 0 HD12 ILE A 72 58.582 4.601 -7.214 1.00 15.00 H new ATOM 0 HD13 ILE A 72 58.838 3.546 -5.804 1.00 15.00 H new ATOM 1171 N LYS A 73 55.726 -0.529 -8.620 1.00 15.00 N ATOM 1172 CA LYS A 73 54.333 -1.064 -8.676 1.00 15.00 C ATOM 1173 C LYS A 73 53.698 -1.033 -7.282 1.00 15.00 C ATOM 1174 O LYS A 73 52.546 -0.669 -7.127 1.00 15.00 O ATOM 1175 CB LYS A 73 54.482 -2.505 -9.166 1.00 15.00 C ATOM 1176 CG LYS A 73 53.102 -3.078 -9.495 1.00 15.00 C ATOM 1177 CD LYS A 73 53.246 -4.537 -9.932 1.00 15.00 C ATOM 1178 CE LYS A 73 51.898 -5.055 -10.437 1.00 15.00 C ATOM 1179 NZ LYS A 73 52.181 -6.424 -10.952 1.00 15.00 N ATOM 0 H LYS A 73 56.415 -1.163 -8.216 1.00 15.00 H new ATOM 0 HA LYS A 73 53.690 -0.475 -9.331 1.00 15.00 H new ATOM 0 HB2 LYS A 73 55.120 -2.536 -10.049 1.00 15.00 H new ATOM 0 HB3 LYS A 73 54.967 -3.112 -8.401 1.00 15.00 H new ATOM 0 HG2 LYS A 73 52.451 -3.011 -8.623 1.00 15.00 H new ATOM 0 HG3 LYS A 73 52.634 -2.494 -10.288 1.00 15.00 H new ATOM 0 HD2 LYS A 73 53.997 -4.620 -10.718 1.00 15.00 H new ATOM 0 HD3 LYS A 73 53.591 -5.146 -9.096 1.00 15.00 H new ATOM 0 HE2 LYS A 73 51.159 -5.079 -9.636 1.00 15.00 H new ATOM 0 HE3 LYS A 73 51.497 -4.413 -11.221 1.00 15.00 H new ATOM 0 HZ1 LYS A 73 51.303 -6.846 -11.316 1.00 15.00 H new ATOM 0 HZ2 LYS A 73 52.883 -6.369 -11.718 1.00 15.00 H new ATOM 0 HZ3 LYS A 73 52.555 -7.014 -10.182 1.00 15.00 H new ATOM 1193 N ASP A 74 54.443 -1.412 -6.271 1.00 15.00 N ATOM 1194 CA ASP A 74 53.875 -1.441 -4.885 1.00 15.00 C ATOM 1195 C ASP A 74 54.947 -1.074 -3.853 1.00 15.00 C ATOM 1196 O ASP A 74 56.108 -1.393 -4.016 1.00 15.00 O ATOM 1197 CB ASP A 74 53.408 -2.883 -4.683 1.00 15.00 C ATOM 1198 CG ASP A 74 52.582 -2.979 -3.398 1.00 15.00 C ATOM 1199 OD1 ASP A 74 53.148 -3.341 -2.379 1.00 15.00 O ATOM 1200 OD2 ASP A 74 51.399 -2.689 -3.455 1.00 15.00 O ATOM 0 H ASP A 74 55.418 -1.702 -6.345 1.00 15.00 H new ATOM 0 HA ASP A 74 53.064 -0.723 -4.759 1.00 15.00 H new ATOM 0 HB2 ASP A 74 52.811 -3.206 -5.536 1.00 15.00 H new ATOM 0 HB3 ASP A 74 54.268 -3.550 -4.625 1.00 15.00 H new ATOM 1205 N LEU A 75 54.555 -0.407 -2.792 1.00 15.00 N ATOM 1206 CA LEU A 75 55.531 -0.028 -1.723 1.00 15.00 C ATOM 1207 C LEU A 75 55.006 -0.465 -0.350 1.00 15.00 C ATOM 1208 O LEU A 75 53.879 -0.173 0.009 1.00 15.00 O ATOM 1209 CB LEU A 75 55.627 1.497 -1.801 1.00 15.00 C ATOM 1210 CG LEU A 75 56.836 1.982 -0.997 1.00 15.00 C ATOM 1211 CD1 LEU A 75 57.277 3.353 -1.515 1.00 15.00 C ATOM 1212 CD2 LEU A 75 56.457 2.098 0.482 1.00 15.00 C ATOM 0 H LEU A 75 53.595 -0.108 -2.621 1.00 15.00 H new ATOM 0 HA LEU A 75 56.501 -0.505 -1.858 1.00 15.00 H new ATOM 0 HB2 LEU A 75 55.720 1.812 -2.840 1.00 15.00 H new ATOM 0 HB3 LEU A 75 54.715 1.948 -1.411 1.00 15.00 H new ATOM 0 HG LEU A 75 57.652 1.268 -1.108 1.00 15.00 H new ATOM 0 HD11 LEU A 75 58.138 3.699 -0.943 1.00 15.00 H new ATOM 0 HD12 LEU A 75 57.549 3.274 -2.568 1.00 15.00 H new ATOM 0 HD13 LEU A 75 56.459 4.064 -1.404 1.00 15.00 H new ATOM 0 HD21 LEU A 75 57.319 2.443 1.053 1.00 15.00 H new ATOM 0 HD22 LEU A 75 55.639 2.810 0.593 1.00 15.00 H new ATOM 0 HD23 LEU A 75 56.142 1.123 0.855 1.00 15.00 H new ATOM 1224 N THR A 76 55.814 -1.160 0.416 1.00 15.00 N ATOM 1225 CA THR A 76 55.373 -1.609 1.774 1.00 15.00 C ATOM 1226 C THR A 76 56.481 -1.363 2.805 1.00 15.00 C ATOM 1227 O THR A 76 57.651 -1.524 2.518 1.00 15.00 O ATOM 1228 CB THR A 76 55.103 -3.107 1.624 1.00 15.00 C ATOM 1229 OG1 THR A 76 54.262 -3.325 0.500 1.00 15.00 O ATOM 1230 CG2 THR A 76 54.417 -3.633 2.886 1.00 15.00 C ATOM 0 H THR A 76 56.762 -1.436 0.158 1.00 15.00 H new ATOM 0 HA THR A 76 54.494 -1.066 2.122 1.00 15.00 H new ATOM 0 HB THR A 76 56.046 -3.633 1.480 1.00 15.00 H new ATOM 0 HG1 THR A 76 54.089 -4.285 0.402 1.00 15.00 H new ATOM 0 HG21 THR A 76 54.225 -4.701 2.778 1.00 15.00 H new ATOM 0 HG22 THR A 76 55.063 -3.466 3.748 1.00 15.00 H new ATOM 0 HG23 THR A 76 53.473 -3.108 3.033 1.00 15.00 H new