USER MOD reduce.3.24.130724 H: found=0, std=0, add=706, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 707 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 Single : A 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 LYS NZ :NH3+ 163:sc= -1.27 (180deg=-2.06!) USER MOD Single : A 18 MET CE :methyl 143:sc= -3.69! (180deg=-6.29!) USER MOD Single : A 21 ASN : amide:sc= -1.68 K(o=-1.7,f=-8.6!) USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 TYR OH : rot 180:sc= -0.918 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 53:sc= 1.23 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot 110:sc= -2.87! USER MOD Single : A 56 THR OG1 : rot 180:sc= -0.371 USER MOD Single : A 59 TYR OH : rot 180:sc= -0.454 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 4:sc= 0.579 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 152:sc= -0.0179 (180deg=-0.0473) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 86 MET CE :methyl -177:sc= -1.34 (180deg=-1.43) USER MOD Single : A 87 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 SER OG : rot 91:sc= 0.657 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 75 N LEU A 5 9.598 -6.704 -7.176 1.00 0.00 N ATOM 76 CA LEU A 5 10.788 -6.758 -8.018 1.00 0.00 C ATOM 77 C LEU A 5 11.111 -8.196 -8.413 1.00 0.00 C ATOM 78 O LEU A 5 11.074 -9.103 -7.582 1.00 0.00 O ATOM 79 CB LEU A 5 11.981 -6.138 -7.288 1.00 0.00 C ATOM 80 CG LEU A 5 12.142 -4.624 -7.430 1.00 0.00 C ATOM 81 CD1 LEU A 5 11.174 -3.897 -6.509 1.00 0.00 C ATOM 82 CD2 LEU A 5 13.576 -4.210 -7.135 1.00 0.00 C ATOM 0 HA LEU A 5 10.588 -6.188 -8.925 1.00 0.00 H new ATOM 0 HB2 LEU A 5 11.896 -6.376 -6.228 1.00 0.00 H new ATOM 0 HB3 LEU A 5 12.891 -6.616 -7.650 1.00 0.00 H new ATOM 0 HG LEU A 5 11.910 -4.347 -8.459 1.00 0.00 H new ATOM 0 HD11 LEU A 5 11.302 -2.821 -6.623 1.00 0.00 H new ATOM 0 HD12 LEU A 5 10.151 -4.170 -6.768 1.00 0.00 H new ATOM 0 HD13 LEU A 5 11.374 -4.179 -5.475 1.00 0.00 H new ATOM 0 HD21 LEU A 5 13.672 -3.129 -7.241 1.00 0.00 H new ATOM 0 HD22 LEU A 5 13.836 -4.499 -6.117 1.00 0.00 H new ATOM 0 HD23 LEU A 5 14.249 -4.704 -7.836 1.00 0.00 H new ATOM 94 N LYS A 6 11.428 -8.396 -9.688 1.00 0.00 N ATOM 95 CA LYS A 6 11.761 -9.722 -10.195 1.00 0.00 C ATOM 96 C LYS A 6 13.121 -9.715 -10.885 1.00 0.00 C ATOM 97 O LYS A 6 13.514 -8.721 -11.495 1.00 0.00 O ATOM 98 CB LYS A 6 10.684 -10.202 -11.171 1.00 0.00 C ATOM 99 CG LYS A 6 10.223 -9.131 -12.143 1.00 0.00 C ATOM 100 CD LYS A 6 9.163 -9.660 -13.095 1.00 0.00 C ATOM 101 CE LYS A 6 9.766 -10.585 -14.141 1.00 0.00 C ATOM 102 NZ LYS A 6 8.717 -11.270 -14.946 1.00 0.00 N ATOM 0 H LYS A 6 11.461 -7.656 -10.389 1.00 0.00 H new ATOM 0 HA LYS A 6 11.807 -10.407 -9.348 1.00 0.00 H new ATOM 0 HB2 LYS A 6 11.069 -11.051 -11.735 1.00 0.00 H new ATOM 0 HB3 LYS A 6 9.825 -10.560 -10.604 1.00 0.00 H new ATOM 0 HG2 LYS A 6 9.824 -8.282 -11.588 1.00 0.00 H new ATOM 0 HG3 LYS A 6 11.076 -8.765 -12.714 1.00 0.00 H new ATOM 0 HD2 LYS A 6 8.400 -10.196 -12.530 1.00 0.00 H new ATOM 0 HD3 LYS A 6 8.666 -8.825 -13.589 1.00 0.00 H new ATOM 0 HE2 LYS A 6 10.415 -10.011 -14.803 1.00 0.00 H new ATOM 0 HE3 LYS A 6 10.391 -11.330 -13.650 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 9.168 -11.891 -15.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 8.113 -11.838 -14.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 8.136 -10.560 -15.435 1.00 0.00 H new ATOM 116 N VAL A 7 13.836 -10.832 -10.785 1.00 0.00 N ATOM 117 CA VAL A 7 15.151 -10.955 -11.402 1.00 0.00 C ATOM 118 C VAL A 7 15.229 -12.194 -12.286 1.00 0.00 C ATOM 119 O VAL A 7 15.028 -13.317 -11.821 1.00 0.00 O ATOM 120 CB VAL A 7 16.265 -11.024 -10.340 1.00 0.00 C ATOM 121 CG1 VAL A 7 15.916 -12.043 -9.266 1.00 0.00 C ATOM 122 CG2 VAL A 7 17.599 -11.358 -10.989 1.00 0.00 C ATOM 0 H VAL A 7 13.526 -11.664 -10.283 1.00 0.00 H new ATOM 0 HA VAL A 7 15.298 -10.065 -12.015 1.00 0.00 H new ATOM 0 HB VAL A 7 16.352 -10.047 -9.866 1.00 0.00 H new ATOM 0 HG11 VAL A 7 16.714 -12.078 -8.525 1.00 0.00 H new ATOM 0 HG12 VAL A 7 14.983 -11.756 -8.781 1.00 0.00 H new ATOM 0 HG13 VAL A 7 15.800 -13.027 -9.721 1.00 0.00 H new ATOM 0 HG21 VAL A 7 18.375 -11.403 -10.224 1.00 0.00 H new ATOM 0 HG22 VAL A 7 17.528 -12.323 -11.491 1.00 0.00 H new ATOM 0 HG23 VAL A 7 17.852 -10.588 -11.718 1.00 0.00 H new ATOM 132 N LYS A 8 15.523 -11.985 -13.565 1.00 0.00 N ATOM 133 CA LYS A 8 15.631 -13.084 -14.516 1.00 0.00 C ATOM 134 C LYS A 8 16.940 -13.004 -15.295 1.00 0.00 C ATOM 135 O LYS A 8 17.519 -11.928 -15.447 1.00 0.00 O ATOM 136 CB LYS A 8 14.446 -13.065 -15.485 1.00 0.00 C ATOM 137 CG LYS A 8 14.505 -11.933 -16.496 1.00 0.00 C ATOM 138 CD LYS A 8 13.411 -10.908 -16.250 1.00 0.00 C ATOM 139 CE LYS A 8 13.857 -9.842 -15.261 1.00 0.00 C ATOM 140 NZ LYS A 8 13.295 -10.077 -13.901 1.00 0.00 N ATOM 0 H LYS A 8 15.691 -11.063 -13.967 1.00 0.00 H new ATOM 0 HA LYS A 8 15.620 -14.019 -13.955 1.00 0.00 H new ATOM 0 HB2 LYS A 8 14.408 -14.015 -16.018 1.00 0.00 H new ATOM 0 HB3 LYS A 8 13.521 -12.983 -14.914 1.00 0.00 H new ATOM 0 HG2 LYS A 8 15.479 -11.447 -16.443 1.00 0.00 H new ATOM 0 HG3 LYS A 8 14.406 -12.338 -17.503 1.00 0.00 H new ATOM 0 HD2 LYS A 8 13.133 -10.437 -17.193 1.00 0.00 H new ATOM 0 HD3 LYS A 8 12.521 -11.409 -15.870 1.00 0.00 H new ATOM 0 HE2 LYS A 8 14.946 -9.829 -15.207 1.00 0.00 H new ATOM 0 HE3 LYS A 8 13.544 -8.861 -15.619 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 13.831 -9.523 -13.203 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 12.297 -9.784 -13.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 13.364 -11.088 -13.667 1.00 0.00 H new ATOM 154 N VAL A 9 17.401 -14.149 -15.789 1.00 0.00 N ATOM 155 CA VAL A 9 18.640 -14.207 -16.555 1.00 0.00 C ATOM 156 C VAL A 9 18.480 -13.530 -17.911 1.00 0.00 C ATOM 157 O VAL A 9 17.462 -13.695 -18.582 1.00 0.00 O ATOM 158 CB VAL A 9 19.098 -15.662 -16.770 1.00 0.00 C ATOM 159 CG1 VAL A 9 20.474 -15.698 -17.418 1.00 0.00 C ATOM 160 CG2 VAL A 9 19.100 -16.421 -15.452 1.00 0.00 C ATOM 0 H VAL A 9 16.935 -15.049 -15.672 1.00 0.00 H new ATOM 0 HA VAL A 9 19.396 -13.677 -15.976 1.00 0.00 H new ATOM 0 HB VAL A 9 18.393 -16.151 -17.442 1.00 0.00 H new ATOM 0 HG11 VAL A 9 20.781 -16.734 -17.562 1.00 0.00 H new ATOM 0 HG12 VAL A 9 20.435 -15.193 -18.383 1.00 0.00 H new ATOM 0 HG13 VAL A 9 21.193 -15.193 -16.773 1.00 0.00 H new ATOM 0 HG21 VAL A 9 19.426 -17.447 -15.623 1.00 0.00 H new ATOM 0 HG22 VAL A 9 19.782 -15.935 -14.754 1.00 0.00 H new ATOM 0 HG23 VAL A 9 18.094 -16.425 -15.033 1.00 0.00 H new ATOM 170 N GLU A 10 19.494 -12.768 -18.309 1.00 0.00 N ATOM 171 CA GLU A 10 19.465 -12.065 -19.586 1.00 0.00 C ATOM 172 C GLU A 10 20.517 -12.624 -20.539 1.00 0.00 C ATOM 173 O GLU A 10 20.283 -12.738 -21.743 1.00 0.00 O ATOM 174 CB GLU A 10 19.698 -10.567 -19.375 1.00 0.00 C ATOM 175 CG GLU A 10 20.830 -10.257 -18.411 1.00 0.00 C ATOM 176 CD GLU A 10 21.220 -8.792 -18.420 1.00 0.00 C ATOM 177 OE1 GLU A 10 20.408 -7.960 -17.963 1.00 0.00 O ATOM 178 OE2 GLU A 10 22.335 -8.477 -18.884 1.00 0.00 O ATOM 0 H GLU A 10 20.345 -12.622 -17.766 1.00 0.00 H new ATOM 0 HA GLU A 10 18.481 -12.214 -20.030 1.00 0.00 H new ATOM 0 HB2 GLU A 10 19.914 -10.102 -20.337 1.00 0.00 H new ATOM 0 HB3 GLU A 10 18.780 -10.114 -19.001 1.00 0.00 H new ATOM 0 HG2 GLU A 10 20.532 -10.543 -17.402 1.00 0.00 H new ATOM 0 HG3 GLU A 10 21.699 -10.862 -18.670 1.00 0.00 H new ATOM 185 N ASP A 11 21.677 -12.972 -19.992 1.00 0.00 N ATOM 186 CA ASP A 11 22.766 -13.520 -20.793 1.00 0.00 C ATOM 187 C ASP A 11 23.856 -14.104 -19.899 1.00 0.00 C ATOM 188 O ASP A 11 24.452 -13.396 -19.087 1.00 0.00 O ATOM 189 CB ASP A 11 23.356 -12.439 -21.699 1.00 0.00 C ATOM 190 CG ASP A 11 23.964 -13.012 -22.964 1.00 0.00 C ATOM 191 OD1 ASP A 11 24.563 -14.105 -22.891 1.00 0.00 O ATOM 192 OD2 ASP A 11 23.842 -12.367 -24.026 1.00 0.00 O ATOM 0 H ASP A 11 21.887 -12.884 -18.998 1.00 0.00 H new ATOM 0 HA ASP A 11 22.362 -14.320 -21.413 1.00 0.00 H new ATOM 0 HB2 ASP A 11 22.575 -11.726 -21.965 1.00 0.00 H new ATOM 0 HB3 ASP A 11 24.119 -11.886 -21.151 1.00 0.00 H new ATOM 197 N PHE A 12 24.111 -15.399 -20.055 1.00 0.00 N ATOM 198 CA PHE A 12 25.129 -16.078 -19.261 1.00 0.00 C ATOM 199 C PHE A 12 26.171 -16.735 -20.161 1.00 0.00 C ATOM 200 O PHE A 12 25.952 -16.910 -21.358 1.00 0.00 O ATOM 201 CB PHE A 12 24.482 -17.130 -18.358 1.00 0.00 C ATOM 202 CG PHE A 12 24.031 -18.358 -19.096 1.00 0.00 C ATOM 203 CD1 PHE A 12 22.767 -18.418 -19.660 1.00 0.00 C ATOM 204 CD2 PHE A 12 24.871 -19.453 -19.224 1.00 0.00 C ATOM 205 CE1 PHE A 12 22.349 -19.546 -20.340 1.00 0.00 C ATOM 206 CE2 PHE A 12 24.458 -20.584 -19.904 1.00 0.00 C ATOM 207 CZ PHE A 12 23.195 -20.631 -20.461 1.00 0.00 C ATOM 0 H PHE A 12 23.627 -15.999 -20.723 1.00 0.00 H new ATOM 0 HA PHE A 12 25.628 -15.334 -18.641 1.00 0.00 H new ATOM 0 HB2 PHE A 12 25.194 -17.421 -17.585 1.00 0.00 H new ATOM 0 HB3 PHE A 12 23.625 -16.685 -17.851 1.00 0.00 H new ATOM 0 HD1 PHE A 12 22.101 -17.573 -19.567 1.00 0.00 H new ATOM 0 HD2 PHE A 12 25.859 -19.423 -18.788 1.00 0.00 H new ATOM 0 HE1 PHE A 12 21.362 -19.579 -20.776 1.00 0.00 H new ATOM 0 HE2 PHE A 12 25.123 -21.430 -19.999 1.00 0.00 H new ATOM 0 HZ PHE A 12 22.870 -21.514 -20.990 1.00 0.00 H new ATOM 217 N GLY A 13 27.308 -17.096 -19.573 1.00 0.00 N ATOM 218 CA GLY A 13 28.369 -17.729 -20.335 1.00 0.00 C ATOM 219 C GLY A 13 29.458 -18.299 -19.449 1.00 0.00 C ATOM 220 O GLY A 13 29.348 -18.275 -18.223 1.00 0.00 O ATOM 0 H GLY A 13 27.513 -16.961 -18.583 1.00 0.00 H new ATOM 0 HA2 GLY A 13 27.947 -18.527 -20.946 1.00 0.00 H new ATOM 0 HA3 GLY A 13 28.805 -17.001 -21.019 1.00 0.00 H new ATOM 224 N PHE A 14 30.514 -18.816 -20.070 1.00 0.00 N ATOM 225 CA PHE A 14 31.627 -19.398 -19.329 1.00 0.00 C ATOM 226 C PHE A 14 32.961 -19.011 -19.960 1.00 0.00 C ATOM 227 O PHE A 14 33.095 -18.977 -21.183 1.00 0.00 O ATOM 228 CB PHE A 14 31.495 -20.922 -19.283 1.00 0.00 C ATOM 229 CG PHE A 14 32.714 -21.613 -18.744 1.00 0.00 C ATOM 230 CD1 PHE A 14 32.850 -21.848 -17.385 1.00 0.00 C ATOM 231 CD2 PHE A 14 33.725 -22.029 -19.595 1.00 0.00 C ATOM 232 CE1 PHE A 14 33.971 -22.483 -16.886 1.00 0.00 C ATOM 233 CE2 PHE A 14 34.849 -22.665 -19.102 1.00 0.00 C ATOM 234 CZ PHE A 14 34.972 -22.893 -17.746 1.00 0.00 C ATOM 0 H PHE A 14 30.622 -18.844 -21.084 1.00 0.00 H new ATOM 0 HA PHE A 14 31.599 -19.007 -18.312 1.00 0.00 H new ATOM 0 HB2 PHE A 14 30.635 -21.186 -18.667 1.00 0.00 H new ATOM 0 HB3 PHE A 14 31.292 -21.292 -20.288 1.00 0.00 H new ATOM 0 HD1 PHE A 14 32.071 -21.531 -16.708 1.00 0.00 H new ATOM 0 HD2 PHE A 14 33.634 -21.854 -20.657 1.00 0.00 H new ATOM 0 HE1 PHE A 14 34.065 -22.659 -15.825 1.00 0.00 H new ATOM 0 HE2 PHE A 14 35.630 -22.983 -19.777 1.00 0.00 H new ATOM 0 HZ PHE A 14 35.849 -23.391 -17.358 1.00 0.00 H new ATOM 244 N ARG A 15 33.945 -18.719 -19.116 1.00 0.00 N ATOM 245 CA ARG A 15 35.269 -18.332 -19.589 1.00 0.00 C ATOM 246 C ARG A 15 36.312 -19.376 -19.201 1.00 0.00 C ATOM 247 O ARG A 15 36.622 -19.548 -18.023 1.00 0.00 O ATOM 248 CB ARG A 15 35.660 -16.968 -19.018 1.00 0.00 C ATOM 249 CG ARG A 15 35.876 -15.902 -20.080 1.00 0.00 C ATOM 250 CD ARG A 15 34.555 -15.361 -20.604 1.00 0.00 C ATOM 251 NE ARG A 15 34.303 -15.775 -21.982 1.00 0.00 N ATOM 252 CZ ARG A 15 34.848 -15.182 -23.038 1.00 0.00 C ATOM 253 NH1 ARG A 15 35.672 -14.156 -22.876 1.00 0.00 N ATOM 254 NH2 ARG A 15 34.569 -15.616 -24.261 1.00 0.00 N ATOM 0 H ARG A 15 33.850 -18.743 -18.101 1.00 0.00 H new ATOM 0 HA ARG A 15 35.233 -18.266 -20.676 1.00 0.00 H new ATOM 0 HB2 ARG A 15 34.881 -16.634 -18.333 1.00 0.00 H new ATOM 0 HB3 ARG A 15 36.574 -17.077 -18.433 1.00 0.00 H new ATOM 0 HG2 ARG A 15 36.465 -15.085 -19.663 1.00 0.00 H new ATOM 0 HG3 ARG A 15 36.452 -16.321 -20.905 1.00 0.00 H new ATOM 0 HD2 ARG A 15 33.742 -15.709 -19.966 1.00 0.00 H new ATOM 0 HD3 ARG A 15 34.561 -14.272 -20.548 1.00 0.00 H new ATOM 0 HE ARG A 15 33.674 -16.562 -22.142 1.00 0.00 H new ATOM 0 HH11 ARG A 15 35.889 -13.820 -21.938 1.00 0.00 H new ATOM 0 HH12 ARG A 15 36.089 -13.703 -23.689 1.00 0.00 H new ATOM 0 HH21 ARG A 15 33.936 -16.405 -24.390 1.00 0.00 H new ATOM 0 HH22 ARG A 15 34.988 -15.160 -25.072 1.00 0.00 H new ATOM 268 N GLU A 16 36.848 -20.070 -20.200 1.00 0.00 N ATOM 269 CA GLU A 16 37.854 -21.098 -19.962 1.00 0.00 C ATOM 270 C GLU A 16 39.169 -20.475 -19.502 1.00 0.00 C ATOM 271 O GLU A 16 39.987 -21.130 -18.855 1.00 0.00 O ATOM 272 CB GLU A 16 38.084 -21.922 -21.230 1.00 0.00 C ATOM 273 CG GLU A 16 38.690 -21.125 -22.373 1.00 0.00 C ATOM 274 CD GLU A 16 39.016 -21.987 -23.577 1.00 0.00 C ATOM 275 OE1 GLU A 16 39.319 -23.183 -23.385 1.00 0.00 O ATOM 276 OE2 GLU A 16 38.970 -21.466 -24.711 1.00 0.00 O ATOM 0 H GLU A 16 36.602 -19.939 -21.181 1.00 0.00 H new ATOM 0 HA GLU A 16 37.486 -21.754 -19.173 1.00 0.00 H new ATOM 0 HB2 GLU A 16 38.740 -22.760 -20.995 1.00 0.00 H new ATOM 0 HB3 GLU A 16 37.133 -22.344 -21.556 1.00 0.00 H new ATOM 0 HG2 GLU A 16 37.996 -20.339 -22.671 1.00 0.00 H new ATOM 0 HG3 GLU A 16 39.599 -20.633 -22.026 1.00 0.00 H new ATOM 283 N ASP A 17 39.366 -19.205 -19.841 1.00 0.00 N ATOM 284 CA ASP A 17 40.581 -18.493 -19.463 1.00 0.00 C ATOM 285 C ASP A 17 40.592 -18.192 -17.968 1.00 0.00 C ATOM 286 O ASP A 17 41.652 -18.025 -17.366 1.00 0.00 O ATOM 287 CB ASP A 17 40.703 -17.192 -20.258 1.00 0.00 C ATOM 288 CG ASP A 17 39.778 -16.108 -19.741 1.00 0.00 C ATOM 289 OD1 ASP A 17 40.072 -15.540 -18.667 1.00 0.00 O ATOM 290 OD2 ASP A 17 38.762 -15.826 -20.409 1.00 0.00 O ATOM 0 H ASP A 17 38.700 -18.648 -20.377 1.00 0.00 H new ATOM 0 HA ASP A 17 41.433 -19.132 -19.693 1.00 0.00 H new ATOM 0 HB2 ASP A 17 41.733 -16.838 -20.214 1.00 0.00 H new ATOM 0 HB3 ASP A 17 40.478 -17.388 -21.306 1.00 0.00 H new ATOM 295 N MET A 18 39.405 -18.123 -17.375 1.00 0.00 N ATOM 296 CA MET A 18 39.278 -17.843 -15.949 1.00 0.00 C ATOM 297 C MET A 18 38.978 -19.118 -15.168 1.00 0.00 C ATOM 298 O MET A 18 39.282 -19.216 -13.980 1.00 0.00 O ATOM 299 CB MET A 18 38.175 -16.811 -15.707 1.00 0.00 C ATOM 300 CG MET A 18 38.617 -15.378 -15.958 1.00 0.00 C ATOM 301 SD MET A 18 37.651 -14.178 -15.022 1.00 0.00 S ATOM 302 CE MET A 18 36.060 -14.318 -15.832 1.00 0.00 C ATOM 0 H MET A 18 38.517 -18.257 -17.859 1.00 0.00 H new ATOM 0 HA MET A 18 40.228 -17.439 -15.598 1.00 0.00 H new ATOM 0 HB2 MET A 18 37.327 -17.039 -16.353 1.00 0.00 H new ATOM 0 HB3 MET A 18 37.825 -16.900 -14.678 1.00 0.00 H new ATOM 0 HG2 MET A 18 39.670 -15.275 -15.695 1.00 0.00 H new ATOM 0 HG3 MET A 18 38.531 -15.157 -17.022 1.00 0.00 H new ATOM 0 HE1 MET A 18 35.265 -14.221 -15.092 1.00 0.00 H new ATOM 0 HE2 MET A 18 35.960 -13.529 -16.577 1.00 0.00 H new ATOM 0 HE3 MET A 18 35.984 -15.290 -16.320 1.00 0.00 H new ATOM 312 N GLY A 19 38.378 -20.094 -15.845 1.00 0.00 N ATOM 313 CA GLY A 19 38.046 -21.350 -15.198 1.00 0.00 C ATOM 314 C GLY A 19 36.749 -21.275 -14.417 1.00 0.00 C ATOM 315 O GLY A 19 36.437 -22.170 -13.631 1.00 0.00 O ATOM 0 H GLY A 19 38.116 -20.037 -16.829 1.00 0.00 H new ATOM 0 HA2 GLY A 19 37.968 -22.134 -15.952 1.00 0.00 H new ATOM 0 HA3 GLY A 19 38.856 -21.634 -14.526 1.00 0.00 H new ATOM 319 N LEU A 20 35.992 -20.204 -14.632 1.00 0.00 N ATOM 320 CA LEU A 20 34.722 -20.015 -13.941 1.00 0.00 C ATOM 321 C LEU A 20 33.629 -19.590 -14.917 1.00 0.00 C ATOM 322 O LEU A 20 33.904 -19.284 -16.077 1.00 0.00 O ATOM 323 CB LEU A 20 34.870 -18.967 -12.837 1.00 0.00 C ATOM 324 CG LEU A 20 35.732 -17.750 -13.177 1.00 0.00 C ATOM 325 CD1 LEU A 20 35.035 -16.874 -14.206 1.00 0.00 C ATOM 326 CD2 LEU A 20 36.049 -16.953 -11.921 1.00 0.00 C ATOM 0 H LEU A 20 36.236 -19.454 -15.279 1.00 0.00 H new ATOM 0 HA LEU A 20 34.435 -20.967 -13.494 1.00 0.00 H new ATOM 0 HB2 LEU A 20 33.875 -18.617 -12.561 1.00 0.00 H new ATOM 0 HB3 LEU A 20 35.293 -19.452 -11.957 1.00 0.00 H new ATOM 0 HG LEU A 20 36.671 -18.101 -13.605 1.00 0.00 H new ATOM 0 HD11 LEU A 20 35.663 -16.013 -14.436 1.00 0.00 H new ATOM 0 HD12 LEU A 20 34.861 -17.449 -15.115 1.00 0.00 H new ATOM 0 HD13 LEU A 20 34.081 -16.531 -13.805 1.00 0.00 H new ATOM 0 HD21 LEU A 20 36.663 -16.091 -12.182 1.00 0.00 H new ATOM 0 HD22 LEU A 20 35.121 -16.612 -11.463 1.00 0.00 H new ATOM 0 HD23 LEU A 20 36.591 -17.584 -11.217 1.00 0.00 H new ATOM 338 N ASN A 21 32.389 -19.571 -14.439 1.00 0.00 N ATOM 339 CA ASN A 21 31.255 -19.182 -15.269 1.00 0.00 C ATOM 340 C ASN A 21 30.605 -17.908 -14.739 1.00 0.00 C ATOM 341 O ASN A 21 30.576 -17.669 -13.531 1.00 0.00 O ATOM 342 CB ASN A 21 30.223 -20.310 -15.321 1.00 0.00 C ATOM 343 CG ASN A 21 29.195 -20.205 -14.211 1.00 0.00 C ATOM 344 OD1 ASN A 21 29.510 -20.399 -13.037 1.00 0.00 O ATOM 345 ND2 ASN A 21 27.957 -19.897 -14.580 1.00 0.00 N ATOM 0 H ASN A 21 32.144 -19.821 -13.481 1.00 0.00 H new ATOM 0 HA ASN A 21 31.624 -18.989 -16.276 1.00 0.00 H new ATOM 0 HB2 ASN A 21 29.716 -20.290 -16.285 1.00 0.00 H new ATOM 0 HB3 ASN A 21 30.734 -21.270 -15.249 1.00 0.00 H new ATOM 0 HD21 ASN A 21 27.222 -19.813 -13.878 1.00 0.00 H new ATOM 0 HD22 ASN A 21 27.741 -19.745 -15.565 1.00 0.00 H new ATOM 352 N TYR A 22 30.085 -17.093 -15.649 1.00 0.00 N ATOM 353 CA TYR A 22 29.437 -15.841 -15.274 1.00 0.00 C ATOM 354 C TYR A 22 28.032 -15.758 -15.863 1.00 0.00 C ATOM 355 O TYR A 22 27.735 -16.382 -16.882 1.00 0.00 O ATOM 356 CB TYR A 22 30.271 -14.649 -15.746 1.00 0.00 C ATOM 357 CG TYR A 22 30.207 -14.417 -17.239 1.00 0.00 C ATOM 358 CD1 TYR A 22 29.208 -13.629 -17.796 1.00 0.00 C ATOM 359 CD2 TYR A 22 31.144 -14.987 -18.091 1.00 0.00 C ATOM 360 CE1 TYR A 22 29.144 -13.415 -19.160 1.00 0.00 C ATOM 361 CE2 TYR A 22 31.089 -14.778 -19.455 1.00 0.00 C ATOM 362 CZ TYR A 22 30.088 -13.991 -19.985 1.00 0.00 C ATOM 363 OH TYR A 22 30.029 -13.781 -21.344 1.00 0.00 O ATOM 0 H TYR A 22 30.099 -17.276 -16.652 1.00 0.00 H new ATOM 0 HA TYR A 22 29.359 -15.813 -14.187 1.00 0.00 H new ATOM 0 HB2 TYR A 22 29.928 -13.751 -15.232 1.00 0.00 H new ATOM 0 HB3 TYR A 22 31.310 -14.806 -15.456 1.00 0.00 H new ATOM 0 HD1 TYR A 22 28.469 -13.176 -17.152 1.00 0.00 H new ATOM 0 HD2 TYR A 22 31.929 -15.604 -17.680 1.00 0.00 H new ATOM 0 HE1 TYR A 22 28.360 -12.801 -19.577 1.00 0.00 H new ATOM 0 HE2 TYR A 22 31.826 -15.228 -20.103 1.00 0.00 H new ATOM 0 HH TYR A 22 30.767 -14.256 -21.781 1.00 0.00 H new ATOM 373 N VAL A 23 27.171 -14.981 -15.214 1.00 0.00 N ATOM 374 CA VAL A 23 25.797 -14.813 -15.672 1.00 0.00 C ATOM 375 C VAL A 23 25.280 -13.414 -15.357 1.00 0.00 C ATOM 376 O VAL A 23 25.486 -12.897 -14.259 1.00 0.00 O ATOM 377 CB VAL A 23 24.859 -15.852 -15.028 1.00 0.00 C ATOM 378 CG1 VAL A 23 25.098 -15.929 -13.528 1.00 0.00 C ATOM 379 CG2 VAL A 23 23.406 -15.516 -15.328 1.00 0.00 C ATOM 0 H VAL A 23 27.401 -14.458 -14.369 1.00 0.00 H new ATOM 0 HA VAL A 23 25.803 -14.960 -16.752 1.00 0.00 H new ATOM 0 HB VAL A 23 25.078 -16.830 -15.458 1.00 0.00 H new ATOM 0 HG11 VAL A 23 24.427 -16.668 -13.090 1.00 0.00 H new ATOM 0 HG12 VAL A 23 26.131 -16.220 -13.339 1.00 0.00 H new ATOM 0 HG13 VAL A 23 24.908 -14.954 -13.079 1.00 0.00 H new ATOM 0 HG21 VAL A 23 22.758 -16.260 -14.866 1.00 0.00 H new ATOM 0 HG22 VAL A 23 23.170 -14.530 -14.927 1.00 0.00 H new ATOM 0 HG23 VAL A 23 23.248 -15.517 -16.406 1.00 0.00 H new ATOM 389 N ARG A 24 24.607 -12.806 -16.329 1.00 0.00 N ATOM 390 CA ARG A 24 24.060 -11.465 -16.156 1.00 0.00 C ATOM 391 C ARG A 24 22.578 -11.524 -15.796 1.00 0.00 C ATOM 392 O ARG A 24 21.789 -12.180 -16.477 1.00 0.00 O ATOM 393 CB ARG A 24 24.254 -10.644 -17.432 1.00 0.00 C ATOM 394 CG ARG A 24 25.621 -9.987 -17.532 1.00 0.00 C ATOM 395 CD ARG A 24 26.733 -11.023 -17.586 1.00 0.00 C ATOM 396 NE ARG A 24 27.937 -10.500 -18.226 1.00 0.00 N ATOM 397 CZ ARG A 24 28.020 -10.225 -19.523 1.00 0.00 C ATOM 398 NH1 ARG A 24 26.975 -10.423 -20.314 1.00 0.00 N ATOM 399 NH2 ARG A 24 29.151 -9.752 -20.032 1.00 0.00 N ATOM 0 H ARG A 24 24.428 -13.220 -17.244 1.00 0.00 H new ATOM 0 HA ARG A 24 24.596 -10.984 -15.338 1.00 0.00 H new ATOM 0 HB2 ARG A 24 24.108 -11.292 -18.296 1.00 0.00 H new ATOM 0 HB3 ARG A 24 23.485 -9.873 -17.478 1.00 0.00 H new ATOM 0 HG2 ARG A 24 25.661 -9.361 -18.424 1.00 0.00 H new ATOM 0 HG3 ARG A 24 25.774 -9.331 -16.675 1.00 0.00 H new ATOM 0 HD2 ARG A 24 26.973 -11.350 -16.574 1.00 0.00 H new ATOM 0 HD3 ARG A 24 26.385 -11.901 -18.131 1.00 0.00 H new ATOM 0 HE ARG A 24 28.759 -10.337 -17.645 1.00 0.00 H new ATOM 0 HH11 ARG A 24 26.104 -10.787 -19.927 1.00 0.00 H new ATOM 0 HH12 ARG A 24 27.041 -10.211 -21.310 1.00 0.00 H new ATOM 0 HH21 ARG A 24 29.958 -9.599 -19.427 1.00 0.00 H new ATOM 0 HH22 ARG A 24 29.213 -9.541 -21.028 1.00 0.00 H new ATOM 413 N TYR A 25 22.208 -10.836 -14.722 1.00 0.00 N ATOM 414 CA TYR A 25 20.822 -10.813 -14.270 1.00 0.00 C ATOM 415 C TYR A 25 20.178 -9.459 -14.557 1.00 0.00 C ATOM 416 O TYR A 25 20.847 -8.426 -14.540 1.00 0.00 O ATOM 417 CB TYR A 25 20.746 -11.119 -12.773 1.00 0.00 C ATOM 418 CG TYR A 25 21.377 -12.439 -12.393 1.00 0.00 C ATOM 419 CD1 TYR A 25 20.736 -13.642 -12.663 1.00 0.00 C ATOM 420 CD2 TYR A 25 22.615 -12.484 -11.764 1.00 0.00 C ATOM 421 CE1 TYR A 25 21.308 -14.850 -12.316 1.00 0.00 C ATOM 422 CE2 TYR A 25 23.196 -13.688 -11.415 1.00 0.00 C ATOM 423 CZ TYR A 25 22.538 -14.868 -11.693 1.00 0.00 C ATOM 424 OH TYR A 25 23.112 -16.070 -11.347 1.00 0.00 O ATOM 0 H TYR A 25 22.848 -10.287 -14.148 1.00 0.00 H new ATOM 0 HA TYR A 25 20.275 -11.580 -14.819 1.00 0.00 H new ATOM 0 HB2 TYR A 25 21.238 -10.318 -12.221 1.00 0.00 H new ATOM 0 HB3 TYR A 25 19.701 -11.123 -12.464 1.00 0.00 H new ATOM 0 HD1 TYR A 25 19.774 -13.632 -13.153 1.00 0.00 H new ATOM 0 HD2 TYR A 25 23.132 -11.562 -11.544 1.00 0.00 H new ATOM 0 HE1 TYR A 25 20.795 -15.776 -12.531 1.00 0.00 H new ATOM 0 HE2 TYR A 25 24.160 -13.705 -10.927 1.00 0.00 H new ATOM 0 HH TYR A 25 23.978 -15.907 -10.918 1.00 0.00 H new ATOM 434 N ARG A 26 18.875 -9.475 -14.818 1.00 0.00 N ATOM 435 CA ARG A 26 18.140 -8.250 -15.109 1.00 0.00 C ATOM 436 C ARG A 26 17.226 -7.876 -13.946 1.00 0.00 C ATOM 437 O ARG A 26 16.263 -8.582 -13.648 1.00 0.00 O ATOM 438 CB ARG A 26 17.315 -8.417 -16.387 1.00 0.00 C ATOM 439 CG ARG A 26 17.226 -7.151 -17.224 1.00 0.00 C ATOM 440 CD ARG A 26 17.099 -7.470 -18.705 1.00 0.00 C ATOM 441 NE ARG A 26 15.713 -7.712 -19.096 1.00 0.00 N ATOM 442 CZ ARG A 26 15.358 -8.200 -20.279 1.00 0.00 C ATOM 443 NH1 ARG A 26 16.282 -8.497 -21.182 1.00 0.00 N ATOM 444 NH2 ARG A 26 14.075 -8.392 -20.561 1.00 0.00 N ATOM 0 H ARG A 26 18.307 -10.322 -14.834 1.00 0.00 H new ATOM 0 HA ARG A 26 18.863 -7.447 -15.253 1.00 0.00 H new ATOM 0 HB2 ARG A 26 17.753 -9.212 -16.991 1.00 0.00 H new ATOM 0 HB3 ARG A 26 16.308 -8.738 -16.120 1.00 0.00 H new ATOM 0 HG2 ARG A 26 16.368 -6.561 -16.903 1.00 0.00 H new ATOM 0 HG3 ARG A 26 18.113 -6.540 -17.057 1.00 0.00 H new ATOM 0 HD2 ARG A 26 17.501 -6.643 -19.290 1.00 0.00 H new ATOM 0 HD3 ARG A 26 17.700 -8.348 -18.939 1.00 0.00 H new ATOM 0 HE ARG A 26 14.977 -7.494 -18.424 1.00 0.00 H new ATOM 0 HH11 ARG A 26 17.269 -8.351 -20.969 1.00 0.00 H new ATOM 0 HH12 ARG A 26 16.006 -8.872 -22.090 1.00 0.00 H new ATOM 0 HH21 ARG A 26 13.361 -8.165 -19.869 1.00 0.00 H new ATOM 0 HH22 ARG A 26 13.803 -8.767 -21.470 1.00 0.00 H new ATOM 458 N VAL A 27 17.535 -6.760 -13.293 1.00 0.00 N ATOM 459 CA VAL A 27 16.741 -6.291 -12.163 1.00 0.00 C ATOM 460 C VAL A 27 16.211 -4.883 -12.411 1.00 0.00 C ATOM 461 O VAL A 27 16.982 -3.946 -12.617 1.00 0.00 O ATOM 462 CB VAL A 27 17.562 -6.297 -10.860 1.00 0.00 C ATOM 463 CG1 VAL A 27 16.685 -5.924 -9.675 1.00 0.00 C ATOM 464 CG2 VAL A 27 18.212 -7.655 -10.646 1.00 0.00 C ATOM 0 H VAL A 27 18.329 -6.164 -13.527 1.00 0.00 H new ATOM 0 HA VAL A 27 15.902 -6.979 -12.058 1.00 0.00 H new ATOM 0 HB VAL A 27 18.352 -5.551 -10.946 1.00 0.00 H new ATOM 0 HG11 VAL A 27 17.282 -5.933 -8.763 1.00 0.00 H new ATOM 0 HG12 VAL A 27 16.272 -4.927 -9.828 1.00 0.00 H new ATOM 0 HG13 VAL A 27 15.872 -6.644 -9.584 1.00 0.00 H new ATOM 0 HG21 VAL A 27 18.788 -7.641 -9.721 1.00 0.00 H new ATOM 0 HG22 VAL A 27 17.440 -8.422 -10.581 1.00 0.00 H new ATOM 0 HG23 VAL A 27 18.875 -7.877 -11.483 1.00 0.00 H new ATOM 474 N SER A 28 14.890 -4.742 -12.390 1.00 0.00 N ATOM 475 CA SER A 28 14.255 -3.449 -12.615 1.00 0.00 C ATOM 476 C SER A 28 13.491 -2.995 -11.375 1.00 0.00 C ATOM 477 O SER A 28 12.775 -3.778 -10.752 1.00 0.00 O ATOM 478 CB SER A 28 13.307 -3.524 -13.813 1.00 0.00 C ATOM 479 OG SER A 28 12.889 -4.858 -14.049 1.00 0.00 O ATOM 0 H SER A 28 14.238 -5.508 -12.219 1.00 0.00 H new ATOM 0 HA SER A 28 15.038 -2.720 -12.825 1.00 0.00 H new ATOM 0 HB2 SER A 28 12.437 -2.893 -13.632 1.00 0.00 H new ATOM 0 HB3 SER A 28 13.805 -3.133 -14.700 1.00 0.00 H new ATOM 0 HG SER A 28 12.283 -4.879 -14.818 1.00 0.00 H new ATOM 485 N GLY A 29 13.650 -1.723 -11.022 1.00 0.00 N ATOM 486 CA GLY A 29 12.970 -1.185 -9.858 1.00 0.00 C ATOM 487 C GLY A 29 13.930 -0.578 -8.855 1.00 0.00 C ATOM 488 O GLY A 29 13.542 -0.249 -7.733 1.00 0.00 O ATOM 0 H GLY A 29 14.238 -1.055 -11.521 1.00 0.00 H new ATOM 0 HA2 GLY A 29 12.255 -0.427 -10.177 1.00 0.00 H new ATOM 0 HA3 GLY A 29 12.399 -1.978 -9.376 1.00 0.00 H new ATOM 492 N LEU A 30 15.188 -0.430 -9.256 1.00 0.00 N ATOM 493 CA LEU A 30 16.208 0.140 -8.383 1.00 0.00 C ATOM 494 C LEU A 30 16.465 1.603 -8.730 1.00 0.00 C ATOM 495 O LEU A 30 15.945 2.117 -9.720 1.00 0.00 O ATOM 496 CB LEU A 30 17.508 -0.659 -8.495 1.00 0.00 C ATOM 497 CG LEU A 30 17.364 -2.181 -8.477 1.00 0.00 C ATOM 498 CD1 LEU A 30 18.627 -2.843 -9.006 1.00 0.00 C ATOM 499 CD2 LEU A 30 17.052 -2.670 -7.070 1.00 0.00 C ATOM 0 H LEU A 30 15.526 -0.697 -10.181 1.00 0.00 H new ATOM 0 HA LEU A 30 15.844 0.087 -7.357 1.00 0.00 H new ATOM 0 HB2 LEU A 30 18.009 -0.372 -9.420 1.00 0.00 H new ATOM 0 HB3 LEU A 30 18.163 -0.366 -7.674 1.00 0.00 H new ATOM 0 HG LEU A 30 16.534 -2.456 -9.128 1.00 0.00 H new ATOM 0 HD11 LEU A 30 18.506 -3.926 -8.986 1.00 0.00 H new ATOM 0 HD12 LEU A 30 18.807 -2.517 -10.030 1.00 0.00 H new ATOM 0 HD13 LEU A 30 19.475 -2.561 -8.381 1.00 0.00 H new ATOM 0 HD21 LEU A 30 16.953 -3.755 -7.076 1.00 0.00 H new ATOM 0 HD22 LEU A 30 17.860 -2.383 -6.397 1.00 0.00 H new ATOM 0 HD23 LEU A 30 16.119 -2.222 -6.728 1.00 0.00 H new ATOM 511 N ASP A 31 17.271 2.267 -7.909 1.00 0.00 N ATOM 512 CA ASP A 31 17.600 3.670 -8.130 1.00 0.00 C ATOM 513 C ASP A 31 19.112 3.874 -8.170 1.00 0.00 C ATOM 514 O ASP A 31 19.878 2.972 -7.833 1.00 0.00 O ATOM 515 CB ASP A 31 16.985 4.540 -7.032 1.00 0.00 C ATOM 516 CG ASP A 31 15.678 5.176 -7.461 1.00 0.00 C ATOM 517 OD1 ASP A 31 15.575 5.585 -8.637 1.00 0.00 O ATOM 518 OD2 ASP A 31 14.757 5.265 -6.622 1.00 0.00 O ATOM 0 H ASP A 31 17.709 1.856 -7.084 1.00 0.00 H new ATOM 0 HA ASP A 31 17.185 3.967 -9.093 1.00 0.00 H new ATOM 0 HB2 ASP A 31 16.815 3.932 -6.143 1.00 0.00 H new ATOM 0 HB3 ASP A 31 17.692 5.322 -6.753 1.00 0.00 H new ATOM 523 N GLU A 32 19.532 5.064 -8.586 1.00 0.00 N ATOM 524 CA GLU A 32 20.952 5.385 -8.672 1.00 0.00 C ATOM 525 C GLU A 32 21.610 5.315 -7.297 1.00 0.00 C ATOM 526 O GLU A 32 22.714 4.791 -7.152 1.00 0.00 O ATOM 527 CB GLU A 32 21.148 6.778 -9.273 1.00 0.00 C ATOM 528 CG GLU A 32 20.416 6.982 -10.589 1.00 0.00 C ATOM 529 CD GLU A 32 19.245 7.938 -10.463 1.00 0.00 C ATOM 530 OE1 GLU A 32 18.607 7.958 -9.390 1.00 0.00 O ATOM 531 OE2 GLU A 32 18.968 8.667 -11.438 1.00 0.00 O ATOM 0 H GLU A 32 18.910 5.821 -8.869 1.00 0.00 H new ATOM 0 HA GLU A 32 21.426 4.648 -9.320 1.00 0.00 H new ATOM 0 HB2 GLU A 32 20.805 7.525 -8.557 1.00 0.00 H new ATOM 0 HB3 GLU A 32 22.213 6.951 -9.429 1.00 0.00 H new ATOM 0 HG2 GLU A 32 21.114 7.365 -11.333 1.00 0.00 H new ATOM 0 HG3 GLU A 32 20.057 6.020 -10.954 1.00 0.00 H new ATOM 538 N GLU A 33 20.923 5.848 -6.291 1.00 0.00 N ATOM 539 CA GLU A 33 21.442 5.847 -4.928 1.00 0.00 C ATOM 540 C GLU A 33 21.303 4.466 -4.294 1.00 0.00 C ATOM 541 O GLU A 33 22.123 4.064 -3.467 1.00 0.00 O ATOM 542 CB GLU A 33 20.707 6.887 -4.079 1.00 0.00 C ATOM 543 CG GLU A 33 21.272 7.035 -2.676 1.00 0.00 C ATOM 544 CD GLU A 33 22.594 7.776 -2.654 1.00 0.00 C ATOM 545 OE1 GLU A 33 22.775 8.692 -3.484 1.00 0.00 O ATOM 546 OE2 GLU A 33 23.448 7.441 -1.807 1.00 0.00 O ATOM 0 H GLU A 33 20.007 6.285 -6.394 1.00 0.00 H new ATOM 0 HA GLU A 33 22.501 6.104 -4.969 1.00 0.00 H new ATOM 0 HB2 GLU A 33 20.751 7.852 -4.583 1.00 0.00 H new ATOM 0 HB3 GLU A 33 19.655 6.611 -4.011 1.00 0.00 H new ATOM 0 HG2 GLU A 33 20.552 7.566 -2.053 1.00 0.00 H new ATOM 0 HG3 GLU A 33 21.407 6.047 -2.237 1.00 0.00 H new ATOM 553 N LEU A 34 20.259 3.744 -4.686 1.00 0.00 N ATOM 554 CA LEU A 34 20.010 2.408 -4.156 1.00 0.00 C ATOM 555 C LEU A 34 21.010 1.404 -4.720 1.00 0.00 C ATOM 556 O LEU A 34 21.438 0.480 -4.027 1.00 0.00 O ATOM 557 CB LEU A 34 18.584 1.964 -4.485 1.00 0.00 C ATOM 558 CG LEU A 34 17.691 1.631 -3.289 1.00 0.00 C ATOM 559 CD1 LEU A 34 18.298 0.504 -2.468 1.00 0.00 C ATOM 560 CD2 LEU A 34 17.474 2.865 -2.425 1.00 0.00 C ATOM 0 H LEU A 34 19.571 4.061 -5.369 1.00 0.00 H new ATOM 0 HA LEU A 34 20.131 2.445 -3.073 1.00 0.00 H new ATOM 0 HB2 LEU A 34 18.103 2.753 -5.063 1.00 0.00 H new ATOM 0 HB3 LEU A 34 18.638 1.086 -5.128 1.00 0.00 H new ATOM 0 HG LEU A 34 16.723 1.300 -3.664 1.00 0.00 H new ATOM 0 HD11 LEU A 34 17.649 0.280 -1.621 1.00 0.00 H new ATOM 0 HD12 LEU A 34 18.401 -0.385 -3.090 1.00 0.00 H new ATOM 0 HD13 LEU A 34 19.279 0.807 -2.103 1.00 0.00 H new ATOM 0 HD21 LEU A 34 16.836 2.609 -1.579 1.00 0.00 H new ATOM 0 HD22 LEU A 34 18.435 3.226 -2.059 1.00 0.00 H new ATOM 0 HD23 LEU A 34 16.995 3.644 -3.018 1.00 0.00 H new ATOM 572 N THR A 35 21.381 1.591 -5.983 1.00 0.00 N ATOM 573 CA THR A 35 22.331 0.703 -6.641 1.00 0.00 C ATOM 574 C THR A 35 23.607 0.559 -5.821 1.00 0.00 C ATOM 575 O THR A 35 24.175 -0.528 -5.725 1.00 0.00 O ATOM 576 CB THR A 35 22.694 1.212 -8.049 1.00 0.00 C ATOM 577 OG1 THR A 35 21.523 1.251 -8.872 1.00 0.00 O ATOM 578 CG2 THR A 35 23.743 0.319 -8.693 1.00 0.00 C ATOM 0 H THR A 35 21.037 2.350 -6.571 1.00 0.00 H new ATOM 0 HA THR A 35 21.846 -0.269 -6.728 1.00 0.00 H new ATOM 0 HB THR A 35 23.105 2.217 -7.954 1.00 0.00 H new ATOM 0 HG1 THR A 35 20.823 1.767 -8.421 1.00 0.00 H new ATOM 0 HG21 THR A 35 23.983 0.698 -9.686 1.00 0.00 H new ATOM 0 HG22 THR A 35 24.643 0.314 -8.079 1.00 0.00 H new ATOM 0 HG23 THR A 35 23.355 -0.696 -8.776 1.00 0.00 H new ATOM 586 N GLU A 36 24.053 1.664 -5.230 1.00 0.00 N ATOM 587 CA GLU A 36 25.264 1.659 -4.417 1.00 0.00 C ATOM 588 C GLU A 36 25.116 0.717 -3.225 1.00 0.00 C ATOM 589 O GLU A 36 26.102 0.198 -2.702 1.00 0.00 O ATOM 590 CB GLU A 36 25.582 3.073 -3.928 1.00 0.00 C ATOM 591 CG GLU A 36 26.001 4.022 -5.038 1.00 0.00 C ATOM 592 CD GLU A 36 27.098 4.976 -4.607 1.00 0.00 C ATOM 593 OE1 GLU A 36 28.070 4.517 -3.973 1.00 0.00 O ATOM 594 OE2 GLU A 36 26.983 6.184 -4.905 1.00 0.00 O ATOM 0 H GLU A 36 23.594 2.573 -5.299 1.00 0.00 H new ATOM 0 HA GLU A 36 26.086 1.304 -5.038 1.00 0.00 H new ATOM 0 HB2 GLU A 36 24.705 3.480 -3.425 1.00 0.00 H new ATOM 0 HB3 GLU A 36 26.379 3.021 -3.186 1.00 0.00 H new ATOM 0 HG2 GLU A 36 26.344 3.443 -5.895 1.00 0.00 H new ATOM 0 HG3 GLU A 36 25.134 4.596 -5.367 1.00 0.00 H new ATOM 601 N LYS A 37 23.875 0.502 -2.800 1.00 0.00 N ATOM 602 CA LYS A 37 23.595 -0.376 -1.670 1.00 0.00 C ATOM 603 C LYS A 37 23.797 -1.838 -2.055 1.00 0.00 C ATOM 604 O LYS A 37 24.543 -2.566 -1.398 1.00 0.00 O ATOM 605 CB LYS A 37 22.163 -0.162 -1.174 1.00 0.00 C ATOM 606 CG LYS A 37 21.770 1.301 -1.065 1.00 0.00 C ATOM 607 CD LYS A 37 22.657 2.045 -0.080 1.00 0.00 C ATOM 608 CE LYS A 37 23.776 2.791 -0.791 1.00 0.00 C ATOM 609 NZ LYS A 37 24.238 3.972 -0.010 1.00 0.00 N ATOM 0 H LYS A 37 23.047 0.924 -3.221 1.00 0.00 H new ATOM 0 HA LYS A 37 24.291 -0.129 -0.869 1.00 0.00 H new ATOM 0 HB2 LYS A 37 21.474 -0.665 -1.852 1.00 0.00 H new ATOM 0 HB3 LYS A 37 22.051 -0.633 -0.198 1.00 0.00 H new ATOM 0 HG2 LYS A 37 21.840 1.771 -2.046 1.00 0.00 H new ATOM 0 HG3 LYS A 37 20.730 1.377 -0.748 1.00 0.00 H new ATOM 0 HD2 LYS A 37 22.055 2.750 0.493 1.00 0.00 H new ATOM 0 HD3 LYS A 37 23.084 1.339 0.632 1.00 0.00 H new ATOM 0 HE2 LYS A 37 24.615 2.115 -0.958 1.00 0.00 H new ATOM 0 HE3 LYS A 37 23.430 3.117 -1.772 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 25.001 4.454 -0.528 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 23.444 4.629 0.128 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 24.592 3.659 0.916 1.00 0.00 H new ATOM 623 N LEU A 38 23.131 -2.262 -3.123 1.00 0.00 N ATOM 624 CA LEU A 38 23.239 -3.637 -3.596 1.00 0.00 C ATOM 625 C LEU A 38 24.655 -3.938 -4.079 1.00 0.00 C ATOM 626 O LEU A 38 25.250 -4.945 -3.697 1.00 0.00 O ATOM 627 CB LEU A 38 22.239 -3.889 -4.726 1.00 0.00 C ATOM 628 CG LEU A 38 20.803 -3.433 -4.465 1.00 0.00 C ATOM 629 CD1 LEU A 38 20.481 -3.505 -2.980 1.00 0.00 C ATOM 630 CD2 LEU A 38 20.588 -2.021 -4.991 1.00 0.00 C ATOM 0 H LEU A 38 22.510 -1.673 -3.678 1.00 0.00 H new ATOM 0 HA LEU A 38 23.011 -4.300 -2.762 1.00 0.00 H new ATOM 0 HB2 LEU A 38 22.601 -3.387 -5.623 1.00 0.00 H new ATOM 0 HB3 LEU A 38 22.226 -4.957 -4.942 1.00 0.00 H new ATOM 0 HG LEU A 38 20.127 -4.104 -4.995 1.00 0.00 H new ATOM 0 HD11 LEU A 38 19.455 -3.177 -2.814 1.00 0.00 H new ATOM 0 HD12 LEU A 38 20.594 -4.532 -2.633 1.00 0.00 H new ATOM 0 HD13 LEU A 38 21.163 -2.858 -2.428 1.00 0.00 H new ATOM 0 HD21 LEU A 38 19.561 -1.713 -4.797 1.00 0.00 H new ATOM 0 HD22 LEU A 38 21.273 -1.338 -4.489 1.00 0.00 H new ATOM 0 HD23 LEU A 38 20.776 -2.000 -6.064 1.00 0.00 H new ATOM 642 N ILE A 39 25.187 -3.056 -4.918 1.00 0.00 N ATOM 643 CA ILE A 39 26.534 -3.225 -5.450 1.00 0.00 C ATOM 644 C ILE A 39 27.549 -3.410 -4.327 1.00 0.00 C ATOM 645 O ILE A 39 28.581 -4.055 -4.510 1.00 0.00 O ATOM 646 CB ILE A 39 26.954 -2.021 -6.313 1.00 0.00 C ATOM 647 CG1 ILE A 39 28.104 -2.410 -7.245 1.00 0.00 C ATOM 648 CG2 ILE A 39 27.355 -0.850 -5.429 1.00 0.00 C ATOM 649 CD1 ILE A 39 28.646 -1.251 -8.052 1.00 0.00 C ATOM 0 H ILE A 39 24.706 -2.217 -5.244 1.00 0.00 H new ATOM 0 HA ILE A 39 26.517 -4.119 -6.073 1.00 0.00 H new ATOM 0 HB ILE A 39 26.104 -1.716 -6.923 1.00 0.00 H new ATOM 0 HG12 ILE A 39 28.912 -2.839 -6.652 1.00 0.00 H new ATOM 0 HG13 ILE A 39 27.761 -3.188 -7.927 1.00 0.00 H new ATOM 0 HG21 ILE A 39 27.649 -0.007 -6.054 1.00 0.00 H new ATOM 0 HG22 ILE A 39 26.511 -0.561 -4.803 1.00 0.00 H new ATOM 0 HG23 ILE A 39 28.193 -1.142 -4.796 1.00 0.00 H new ATOM 0 HD11 ILE A 39 29.458 -1.600 -8.690 1.00 0.00 H new ATOM 0 HD12 ILE A 39 27.851 -0.836 -8.671 1.00 0.00 H new ATOM 0 HD13 ILE A 39 29.020 -0.481 -7.377 1.00 0.00 H new ATOM 661 N GLU A 40 27.247 -2.841 -3.164 1.00 0.00 N ATOM 662 CA GLU A 40 28.134 -2.944 -2.011 1.00 0.00 C ATOM 663 C GLU A 40 28.003 -4.311 -1.345 1.00 0.00 C ATOM 664 O GLU A 40 29.002 -4.968 -1.051 1.00 0.00 O ATOM 665 CB GLU A 40 27.822 -1.840 -0.999 1.00 0.00 C ATOM 666 CG GLU A 40 28.732 -0.629 -1.119 1.00 0.00 C ATOM 667 CD GLU A 40 30.114 -0.880 -0.547 1.00 0.00 C ATOM 668 OE1 GLU A 40 30.278 -0.757 0.685 1.00 0.00 O ATOM 669 OE2 GLU A 40 31.031 -1.200 -1.332 1.00 0.00 O ATOM 0 H GLU A 40 26.396 -2.305 -2.995 1.00 0.00 H new ATOM 0 HA GLU A 40 29.159 -2.826 -2.362 1.00 0.00 H new ATOM 0 HB2 GLU A 40 26.788 -1.521 -1.129 1.00 0.00 H new ATOM 0 HB3 GLU A 40 27.905 -2.248 0.008 1.00 0.00 H new ATOM 0 HG2 GLU A 40 28.822 -0.349 -2.169 1.00 0.00 H new ATOM 0 HG3 GLU A 40 28.277 0.216 -0.602 1.00 0.00 H new ATOM 676 N ARG A 41 26.765 -4.732 -1.109 1.00 0.00 N ATOM 677 CA ARG A 41 26.503 -6.019 -0.476 1.00 0.00 C ATOM 678 C ARG A 41 26.934 -7.168 -1.383 1.00 0.00 C ATOM 679 O ARG A 41 27.576 -8.119 -0.935 1.00 0.00 O ATOM 680 CB ARG A 41 25.017 -6.151 -0.138 1.00 0.00 C ATOM 681 CG ARG A 41 24.531 -5.135 0.882 1.00 0.00 C ATOM 682 CD ARG A 41 24.778 -5.612 2.305 1.00 0.00 C ATOM 683 NE ARG A 41 24.290 -4.657 3.295 1.00 0.00 N ATOM 684 CZ ARG A 41 24.235 -4.911 4.598 1.00 0.00 C ATOM 685 NH1 ARG A 41 24.638 -6.085 5.064 1.00 0.00 N ATOM 686 NH2 ARG A 41 23.779 -3.990 5.437 1.00 0.00 N ATOM 0 H ARG A 41 25.927 -4.201 -1.347 1.00 0.00 H new ATOM 0 HA ARG A 41 27.084 -6.069 0.445 1.00 0.00 H new ATOM 0 HB2 ARG A 41 24.434 -6.042 -1.053 1.00 0.00 H new ATOM 0 HB3 ARG A 41 24.828 -7.155 0.243 1.00 0.00 H new ATOM 0 HG2 ARG A 41 25.041 -4.185 0.722 1.00 0.00 H new ATOM 0 HG3 ARG A 41 23.466 -4.954 0.738 1.00 0.00 H new ATOM 0 HD2 ARG A 41 24.286 -6.573 2.456 1.00 0.00 H new ATOM 0 HD3 ARG A 41 25.846 -5.774 2.453 1.00 0.00 H new ATOM 0 HE ARG A 41 23.974 -3.744 2.968 1.00 0.00 H new ATOM 0 HH11 ARG A 41 24.991 -6.795 4.422 1.00 0.00 H new ATOM 0 HH12 ARG A 41 24.595 -6.278 6.065 1.00 0.00 H new ATOM 0 HH21 ARG A 41 23.470 -3.085 5.082 1.00 0.00 H new ATOM 0 HH22 ARG A 41 23.738 -4.187 6.437 1.00 0.00 H new ATOM 700 N LEU A 42 26.576 -7.074 -2.659 1.00 0.00 N ATOM 701 CA LEU A 42 26.925 -8.106 -3.629 1.00 0.00 C ATOM 702 C LEU A 42 28.388 -7.989 -4.046 1.00 0.00 C ATOM 703 O LEU A 42 29.076 -8.995 -4.222 1.00 0.00 O ATOM 704 CB LEU A 42 26.023 -8.003 -4.860 1.00 0.00 C ATOM 705 CG LEU A 42 24.522 -8.145 -4.605 1.00 0.00 C ATOM 706 CD1 LEU A 42 23.735 -7.846 -5.871 1.00 0.00 C ATOM 707 CD2 LEU A 42 24.198 -9.540 -4.091 1.00 0.00 C ATOM 0 H LEU A 42 26.044 -6.294 -3.046 1.00 0.00 H new ATOM 0 HA LEU A 42 26.777 -9.078 -3.158 1.00 0.00 H new ATOM 0 HB2 LEU A 42 26.201 -7.039 -5.336 1.00 0.00 H new ATOM 0 HB3 LEU A 42 26.325 -8.771 -5.572 1.00 0.00 H new ATOM 0 HG LEU A 42 24.233 -7.422 -3.842 1.00 0.00 H new ATOM 0 HD11 LEU A 42 22.669 -7.952 -5.670 1.00 0.00 H new ATOM 0 HD12 LEU A 42 23.943 -6.827 -6.197 1.00 0.00 H new ATOM 0 HD13 LEU A 42 24.028 -8.544 -6.655 1.00 0.00 H new ATOM 0 HD21 LEU A 42 23.126 -9.623 -3.915 1.00 0.00 H new ATOM 0 HD22 LEU A 42 24.503 -10.280 -4.831 1.00 0.00 H new ATOM 0 HD23 LEU A 42 24.733 -9.718 -3.158 1.00 0.00 H new ATOM 719 N ASP A 43 28.857 -6.756 -4.199 1.00 0.00 N ATOM 720 CA ASP A 43 30.239 -6.507 -4.592 1.00 0.00 C ATOM 721 C ASP A 43 30.500 -7.006 -6.009 1.00 0.00 C ATOM 722 O ASP A 43 31.490 -7.691 -6.263 1.00 0.00 O ATOM 723 CB ASP A 43 31.200 -7.185 -3.614 1.00 0.00 C ATOM 724 CG ASP A 43 32.508 -6.433 -3.470 1.00 0.00 C ATOM 725 OD1 ASP A 43 32.859 -5.672 -4.396 1.00 0.00 O ATOM 726 OD2 ASP A 43 33.182 -6.605 -2.433 1.00 0.00 O ATOM 0 H ASP A 43 28.301 -5.913 -4.057 1.00 0.00 H new ATOM 0 HA ASP A 43 30.409 -5.431 -4.569 1.00 0.00 H new ATOM 0 HB2 ASP A 43 30.722 -7.266 -2.638 1.00 0.00 H new ATOM 0 HB3 ASP A 43 31.404 -8.200 -3.955 1.00 0.00 H new ATOM 731 N GLU A 44 29.604 -6.658 -6.928 1.00 0.00 N ATOM 732 CA GLU A 44 29.737 -7.074 -8.319 1.00 0.00 C ATOM 733 C GLU A 44 29.615 -5.877 -9.258 1.00 0.00 C ATOM 734 O GLU A 44 29.435 -4.743 -8.815 1.00 0.00 O ATOM 735 CB GLU A 44 28.675 -8.119 -8.667 1.00 0.00 C ATOM 736 CG GLU A 44 27.357 -7.912 -7.940 1.00 0.00 C ATOM 737 CD GLU A 44 26.726 -6.568 -8.247 1.00 0.00 C ATOM 738 OE1 GLU A 44 27.221 -5.547 -7.727 1.00 0.00 O ATOM 739 OE2 GLU A 44 25.737 -6.539 -9.009 1.00 0.00 O ATOM 0 H GLU A 44 28.779 -6.090 -6.734 1.00 0.00 H new ATOM 0 HA GLU A 44 30.725 -7.516 -8.446 1.00 0.00 H new ATOM 0 HB2 GLU A 44 28.495 -8.098 -9.742 1.00 0.00 H new ATOM 0 HB3 GLU A 44 29.060 -9.110 -8.428 1.00 0.00 H new ATOM 0 HG2 GLU A 44 26.664 -8.706 -8.218 1.00 0.00 H new ATOM 0 HG3 GLU A 44 27.522 -7.995 -6.866 1.00 0.00 H new ATOM 746 N ASP A 45 29.714 -6.139 -10.557 1.00 0.00 N ATOM 747 CA ASP A 45 29.614 -5.085 -11.559 1.00 0.00 C ATOM 748 C ASP A 45 28.155 -4.760 -11.863 1.00 0.00 C ATOM 749 O ASP A 45 27.430 -5.578 -12.432 1.00 0.00 O ATOM 750 CB ASP A 45 30.334 -5.501 -12.842 1.00 0.00 C ATOM 751 CG ASP A 45 31.485 -4.577 -13.187 1.00 0.00 C ATOM 752 OD1 ASP A 45 32.414 -4.451 -12.361 1.00 0.00 O ATOM 753 OD2 ASP A 45 31.458 -3.979 -14.283 1.00 0.00 O ATOM 0 H ASP A 45 29.863 -7.072 -10.940 1.00 0.00 H new ATOM 0 HA ASP A 45 30.091 -4.191 -11.158 1.00 0.00 H new ATOM 0 HB2 ASP A 45 30.710 -6.518 -12.731 1.00 0.00 H new ATOM 0 HB3 ASP A 45 29.622 -5.513 -13.667 1.00 0.00 H new ATOM 758 N THR A 46 27.728 -3.561 -11.479 1.00 0.00 N ATOM 759 CA THR A 46 26.355 -3.129 -11.708 1.00 0.00 C ATOM 760 C THR A 46 26.289 -2.052 -12.785 1.00 0.00 C ATOM 761 O THR A 46 27.256 -1.324 -13.006 1.00 0.00 O ATOM 762 CB THR A 46 25.714 -2.587 -10.417 1.00 0.00 C ATOM 763 OG1 THR A 46 26.467 -1.473 -9.926 1.00 0.00 O ATOM 764 CG2 THR A 46 25.647 -3.670 -9.350 1.00 0.00 C ATOM 0 H THR A 46 28.314 -2.872 -11.008 1.00 0.00 H new ATOM 0 HA THR A 46 25.800 -4.006 -12.041 1.00 0.00 H new ATOM 0 HB THR A 46 24.699 -2.265 -10.650 1.00 0.00 H new ATOM 0 HG1 THR A 46 25.948 -0.650 -10.043 1.00 0.00 H new ATOM 0 HG21 THR A 46 25.191 -3.264 -8.447 1.00 0.00 H new ATOM 0 HG22 THR A 46 25.048 -4.504 -9.715 1.00 0.00 H new ATOM 0 HG23 THR A 46 26.654 -4.019 -9.122 1.00 0.00 H new ATOM 772 N GLU A 47 25.143 -1.957 -13.452 1.00 0.00 N ATOM 773 CA GLU A 47 24.953 -0.969 -14.507 1.00 0.00 C ATOM 774 C GLU A 47 23.469 -0.748 -14.785 1.00 0.00 C ATOM 775 O GLU A 47 22.675 -1.688 -14.757 1.00 0.00 O ATOM 776 CB GLU A 47 25.663 -1.413 -15.787 1.00 0.00 C ATOM 777 CG GLU A 47 27.047 -0.811 -15.957 1.00 0.00 C ATOM 778 CD GLU A 47 27.359 -0.462 -17.399 1.00 0.00 C ATOM 779 OE1 GLU A 47 27.620 -1.392 -18.191 1.00 0.00 O ATOM 780 OE2 GLU A 47 27.343 0.740 -17.737 1.00 0.00 O ATOM 0 H GLU A 47 24.333 -2.552 -13.280 1.00 0.00 H new ATOM 0 HA GLU A 47 25.385 -0.027 -14.169 1.00 0.00 H new ATOM 0 HB2 GLU A 47 25.747 -2.500 -15.787 1.00 0.00 H new ATOM 0 HB3 GLU A 47 25.050 -1.140 -16.646 1.00 0.00 H new ATOM 0 HG2 GLU A 47 27.126 0.087 -15.345 1.00 0.00 H new ATOM 0 HG3 GLU A 47 27.793 -1.515 -15.588 1.00 0.00 H new ATOM 787 N ARG A 48 23.103 0.502 -15.052 1.00 0.00 N ATOM 788 CA ARG A 48 21.715 0.847 -15.333 1.00 0.00 C ATOM 789 C ARG A 48 21.498 1.054 -16.829 1.00 0.00 C ATOM 790 O ARG A 48 22.109 1.932 -17.440 1.00 0.00 O ATOM 791 CB ARG A 48 21.317 2.112 -14.570 1.00 0.00 C ATOM 792 CG ARG A 48 22.435 3.135 -14.463 1.00 0.00 C ATOM 793 CD ARG A 48 22.005 4.348 -13.653 1.00 0.00 C ATOM 794 NE ARG A 48 21.067 5.193 -14.388 1.00 0.00 N ATOM 795 CZ ARG A 48 19.748 5.049 -14.332 1.00 0.00 C ATOM 796 NH1 ARG A 48 19.213 4.099 -13.577 1.00 0.00 N ATOM 797 NH2 ARG A 48 18.961 5.857 -15.030 1.00 0.00 N ATOM 0 H ARG A 48 23.748 1.292 -15.079 1.00 0.00 H new ATOM 0 HA ARG A 48 21.088 0.019 -15.003 1.00 0.00 H new ATOM 0 HB2 ARG A 48 20.462 2.571 -15.066 1.00 0.00 H new ATOM 0 HB3 ARG A 48 20.993 1.834 -13.567 1.00 0.00 H new ATOM 0 HG2 ARG A 48 23.307 2.675 -13.997 1.00 0.00 H new ATOM 0 HG3 ARG A 48 22.737 3.451 -15.461 1.00 0.00 H new ATOM 0 HD2 ARG A 48 21.543 4.017 -12.723 1.00 0.00 H new ATOM 0 HD3 ARG A 48 22.884 4.933 -13.382 1.00 0.00 H new ATOM 0 HE ARG A 48 21.446 5.935 -14.977 1.00 0.00 H new ATOM 0 HH11 ARG A 48 19.815 3.477 -13.038 1.00 0.00 H new ATOM 0 HH12 ARG A 48 18.200 3.991 -13.536 1.00 0.00 H new ATOM 0 HH21 ARG A 48 19.369 6.590 -15.611 1.00 0.00 H new ATOM 0 HH22 ARG A 48 17.948 5.745 -14.986 1.00 0.00 H new ATOM 811 N ASP A 49 20.626 0.240 -17.414 1.00 0.00 N ATOM 812 CA ASP A 49 20.329 0.333 -18.838 1.00 0.00 C ATOM 813 C ASP A 49 18.823 0.301 -19.082 1.00 0.00 C ATOM 814 O ASP A 49 18.173 -0.724 -18.877 1.00 0.00 O ATOM 815 CB ASP A 49 21.006 -0.808 -19.599 1.00 0.00 C ATOM 816 CG ASP A 49 20.960 -0.611 -21.101 1.00 0.00 C ATOM 817 OD1 ASP A 49 21.602 0.339 -21.594 1.00 0.00 O ATOM 818 OD2 ASP A 49 20.280 -1.406 -21.784 1.00 0.00 O ATOM 0 H ASP A 49 20.112 -0.492 -16.923 1.00 0.00 H new ATOM 0 HA ASP A 49 20.718 1.283 -19.203 1.00 0.00 H new ATOM 0 HB2 ASP A 49 22.045 -0.889 -19.278 1.00 0.00 H new ATOM 0 HB3 ASP A 49 20.519 -1.750 -19.344 1.00 0.00 H new ATOM 823 N ASP A 50 18.276 1.429 -19.520 1.00 0.00 N ATOM 824 CA ASP A 50 16.847 1.531 -19.792 1.00 0.00 C ATOM 825 C ASP A 50 16.031 1.151 -18.560 1.00 0.00 C ATOM 826 O ASP A 50 14.894 0.694 -18.672 1.00 0.00 O ATOM 827 CB ASP A 50 16.465 0.631 -20.968 1.00 0.00 C ATOM 828 CG ASP A 50 16.835 1.240 -22.306 1.00 0.00 C ATOM 829 OD1 ASP A 50 16.883 2.485 -22.399 1.00 0.00 O ATOM 830 OD2 ASP A 50 17.078 0.472 -23.260 1.00 0.00 O ATOM 0 H ASP A 50 18.801 2.286 -19.694 1.00 0.00 H new ATOM 0 HA ASP A 50 16.624 2.567 -20.049 1.00 0.00 H new ATOM 0 HB2 ASP A 50 16.962 -0.333 -20.861 1.00 0.00 H new ATOM 0 HB3 ASP A 50 15.392 0.441 -20.943 1.00 0.00 H new ATOM 835 N GLY A 51 16.621 1.343 -17.383 1.00 0.00 N ATOM 836 CA GLY A 51 15.935 1.015 -16.147 1.00 0.00 C ATOM 837 C GLY A 51 16.297 -0.364 -15.632 1.00 0.00 C ATOM 838 O GLY A 51 16.018 -0.696 -14.479 1.00 0.00 O ATOM 0 H GLY A 51 17.561 1.720 -17.264 1.00 0.00 H new ATOM 0 HA2 GLY A 51 16.182 1.759 -15.389 1.00 0.00 H new ATOM 0 HA3 GLY A 51 14.858 1.069 -16.307 1.00 0.00 H new ATOM 842 N ASP A 52 16.919 -1.169 -16.486 1.00 0.00 N ATOM 843 CA ASP A 52 17.319 -2.520 -16.111 1.00 0.00 C ATOM 844 C ASP A 52 18.687 -2.513 -15.435 1.00 0.00 C ATOM 845 O ASP A 52 19.532 -1.667 -15.729 1.00 0.00 O ATOM 846 CB ASP A 52 17.350 -3.426 -17.343 1.00 0.00 C ATOM 847 CG ASP A 52 16.242 -3.104 -18.326 1.00 0.00 C ATOM 848 OD1 ASP A 52 15.081 -2.961 -17.887 1.00 0.00 O ATOM 849 OD2 ASP A 52 16.535 -2.995 -19.535 1.00 0.00 O ATOM 0 H ASP A 52 17.157 -0.909 -17.443 1.00 0.00 H new ATOM 0 HA ASP A 52 16.586 -2.907 -15.404 1.00 0.00 H new ATOM 0 HB2 ASP A 52 18.314 -3.325 -17.841 1.00 0.00 H new ATOM 0 HB3 ASP A 52 17.262 -4.466 -17.028 1.00 0.00 H new ATOM 854 N LEU A 53 18.897 -3.460 -14.528 1.00 0.00 N ATOM 855 CA LEU A 53 20.162 -3.563 -13.808 1.00 0.00 C ATOM 856 C LEU A 53 20.879 -4.864 -14.152 1.00 0.00 C ATOM 857 O LEU A 53 20.308 -5.949 -14.038 1.00 0.00 O ATOM 858 CB LEU A 53 19.921 -3.484 -12.300 1.00 0.00 C ATOM 859 CG LEU A 53 21.069 -2.915 -11.466 1.00 0.00 C ATOM 860 CD1 LEU A 53 22.331 -3.742 -11.660 1.00 0.00 C ATOM 861 CD2 LEU A 53 21.322 -1.459 -11.829 1.00 0.00 C ATOM 0 H LEU A 53 18.208 -4.168 -14.273 1.00 0.00 H new ATOM 0 HA LEU A 53 20.794 -2.729 -14.113 1.00 0.00 H new ATOM 0 HB2 LEU A 53 19.035 -2.874 -12.125 1.00 0.00 H new ATOM 0 HB3 LEU A 53 19.695 -4.486 -11.935 1.00 0.00 H new ATOM 0 HG LEU A 53 20.786 -2.962 -10.414 1.00 0.00 H new ATOM 0 HD11 LEU A 53 23.137 -3.322 -11.059 1.00 0.00 H new ATOM 0 HD12 LEU A 53 22.144 -4.770 -11.349 1.00 0.00 H new ATOM 0 HD13 LEU A 53 22.617 -3.728 -12.712 1.00 0.00 H new ATOM 0 HD21 LEU A 53 22.142 -1.071 -11.225 1.00 0.00 H new ATOM 0 HD22 LEU A 53 21.583 -1.387 -12.885 1.00 0.00 H new ATOM 0 HD23 LEU A 53 20.422 -0.875 -11.637 1.00 0.00 H new ATOM 873 N ILE A 54 22.135 -4.748 -14.571 1.00 0.00 N ATOM 874 CA ILE A 54 22.932 -5.916 -14.928 1.00 0.00 C ATOM 875 C ILE A 54 23.822 -6.349 -13.769 1.00 0.00 C ATOM 876 O ILE A 54 24.524 -5.531 -13.174 1.00 0.00 O ATOM 877 CB ILE A 54 23.811 -5.641 -16.162 1.00 0.00 C ATOM 878 CG1 ILE A 54 23.050 -4.786 -17.178 1.00 0.00 C ATOM 879 CG2 ILE A 54 24.260 -6.950 -16.794 1.00 0.00 C ATOM 880 CD1 ILE A 54 21.759 -5.416 -17.651 1.00 0.00 C ATOM 0 H ILE A 54 22.622 -3.858 -14.672 1.00 0.00 H new ATOM 0 HA ILE A 54 22.231 -6.717 -15.163 1.00 0.00 H new ATOM 0 HB ILE A 54 24.696 -5.091 -15.844 1.00 0.00 H new ATOM 0 HG12 ILE A 54 22.830 -3.816 -16.732 1.00 0.00 H new ATOM 0 HG13 ILE A 54 23.692 -4.602 -18.039 1.00 0.00 H new ATOM 0 HG21 ILE A 54 24.880 -6.739 -17.665 1.00 0.00 H new ATOM 0 HG22 ILE A 54 24.836 -7.525 -16.069 1.00 0.00 H new ATOM 0 HG23 ILE A 54 23.386 -7.524 -17.101 1.00 0.00 H new ATOM 0 HD11 ILE A 54 21.273 -4.755 -18.369 1.00 0.00 H new ATOM 0 HD12 ILE A 54 21.974 -6.373 -18.127 1.00 0.00 H new ATOM 0 HD13 ILE A 54 21.098 -5.575 -16.799 1.00 0.00 H new ATOM 892 N ILE A 55 23.790 -7.640 -13.455 1.00 0.00 N ATOM 893 CA ILE A 55 24.597 -8.182 -12.369 1.00 0.00 C ATOM 894 C ILE A 55 25.362 -9.422 -12.819 1.00 0.00 C ATOM 895 O ILE A 55 24.766 -10.449 -13.146 1.00 0.00 O ATOM 896 CB ILE A 55 23.730 -8.542 -11.149 1.00 0.00 C ATOM 897 CG1 ILE A 55 22.877 -7.343 -10.730 1.00 0.00 C ATOM 898 CG2 ILE A 55 24.606 -9.004 -9.994 1.00 0.00 C ATOM 899 CD1 ILE A 55 21.949 -7.635 -9.572 1.00 0.00 C ATOM 0 H ILE A 55 23.214 -8.330 -13.937 1.00 0.00 H new ATOM 0 HA ILE A 55 25.306 -7.404 -12.084 1.00 0.00 H new ATOM 0 HB ILE A 55 23.064 -9.360 -11.424 1.00 0.00 H new ATOM 0 HG12 ILE A 55 23.535 -6.517 -10.458 1.00 0.00 H new ATOM 0 HG13 ILE A 55 22.286 -7.012 -11.584 1.00 0.00 H new ATOM 0 HG21 ILE A 55 23.978 -9.255 -9.139 1.00 0.00 H new ATOM 0 HG22 ILE A 55 25.174 -9.883 -10.297 1.00 0.00 H new ATOM 0 HG23 ILE A 55 25.294 -8.205 -9.717 1.00 0.00 H new ATOM 0 HD11 ILE A 55 21.376 -6.740 -9.330 1.00 0.00 H new ATOM 0 HD12 ILE A 55 21.267 -8.439 -9.847 1.00 0.00 H new ATOM 0 HD13 ILE A 55 22.535 -7.937 -8.704 1.00 0.00 H new ATOM 911 N THR A 56 26.688 -9.321 -12.831 1.00 0.00 N ATOM 912 CA THR A 56 27.535 -10.434 -13.240 1.00 0.00 C ATOM 913 C THR A 56 28.368 -10.949 -12.072 1.00 0.00 C ATOM 914 O THR A 56 29.187 -10.220 -11.512 1.00 0.00 O ATOM 915 CB THR A 56 28.478 -10.030 -14.389 1.00 0.00 C ATOM 916 OG1 THR A 56 27.764 -9.256 -15.359 1.00 0.00 O ATOM 917 CG2 THR A 56 29.076 -11.260 -15.056 1.00 0.00 C ATOM 0 H THR A 56 27.198 -8.480 -12.562 1.00 0.00 H new ATOM 0 HA THR A 56 26.871 -11.226 -13.586 1.00 0.00 H new ATOM 0 HB THR A 56 29.288 -9.432 -13.972 1.00 0.00 H new ATOM 0 HG1 THR A 56 28.371 -9.002 -16.085 1.00 0.00 H new ATOM 0 HG21 THR A 56 29.738 -10.950 -15.864 1.00 0.00 H new ATOM 0 HG22 THR A 56 29.643 -11.833 -14.322 1.00 0.00 H new ATOM 0 HG23 THR A 56 28.276 -11.880 -15.460 1.00 0.00 H new ATOM 925 N VAL A 57 28.154 -12.209 -11.708 1.00 0.00 N ATOM 926 CA VAL A 57 28.887 -12.822 -10.607 1.00 0.00 C ATOM 927 C VAL A 57 29.473 -14.168 -11.018 1.00 0.00 C ATOM 928 O VAL A 57 28.739 -15.112 -11.316 1.00 0.00 O ATOM 929 CB VAL A 57 27.984 -13.022 -9.375 1.00 0.00 C ATOM 930 CG1 VAL A 57 27.652 -11.684 -8.733 1.00 0.00 C ATOM 931 CG2 VAL A 57 26.716 -13.769 -9.759 1.00 0.00 C ATOM 0 H VAL A 57 27.479 -12.826 -12.160 1.00 0.00 H new ATOM 0 HA VAL A 57 29.697 -12.141 -10.348 1.00 0.00 H new ATOM 0 HB VAL A 57 28.524 -13.624 -8.644 1.00 0.00 H new ATOM 0 HG11 VAL A 57 27.013 -11.846 -7.865 1.00 0.00 H new ATOM 0 HG12 VAL A 57 28.573 -11.192 -8.420 1.00 0.00 H new ATOM 0 HG13 VAL A 57 27.131 -11.054 -9.454 1.00 0.00 H new ATOM 0 HG21 VAL A 57 26.090 -13.901 -8.876 1.00 0.00 H new ATOM 0 HG22 VAL A 57 26.170 -13.197 -10.509 1.00 0.00 H new ATOM 0 HG23 VAL A 57 26.978 -14.745 -10.167 1.00 0.00 H new ATOM 941 N PHE A 58 30.799 -14.251 -11.032 1.00 0.00 N ATOM 942 CA PHE A 58 31.484 -15.482 -11.408 1.00 0.00 C ATOM 943 C PHE A 58 32.371 -15.980 -10.270 1.00 0.00 C ATOM 944 O PHE A 58 32.941 -15.187 -9.520 1.00 0.00 O ATOM 945 CB PHE A 58 32.327 -15.259 -12.665 1.00 0.00 C ATOM 946 CG PHE A 58 33.148 -14.002 -12.621 1.00 0.00 C ATOM 947 CD1 PHE A 58 34.242 -13.903 -11.777 1.00 0.00 C ATOM 948 CD2 PHE A 58 32.826 -12.919 -13.423 1.00 0.00 C ATOM 949 CE1 PHE A 58 35.001 -12.748 -11.734 1.00 0.00 C ATOM 950 CE2 PHE A 58 33.581 -11.762 -13.385 1.00 0.00 C ATOM 951 CZ PHE A 58 34.669 -11.676 -12.538 1.00 0.00 C ATOM 0 H PHE A 58 31.421 -13.480 -10.787 1.00 0.00 H new ATOM 0 HA PHE A 58 30.728 -16.239 -11.615 1.00 0.00 H new ATOM 0 HB2 PHE A 58 32.991 -16.112 -12.804 1.00 0.00 H new ATOM 0 HB3 PHE A 58 31.668 -15.223 -13.533 1.00 0.00 H new ATOM 0 HD1 PHE A 58 34.505 -14.738 -11.145 1.00 0.00 H new ATOM 0 HD2 PHE A 58 31.975 -12.980 -14.085 1.00 0.00 H new ATOM 0 HE1 PHE A 58 35.852 -12.685 -11.072 1.00 0.00 H new ATOM 0 HE2 PHE A 58 33.321 -10.926 -14.017 1.00 0.00 H new ATOM 0 HZ PHE A 58 35.259 -10.772 -12.505 1.00 0.00 H new ATOM 961 N TYR A 59 32.481 -17.298 -10.147 1.00 0.00 N ATOM 962 CA TYR A 59 33.295 -17.903 -9.100 1.00 0.00 C ATOM 963 C TYR A 59 33.961 -19.182 -9.597 1.00 0.00 C ATOM 964 O TYR A 59 33.344 -19.983 -10.299 1.00 0.00 O ATOM 965 CB TYR A 59 32.438 -18.206 -7.870 1.00 0.00 C ATOM 966 CG TYR A 59 31.521 -17.070 -7.476 1.00 0.00 C ATOM 967 CD1 TYR A 59 30.286 -16.901 -8.091 1.00 0.00 C ATOM 968 CD2 TYR A 59 31.889 -16.165 -6.487 1.00 0.00 C ATOM 969 CE1 TYR A 59 29.446 -15.864 -7.734 1.00 0.00 C ATOM 970 CE2 TYR A 59 31.055 -15.126 -6.124 1.00 0.00 C ATOM 971 CZ TYR A 59 29.835 -14.979 -6.750 1.00 0.00 C ATOM 972 OH TYR A 59 29.000 -13.946 -6.391 1.00 0.00 O ATOM 0 H TYR A 59 32.016 -17.968 -10.760 1.00 0.00 H new ATOM 0 HA TYR A 59 34.075 -17.192 -8.826 1.00 0.00 H new ATOM 0 HB2 TYR A 59 31.838 -19.095 -8.066 1.00 0.00 H new ATOM 0 HB3 TYR A 59 33.092 -18.441 -7.031 1.00 0.00 H new ATOM 0 HD1 TYR A 59 29.978 -17.592 -8.861 1.00 0.00 H new ATOM 0 HD2 TYR A 59 32.843 -16.276 -5.994 1.00 0.00 H new ATOM 0 HE1 TYR A 59 28.490 -15.747 -8.223 1.00 0.00 H new ATOM 0 HE2 TYR A 59 31.357 -14.432 -5.354 1.00 0.00 H new ATOM 0 HH TYR A 59 29.422 -13.415 -5.684 1.00 0.00 H new ATOM 982 N GLU A 60 35.224 -19.366 -9.227 1.00 0.00 N ATOM 983 CA GLU A 60 35.975 -20.548 -9.636 1.00 0.00 C ATOM 984 C GLU A 60 35.870 -21.649 -8.585 1.00 0.00 C ATOM 985 O GLU A 60 35.180 -21.496 -7.576 1.00 0.00 O ATOM 986 CB GLU A 60 37.444 -20.190 -9.871 1.00 0.00 C ATOM 987 CG GLU A 60 38.220 -19.931 -8.590 1.00 0.00 C ATOM 988 CD GLU A 60 39.118 -18.714 -8.689 1.00 0.00 C ATOM 989 OE1 GLU A 60 39.682 -18.480 -9.778 1.00 0.00 O ATOM 990 OE2 GLU A 60 39.256 -17.994 -7.677 1.00 0.00 O ATOM 0 H GLU A 60 35.749 -18.713 -8.645 1.00 0.00 H new ATOM 0 HA GLU A 60 35.545 -20.916 -10.567 1.00 0.00 H new ATOM 0 HB2 GLU A 60 37.924 -21.001 -10.419 1.00 0.00 H new ATOM 0 HB3 GLU A 60 37.497 -19.304 -10.503 1.00 0.00 H new ATOM 0 HG2 GLU A 60 37.519 -19.795 -7.766 1.00 0.00 H new ATOM 0 HG3 GLU A 60 38.825 -20.806 -8.353 1.00 0.00 H new ATOM 997 N ARG A 61 36.558 -22.760 -8.829 1.00 0.00 N ATOM 998 CA ARG A 61 36.541 -23.888 -7.905 1.00 0.00 C ATOM 999 C ARG A 61 36.733 -23.416 -6.467 1.00 0.00 C ATOM 1000 O ARG A 61 36.176 -23.994 -5.535 1.00 0.00 O ATOM 1001 CB ARG A 61 37.634 -24.892 -8.274 1.00 0.00 C ATOM 1002 CG ARG A 61 37.097 -26.197 -8.839 1.00 0.00 C ATOM 1003 CD ARG A 61 36.258 -26.944 -7.815 1.00 0.00 C ATOM 1004 NE ARG A 61 35.911 -28.289 -8.266 1.00 0.00 N ATOM 1005 CZ ARG A 61 36.773 -29.299 -8.295 1.00 0.00 C ATOM 1006 NH1 ARG A 61 38.026 -29.118 -7.899 1.00 0.00 N ATOM 1007 NH2 ARG A 61 36.383 -30.494 -8.719 1.00 0.00 N ATOM 0 H ARG A 61 37.134 -22.903 -9.659 1.00 0.00 H new ATOM 0 HA ARG A 61 35.569 -24.375 -7.982 1.00 0.00 H new ATOM 0 HB2 ARG A 61 38.302 -24.437 -9.005 1.00 0.00 H new ATOM 0 HB3 ARG A 61 38.231 -25.108 -7.388 1.00 0.00 H new ATOM 0 HG2 ARG A 61 36.495 -25.991 -9.724 1.00 0.00 H new ATOM 0 HG3 ARG A 61 37.928 -26.826 -9.158 1.00 0.00 H new ATOM 0 HD2 ARG A 61 36.806 -27.007 -6.875 1.00 0.00 H new ATOM 0 HD3 ARG A 61 35.346 -26.382 -7.615 1.00 0.00 H new ATOM 0 HE ARG A 61 34.955 -28.462 -8.576 1.00 0.00 H new ATOM 0 HH11 ARG A 61 38.330 -28.201 -7.571 1.00 0.00 H new ATOM 0 HH12 ARG A 61 38.686 -29.896 -7.922 1.00 0.00 H new ATOM 0 HH21 ARG A 61 35.420 -30.638 -9.023 1.00 0.00 H new ATOM 0 HH22 ARG A 61 37.046 -31.269 -8.741 1.00 0.00 H new ATOM 1021 N GLU A 62 37.526 -22.362 -6.296 1.00 0.00 N ATOM 1022 CA GLU A 62 37.792 -21.814 -4.971 1.00 0.00 C ATOM 1023 C GLU A 62 36.490 -21.529 -4.229 1.00 0.00 C ATOM 1024 O GLU A 62 36.400 -21.718 -3.015 1.00 0.00 O ATOM 1025 CB GLU A 62 38.619 -20.531 -5.082 1.00 0.00 C ATOM 1026 CG GLU A 62 40.034 -20.761 -5.587 1.00 0.00 C ATOM 1027 CD GLU A 62 40.998 -21.123 -4.474 1.00 0.00 C ATOM 1028 OE1 GLU A 62 41.220 -20.276 -3.584 1.00 0.00 O ATOM 1029 OE2 GLU A 62 41.531 -22.252 -4.494 1.00 0.00 O ATOM 0 H GLU A 62 37.995 -21.871 -7.058 1.00 0.00 H new ATOM 0 HA GLU A 62 38.358 -22.555 -4.406 1.00 0.00 H new ATOM 0 HB2 GLU A 62 38.111 -19.838 -5.753 1.00 0.00 H new ATOM 0 HB3 GLU A 62 38.665 -20.052 -4.104 1.00 0.00 H new ATOM 0 HG2 GLU A 62 40.026 -21.559 -6.329 1.00 0.00 H new ATOM 0 HG3 GLU A 62 40.387 -19.861 -6.090 1.00 0.00 H new ATOM 1036 N TYR A 63 35.483 -21.074 -4.966 1.00 0.00 N ATOM 1037 CA TYR A 63 34.186 -20.760 -4.378 1.00 0.00 C ATOM 1038 C TYR A 63 33.082 -21.599 -5.014 1.00 0.00 C ATOM 1039 O TYR A 63 31.895 -21.326 -4.832 1.00 0.00 O ATOM 1040 CB TYR A 63 33.873 -19.273 -4.545 1.00 0.00 C ATOM 1041 CG TYR A 63 34.183 -18.446 -3.318 1.00 0.00 C ATOM 1042 CD1 TYR A 63 35.493 -18.262 -2.893 1.00 0.00 C ATOM 1043 CD2 TYR A 63 33.166 -17.850 -2.582 1.00 0.00 C ATOM 1044 CE1 TYR A 63 35.781 -17.509 -1.771 1.00 0.00 C ATOM 1045 CE2 TYR A 63 33.445 -17.094 -1.460 1.00 0.00 C ATOM 1046 CZ TYR A 63 34.753 -16.926 -1.059 1.00 0.00 C ATOM 1047 OH TYR A 63 35.035 -16.175 0.059 1.00 0.00 O ATOM 0 H TYR A 63 35.540 -20.914 -5.972 1.00 0.00 H new ATOM 0 HA TYR A 63 34.231 -20.997 -3.315 1.00 0.00 H new ATOM 0 HB2 TYR A 63 34.443 -18.883 -5.389 1.00 0.00 H new ATOM 0 HB3 TYR A 63 32.818 -19.158 -4.793 1.00 0.00 H new ATOM 0 HD1 TYR A 63 36.300 -18.715 -3.449 1.00 0.00 H new ATOM 0 HD2 TYR A 63 32.140 -17.980 -2.893 1.00 0.00 H new ATOM 0 HE1 TYR A 63 36.805 -17.378 -1.453 1.00 0.00 H new ATOM 0 HE2 TYR A 63 32.643 -16.637 -0.900 1.00 0.00 H new ATOM 0 HH TYR A 63 34.200 -15.835 0.443 1.00 0.00 H new ATOM 1057 N PHE A 64 33.482 -22.622 -5.762 1.00 0.00 N ATOM 1058 CA PHE A 64 32.527 -23.502 -6.427 1.00 0.00 C ATOM 1059 C PHE A 64 31.774 -22.756 -7.525 1.00 0.00 C ATOM 1060 O PHE A 64 30.852 -21.983 -7.265 1.00 0.00 O ATOM 1061 CB PHE A 64 31.537 -24.075 -5.412 1.00 0.00 C ATOM 1062 CG PHE A 64 31.189 -25.515 -5.661 1.00 0.00 C ATOM 1063 CD1 PHE A 64 32.176 -26.486 -5.681 1.00 0.00 C ATOM 1064 CD2 PHE A 64 29.874 -25.896 -5.875 1.00 0.00 C ATOM 1065 CE1 PHE A 64 31.859 -27.812 -5.909 1.00 0.00 C ATOM 1066 CE2 PHE A 64 29.551 -27.220 -6.103 1.00 0.00 C ATOM 1067 CZ PHE A 64 30.545 -28.179 -6.122 1.00 0.00 C ATOM 0 H PHE A 64 34.460 -22.862 -5.923 1.00 0.00 H new ATOM 0 HA PHE A 64 33.082 -24.321 -6.884 1.00 0.00 H new ATOM 0 HB2 PHE A 64 31.959 -23.979 -4.411 1.00 0.00 H new ATOM 0 HB3 PHE A 64 30.624 -23.480 -5.431 1.00 0.00 H new ATOM 0 HD1 PHE A 64 33.205 -26.204 -5.517 1.00 0.00 H new ATOM 0 HD2 PHE A 64 29.093 -25.150 -5.863 1.00 0.00 H new ATOM 0 HE1 PHE A 64 32.638 -28.560 -5.921 1.00 0.00 H new ATOM 0 HE2 PHE A 64 28.522 -27.505 -6.266 1.00 0.00 H new ATOM 0 HZ PHE A 64 30.295 -29.214 -6.303 1.00 0.00 H new ATOM 1077 N PRO A 65 32.175 -22.993 -8.783 1.00 0.00 N ATOM 1078 CA PRO A 65 31.552 -22.355 -9.946 1.00 0.00 C ATOM 1079 C PRO A 65 30.137 -22.863 -10.198 1.00 0.00 C ATOM 1080 O PRO A 65 29.794 -23.985 -9.824 1.00 0.00 O ATOM 1081 CB PRO A 65 32.475 -22.748 -11.103 1.00 0.00 C ATOM 1082 CG PRO A 65 33.121 -24.014 -10.659 1.00 0.00 C ATOM 1083 CD PRO A 65 33.267 -23.904 -9.166 1.00 0.00 C ATOM 0 HA PRO A 65 31.447 -21.278 -9.812 1.00 0.00 H new ATOM 0 HB2 PRO A 65 31.913 -22.893 -12.026 1.00 0.00 H new ATOM 0 HB3 PRO A 65 33.216 -21.973 -11.299 1.00 0.00 H new ATOM 0 HG2 PRO A 65 32.513 -24.878 -10.929 1.00 0.00 H new ATOM 0 HG3 PRO A 65 34.092 -24.145 -11.137 1.00 0.00 H new ATOM 0 HD2 PRO A 65 33.170 -24.875 -8.680 1.00 0.00 H new ATOM 0 HD3 PRO A 65 34.241 -23.504 -8.886 1.00 0.00 H new ATOM 1091 N PHE A 66 29.319 -22.031 -10.834 1.00 0.00 N ATOM 1092 CA PHE A 66 27.939 -22.397 -11.135 1.00 0.00 C ATOM 1093 C PHE A 66 27.862 -23.213 -12.422 1.00 0.00 C ATOM 1094 O PHE A 66 27.944 -22.668 -13.521 1.00 0.00 O ATOM 1095 CB PHE A 66 27.073 -21.142 -11.260 1.00 0.00 C ATOM 1096 CG PHE A 66 27.101 -20.269 -10.039 1.00 0.00 C ATOM 1097 CD1 PHE A 66 27.060 -20.827 -8.771 1.00 0.00 C ATOM 1098 CD2 PHE A 66 27.169 -18.890 -10.157 1.00 0.00 C ATOM 1099 CE1 PHE A 66 27.086 -20.026 -7.645 1.00 0.00 C ATOM 1100 CE2 PHE A 66 27.195 -18.084 -9.035 1.00 0.00 C ATOM 1101 CZ PHE A 66 27.154 -18.653 -7.777 1.00 0.00 C ATOM 0 H PHE A 66 29.587 -21.099 -11.151 1.00 0.00 H new ATOM 0 HA PHE A 66 27.563 -23.009 -10.315 1.00 0.00 H new ATOM 0 HB2 PHE A 66 27.410 -20.562 -12.119 1.00 0.00 H new ATOM 0 HB3 PHE A 66 26.044 -21.439 -11.460 1.00 0.00 H new ATOM 0 HD1 PHE A 66 27.007 -21.900 -8.662 1.00 0.00 H new ATOM 0 HD2 PHE A 66 27.202 -18.440 -11.138 1.00 0.00 H new ATOM 0 HE1 PHE A 66 27.053 -20.473 -6.663 1.00 0.00 H new ATOM 0 HE2 PHE A 66 27.247 -17.011 -9.141 1.00 0.00 H new ATOM 0 HZ PHE A 66 27.175 -18.025 -6.898 1.00 0.00 H new ATOM 1111 N GLY A 67 27.703 -24.525 -12.274 1.00 0.00 N ATOM 1112 CA GLY A 67 27.618 -25.397 -13.432 1.00 0.00 C ATOM 1113 C GLY A 67 27.190 -26.804 -13.067 1.00 0.00 C ATOM 1114 O GLY A 67 27.932 -27.536 -12.412 1.00 0.00 O ATOM 0 H GLY A 67 27.632 -24.999 -11.374 1.00 0.00 H new ATOM 0 HA2 GLY A 67 26.909 -24.979 -14.147 1.00 0.00 H new ATOM 0 HA3 GLY A 67 28.588 -25.433 -13.928 1.00 0.00 H new ATOM 1118 N SER A 68 25.989 -27.185 -13.491 1.00 0.00 N ATOM 1119 CA SER A 68 25.461 -28.513 -13.201 1.00 0.00 C ATOM 1120 C SER A 68 24.422 -28.923 -14.240 1.00 0.00 C ATOM 1121 O SER A 68 23.544 -29.740 -13.965 1.00 0.00 O ATOM 1122 CB SER A 68 24.841 -28.544 -11.803 1.00 0.00 C ATOM 1123 OG SER A 68 25.830 -28.367 -10.803 1.00 0.00 O ATOM 0 H SER A 68 25.363 -26.593 -14.037 1.00 0.00 H new ATOM 0 HA SER A 68 26.288 -29.222 -13.240 1.00 0.00 H new ATOM 0 HB2 SER A 68 24.089 -27.760 -11.718 1.00 0.00 H new ATOM 0 HB3 SER A 68 24.330 -29.494 -11.649 1.00 0.00 H new ATOM 0 HG SER A 68 26.699 -28.207 -11.227 1.00 0.00 H new ATOM 1129 N GLU A 69 24.529 -28.349 -15.434 1.00 0.00 N ATOM 1130 CA GLU A 69 23.598 -28.654 -16.514 1.00 0.00 C ATOM 1131 C GLU A 69 23.586 -30.150 -16.815 1.00 0.00 C ATOM 1132 O GLU A 69 22.613 -30.677 -17.354 1.00 0.00 O ATOM 1133 CB GLU A 69 23.971 -27.872 -17.775 1.00 0.00 C ATOM 1134 CG GLU A 69 23.225 -28.329 -19.017 1.00 0.00 C ATOM 1135 CD GLU A 69 23.265 -27.302 -20.132 1.00 0.00 C ATOM 1136 OE1 GLU A 69 23.994 -26.299 -19.990 1.00 0.00 O ATOM 1137 OE2 GLU A 69 22.566 -27.503 -21.148 1.00 0.00 O ATOM 0 H GLU A 69 25.251 -27.671 -15.678 1.00 0.00 H new ATOM 0 HA GLU A 69 22.599 -28.357 -16.193 1.00 0.00 H new ATOM 0 HB2 GLU A 69 23.769 -26.814 -17.609 1.00 0.00 H new ATOM 0 HB3 GLU A 69 25.043 -27.969 -17.949 1.00 0.00 H new ATOM 0 HG2 GLU A 69 23.658 -29.264 -19.373 1.00 0.00 H new ATOM 0 HG3 GLU A 69 22.187 -28.537 -18.757 1.00 0.00 H new ATOM 1144 N GLU A 70 24.674 -30.828 -16.463 1.00 0.00 N ATOM 1145 CA GLU A 70 24.789 -32.262 -16.697 1.00 0.00 C ATOM 1146 C GLU A 70 23.721 -33.028 -15.922 1.00 0.00 C ATOM 1147 O GLU A 70 23.346 -34.140 -16.293 1.00 0.00 O ATOM 1148 CB GLU A 70 26.180 -32.758 -16.295 1.00 0.00 C ATOM 1149 CG GLU A 70 26.435 -34.213 -16.650 1.00 0.00 C ATOM 1150 CD GLU A 70 26.514 -34.442 -18.147 1.00 0.00 C ATOM 1151 OE1 GLU A 70 27.408 -33.853 -18.791 1.00 0.00 O ATOM 1152 OE2 GLU A 70 25.684 -35.211 -18.675 1.00 0.00 O ATOM 0 H GLU A 70 25.488 -30.407 -16.015 1.00 0.00 H new ATOM 0 HA GLU A 70 24.640 -32.442 -17.762 1.00 0.00 H new ATOM 0 HB2 GLU A 70 26.932 -32.137 -16.782 1.00 0.00 H new ATOM 0 HB3 GLU A 70 26.306 -32.628 -15.220 1.00 0.00 H new ATOM 0 HG2 GLU A 70 27.366 -34.539 -16.187 1.00 0.00 H new ATOM 0 HG3 GLU A 70 25.639 -34.830 -16.233 1.00 0.00 H new ATOM 1159 N SER A 71 23.235 -32.423 -14.842 1.00 0.00 N ATOM 1160 CA SER A 71 22.213 -33.049 -14.011 1.00 0.00 C ATOM 1161 C SER A 71 20.857 -33.030 -14.711 1.00 0.00 C ATOM 1162 O SER A 71 20.244 -34.075 -14.931 1.00 0.00 O ATOM 1163 CB SER A 71 22.114 -32.333 -12.663 1.00 0.00 C ATOM 1164 OG SER A 71 23.251 -32.598 -11.860 1.00 0.00 O ATOM 0 H SER A 71 23.532 -31.501 -14.523 1.00 0.00 H new ATOM 0 HA SER A 71 22.501 -34.087 -13.843 1.00 0.00 H new ATOM 0 HB2 SER A 71 22.021 -31.259 -12.824 1.00 0.00 H new ATOM 0 HB3 SER A 71 21.213 -32.656 -12.141 1.00 0.00 H new ATOM 0 HG SER A 71 23.164 -32.128 -11.005 1.00 0.00 H new ATOM 1170 N LYS A 72 20.395 -31.834 -15.059 1.00 0.00 N ATOM 1171 CA LYS A 72 19.112 -31.676 -15.735 1.00 0.00 C ATOM 1172 C LYS A 72 19.196 -32.157 -17.180 1.00 0.00 C ATOM 1173 O LYS A 72 18.184 -32.499 -17.791 1.00 0.00 O ATOM 1174 CB LYS A 72 18.670 -30.211 -15.699 1.00 0.00 C ATOM 1175 CG LYS A 72 17.164 -30.032 -15.620 1.00 0.00 C ATOM 1176 CD LYS A 72 16.790 -28.604 -15.260 1.00 0.00 C ATOM 1177 CE LYS A 72 16.089 -28.534 -13.913 1.00 0.00 C ATOM 1178 NZ LYS A 72 16.556 -27.374 -13.104 1.00 0.00 N ATOM 0 H LYS A 72 20.890 -30.959 -14.884 1.00 0.00 H new ATOM 0 HA LYS A 72 18.376 -32.284 -15.210 1.00 0.00 H new ATOM 0 HB2 LYS A 72 19.131 -29.722 -14.841 1.00 0.00 H new ATOM 0 HB3 LYS A 72 19.041 -29.706 -16.591 1.00 0.00 H new ATOM 0 HG2 LYS A 72 16.715 -30.296 -16.577 1.00 0.00 H new ATOM 0 HG3 LYS A 72 16.754 -30.715 -14.876 1.00 0.00 H new ATOM 0 HD2 LYS A 72 17.688 -27.987 -15.236 1.00 0.00 H new ATOM 0 HD3 LYS A 72 16.140 -28.192 -16.032 1.00 0.00 H new ATOM 0 HE2 LYS A 72 15.013 -28.459 -14.067 1.00 0.00 H new ATOM 0 HE3 LYS A 72 16.269 -29.457 -13.362 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 15.796 -27.069 -12.463 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 17.388 -27.652 -12.546 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 16.810 -26.589 -13.737 1.00 0.00 H new ATOM 1192 N VAL A 73 20.410 -32.182 -17.721 1.00 0.00 N ATOM 1193 CA VAL A 73 20.627 -32.624 -19.094 1.00 0.00 C ATOM 1194 C VAL A 73 19.980 -31.666 -20.088 1.00 0.00 C ATOM 1195 O VAL A 73 19.467 -32.084 -21.126 1.00 0.00 O ATOM 1196 CB VAL A 73 20.066 -34.040 -19.322 1.00 0.00 C ATOM 1197 CG1 VAL A 73 20.643 -34.644 -20.594 1.00 0.00 C ATOM 1198 CG2 VAL A 73 20.355 -34.928 -18.121 1.00 0.00 C ATOM 0 H VAL A 73 21.259 -31.901 -17.229 1.00 0.00 H new ATOM 0 HA VAL A 73 21.705 -32.638 -19.256 1.00 0.00 H new ATOM 0 HB VAL A 73 18.985 -33.969 -19.440 1.00 0.00 H new ATOM 0 HG11 VAL A 73 20.235 -35.645 -20.739 1.00 0.00 H new ATOM 0 HG12 VAL A 73 20.379 -34.018 -21.446 1.00 0.00 H new ATOM 0 HG13 VAL A 73 21.728 -34.703 -20.509 1.00 0.00 H new ATOM 0 HG21 VAL A 73 19.951 -35.925 -18.300 1.00 0.00 H new ATOM 0 HG22 VAL A 73 21.432 -34.995 -17.969 1.00 0.00 H new ATOM 0 HG23 VAL A 73 19.889 -34.502 -17.233 1.00 0.00 H new ATOM 1208 N LYS A 74 20.006 -30.378 -19.763 1.00 0.00 N ATOM 1209 CA LYS A 74 19.424 -29.358 -20.627 1.00 0.00 C ATOM 1210 C LYS A 74 19.799 -27.960 -20.147 1.00 0.00 C ATOM 1211 O LYS A 74 20.037 -27.744 -18.959 1.00 0.00 O ATOM 1212 CB LYS A 74 17.901 -29.503 -20.668 1.00 0.00 C ATOM 1213 CG LYS A 74 17.388 -30.173 -21.931 1.00 0.00 C ATOM 1214 CD LYS A 74 16.160 -29.465 -22.478 1.00 0.00 C ATOM 1215 CE LYS A 74 16.538 -28.406 -23.503 1.00 0.00 C ATOM 1216 NZ LYS A 74 15.477 -28.227 -24.532 1.00 0.00 N ATOM 0 H LYS A 74 20.424 -30.015 -18.906 1.00 0.00 H new ATOM 0 HA LYS A 74 19.823 -29.498 -21.632 1.00 0.00 H new ATOM 0 HB2 LYS A 74 17.576 -30.081 -19.803 1.00 0.00 H new ATOM 0 HB3 LYS A 74 17.448 -28.516 -20.581 1.00 0.00 H new ATOM 0 HG2 LYS A 74 18.174 -30.177 -22.687 1.00 0.00 H new ATOM 0 HG3 LYS A 74 17.145 -31.214 -21.719 1.00 0.00 H new ATOM 0 HD2 LYS A 74 15.492 -30.194 -22.936 1.00 0.00 H new ATOM 0 HD3 LYS A 74 15.611 -29.001 -21.659 1.00 0.00 H new ATOM 0 HE2 LYS A 74 16.716 -27.458 -22.996 1.00 0.00 H new ATOM 0 HE3 LYS A 74 17.472 -28.688 -23.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 15.772 -27.497 -25.212 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 15.324 -29.125 -25.033 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 14.592 -27.933 -24.071 1.00 0.00 H new ATOM 1230 N MET A 75 19.849 -27.013 -21.079 1.00 0.00 N ATOM 1231 CA MET A 75 20.192 -25.634 -20.749 1.00 0.00 C ATOM 1232 C MET A 75 19.262 -25.085 -19.673 1.00 0.00 C ATOM 1233 O MET A 75 19.625 -24.171 -18.933 1.00 0.00 O ATOM 1234 CB MET A 75 20.120 -24.756 -22.000 1.00 0.00 C ATOM 1235 CG MET A 75 21.051 -25.206 -23.114 1.00 0.00 C ATOM 1236 SD MET A 75 21.699 -23.826 -24.077 1.00 0.00 S ATOM 1237 CE MET A 75 20.970 -24.160 -25.679 1.00 0.00 C ATOM 0 H MET A 75 19.657 -27.175 -22.067 1.00 0.00 H new ATOM 0 HA MET A 75 21.211 -25.621 -20.363 1.00 0.00 H new ATOM 0 HB2 MET A 75 19.096 -24.753 -22.373 1.00 0.00 H new ATOM 0 HB3 MET A 75 20.363 -23.729 -21.727 1.00 0.00 H new ATOM 0 HG2 MET A 75 21.882 -25.766 -22.684 1.00 0.00 H new ATOM 0 HG3 MET A 75 20.516 -25.887 -23.776 1.00 0.00 H new ATOM 0 HE1 MET A 75 21.278 -23.390 -26.387 1.00 0.00 H new ATOM 0 HE2 MET A 75 21.304 -25.135 -26.035 1.00 0.00 H new ATOM 0 HE3 MET A 75 19.883 -24.158 -25.592 1.00 0.00 H new ATOM 1247 N ALA A 76 18.061 -25.648 -19.591 1.00 0.00 N ATOM 1248 CA ALA A 76 17.080 -25.215 -18.604 1.00 0.00 C ATOM 1249 C ALA A 76 17.692 -25.160 -17.208 1.00 0.00 C ATOM 1250 O ALA A 76 17.280 -24.358 -16.370 1.00 0.00 O ATOM 1251 CB ALA A 76 15.873 -26.142 -18.616 1.00 0.00 C ATOM 0 H ALA A 76 17.744 -26.405 -20.197 1.00 0.00 H new ATOM 0 HA ALA A 76 16.755 -24.209 -18.870 1.00 0.00 H new ATOM 0 HB1 ALA A 76 15.149 -25.806 -17.874 1.00 0.00 H new ATOM 0 HB2 ALA A 76 15.413 -26.128 -19.604 1.00 0.00 H new ATOM 0 HB3 ALA A 76 16.191 -27.157 -18.379 1.00 0.00 H new ATOM 1257 N ASP A 77 18.677 -26.018 -16.966 1.00 0.00 N ATOM 1258 CA ASP A 77 19.347 -26.067 -15.671 1.00 0.00 C ATOM 1259 C ASP A 77 20.077 -24.758 -15.388 1.00 0.00 C ATOM 1260 O ASP A 77 20.063 -24.259 -14.262 1.00 0.00 O ATOM 1261 CB ASP A 77 20.334 -27.235 -15.628 1.00 0.00 C ATOM 1262 CG ASP A 77 20.523 -27.781 -14.226 1.00 0.00 C ATOM 1263 OD1 ASP A 77 20.087 -27.112 -13.265 1.00 0.00 O ATOM 1264 OD2 ASP A 77 21.105 -28.877 -14.090 1.00 0.00 O ATOM 0 H ASP A 77 19.029 -26.689 -17.649 1.00 0.00 H new ATOM 0 HA ASP A 77 18.589 -26.213 -14.902 1.00 0.00 H new ATOM 0 HB2 ASP A 77 19.978 -28.032 -16.280 1.00 0.00 H new ATOM 0 HB3 ASP A 77 21.297 -26.908 -16.021 1.00 0.00 H new ATOM 1269 N PHE A 78 20.715 -24.207 -16.415 1.00 0.00 N ATOM 1270 CA PHE A 78 21.453 -22.957 -16.276 1.00 0.00 C ATOM 1271 C PHE A 78 20.511 -21.804 -15.937 1.00 0.00 C ATOM 1272 O PHE A 78 20.727 -21.076 -14.968 1.00 0.00 O ATOM 1273 CB PHE A 78 22.217 -22.644 -17.564 1.00 0.00 C ATOM 1274 CG PHE A 78 23.687 -22.940 -17.476 1.00 0.00 C ATOM 1275 CD1 PHE A 78 24.574 -21.979 -17.020 1.00 0.00 C ATOM 1276 CD2 PHE A 78 24.181 -24.180 -17.848 1.00 0.00 C ATOM 1277 CE1 PHE A 78 25.927 -22.248 -16.939 1.00 0.00 C ATOM 1278 CE2 PHE A 78 25.533 -24.455 -17.769 1.00 0.00 C ATOM 1279 CZ PHE A 78 26.407 -23.488 -17.313 1.00 0.00 C ATOM 0 H PHE A 78 20.736 -24.607 -17.353 1.00 0.00 H new ATOM 0 HA PHE A 78 22.165 -23.074 -15.459 1.00 0.00 H new ATOM 0 HB2 PHE A 78 21.786 -23.222 -18.382 1.00 0.00 H new ATOM 0 HB3 PHE A 78 22.081 -21.591 -17.811 1.00 0.00 H new ATOM 0 HD1 PHE A 78 24.204 -21.008 -16.724 1.00 0.00 H new ATOM 0 HD2 PHE A 78 23.502 -24.940 -18.204 1.00 0.00 H new ATOM 0 HE1 PHE A 78 26.609 -21.489 -16.584 1.00 0.00 H new ATOM 0 HE2 PHE A 78 25.906 -25.425 -18.064 1.00 0.00 H new ATOM 0 HZ PHE A 78 27.464 -23.701 -17.249 1.00 0.00 H new ATOM 1289 N ILE A 79 19.467 -21.646 -16.743 1.00 0.00 N ATOM 1290 CA ILE A 79 18.492 -20.583 -16.530 1.00 0.00 C ATOM 1291 C ILE A 79 17.717 -20.800 -15.234 1.00 0.00 C ATOM 1292 O ILE A 79 17.346 -19.845 -14.554 1.00 0.00 O ATOM 1293 CB ILE A 79 17.496 -20.489 -17.701 1.00 0.00 C ATOM 1294 CG1 ILE A 79 16.368 -19.513 -17.362 1.00 0.00 C ATOM 1295 CG2 ILE A 79 16.933 -21.864 -18.029 1.00 0.00 C ATOM 1296 CD1 ILE A 79 15.119 -20.190 -16.841 1.00 0.00 C ATOM 0 H ILE A 79 19.274 -22.240 -17.549 1.00 0.00 H new ATOM 0 HA ILE A 79 19.052 -19.650 -16.465 1.00 0.00 H new ATOM 0 HB ILE A 79 18.024 -20.115 -18.578 1.00 0.00 H new ATOM 0 HG12 ILE A 79 16.725 -18.803 -16.616 1.00 0.00 H new ATOM 0 HG13 ILE A 79 16.115 -18.939 -18.253 1.00 0.00 H new ATOM 0 HG21 ILE A 79 16.231 -21.781 -18.858 1.00 0.00 H new ATOM 0 HG22 ILE A 79 17.747 -22.533 -18.308 1.00 0.00 H new ATOM 0 HG23 ILE A 79 16.418 -22.264 -17.156 1.00 0.00 H new ATOM 0 HD11 ILE A 79 14.362 -19.437 -16.621 1.00 0.00 H new ATOM 0 HD12 ILE A 79 14.738 -20.879 -17.594 1.00 0.00 H new ATOM 0 HD13 ILE A 79 15.357 -20.742 -15.931 1.00 0.00 H new ATOM 1308 N ALA A 80 17.479 -22.064 -14.899 1.00 0.00 N ATOM 1309 CA ALA A 80 16.752 -22.407 -13.683 1.00 0.00 C ATOM 1310 C ALA A 80 17.595 -22.130 -12.443 1.00 0.00 C ATOM 1311 O ALA A 80 17.130 -21.500 -11.492 1.00 0.00 O ATOM 1312 CB ALA A 80 16.324 -23.866 -13.718 1.00 0.00 C ATOM 0 H ALA A 80 17.779 -22.867 -15.452 1.00 0.00 H new ATOM 0 HA ALA A 80 15.862 -21.780 -13.632 1.00 0.00 H new ATOM 0 HB1 ALA A 80 15.782 -24.108 -12.804 1.00 0.00 H new ATOM 0 HB2 ALA A 80 15.677 -24.035 -14.579 1.00 0.00 H new ATOM 0 HB3 ALA A 80 17.206 -24.502 -13.797 1.00 0.00 H new ATOM 1318 N ARG A 81 18.836 -22.606 -12.459 1.00 0.00 N ATOM 1319 CA ARG A 81 19.743 -22.411 -11.334 1.00 0.00 C ATOM 1320 C ARG A 81 20.144 -20.945 -11.207 1.00 0.00 C ATOM 1321 O ARG A 81 20.383 -20.451 -10.105 1.00 0.00 O ATOM 1322 CB ARG A 81 20.991 -23.280 -11.502 1.00 0.00 C ATOM 1323 CG ARG A 81 21.984 -23.147 -10.359 1.00 0.00 C ATOM 1324 CD ARG A 81 22.480 -24.506 -9.890 1.00 0.00 C ATOM 1325 NE ARG A 81 23.934 -24.541 -9.755 1.00 0.00 N ATOM 1326 CZ ARG A 81 24.585 -24.073 -8.696 1.00 0.00 C ATOM 1327 NH1 ARG A 81 23.914 -23.537 -7.685 1.00 0.00 N ATOM 1328 NH2 ARG A 81 25.909 -24.141 -8.646 1.00 0.00 N ATOM 0 H ARG A 81 19.236 -23.129 -13.238 1.00 0.00 H new ATOM 0 HA ARG A 81 19.222 -22.707 -10.423 1.00 0.00 H new ATOM 0 HB2 ARG A 81 20.688 -24.323 -11.589 1.00 0.00 H new ATOM 0 HB3 ARG A 81 21.486 -23.013 -12.435 1.00 0.00 H new ATOM 0 HG2 ARG A 81 22.831 -22.541 -10.680 1.00 0.00 H new ATOM 0 HG3 ARG A 81 21.514 -22.623 -9.527 1.00 0.00 H new ATOM 0 HD2 ARG A 81 22.021 -24.748 -8.932 1.00 0.00 H new ATOM 0 HD3 ARG A 81 22.163 -25.272 -10.598 1.00 0.00 H new ATOM 0 HE ARG A 81 24.479 -24.947 -10.515 1.00 0.00 H new ATOM 0 HH11 ARG A 81 22.896 -23.484 -7.720 1.00 0.00 H new ATOM 0 HH12 ARG A 81 24.416 -23.178 -6.873 1.00 0.00 H new ATOM 0 HH21 ARG A 81 26.428 -24.553 -9.421 1.00 0.00 H new ATOM 0 HH22 ARG A 81 26.408 -23.781 -7.832 1.00 0.00 H new ATOM 1342 N GLU A 82 20.217 -20.256 -12.341 1.00 0.00 N ATOM 1343 CA GLU A 82 20.590 -18.846 -12.355 1.00 0.00 C ATOM 1344 C GLU A 82 19.456 -17.977 -11.820 1.00 0.00 C ATOM 1345 O GLU A 82 19.666 -17.134 -10.948 1.00 0.00 O ATOM 1346 CB GLU A 82 20.958 -18.407 -13.774 1.00 0.00 C ATOM 1347 CG GLU A 82 22.345 -18.848 -14.208 1.00 0.00 C ATOM 1348 CD GLU A 82 22.570 -18.685 -15.699 1.00 0.00 C ATOM 1349 OE1 GLU A 82 21.589 -18.405 -16.419 1.00 0.00 O ATOM 1350 OE2 GLU A 82 23.726 -18.838 -16.146 1.00 0.00 O ATOM 0 H GLU A 82 20.023 -20.651 -13.261 1.00 0.00 H new ATOM 0 HA GLU A 82 21.457 -18.720 -11.707 1.00 0.00 H new ATOM 0 HB2 GLU A 82 20.223 -18.809 -14.472 1.00 0.00 H new ATOM 0 HB3 GLU A 82 20.895 -17.321 -13.837 1.00 0.00 H new ATOM 0 HG2 GLU A 82 23.092 -18.268 -13.666 1.00 0.00 H new ATOM 0 HG3 GLU A 82 22.492 -19.893 -13.934 1.00 0.00 H new ATOM 1357 N GLU A 83 18.255 -18.189 -12.349 1.00 0.00 N ATOM 1358 CA GLU A 83 17.088 -17.424 -11.925 1.00 0.00 C ATOM 1359 C GLU A 83 16.828 -17.611 -10.433 1.00 0.00 C ATOM 1360 O GLU A 83 16.712 -16.639 -9.686 1.00 0.00 O ATOM 1361 CB GLU A 83 15.855 -17.847 -12.726 1.00 0.00 C ATOM 1362 CG GLU A 83 15.807 -17.257 -14.126 1.00 0.00 C ATOM 1363 CD GLU A 83 14.499 -17.545 -14.836 1.00 0.00 C ATOM 1364 OE1 GLU A 83 13.774 -18.462 -14.396 1.00 0.00 O ATOM 1365 OE2 GLU A 83 14.199 -16.853 -15.831 1.00 0.00 O ATOM 0 H GLU A 83 18.065 -18.884 -13.071 1.00 0.00 H new ATOM 0 HA GLU A 83 17.289 -16.369 -12.112 1.00 0.00 H new ATOM 0 HB2 GLU A 83 15.834 -18.934 -12.798 1.00 0.00 H new ATOM 0 HB3 GLU A 83 14.959 -17.547 -12.183 1.00 0.00 H new ATOM 0 HG2 GLU A 83 15.954 -16.179 -14.067 1.00 0.00 H new ATOM 0 HG3 GLU A 83 16.632 -17.659 -14.714 1.00 0.00 H new ATOM 1372 N ILE A 84 16.736 -18.867 -10.008 1.00 0.00 N ATOM 1373 CA ILE A 84 16.490 -19.182 -8.606 1.00 0.00 C ATOM 1374 C ILE A 84 17.621 -18.670 -7.721 1.00 0.00 C ATOM 1375 O ILE A 84 17.403 -18.309 -6.565 1.00 0.00 O ATOM 1376 CB ILE A 84 16.328 -20.698 -8.389 1.00 0.00 C ATOM 1377 CG1 ILE A 84 17.654 -21.416 -8.648 1.00 0.00 C ATOM 1378 CG2 ILE A 84 15.236 -21.249 -9.293 1.00 0.00 C ATOM 1379 CD1 ILE A 84 18.415 -21.753 -7.385 1.00 0.00 C ATOM 0 H ILE A 84 16.828 -19.682 -10.614 1.00 0.00 H new ATOM 0 HA ILE A 84 15.561 -18.683 -8.329 1.00 0.00 H new ATOM 0 HB ILE A 84 16.037 -20.873 -7.353 1.00 0.00 H new ATOM 0 HG12 ILE A 84 17.458 -22.335 -9.201 1.00 0.00 H new ATOM 0 HG13 ILE A 84 18.280 -20.789 -9.283 1.00 0.00 H new ATOM 0 HG21 ILE A 84 15.134 -22.322 -9.128 1.00 0.00 H new ATOM 0 HG22 ILE A 84 14.291 -20.755 -9.065 1.00 0.00 H new ATOM 0 HG23 ILE A 84 15.499 -21.066 -10.335 1.00 0.00 H new ATOM 0 HD11 ILE A 84 19.344 -22.260 -7.644 1.00 0.00 H new ATOM 0 HD12 ILE A 84 18.642 -20.836 -6.841 1.00 0.00 H new ATOM 0 HD13 ILE A 84 17.808 -22.406 -6.758 1.00 0.00 H new ATOM 1391 N GLU A 85 18.831 -18.642 -8.272 1.00 0.00 N ATOM 1392 CA GLU A 85 19.996 -18.174 -7.532 1.00 0.00 C ATOM 1393 C GLU A 85 19.777 -16.757 -7.011 1.00 0.00 C ATOM 1394 O GLU A 85 19.995 -16.477 -5.833 1.00 0.00 O ATOM 1395 CB GLU A 85 21.242 -18.216 -8.420 1.00 0.00 C ATOM 1396 CG GLU A 85 22.189 -19.356 -8.086 1.00 0.00 C ATOM 1397 CD GLU A 85 22.968 -19.113 -6.808 1.00 0.00 C ATOM 1398 OE1 GLU A 85 23.219 -17.934 -6.483 1.00 0.00 O ATOM 1399 OE2 GLU A 85 23.327 -20.101 -6.134 1.00 0.00 O ATOM 0 H GLU A 85 19.029 -18.938 -9.228 1.00 0.00 H new ATOM 0 HA GLU A 85 20.143 -18.837 -6.679 1.00 0.00 H new ATOM 0 HB2 GLU A 85 20.933 -18.305 -9.461 1.00 0.00 H new ATOM 0 HB3 GLU A 85 21.777 -17.271 -8.326 1.00 0.00 H new ATOM 0 HG2 GLU A 85 21.619 -20.280 -7.989 1.00 0.00 H new ATOM 0 HG3 GLU A 85 22.887 -19.497 -8.911 1.00 0.00 H new ATOM 1406 N MET A 86 19.344 -15.867 -7.898 1.00 0.00 N ATOM 1407 CA MET A 86 19.095 -14.479 -7.528 1.00 0.00 C ATOM 1408 C MET A 86 17.764 -14.342 -6.796 1.00 0.00 C ATOM 1409 O MET A 86 17.679 -13.682 -5.761 1.00 0.00 O ATOM 1410 CB MET A 86 19.099 -13.588 -8.772 1.00 0.00 C ATOM 1411 CG MET A 86 19.762 -12.238 -8.551 1.00 0.00 C ATOM 1412 SD MET A 86 19.033 -11.323 -7.180 1.00 0.00 S ATOM 1413 CE MET A 86 20.428 -11.219 -6.062 1.00 0.00 C ATOM 0 H MET A 86 19.158 -16.082 -8.878 1.00 0.00 H new ATOM 0 HA MET A 86 19.893 -14.159 -6.858 1.00 0.00 H new ATOM 0 HB2 MET A 86 19.614 -14.108 -9.580 1.00 0.00 H new ATOM 0 HB3 MET A 86 18.071 -13.430 -9.099 1.00 0.00 H new ATOM 0 HG2 MET A 86 20.825 -12.386 -8.359 1.00 0.00 H new ATOM 0 HG3 MET A 86 19.682 -11.645 -9.462 1.00 0.00 H new ATOM 0 HE1 MET A 86 20.120 -10.725 -5.140 1.00 0.00 H new ATOM 0 HE2 MET A 86 20.787 -12.223 -5.833 1.00 0.00 H new ATOM 0 HE3 MET A 86 21.228 -10.646 -6.531 1.00 0.00 H new ATOM 1423 N MET A 87 16.727 -14.971 -7.340 1.00 0.00 N ATOM 1424 CA MET A 87 15.400 -14.919 -6.737 1.00 0.00 C ATOM 1425 C MET A 87 15.450 -15.354 -5.275 1.00 0.00 C ATOM 1426 O MET A 87 14.906 -14.682 -4.399 1.00 0.00 O ATOM 1427 CB MET A 87 14.429 -15.811 -7.513 1.00 0.00 C ATOM 1428 CG MET A 87 14.124 -15.303 -8.913 1.00 0.00 C ATOM 1429 SD MET A 87 12.359 -15.076 -9.201 1.00 0.00 S ATOM 1430 CE MET A 87 12.031 -16.403 -10.358 1.00 0.00 C ATOM 0 H MET A 87 16.780 -15.522 -8.197 1.00 0.00 H new ATOM 0 HA MET A 87 15.049 -13.888 -6.780 1.00 0.00 H new ATOM 0 HB2 MET A 87 14.847 -16.815 -7.583 1.00 0.00 H new ATOM 0 HB3 MET A 87 13.497 -15.892 -6.954 1.00 0.00 H new ATOM 0 HG2 MET A 87 14.639 -14.355 -9.071 1.00 0.00 H new ATOM 0 HG3 MET A 87 14.520 -16.007 -9.645 1.00 0.00 H new ATOM 0 HE1 MET A 87 10.976 -16.394 -10.632 1.00 0.00 H new ATOM 0 HE2 MET A 87 12.640 -16.265 -11.252 1.00 0.00 H new ATOM 0 HE3 MET A 87 12.277 -17.359 -9.895 1.00 0.00 H new ATOM 1440 N VAL A 88 16.106 -16.481 -5.020 1.00 0.00 N ATOM 1441 CA VAL A 88 16.228 -17.004 -3.664 1.00 0.00 C ATOM 1442 C VAL A 88 17.166 -16.144 -2.825 1.00 0.00 C ATOM 1443 O VAL A 88 16.927 -15.921 -1.638 1.00 0.00 O ATOM 1444 CB VAL A 88 16.744 -18.456 -3.667 1.00 0.00 C ATOM 1445 CG1 VAL A 88 17.014 -18.929 -2.247 1.00 0.00 C ATOM 1446 CG2 VAL A 88 15.751 -19.373 -4.364 1.00 0.00 C ATOM 0 H VAL A 88 16.561 -17.050 -5.734 1.00 0.00 H new ATOM 0 HA VAL A 88 15.230 -16.982 -3.225 1.00 0.00 H new ATOM 0 HB VAL A 88 17.683 -18.489 -4.220 1.00 0.00 H new ATOM 0 HG11 VAL A 88 17.378 -19.956 -2.269 1.00 0.00 H new ATOM 0 HG12 VAL A 88 17.766 -18.288 -1.787 1.00 0.00 H new ATOM 0 HG13 VAL A 88 16.093 -18.882 -1.667 1.00 0.00 H new ATOM 0 HG21 VAL A 88 16.132 -20.394 -4.357 1.00 0.00 H new ATOM 0 HG22 VAL A 88 14.795 -19.338 -3.841 1.00 0.00 H new ATOM 0 HG23 VAL A 88 15.613 -19.044 -5.394 1.00 0.00 H new ATOM 1456 N PHE A 89 18.236 -15.663 -3.450 1.00 0.00 N ATOM 1457 CA PHE A 89 19.212 -14.827 -2.761 1.00 0.00 C ATOM 1458 C PHE A 89 18.540 -13.605 -2.140 1.00 0.00 C ATOM 1459 O PHE A 89 18.667 -13.355 -0.941 1.00 0.00 O ATOM 1460 CB PHE A 89 20.309 -14.381 -3.730 1.00 0.00 C ATOM 1461 CG PHE A 89 21.317 -13.456 -3.111 1.00 0.00 C ATOM 1462 CD1 PHE A 89 21.082 -12.091 -3.056 1.00 0.00 C ATOM 1463 CD2 PHE A 89 22.498 -13.950 -2.583 1.00 0.00 C ATOM 1464 CE1 PHE A 89 22.008 -11.237 -2.488 1.00 0.00 C ATOM 1465 CE2 PHE A 89 23.428 -13.101 -2.013 1.00 0.00 C ATOM 1466 CZ PHE A 89 23.182 -11.743 -1.964 1.00 0.00 C ATOM 0 H PHE A 89 18.449 -15.838 -4.432 1.00 0.00 H new ATOM 0 HA PHE A 89 19.660 -15.419 -1.963 1.00 0.00 H new ATOM 0 HB2 PHE A 89 20.824 -15.262 -4.113 1.00 0.00 H new ATOM 0 HB3 PHE A 89 19.848 -13.884 -4.584 1.00 0.00 H new ATOM 0 HD1 PHE A 89 20.165 -11.690 -3.462 1.00 0.00 H new ATOM 0 HD2 PHE A 89 22.695 -15.011 -2.617 1.00 0.00 H new ATOM 0 HE1 PHE A 89 21.814 -10.175 -2.454 1.00 0.00 H new ATOM 0 HE2 PHE A 89 24.346 -13.499 -1.606 1.00 0.00 H new ATOM 0 HZ PHE A 89 23.906 -11.078 -1.517 1.00 0.00 H new ATOM 1476 N LEU A 90 17.824 -12.848 -2.964 1.00 0.00 N ATOM 1477 CA LEU A 90 17.132 -11.652 -2.498 1.00 0.00 C ATOM 1478 C LEU A 90 15.941 -12.021 -1.618 1.00 0.00 C ATOM 1479 O LEU A 90 15.655 -11.345 -0.630 1.00 0.00 O ATOM 1480 CB LEU A 90 16.661 -10.815 -3.688 1.00 0.00 C ATOM 1481 CG LEU A 90 15.563 -11.435 -4.553 1.00 0.00 C ATOM 1482 CD1 LEU A 90 14.189 -11.035 -4.039 1.00 0.00 C ATOM 1483 CD2 LEU A 90 15.732 -11.020 -6.007 1.00 0.00 C ATOM 0 H LEU A 90 17.708 -13.042 -3.959 1.00 0.00 H new ATOM 0 HA LEU A 90 17.832 -11.065 -1.904 1.00 0.00 H new ATOM 0 HB2 LEU A 90 16.302 -9.857 -3.313 1.00 0.00 H new ATOM 0 HB3 LEU A 90 17.522 -10.607 -4.323 1.00 0.00 H new ATOM 0 HG LEU A 90 15.649 -12.520 -4.493 1.00 0.00 H new ATOM 0 HD11 LEU A 90 13.420 -11.485 -4.667 1.00 0.00 H new ATOM 0 HD12 LEU A 90 14.069 -11.383 -3.013 1.00 0.00 H new ATOM 0 HD13 LEU A 90 14.091 -9.950 -4.068 1.00 0.00 H new ATOM 0 HD21 LEU A 90 14.942 -11.470 -6.608 1.00 0.00 H new ATOM 0 HD22 LEU A 90 15.673 -9.934 -6.085 1.00 0.00 H new ATOM 0 HD23 LEU A 90 16.702 -11.358 -6.371 1.00 0.00 H new ATOM 1495 N SER A 91 15.253 -13.097 -1.983 1.00 0.00 N ATOM 1496 CA SER A 91 14.092 -13.555 -1.228 1.00 0.00 C ATOM 1497 C SER A 91 14.466 -13.838 0.223 1.00 0.00 C ATOM 1498 O SER A 91 13.669 -13.617 1.135 1.00 0.00 O ATOM 1499 CB SER A 91 13.504 -14.813 -1.870 1.00 0.00 C ATOM 1500 OG SER A 91 12.595 -14.480 -2.905 1.00 0.00 O ATOM 0 H SER A 91 15.479 -13.669 -2.797 1.00 0.00 H new ATOM 0 HA SER A 91 13.343 -12.763 -1.244 1.00 0.00 H new ATOM 0 HB2 SER A 91 14.308 -15.430 -2.272 1.00 0.00 H new ATOM 0 HB3 SER A 91 12.995 -15.408 -1.112 1.00 0.00 H new ATOM 0 HG SER A 91 13.074 -14.435 -3.759 1.00 0.00 H new ATOM 1506 N SER A 92 15.684 -14.329 0.429 1.00 0.00 N ATOM 1507 CA SER A 92 16.163 -14.647 1.769 1.00 0.00 C ATOM 1508 C SER A 92 16.357 -13.377 2.592 1.00 0.00 C ATOM 1509 O SER A 92 16.183 -13.381 3.811 1.00 0.00 O ATOM 1510 CB SER A 92 17.479 -15.424 1.692 1.00 0.00 C ATOM 1511 OG SER A 92 17.779 -16.043 2.931 1.00 0.00 O ATOM 0 H SER A 92 16.357 -14.515 -0.315 1.00 0.00 H new ATOM 0 HA SER A 92 15.412 -15.266 2.259 1.00 0.00 H new ATOM 0 HB2 SER A 92 17.413 -16.181 0.910 1.00 0.00 H new ATOM 0 HB3 SER A 92 18.288 -14.749 1.414 1.00 0.00 H new ATOM 0 HG SER A 92 18.624 -16.534 2.855 1.00 0.00 H new