USER MOD reduce.3.24.130724 H: found=0, std=0, add=669, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 669 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 68 SER OG : rot 120:sc= -0.131 USER MOD Set 1.2: A 72 THR OG1 : rot 160:sc= 0.0788 USER MOD Single : A 6 THR OG1 : rot -32:sc= 0.065 USER MOD Single : A 8 GLN : amide:sc= 0 K(o=0,f=-0.81) USER MOD Single : A 15 GLN : amide:sc= 0.711 K(o=0.71,f=-0.85) USER MOD Single : A 16 LYS NZ :NH3+ 171:sc= 0 (180deg=-0.0978) USER MOD Single : A 19 GLN : amide:sc= 0.655 K(o=0.66,f=-0.0086) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 ASN : amide:sc= -0.316 X(o=-0.32,f=-0.011) USER MOD Single : A 29 TYR OH : rot 148:sc= 0.631 USER MOD Single : A 30 GLN : amide:sc= -0.264 K(o=-0.26,f=-1.1) USER MOD Single : A 31 HIS : no HD1:sc= 0.335 K(o=0.34,f=-1.9!) USER MOD Single : A 32 LYS NZ :NH3+ -145:sc= 0 (180deg=-0.773) USER MOD Single : A 35 SER OG : rot 87:sc= 0.139 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 40 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 51 GLN : amide:sc= 0.473 X(o=0.47,f=-0.00042) USER MOD Single : A 56 LYS NZ :NH3+ -133:sc= -0.0579 (180deg=-0.447) USER MOD Single : A 58 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 71 TYR OH : rot 180:sc= -0.293 USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 ASN : amide:sc= -0.114 K(o=-0.11,f=-1.3) USER MOD Single : A 81 THR OG1 : rot 77:sc= 1.31 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 84 ASN : amide:sc=-0.00727 K(o=-0.0073,f=-0.91) USER MOD Single : A 85 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 82 N THR A 6 10.514 -5.970 -11.222 1.00 0.00 N ATOM 83 CA THR A 6 11.460 -6.358 -10.183 1.00 0.00 C ATOM 84 C THR A 6 11.925 -7.800 -10.390 1.00 0.00 C ATOM 85 O THR A 6 11.422 -8.507 -11.260 1.00 0.00 O ATOM 86 CB THR A 6 10.809 -6.204 -8.806 1.00 0.00 C ATOM 87 OG1 THR A 6 9.682 -7.043 -8.705 1.00 0.00 O ATOM 88 CG2 THR A 6 10.377 -4.757 -8.568 1.00 0.00 C ATOM 0 HA THR A 6 12.332 -5.706 -10.241 1.00 0.00 H new ATOM 0 HB THR A 6 11.546 -6.484 -8.053 1.00 0.00 H new ATOM 0 HG1 THR A 6 9.257 -7.127 -9.584 1.00 0.00 H new ATOM 0 HG21 THR A 6 9.917 -4.672 -7.583 1.00 0.00 H new ATOM 0 HG22 THR A 6 11.248 -4.104 -8.619 1.00 0.00 H new ATOM 0 HG23 THR A 6 9.657 -4.462 -9.331 1.00 0.00 H new ATOM 96 N ASP A 7 12.894 -8.250 -9.592 1.00 0.00 N ATOM 97 CA ASP A 7 13.428 -9.599 -9.738 1.00 0.00 C ATOM 98 C ASP A 7 12.355 -10.653 -9.469 1.00 0.00 C ATOM 99 O ASP A 7 12.545 -11.819 -9.804 1.00 0.00 O ATOM 100 CB ASP A 7 14.619 -9.787 -8.798 1.00 0.00 C ATOM 101 CG ASP A 7 15.680 -8.724 -9.048 1.00 0.00 C ATOM 102 OD1 ASP A 7 16.291 -8.768 -10.139 1.00 0.00 O ATOM 103 OD2 ASP A 7 15.871 -7.870 -8.151 1.00 0.00 O ATOM 0 H ASP A 7 13.321 -7.703 -8.844 1.00 0.00 H new ATOM 0 HA ASP A 7 13.762 -9.729 -10.767 1.00 0.00 H new ATOM 0 HB2 ASP A 7 14.282 -9.734 -7.763 1.00 0.00 H new ATOM 0 HB3 ASP A 7 15.050 -10.778 -8.943 1.00 0.00 H new ATOM 108 N GLN A 8 11.229 -10.261 -8.865 1.00 0.00 N ATOM 109 CA GLN A 8 10.165 -11.195 -8.545 1.00 0.00 C ATOM 110 C GLN A 8 9.518 -11.723 -9.821 1.00 0.00 C ATOM 111 O GLN A 8 9.228 -12.914 -9.909 1.00 0.00 O ATOM 112 CB GLN A 8 9.120 -10.505 -7.667 1.00 0.00 C ATOM 113 CG GLN A 8 9.717 -10.137 -6.307 1.00 0.00 C ATOM 114 CD GLN A 8 8.685 -9.491 -5.386 1.00 0.00 C ATOM 115 OE1 GLN A 8 7.526 -9.310 -5.749 1.00 0.00 O ATOM 116 NE2 GLN A 8 9.103 -9.133 -4.174 1.00 0.00 N ATOM 0 H GLN A 8 11.038 -9.297 -8.590 1.00 0.00 H new ATOM 0 HA GLN A 8 10.587 -12.039 -8.000 1.00 0.00 H new ATOM 0 HB2 GLN A 8 8.755 -9.607 -8.165 1.00 0.00 H new ATOM 0 HB3 GLN A 8 8.262 -11.163 -7.528 1.00 0.00 H new ATOM 0 HG2 GLN A 8 10.117 -11.033 -5.832 1.00 0.00 H new ATOM 0 HG3 GLN A 8 10.553 -9.453 -6.451 1.00 0.00 H new ATOM 0 HE21 GLN A 8 10.072 -9.296 -3.900 1.00 0.00 H new ATOM 0 HE22 GLN A 8 8.454 -8.696 -3.519 1.00 0.00 H new ATOM 125 N VAL A 9 9.288 -10.857 -10.816 1.00 0.00 N ATOM 126 CA VAL A 9 8.685 -11.298 -12.066 1.00 0.00 C ATOM 127 C VAL A 9 9.749 -11.865 -12.994 1.00 0.00 C ATOM 128 O VAL A 9 9.443 -12.677 -13.864 1.00 0.00 O ATOM 129 CB VAL A 9 7.931 -10.157 -12.756 1.00 0.00 C ATOM 130 CG1 VAL A 9 7.081 -9.357 -11.769 1.00 0.00 C ATOM 131 CG2 VAL A 9 8.874 -9.192 -13.473 1.00 0.00 C ATOM 0 H VAL A 9 9.509 -9.862 -10.776 1.00 0.00 H new ATOM 0 HA VAL A 9 7.964 -12.081 -11.832 1.00 0.00 H new ATOM 0 HB VAL A 9 7.283 -10.637 -13.490 1.00 0.00 H new ATOM 0 HG11 VAL A 9 6.563 -8.558 -12.299 1.00 0.00 H new ATOM 0 HG12 VAL A 9 6.349 -10.016 -11.302 1.00 0.00 H new ATOM 0 HG13 VAL A 9 7.724 -8.926 -11.001 1.00 0.00 H new ATOM 0 HG21 VAL A 9 8.293 -8.401 -13.947 1.00 0.00 H new ATOM 0 HG22 VAL A 9 9.564 -8.754 -12.752 1.00 0.00 H new ATOM 0 HG23 VAL A 9 9.439 -9.732 -14.233 1.00 0.00 H new ATOM 141 N LEU A 10 11.003 -11.438 -12.811 1.00 0.00 N ATOM 142 CA LEU A 10 12.088 -11.876 -13.665 1.00 0.00 C ATOM 143 C LEU A 10 12.494 -13.303 -13.305 1.00 0.00 C ATOM 144 O LEU A 10 12.966 -14.043 -14.165 1.00 0.00 O ATOM 145 CB LEU A 10 13.246 -10.884 -13.526 1.00 0.00 C ATOM 146 CG LEU A 10 14.320 -11.063 -14.604 1.00 0.00 C ATOM 147 CD1 LEU A 10 13.744 -10.825 -16.000 1.00 0.00 C ATOM 148 CD2 LEU A 10 15.430 -10.042 -14.367 1.00 0.00 C ATOM 0 H LEU A 10 11.282 -10.789 -12.075 1.00 0.00 H new ATOM 0 HA LEU A 10 11.777 -11.894 -14.709 1.00 0.00 H new ATOM 0 HB2 LEU A 10 12.855 -9.868 -13.576 1.00 0.00 H new ATOM 0 HB3 LEU A 10 13.702 -11.002 -12.543 1.00 0.00 H new ATOM 0 HG LEU A 10 14.700 -12.083 -14.545 1.00 0.00 H new ATOM 0 HD11 LEU A 10 14.528 -10.959 -16.745 1.00 0.00 H new ATOM 0 HD12 LEU A 10 12.940 -11.536 -16.188 1.00 0.00 H new ATOM 0 HD13 LEU A 10 13.352 -9.810 -16.064 1.00 0.00 H new ATOM 0 HD21 LEU A 10 16.201 -10.159 -15.128 1.00 0.00 H new ATOM 0 HD22 LEU A 10 15.016 -9.035 -14.422 1.00 0.00 H new ATOM 0 HD23 LEU A 10 15.867 -10.201 -13.381 1.00 0.00 H new ATOM 160 N VAL A 11 12.314 -13.699 -12.041 1.00 0.00 N ATOM 161 CA VAL A 11 12.579 -15.069 -11.623 1.00 0.00 C ATOM 162 C VAL A 11 11.460 -15.985 -12.110 1.00 0.00 C ATOM 163 O VAL A 11 11.720 -17.132 -12.462 1.00 0.00 O ATOM 164 CB VAL A 11 12.735 -15.114 -10.095 1.00 0.00 C ATOM 165 CG1 VAL A 11 12.677 -16.542 -9.556 1.00 0.00 C ATOM 166 CG2 VAL A 11 14.088 -14.517 -9.712 1.00 0.00 C ATOM 0 H VAL A 11 11.986 -13.087 -11.294 1.00 0.00 H new ATOM 0 HA VAL A 11 13.509 -15.424 -12.067 1.00 0.00 H new ATOM 0 HB VAL A 11 11.911 -14.546 -9.663 1.00 0.00 H new ATOM 0 HG11 VAL A 11 12.791 -16.527 -8.472 1.00 0.00 H new ATOM 0 HG12 VAL A 11 11.717 -16.989 -9.813 1.00 0.00 H new ATOM 0 HG13 VAL A 11 13.481 -17.130 -9.997 1.00 0.00 H new ATOM 0 HG21 VAL A 11 14.205 -14.546 -8.629 1.00 0.00 H new ATOM 0 HG22 VAL A 11 14.886 -15.095 -10.179 1.00 0.00 H new ATOM 0 HG23 VAL A 11 14.140 -13.484 -10.055 1.00 0.00 H new ATOM 176 N GLU A 12 10.216 -15.498 -12.140 1.00 0.00 N ATOM 177 CA GLU A 12 9.115 -16.296 -12.664 1.00 0.00 C ATOM 178 C GLU A 12 9.226 -16.431 -14.179 1.00 0.00 C ATOM 179 O GLU A 12 8.777 -17.421 -14.752 1.00 0.00 O ATOM 180 CB GLU A 12 7.780 -15.643 -12.299 1.00 0.00 C ATOM 181 CG GLU A 12 7.568 -15.682 -10.787 1.00 0.00 C ATOM 182 CD GLU A 12 6.196 -15.133 -10.411 1.00 0.00 C ATOM 183 OE1 GLU A 12 5.933 -13.952 -10.723 1.00 0.00 O ATOM 184 OE2 GLU A 12 5.415 -15.903 -9.806 1.00 0.00 O ATOM 0 H GLU A 12 9.953 -14.569 -11.812 1.00 0.00 H new ATOM 0 HA GLU A 12 9.164 -17.290 -12.220 1.00 0.00 H new ATOM 0 HB2 GLU A 12 7.764 -14.611 -12.649 1.00 0.00 H new ATOM 0 HB3 GLU A 12 6.964 -16.162 -12.801 1.00 0.00 H new ATOM 0 HG2 GLU A 12 7.663 -16.707 -10.430 1.00 0.00 H new ATOM 0 HG3 GLU A 12 8.345 -15.099 -10.293 1.00 0.00 H new ATOM 191 N ARG A 13 9.830 -15.436 -14.834 1.00 0.00 N ATOM 192 CA ARG A 13 10.007 -15.452 -16.278 1.00 0.00 C ATOM 193 C ARG A 13 11.083 -16.461 -16.684 1.00 0.00 C ATOM 194 O ARG A 13 11.023 -17.014 -17.780 1.00 0.00 O ATOM 195 CB ARG A 13 10.331 -14.035 -16.747 1.00 0.00 C ATOM 196 CG ARG A 13 10.508 -13.993 -18.264 1.00 0.00 C ATOM 197 CD ARG A 13 10.702 -12.552 -18.730 1.00 0.00 C ATOM 198 NE ARG A 13 10.980 -12.507 -20.168 1.00 0.00 N ATOM 199 CZ ARG A 13 10.961 -11.400 -20.911 1.00 0.00 C ATOM 200 NH1 ARG A 13 10.665 -10.221 -20.375 1.00 0.00 N ATOM 201 NH2 ARG A 13 11.241 -11.477 -22.207 1.00 0.00 N ATOM 0 H ARG A 13 10.206 -14.605 -14.377 1.00 0.00 H new ATOM 0 HA ARG A 13 9.087 -15.776 -16.765 1.00 0.00 H new ATOM 0 HB2 ARG A 13 9.530 -13.357 -16.451 1.00 0.00 H new ATOM 0 HB3 ARG A 13 11.241 -13.685 -16.260 1.00 0.00 H new ATOM 0 HG2 ARG A 13 11.368 -14.596 -18.554 1.00 0.00 H new ATOM 0 HG3 ARG A 13 9.635 -14.427 -18.752 1.00 0.00 H new ATOM 0 HD2 ARG A 13 9.808 -11.969 -18.509 1.00 0.00 H new ATOM 0 HD3 ARG A 13 11.525 -12.094 -18.181 1.00 0.00 H new ATOM 0 HE ARG A 13 11.204 -13.386 -20.634 1.00 0.00 H new ATOM 0 HH11 ARG A 13 10.448 -10.153 -19.381 1.00 0.00 H new ATOM 0 HH12 ARG A 13 10.655 -9.384 -20.958 1.00 0.00 H new ATOM 0 HH21 ARG A 13 11.468 -12.378 -22.627 1.00 0.00 H new ATOM 0 HH22 ARG A 13 11.229 -10.635 -22.782 1.00 0.00 H new ATOM 215 N VAL A 14 12.065 -16.712 -15.816 1.00 0.00 N ATOM 216 CA VAL A 14 13.086 -17.718 -16.083 1.00 0.00 C ATOM 217 C VAL A 14 12.521 -19.118 -15.843 1.00 0.00 C ATOM 218 O VAL A 14 12.973 -20.077 -16.466 1.00 0.00 O ATOM 219 CB VAL A 14 14.320 -17.442 -15.216 1.00 0.00 C ATOM 220 CG1 VAL A 14 15.367 -18.547 -15.361 1.00 0.00 C ATOM 221 CG2 VAL A 14 14.968 -16.133 -15.662 1.00 0.00 C ATOM 0 H VAL A 14 12.172 -16.231 -14.923 1.00 0.00 H new ATOM 0 HA VAL A 14 13.392 -17.665 -17.128 1.00 0.00 H new ATOM 0 HB VAL A 14 13.989 -17.392 -14.179 1.00 0.00 H new ATOM 0 HG11 VAL A 14 16.227 -18.318 -14.732 1.00 0.00 H new ATOM 0 HG12 VAL A 14 14.936 -19.499 -15.053 1.00 0.00 H new ATOM 0 HG13 VAL A 14 15.685 -18.613 -16.401 1.00 0.00 H new ATOM 0 HG21 VAL A 14 15.846 -15.934 -15.047 1.00 0.00 H new ATOM 0 HG22 VAL A 14 15.267 -16.213 -16.707 1.00 0.00 H new ATOM 0 HG23 VAL A 14 14.254 -15.317 -15.550 1.00 0.00 H new ATOM 231 N GLN A 15 11.532 -19.252 -14.951 1.00 0.00 N ATOM 232 CA GLN A 15 10.862 -20.528 -14.735 1.00 0.00 C ATOM 233 C GLN A 15 9.963 -20.866 -15.925 1.00 0.00 C ATOM 234 O GLN A 15 9.546 -22.015 -16.078 1.00 0.00 O ATOM 235 CB GLN A 15 10.056 -20.478 -13.436 1.00 0.00 C ATOM 236 CG GLN A 15 10.990 -20.442 -12.227 1.00 0.00 C ATOM 237 CD GLN A 15 10.229 -20.414 -10.906 1.00 0.00 C ATOM 238 OE1 GLN A 15 9.016 -20.222 -10.875 1.00 0.00 O ATOM 239 NE2 GLN A 15 10.940 -20.608 -9.797 1.00 0.00 N ATOM 0 H GLN A 15 11.182 -18.490 -14.370 1.00 0.00 H new ATOM 0 HA GLN A 15 11.612 -21.314 -14.647 1.00 0.00 H new ATOM 0 HB2 GLN A 15 9.414 -19.597 -13.433 1.00 0.00 H new ATOM 0 HB3 GLN A 15 9.403 -21.348 -13.373 1.00 0.00 H new ATOM 0 HG2 GLN A 15 11.642 -21.315 -12.249 1.00 0.00 H new ATOM 0 HG3 GLN A 15 11.631 -19.563 -12.293 1.00 0.00 H new ATOM 0 HE21 GLN A 15 11.946 -20.765 -9.857 1.00 0.00 H new ATOM 0 HE22 GLN A 15 10.479 -20.600 -8.887 1.00 0.00 H new ATOM 248 N LYS A 16 9.664 -19.877 -16.774 1.00 0.00 N ATOM 249 CA LYS A 16 8.945 -20.099 -18.024 1.00 0.00 C ATOM 250 C LYS A 16 9.899 -20.547 -19.138 1.00 0.00 C ATOM 251 O LYS A 16 9.483 -20.703 -20.284 1.00 0.00 O ATOM 252 CB LYS A 16 8.153 -18.851 -18.410 1.00 0.00 C ATOM 253 CG LYS A 16 6.982 -18.708 -17.439 1.00 0.00 C ATOM 254 CD LYS A 16 6.199 -17.429 -17.709 1.00 0.00 C ATOM 255 CE LYS A 16 5.597 -17.407 -19.119 1.00 0.00 C ATOM 256 NZ LYS A 16 4.609 -18.484 -19.306 1.00 0.00 N ATOM 0 H LYS A 16 9.915 -18.902 -16.610 1.00 0.00 H new ATOM 0 HA LYS A 16 8.231 -20.909 -17.878 1.00 0.00 H new ATOM 0 HB2 LYS A 16 8.791 -17.968 -18.368 1.00 0.00 H new ATOM 0 HB3 LYS A 16 7.789 -18.933 -19.434 1.00 0.00 H new ATOM 0 HG2 LYS A 16 6.321 -19.569 -17.532 1.00 0.00 H new ATOM 0 HG3 LYS A 16 7.354 -18.701 -16.414 1.00 0.00 H new ATOM 0 HD2 LYS A 16 5.401 -17.331 -16.973 1.00 0.00 H new ATOM 0 HD3 LYS A 16 6.856 -16.569 -17.583 1.00 0.00 H new ATOM 0 HE2 LYS A 16 5.122 -16.442 -19.297 1.00 0.00 H new ATOM 0 HE3 LYS A 16 6.393 -17.511 -19.856 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 4.114 -18.348 -20.210 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 5.095 -19.404 -19.312 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 3.920 -18.462 -18.527 1.00 0.00 H new ATOM 270 N GLY A 17 11.177 -20.756 -18.806 1.00 0.00 N ATOM 271 CA GLY A 17 12.171 -21.267 -19.741 1.00 0.00 C ATOM 272 C GLY A 17 12.879 -20.163 -20.525 1.00 0.00 C ATOM 273 O GLY A 17 13.610 -20.461 -21.468 1.00 0.00 O ATOM 0 H GLY A 17 11.548 -20.573 -17.874 1.00 0.00 H new ATOM 0 HA2 GLY A 17 12.913 -21.848 -19.192 1.00 0.00 H new ATOM 0 HA3 GLY A 17 11.687 -21.948 -20.441 1.00 0.00 H new ATOM 277 N ASP A 18 12.678 -18.894 -20.155 1.00 0.00 N ATOM 278 CA ASP A 18 13.303 -17.785 -20.860 1.00 0.00 C ATOM 279 C ASP A 18 14.770 -17.647 -20.441 1.00 0.00 C ATOM 280 O ASP A 18 15.064 -17.337 -19.285 1.00 0.00 O ATOM 281 CB ASP A 18 12.506 -16.508 -20.577 1.00 0.00 C ATOM 282 CG ASP A 18 12.899 -15.361 -21.505 1.00 0.00 C ATOM 283 OD1 ASP A 18 14.082 -15.312 -21.904 1.00 0.00 O ATOM 284 OD2 ASP A 18 12.003 -14.543 -21.811 1.00 0.00 O ATOM 0 H ASP A 18 12.087 -18.616 -19.372 1.00 0.00 H new ATOM 0 HA ASP A 18 13.294 -17.969 -21.934 1.00 0.00 H new ATOM 0 HB2 ASP A 18 11.442 -16.715 -20.689 1.00 0.00 H new ATOM 0 HB3 ASP A 18 12.665 -16.205 -19.542 1.00 0.00 H new ATOM 289 N GLN A 19 15.690 -17.881 -21.381 1.00 0.00 N ATOM 290 CA GLN A 19 17.121 -17.800 -21.117 1.00 0.00 C ATOM 291 C GLN A 19 17.602 -16.346 -21.136 1.00 0.00 C ATOM 292 O GLN A 19 18.569 -16.006 -20.456 1.00 0.00 O ATOM 293 CB GLN A 19 17.855 -18.639 -22.170 1.00 0.00 C ATOM 294 CG GLN A 19 19.382 -18.608 -22.016 1.00 0.00 C ATOM 295 CD GLN A 19 19.848 -19.210 -20.693 1.00 0.00 C ATOM 296 OE1 GLN A 19 20.194 -20.386 -20.625 1.00 0.00 O ATOM 297 NE2 GLN A 19 19.863 -18.409 -19.632 1.00 0.00 N ATOM 0 H GLN A 19 15.460 -18.131 -22.343 1.00 0.00 H new ATOM 0 HA GLN A 19 17.335 -18.192 -20.122 1.00 0.00 H new ATOM 0 HB2 GLN A 19 17.511 -19.671 -22.106 1.00 0.00 H new ATOM 0 HB3 GLN A 19 17.590 -18.276 -23.163 1.00 0.00 H new ATOM 0 HG2 GLN A 19 19.838 -19.155 -22.841 1.00 0.00 H new ATOM 0 HG3 GLN A 19 19.730 -17.577 -22.085 1.00 0.00 H new ATOM 0 HE21 GLN A 19 19.569 -17.437 -19.723 1.00 0.00 H new ATOM 0 HE22 GLN A 19 20.169 -18.767 -18.727 1.00 0.00 H new ATOM 306 N LYS A 20 16.934 -15.482 -21.907 1.00 0.00 N ATOM 307 CA LYS A 20 17.338 -14.089 -22.026 1.00 0.00 C ATOM 308 C LYS A 20 16.934 -13.327 -20.772 1.00 0.00 C ATOM 309 O LYS A 20 17.610 -12.377 -20.384 1.00 0.00 O ATOM 310 CB LYS A 20 16.692 -13.467 -23.269 1.00 0.00 C ATOM 311 CG LYS A 20 17.038 -14.188 -24.578 1.00 0.00 C ATOM 312 CD LYS A 20 18.396 -13.792 -25.177 1.00 0.00 C ATOM 313 CE LYS A 20 19.583 -14.186 -24.298 1.00 0.00 C ATOM 314 NZ LYS A 20 20.857 -13.949 -24.999 1.00 0.00 N ATOM 0 H LYS A 20 16.111 -15.729 -22.456 1.00 0.00 H new ATOM 0 HA LYS A 20 18.421 -14.032 -22.132 1.00 0.00 H new ATOM 0 HB2 LYS A 20 15.609 -13.466 -23.142 1.00 0.00 H new ATOM 0 HB3 LYS A 20 17.005 -12.426 -23.346 1.00 0.00 H new ATOM 0 HG2 LYS A 20 17.032 -15.263 -24.400 1.00 0.00 H new ATOM 0 HG3 LYS A 20 16.257 -13.982 -25.310 1.00 0.00 H new ATOM 0 HD2 LYS A 20 18.505 -14.262 -26.154 1.00 0.00 H new ATOM 0 HD3 LYS A 20 18.414 -12.714 -25.338 1.00 0.00 H new ATOM 0 HE2 LYS A 20 19.561 -13.612 -23.371 1.00 0.00 H new ATOM 0 HE3 LYS A 20 19.504 -15.238 -24.024 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 21.649 -14.224 -24.383 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 20.884 -14.515 -25.871 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 20.939 -12.940 -25.239 1.00 0.00 H new ATOM 328 N ALA A 21 15.839 -13.741 -20.128 1.00 0.00 N ATOM 329 CA ALA A 21 15.396 -13.119 -18.892 1.00 0.00 C ATOM 330 C ALA A 21 16.414 -13.364 -17.782 1.00 0.00 C ATOM 331 O ALA A 21 16.561 -12.540 -16.881 1.00 0.00 O ATOM 332 CB ALA A 21 14.037 -13.702 -18.509 1.00 0.00 C ATOM 0 H ALA A 21 15.246 -14.507 -20.449 1.00 0.00 H new ATOM 0 HA ALA A 21 15.305 -12.042 -19.033 1.00 0.00 H new ATOM 0 HB1 ALA A 21 13.693 -13.243 -17.582 1.00 0.00 H new ATOM 0 HB2 ALA A 21 13.318 -13.500 -19.303 1.00 0.00 H new ATOM 0 HB3 ALA A 21 14.130 -14.779 -18.368 1.00 0.00 H new ATOM 338 N PHE A 22 17.127 -14.493 -17.838 1.00 0.00 N ATOM 339 CA PHE A 22 18.140 -14.780 -16.840 1.00 0.00 C ATOM 340 C PHE A 22 19.391 -13.947 -17.107 1.00 0.00 C ATOM 341 O PHE A 22 20.099 -13.589 -16.171 1.00 0.00 O ATOM 342 CB PHE A 22 18.456 -16.277 -16.838 1.00 0.00 C ATOM 343 CG PHE A 22 19.330 -16.679 -15.674 1.00 0.00 C ATOM 344 CD1 PHE A 22 18.797 -16.706 -14.377 1.00 0.00 C ATOM 345 CD2 PHE A 22 20.675 -17.021 -15.884 1.00 0.00 C ATOM 346 CE1 PHE A 22 19.604 -17.061 -13.289 1.00 0.00 C ATOM 347 CE2 PHE A 22 21.482 -17.379 -14.797 1.00 0.00 C ATOM 348 CZ PHE A 22 20.947 -17.392 -13.499 1.00 0.00 C ATOM 0 H PHE A 22 17.018 -15.209 -18.556 1.00 0.00 H new ATOM 0 HA PHE A 22 17.764 -14.511 -15.853 1.00 0.00 H new ATOM 0 HB2 PHE A 22 17.525 -16.842 -16.802 1.00 0.00 H new ATOM 0 HB3 PHE A 22 18.954 -16.542 -17.771 1.00 0.00 H new ATOM 0 HD1 PHE A 22 17.760 -16.452 -14.217 1.00 0.00 H new ATOM 0 HD2 PHE A 22 21.087 -17.008 -16.882 1.00 0.00 H new ATOM 0 HE1 PHE A 22 19.191 -17.079 -12.291 1.00 0.00 H new ATOM 0 HE2 PHE A 22 22.516 -17.645 -14.957 1.00 0.00 H new ATOM 0 HZ PHE A 22 21.574 -17.658 -12.661 1.00 0.00 H new ATOM 358 N ASN A 23 19.672 -13.634 -18.373 1.00 0.00 N ATOM 359 CA ASN A 23 20.816 -12.803 -18.712 1.00 0.00 C ATOM 360 C ASN A 23 20.664 -11.406 -18.111 1.00 0.00 C ATOM 361 O ASN A 23 21.653 -10.806 -17.698 1.00 0.00 O ATOM 362 CB ASN A 23 20.953 -12.745 -20.234 1.00 0.00 C ATOM 363 CG ASN A 23 22.159 -11.923 -20.660 1.00 0.00 C ATOM 364 OD1 ASN A 23 23.227 -12.471 -20.917 1.00 0.00 O ATOM 365 ND2 ASN A 23 21.998 -10.607 -20.743 1.00 0.00 N ATOM 0 H ASN A 23 19.122 -13.945 -19.174 1.00 0.00 H new ATOM 0 HA ASN A 23 21.724 -13.236 -18.292 1.00 0.00 H new ATOM 0 HB2 ASN A 23 21.044 -13.757 -20.630 1.00 0.00 H new ATOM 0 HB3 ASN A 23 20.049 -12.314 -20.664 1.00 0.00 H new ATOM 0 HD21 ASN A 23 22.778 -10.015 -21.029 1.00 0.00 H new ATOM 0 HD22 ASN A 23 21.095 -10.189 -20.521 1.00 0.00 H new ATOM 372 N LEU A 24 19.437 -10.879 -18.053 1.00 0.00 N ATOM 373 CA LEU A 24 19.209 -9.584 -17.429 1.00 0.00 C ATOM 374 C LEU A 24 19.340 -9.706 -15.913 1.00 0.00 C ATOM 375 O LEU A 24 19.743 -8.750 -15.253 1.00 0.00 O ATOM 376 CB LEU A 24 17.820 -9.046 -17.798 1.00 0.00 C ATOM 377 CG LEU A 24 17.751 -8.293 -19.135 1.00 0.00 C ATOM 378 CD1 LEU A 24 18.675 -7.076 -19.134 1.00 0.00 C ATOM 379 CD2 LEU A 24 18.110 -9.183 -20.322 1.00 0.00 C ATOM 0 H LEU A 24 18.600 -11.327 -18.427 1.00 0.00 H new ATOM 0 HA LEU A 24 19.959 -8.883 -17.796 1.00 0.00 H new ATOM 0 HB2 LEU A 24 17.120 -9.881 -17.832 1.00 0.00 H new ATOM 0 HB3 LEU A 24 17.482 -8.379 -17.005 1.00 0.00 H new ATOM 0 HG LEU A 24 16.716 -7.969 -19.244 1.00 0.00 H new ATOM 0 HD11 LEU A 24 18.604 -6.564 -20.094 1.00 0.00 H new ATOM 0 HD12 LEU A 24 18.378 -6.395 -18.337 1.00 0.00 H new ATOM 0 HD13 LEU A 24 19.703 -7.400 -18.971 1.00 0.00 H new ATOM 0 HD21 LEU A 24 18.046 -8.604 -21.243 1.00 0.00 H new ATOM 0 HD22 LEU A 24 19.125 -9.560 -20.200 1.00 0.00 H new ATOM 0 HD23 LEU A 24 17.415 -10.021 -20.372 1.00 0.00 H new ATOM 391 N LEU A 25 19.010 -10.872 -15.351 1.00 0.00 N ATOM 392 CA LEU A 25 19.123 -11.105 -13.920 1.00 0.00 C ATOM 393 C LEU A 25 20.603 -11.211 -13.524 1.00 0.00 C ATOM 394 O LEU A 25 20.977 -10.851 -12.407 1.00 0.00 O ATOM 395 CB LEU A 25 18.335 -12.382 -13.602 1.00 0.00 C ATOM 396 CG LEU A 25 18.236 -12.700 -12.109 1.00 0.00 C ATOM 397 CD1 LEU A 25 17.544 -11.580 -11.334 1.00 0.00 C ATOM 398 CD2 LEU A 25 17.410 -13.976 -11.953 1.00 0.00 C ATOM 0 H LEU A 25 18.660 -11.673 -15.877 1.00 0.00 H new ATOM 0 HA LEU A 25 18.708 -10.279 -13.342 1.00 0.00 H new ATOM 0 HB2 LEU A 25 17.329 -12.286 -14.009 1.00 0.00 H new ATOM 0 HB3 LEU A 25 18.806 -13.223 -14.111 1.00 0.00 H new ATOM 0 HG LEU A 25 19.244 -12.815 -11.711 1.00 0.00 H new ATOM 0 HD11 LEU A 25 17.494 -11.845 -10.278 1.00 0.00 H new ATOM 0 HD12 LEU A 25 18.109 -10.655 -11.449 1.00 0.00 H new ATOM 0 HD13 LEU A 25 16.535 -11.440 -11.721 1.00 0.00 H new ATOM 0 HD21 LEU A 25 17.323 -14.226 -10.896 1.00 0.00 H new ATOM 0 HD22 LEU A 25 16.416 -13.819 -12.371 1.00 0.00 H new ATOM 0 HD23 LEU A 25 17.901 -14.794 -12.480 1.00 0.00 H new ATOM 410 N VAL A 26 21.443 -11.698 -14.443 1.00 0.00 N ATOM 411 CA VAL A 26 22.883 -11.757 -14.231 1.00 0.00 C ATOM 412 C VAL A 26 23.460 -10.344 -14.247 1.00 0.00 C ATOM 413 O VAL A 26 24.302 -10.020 -13.413 1.00 0.00 O ATOM 414 CB VAL A 26 23.540 -12.609 -15.326 1.00 0.00 C ATOM 415 CG1 VAL A 26 25.063 -12.505 -15.279 1.00 0.00 C ATOM 416 CG2 VAL A 26 23.168 -14.081 -15.158 1.00 0.00 C ATOM 0 H VAL A 26 21.141 -12.059 -15.348 1.00 0.00 H new ATOM 0 HA VAL A 26 23.086 -12.215 -13.263 1.00 0.00 H new ATOM 0 HB VAL A 26 23.176 -12.228 -16.280 1.00 0.00 H new ATOM 0 HG11 VAL A 26 25.494 -13.121 -16.068 1.00 0.00 H new ATOM 0 HG12 VAL A 26 25.361 -11.467 -15.425 1.00 0.00 H new ATOM 0 HG13 VAL A 26 25.422 -12.853 -14.310 1.00 0.00 H new ATOM 0 HG21 VAL A 26 23.643 -14.668 -15.944 1.00 0.00 H new ATOM 0 HG22 VAL A 26 23.509 -14.434 -14.185 1.00 0.00 H new ATOM 0 HG23 VAL A 26 22.086 -14.193 -15.226 1.00 0.00 H new ATOM 426 N VAL A 27 23.018 -9.498 -15.182 1.00 0.00 N ATOM 427 CA VAL A 27 23.524 -8.134 -15.283 1.00 0.00 C ATOM 428 C VAL A 27 23.160 -7.322 -14.040 1.00 0.00 C ATOM 429 O VAL A 27 23.832 -6.339 -13.729 1.00 0.00 O ATOM 430 CB VAL A 27 22.981 -7.480 -16.559 1.00 0.00 C ATOM 431 CG1 VAL A 27 23.314 -5.990 -16.628 1.00 0.00 C ATOM 432 CG2 VAL A 27 23.607 -8.146 -17.783 1.00 0.00 C ATOM 0 H VAL A 27 22.311 -9.737 -15.877 1.00 0.00 H new ATOM 0 HA VAL A 27 24.612 -8.160 -15.341 1.00 0.00 H new ATOM 0 HB VAL A 27 21.898 -7.604 -16.543 1.00 0.00 H new ATOM 0 HG11 VAL A 27 22.910 -5.569 -17.549 1.00 0.00 H new ATOM 0 HG12 VAL A 27 22.874 -5.479 -15.771 1.00 0.00 H new ATOM 0 HG13 VAL A 27 24.396 -5.858 -16.613 1.00 0.00 H new ATOM 0 HG21 VAL A 27 23.220 -7.680 -18.689 1.00 0.00 H new ATOM 0 HG22 VAL A 27 24.690 -8.027 -17.748 1.00 0.00 H new ATOM 0 HG23 VAL A 27 23.359 -9.207 -17.787 1.00 0.00 H new ATOM 442 N ARG A 28 22.102 -7.715 -13.321 1.00 0.00 N ATOM 443 CA ARG A 28 21.695 -7.004 -12.118 1.00 0.00 C ATOM 444 C ARG A 28 22.608 -7.316 -10.937 1.00 0.00 C ATOM 445 O ARG A 28 22.802 -6.455 -10.079 1.00 0.00 O ATOM 446 CB ARG A 28 20.249 -7.375 -11.774 1.00 0.00 C ATOM 447 CG ARG A 28 19.263 -6.677 -12.713 1.00 0.00 C ATOM 448 CD ARG A 28 17.837 -7.104 -12.360 1.00 0.00 C ATOM 449 NE ARG A 28 16.854 -6.469 -13.246 1.00 0.00 N ATOM 450 CZ ARG A 28 15.532 -6.578 -13.089 1.00 0.00 C ATOM 451 NH1 ARG A 28 15.020 -7.316 -12.109 1.00 0.00 N ATOM 452 NH2 ARG A 28 14.704 -5.945 -13.917 1.00 0.00 N ATOM 0 H ARG A 28 21.519 -8.518 -13.555 1.00 0.00 H new ATOM 0 HA ARG A 28 21.770 -5.935 -12.315 1.00 0.00 H new ATOM 0 HB2 ARG A 28 20.121 -8.455 -11.845 1.00 0.00 H new ATOM 0 HB3 ARG A 28 20.034 -7.095 -10.743 1.00 0.00 H new ATOM 0 HG2 ARG A 28 19.363 -5.595 -12.625 1.00 0.00 H new ATOM 0 HG3 ARG A 28 19.486 -6.934 -13.749 1.00 0.00 H new ATOM 0 HD2 ARG A 28 17.751 -8.188 -12.436 1.00 0.00 H new ATOM 0 HD3 ARG A 28 17.622 -6.838 -11.325 1.00 0.00 H new ATOM 0 HE ARG A 28 17.201 -5.912 -14.027 1.00 0.00 H new ATOM 0 HH11 ARG A 28 15.639 -7.808 -11.465 1.00 0.00 H new ATOM 0 HH12 ARG A 28 14.008 -7.390 -12.001 1.00 0.00 H new ATOM 0 HH21 ARG A 28 15.078 -5.374 -14.675 1.00 0.00 H new ATOM 0 HH22 ARG A 28 13.695 -6.031 -13.794 1.00 0.00 H new ATOM 466 N TYR A 29 23.169 -8.530 -10.874 1.00 0.00 N ATOM 467 CA TYR A 29 23.982 -8.936 -9.734 1.00 0.00 C ATOM 468 C TYR A 29 25.441 -9.253 -10.053 1.00 0.00 C ATOM 469 O TYR A 29 26.186 -9.604 -9.141 1.00 0.00 O ATOM 470 CB TYR A 29 23.289 -10.089 -9.016 1.00 0.00 C ATOM 471 CG TYR A 29 21.968 -9.662 -8.422 1.00 0.00 C ATOM 472 CD1 TYR A 29 21.961 -8.824 -7.299 1.00 0.00 C ATOM 473 CD2 TYR A 29 20.760 -10.077 -9.002 1.00 0.00 C ATOM 474 CE1 TYR A 29 20.748 -8.380 -6.759 1.00 0.00 C ATOM 475 CE2 TYR A 29 19.538 -9.628 -8.471 1.00 0.00 C ATOM 476 CZ TYR A 29 19.528 -8.774 -7.345 1.00 0.00 C ATOM 477 OH TYR A 29 18.353 -8.329 -6.821 1.00 0.00 O ATOM 0 H TYR A 29 23.072 -9.241 -11.598 1.00 0.00 H new ATOM 0 HA TYR A 29 24.053 -8.070 -9.077 1.00 0.00 H new ATOM 0 HB2 TYR A 29 23.126 -10.908 -9.716 1.00 0.00 H new ATOM 0 HB3 TYR A 29 23.938 -10.469 -8.227 1.00 0.00 H new ATOM 0 HD1 TYR A 29 22.894 -8.520 -6.849 1.00 0.00 H new ATOM 0 HD2 TYR A 29 20.769 -10.740 -9.855 1.00 0.00 H new ATOM 0 HE1 TYR A 29 20.747 -7.735 -5.893 1.00 0.00 H new ATOM 0 HE2 TYR A 29 18.607 -9.936 -8.924 1.00 0.00 H new ATOM 0 HH TYR A 29 17.693 -8.226 -7.538 1.00 0.00 H new ATOM 487 N GLN A 30 25.874 -9.145 -11.311 1.00 0.00 N ATOM 488 CA GLN A 30 27.226 -9.537 -11.702 1.00 0.00 C ATOM 489 C GLN A 30 28.316 -8.758 -10.967 1.00 0.00 C ATOM 490 O GLN A 30 29.394 -9.298 -10.726 1.00 0.00 O ATOM 491 CB GLN A 30 27.389 -9.400 -13.219 1.00 0.00 C ATOM 492 CG GLN A 30 27.146 -7.967 -13.707 1.00 0.00 C ATOM 493 CD GLN A 30 27.297 -7.842 -15.219 1.00 0.00 C ATOM 494 OE1 GLN A 30 27.610 -8.805 -15.914 1.00 0.00 O ATOM 495 NE2 GLN A 30 27.071 -6.643 -15.745 1.00 0.00 N ATOM 0 H GLN A 30 25.304 -8.788 -12.078 1.00 0.00 H new ATOM 0 HA GLN A 30 27.353 -10.580 -11.411 1.00 0.00 H new ATOM 0 HB2 GLN A 30 28.394 -9.712 -13.503 1.00 0.00 H new ATOM 0 HB3 GLN A 30 26.693 -10.074 -13.719 1.00 0.00 H new ATOM 0 HG2 GLN A 30 26.144 -7.650 -13.416 1.00 0.00 H new ATOM 0 HG3 GLN A 30 27.848 -7.293 -13.216 1.00 0.00 H new ATOM 0 HE21 GLN A 30 26.813 -5.862 -15.142 1.00 0.00 H new ATOM 0 HE22 GLN A 30 27.156 -6.504 -16.752 1.00 0.00 H new ATOM 504 N HIS A 31 28.057 -7.499 -10.599 1.00 0.00 N ATOM 505 CA HIS A 31 29.043 -6.700 -9.887 1.00 0.00 C ATOM 506 C HIS A 31 28.961 -6.967 -8.386 1.00 0.00 C ATOM 507 O HIS A 31 29.952 -6.830 -7.673 1.00 0.00 O ATOM 508 CB HIS A 31 28.805 -5.222 -10.194 1.00 0.00 C ATOM 509 CG HIS A 31 27.461 -4.728 -9.725 1.00 0.00 C ATOM 510 ND1 HIS A 31 26.227 -5.093 -10.273 1.00 0.00 N ATOM 511 CD2 HIS A 31 27.256 -3.860 -8.693 1.00 0.00 C ATOM 512 CE1 HIS A 31 25.310 -4.425 -9.555 1.00 0.00 C ATOM 513 NE2 HIS A 31 25.894 -3.682 -8.602 1.00 0.00 N ATOM 0 H HIS A 31 27.176 -7.019 -10.784 1.00 0.00 H new ATOM 0 HA HIS A 31 30.045 -6.975 -10.218 1.00 0.00 H new ATOM 0 HB2 HIS A 31 29.588 -4.629 -9.722 1.00 0.00 H new ATOM 0 HB3 HIS A 31 28.889 -5.063 -11.269 1.00 0.00 H new ATOM 0 HD2 HIS A 31 28.012 -3.403 -8.071 1.00 0.00 H new ATOM 0 HE1 HIS A 31 24.244 -4.478 -9.722 1.00 0.00 H new ATOM 0 HE2 HIS A 31 25.412 -3.088 -7.927 1.00 0.00 H new ATOM 521 N LYS A 32 27.774 -7.353 -7.908 1.00 0.00 N ATOM 522 CA LYS A 32 27.540 -7.669 -6.509 1.00 0.00 C ATOM 523 C LYS A 32 28.206 -8.985 -6.140 1.00 0.00 C ATOM 524 O LYS A 32 28.867 -9.088 -5.109 1.00 0.00 O ATOM 525 CB LYS A 32 26.024 -7.722 -6.302 1.00 0.00 C ATOM 526 CG LYS A 32 25.627 -8.476 -5.037 1.00 0.00 C ATOM 527 CD LYS A 32 25.186 -9.904 -5.382 1.00 0.00 C ATOM 528 CE LYS A 32 25.093 -10.767 -4.126 1.00 0.00 C ATOM 529 NZ LYS A 32 24.676 -12.144 -4.452 1.00 0.00 N ATOM 0 H LYS A 32 26.945 -7.454 -8.493 1.00 0.00 H new ATOM 0 HA LYS A 32 27.975 -6.910 -5.859 1.00 0.00 H new ATOM 0 HB2 LYS A 32 25.633 -6.706 -6.252 1.00 0.00 H new ATOM 0 HB3 LYS A 32 25.560 -8.200 -7.165 1.00 0.00 H new ATOM 0 HG2 LYS A 32 26.468 -8.506 -4.345 1.00 0.00 H new ATOM 0 HG3 LYS A 32 24.817 -7.950 -4.532 1.00 0.00 H new ATOM 0 HD2 LYS A 32 24.218 -9.878 -5.882 1.00 0.00 H new ATOM 0 HD3 LYS A 32 25.895 -10.348 -6.081 1.00 0.00 H new ATOM 0 HE2 LYS A 32 26.060 -10.787 -3.623 1.00 0.00 H new ATOM 0 HE3 LYS A 32 24.381 -10.324 -3.430 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 24.075 -12.515 -3.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 24.141 -12.143 -5.344 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 25.517 -12.747 -4.554 1.00 0.00 H new ATOM 543 N VAL A 33 28.029 -9.996 -6.987 1.00 0.00 N ATOM 544 CA VAL A 33 28.555 -11.323 -6.719 1.00 0.00 C ATOM 545 C VAL A 33 30.066 -11.362 -6.897 1.00 0.00 C ATOM 546 O VAL A 33 30.743 -12.121 -6.210 1.00 0.00 O ATOM 547 CB VAL A 33 27.842 -12.338 -7.612 1.00 0.00 C ATOM 548 CG1 VAL A 33 28.188 -12.134 -9.078 1.00 0.00 C ATOM 549 CG2 VAL A 33 28.210 -13.764 -7.209 1.00 0.00 C ATOM 0 H VAL A 33 27.522 -9.916 -7.868 1.00 0.00 H new ATOM 0 HA VAL A 33 28.362 -11.586 -5.679 1.00 0.00 H new ATOM 0 HB VAL A 33 26.771 -12.183 -7.479 1.00 0.00 H new ATOM 0 HG11 VAL A 33 27.663 -12.874 -9.682 1.00 0.00 H new ATOM 0 HG12 VAL A 33 27.887 -11.133 -9.387 1.00 0.00 H new ATOM 0 HG13 VAL A 33 29.263 -12.249 -9.218 1.00 0.00 H new ATOM 0 HG21 VAL A 33 27.692 -14.471 -7.857 1.00 0.00 H new ATOM 0 HG22 VAL A 33 29.287 -13.904 -7.307 1.00 0.00 H new ATOM 0 HG23 VAL A 33 27.915 -13.937 -6.174 1.00 0.00 H new ATOM 559 N ALA A 34 30.613 -10.550 -7.807 1.00 0.00 N ATOM 560 CA ALA A 34 32.050 -10.527 -8.016 1.00 0.00 C ATOM 561 C ALA A 34 32.767 -9.944 -6.798 1.00 0.00 C ATOM 562 O ALA A 34 33.907 -10.308 -6.520 1.00 0.00 O ATOM 563 CB ALA A 34 32.344 -9.716 -9.277 1.00 0.00 C ATOM 0 H ALA A 34 30.084 -9.910 -8.400 1.00 0.00 H new ATOM 0 HA ALA A 34 32.422 -11.543 -8.147 1.00 0.00 H new ATOM 0 HB1 ALA A 34 33.420 -9.688 -9.449 1.00 0.00 H new ATOM 0 HB2 ALA A 34 31.852 -10.180 -10.131 1.00 0.00 H new ATOM 0 HB3 ALA A 34 31.970 -8.700 -9.151 1.00 0.00 H new ATOM 569 N SER A 35 32.103 -9.045 -6.069 1.00 0.00 N ATOM 570 CA SER A 35 32.656 -8.474 -4.848 1.00 0.00 C ATOM 571 C SER A 35 32.481 -9.434 -3.677 1.00 0.00 C ATOM 572 O SER A 35 33.203 -9.339 -2.687 1.00 0.00 O ATOM 573 CB SER A 35 31.983 -7.137 -4.555 1.00 0.00 C ATOM 574 OG SER A 35 32.261 -6.221 -5.593 1.00 0.00 O ATOM 0 H SER A 35 31.175 -8.697 -6.309 1.00 0.00 H new ATOM 0 HA SER A 35 33.724 -8.308 -4.988 1.00 0.00 H new ATOM 0 HB2 SER A 35 30.906 -7.275 -4.459 1.00 0.00 H new ATOM 0 HB3 SER A 35 32.339 -6.741 -3.604 1.00 0.00 H new ATOM 0 HG SER A 35 31.597 -6.323 -6.306 1.00 0.00 H new ATOM 580 N LEU A 36 31.521 -10.361 -3.776 1.00 0.00 N ATOM 581 CA LEU A 36 31.262 -11.338 -2.727 1.00 0.00 C ATOM 582 C LEU A 36 32.189 -12.545 -2.843 1.00 0.00 C ATOM 583 O LEU A 36 32.671 -13.034 -1.825 1.00 0.00 O ATOM 584 CB LEU A 36 29.791 -11.762 -2.818 1.00 0.00 C ATOM 585 CG LEU A 36 29.430 -12.880 -1.832 1.00 0.00 C ATOM 586 CD1 LEU A 36 29.656 -12.472 -0.380 1.00 0.00 C ATOM 587 CD2 LEU A 36 27.952 -13.210 -2.014 1.00 0.00 C ATOM 0 H LEU A 36 30.907 -10.450 -4.585 1.00 0.00 H new ATOM 0 HA LEU A 36 31.460 -10.887 -1.755 1.00 0.00 H new ATOM 0 HB2 LEU A 36 29.156 -10.897 -2.627 1.00 0.00 H new ATOM 0 HB3 LEU A 36 29.577 -12.096 -3.833 1.00 0.00 H new ATOM 0 HG LEU A 36 30.072 -13.736 -2.040 1.00 0.00 H new ATOM 0 HD11 LEU A 36 29.385 -13.299 0.277 1.00 0.00 H new ATOM 0 HD12 LEU A 36 30.706 -12.220 -0.232 1.00 0.00 H new ATOM 0 HD13 LEU A 36 29.038 -11.605 -0.145 1.00 0.00 H new ATOM 0 HD21 LEU A 36 27.669 -14.004 -1.323 1.00 0.00 H new ATOM 0 HD22 LEU A 36 27.353 -12.322 -1.811 1.00 0.00 H new ATOM 0 HD23 LEU A 36 27.776 -13.540 -3.038 1.00 0.00 H new ATOM 599 N VAL A 37 32.448 -13.038 -4.059 1.00 0.00 N ATOM 600 CA VAL A 37 33.314 -14.200 -4.214 1.00 0.00 C ATOM 601 C VAL A 37 34.787 -13.802 -4.154 1.00 0.00 C ATOM 602 O VAL A 37 35.638 -14.643 -3.875 1.00 0.00 O ATOM 603 CB VAL A 37 32.995 -14.983 -5.492 1.00 0.00 C ATOM 604 CG1 VAL A 37 31.507 -15.329 -5.561 1.00 0.00 C ATOM 605 CG2 VAL A 37 33.406 -14.230 -6.751 1.00 0.00 C ATOM 0 H VAL A 37 32.077 -12.657 -4.930 1.00 0.00 H new ATOM 0 HA VAL A 37 33.116 -14.867 -3.375 1.00 0.00 H new ATOM 0 HB VAL A 37 33.579 -15.902 -5.448 1.00 0.00 H new ATOM 0 HG11 VAL A 37 31.305 -15.885 -6.477 1.00 0.00 H new ATOM 0 HG12 VAL A 37 31.235 -15.938 -4.699 1.00 0.00 H new ATOM 0 HG13 VAL A 37 30.919 -14.411 -5.556 1.00 0.00 H new ATOM 0 HG21 VAL A 37 33.159 -14.827 -7.629 1.00 0.00 H new ATOM 0 HG22 VAL A 37 32.874 -13.280 -6.797 1.00 0.00 H new ATOM 0 HG23 VAL A 37 34.480 -14.044 -6.729 1.00 0.00 H new ATOM 615 N SER A 38 35.098 -12.527 -4.411 1.00 0.00 N ATOM 616 CA SER A 38 36.465 -12.031 -4.298 1.00 0.00 C ATOM 617 C SER A 38 36.979 -12.187 -2.863 1.00 0.00 C ATOM 618 O SER A 38 38.182 -12.104 -2.614 1.00 0.00 O ATOM 619 CB SER A 38 36.501 -10.567 -4.738 1.00 0.00 C ATOM 620 OG SER A 38 37.820 -10.064 -4.678 1.00 0.00 O ATOM 0 H SER A 38 34.418 -11.823 -4.698 1.00 0.00 H new ATOM 0 HA SER A 38 37.120 -12.615 -4.945 1.00 0.00 H new ATOM 0 HB2 SER A 38 36.117 -10.477 -5.754 1.00 0.00 H new ATOM 0 HB3 SER A 38 35.849 -9.973 -4.097 1.00 0.00 H new ATOM 0 HG SER A 38 37.826 -9.127 -4.964 1.00 0.00 H new ATOM 626 N ARG A 39 36.068 -12.413 -1.909 1.00 0.00 N ATOM 627 CA ARG A 39 36.409 -12.613 -0.510 1.00 0.00 C ATOM 628 C ARG A 39 36.906 -14.036 -0.252 1.00 0.00 C ATOM 629 O ARG A 39 37.428 -14.307 0.828 1.00 0.00 O ATOM 630 CB ARG A 39 35.177 -12.337 0.358 1.00 0.00 C ATOM 631 CG ARG A 39 34.564 -10.966 0.065 1.00 0.00 C ATOM 632 CD ARG A 39 33.324 -10.764 0.934 1.00 0.00 C ATOM 633 NE ARG A 39 32.628 -9.525 0.573 1.00 0.00 N ATOM 634 CZ ARG A 39 31.420 -9.190 1.038 1.00 0.00 C ATOM 635 NH1 ARG A 39 30.770 -9.984 1.886 1.00 0.00 N ATOM 636 NH2 ARG A 39 30.851 -8.053 0.652 1.00 0.00 N ATOM 0 H ARG A 39 35.066 -12.461 -2.096 1.00 0.00 H new ATOM 0 HA ARG A 39 37.213 -11.923 -0.254 1.00 0.00 H new ATOM 0 HB2 ARG A 39 34.431 -13.112 0.185 1.00 0.00 H new ATOM 0 HB3 ARG A 39 35.455 -12.392 1.410 1.00 0.00 H new ATOM 0 HG2 ARG A 39 35.293 -10.180 0.265 1.00 0.00 H new ATOM 0 HG3 ARG A 39 34.298 -10.893 -0.989 1.00 0.00 H new ATOM 0 HD2 ARG A 39 32.650 -11.612 0.815 1.00 0.00 H new ATOM 0 HD3 ARG A 39 33.613 -10.731 1.985 1.00 0.00 H new ATOM 0 HE ARG A 39 33.092 -8.882 -0.069 1.00 0.00 H new ATOM 0 HH11 ARG A 39 31.193 -10.861 2.189 1.00 0.00 H new ATOM 0 HH12 ARG A 39 29.849 -9.715 2.232 1.00 0.00 H new ATOM 0 HH21 ARG A 39 31.336 -7.436 0.001 1.00 0.00 H new ATOM 0 HH22 ARG A 39 29.929 -7.798 1.007 1.00 0.00 H new ATOM 650 N TYR A 40 36.745 -14.941 -1.224 1.00 0.00 N ATOM 651 CA TYR A 40 37.100 -16.344 -1.050 1.00 0.00 C ATOM 652 C TYR A 40 38.033 -16.859 -2.152 1.00 0.00 C ATOM 653 O TYR A 40 38.641 -17.912 -1.988 1.00 0.00 O ATOM 654 CB TYR A 40 35.814 -17.172 -0.976 1.00 0.00 C ATOM 655 CG TYR A 40 34.806 -16.618 0.008 1.00 0.00 C ATOM 656 CD1 TYR A 40 35.028 -16.752 1.386 1.00 0.00 C ATOM 657 CD2 TYR A 40 33.656 -15.959 -0.454 1.00 0.00 C ATOM 658 CE1 TYR A 40 34.111 -16.218 2.303 1.00 0.00 C ATOM 659 CE2 TYR A 40 32.737 -15.420 0.456 1.00 0.00 C ATOM 660 CZ TYR A 40 32.962 -15.545 1.842 1.00 0.00 C ATOM 661 OH TYR A 40 32.073 -15.018 2.733 1.00 0.00 O ATOM 0 H TYR A 40 36.367 -14.719 -2.145 1.00 0.00 H new ATOM 0 HA TYR A 40 37.659 -16.445 -0.120 1.00 0.00 H new ATOM 0 HB2 TYR A 40 35.360 -17.216 -1.966 1.00 0.00 H new ATOM 0 HB3 TYR A 40 36.063 -18.195 -0.694 1.00 0.00 H new ATOM 0 HD1 TYR A 40 35.907 -17.268 1.742 1.00 0.00 H new ATOM 0 HD2 TYR A 40 33.479 -15.867 -1.515 1.00 0.00 H new ATOM 0 HE1 TYR A 40 34.286 -16.323 3.364 1.00 0.00 H new ATOM 0 HE2 TYR A 40 31.856 -14.909 0.096 1.00 0.00 H new ATOM 0 HH TYR A 40 31.339 -14.588 2.247 1.00 0.00 H new ATOM 671 N VAL A 41 38.160 -16.133 -3.266 1.00 0.00 N ATOM 672 CA VAL A 41 39.079 -16.494 -4.346 1.00 0.00 C ATOM 673 C VAL A 41 39.826 -15.261 -4.850 1.00 0.00 C ATOM 674 O VAL A 41 39.328 -14.143 -4.724 1.00 0.00 O ATOM 675 CB VAL A 41 38.344 -17.166 -5.515 1.00 0.00 C ATOM 676 CG1 VAL A 41 37.997 -18.615 -5.180 1.00 0.00 C ATOM 677 CG2 VAL A 41 37.067 -16.430 -5.910 1.00 0.00 C ATOM 0 H VAL A 41 37.629 -15.280 -3.443 1.00 0.00 H new ATOM 0 HA VAL A 41 39.794 -17.208 -3.937 1.00 0.00 H new ATOM 0 HB VAL A 41 39.030 -17.132 -6.361 1.00 0.00 H new ATOM 0 HG11 VAL A 41 37.477 -19.069 -6.024 1.00 0.00 H new ATOM 0 HG12 VAL A 41 38.912 -19.171 -4.976 1.00 0.00 H new ATOM 0 HG13 VAL A 41 37.353 -18.641 -4.301 1.00 0.00 H new ATOM 0 HG21 VAL A 41 36.590 -16.950 -6.741 1.00 0.00 H new ATOM 0 HG22 VAL A 41 36.385 -16.402 -5.060 1.00 0.00 H new ATOM 0 HG23 VAL A 41 37.312 -15.412 -6.212 1.00 0.00 H new ATOM 687 N PRO A 42 41.024 -15.452 -5.422 1.00 0.00 N ATOM 688 CA PRO A 42 41.814 -14.380 -6.001 1.00 0.00 C ATOM 689 C PRO A 42 41.152 -13.872 -7.279 1.00 0.00 C ATOM 690 O PRO A 42 40.308 -14.555 -7.859 1.00 0.00 O ATOM 691 CB PRO A 42 43.182 -15.004 -6.284 1.00 0.00 C ATOM 692 CG PRO A 42 42.838 -16.468 -6.554 1.00 0.00 C ATOM 693 CD PRO A 42 41.704 -16.729 -5.566 1.00 0.00 C ATOM 0 HA PRO A 42 41.903 -13.518 -5.340 1.00 0.00 H new ATOM 0 HB2 PRO A 42 43.669 -14.539 -7.141 1.00 0.00 H new ATOM 0 HB3 PRO A 42 43.858 -14.897 -5.436 1.00 0.00 H new ATOM 0 HG2 PRO A 42 42.522 -16.627 -7.585 1.00 0.00 H new ATOM 0 HG3 PRO A 42 43.690 -17.124 -6.376 1.00 0.00 H new ATOM 0 HD2 PRO A 42 41.026 -17.497 -5.939 1.00 0.00 H new ATOM 0 HD3 PRO A 42 42.089 -17.081 -4.609 1.00 0.00 H new ATOM 701 N SER A 43 41.536 -12.673 -7.722 1.00 0.00 N ATOM 702 CA SER A 43 40.923 -12.020 -8.873 1.00 0.00 C ATOM 703 C SER A 43 41.065 -12.836 -10.155 1.00 0.00 C ATOM 704 O SER A 43 40.330 -12.601 -11.114 1.00 0.00 O ATOM 705 CB SER A 43 41.563 -10.644 -9.055 1.00 0.00 C ATOM 706 OG SER A 43 42.948 -10.790 -9.298 1.00 0.00 O ATOM 0 H SER A 43 42.283 -12.129 -7.289 1.00 0.00 H new ATOM 0 HA SER A 43 39.855 -11.926 -8.678 1.00 0.00 H new ATOM 0 HB2 SER A 43 41.092 -10.120 -9.887 1.00 0.00 H new ATOM 0 HB3 SER A 43 41.402 -10.037 -8.164 1.00 0.00 H new ATOM 0 HG SER A 43 43.354 -9.906 -9.416 1.00 0.00 H new ATOM 712 N GLY A 44 41.999 -13.792 -10.178 1.00 0.00 N ATOM 713 CA GLY A 44 42.208 -14.645 -11.336 1.00 0.00 C ATOM 714 C GLY A 44 41.131 -15.723 -11.469 1.00 0.00 C ATOM 715 O GLY A 44 41.011 -16.330 -12.530 1.00 0.00 O ATOM 0 H GLY A 44 42.624 -13.990 -9.397 1.00 0.00 H new ATOM 0 HA2 GLY A 44 42.218 -14.033 -12.238 1.00 0.00 H new ATOM 0 HA3 GLY A 44 43.186 -15.120 -11.262 1.00 0.00 H new ATOM 719 N ASP A 45 40.349 -15.964 -10.409 1.00 0.00 N ATOM 720 CA ASP A 45 39.305 -16.981 -10.414 1.00 0.00 C ATOM 721 C ASP A 45 37.915 -16.382 -10.189 1.00 0.00 C ATOM 722 O ASP A 45 36.919 -17.097 -10.277 1.00 0.00 O ATOM 723 CB ASP A 45 39.628 -18.043 -9.361 1.00 0.00 C ATOM 724 CG ASP A 45 40.934 -18.772 -9.674 1.00 0.00 C ATOM 725 OD1 ASP A 45 41.117 -19.166 -10.849 1.00 0.00 O ATOM 726 OD2 ASP A 45 41.743 -18.930 -8.732 1.00 0.00 O ATOM 0 H ASP A 45 40.427 -15.457 -9.528 1.00 0.00 H new ATOM 0 HA ASP A 45 39.283 -17.445 -11.400 1.00 0.00 H new ATOM 0 HB2 ASP A 45 39.700 -17.573 -8.380 1.00 0.00 H new ATOM 0 HB3 ASP A 45 38.812 -18.764 -9.310 1.00 0.00 H new ATOM 731 N VAL A 46 37.824 -15.079 -9.903 1.00 0.00 N ATOM 732 CA VAL A 46 36.541 -14.429 -9.661 1.00 0.00 C ATOM 733 C VAL A 46 35.575 -14.604 -10.833 1.00 0.00 C ATOM 734 O VAL A 46 34.445 -15.017 -10.599 1.00 0.00 O ATOM 735 CB VAL A 46 36.747 -12.948 -9.330 1.00 0.00 C ATOM 736 CG1 VAL A 46 35.422 -12.186 -9.315 1.00 0.00 C ATOM 737 CG2 VAL A 46 37.361 -12.805 -7.938 1.00 0.00 C ATOM 0 H VAL A 46 38.629 -14.456 -9.834 1.00 0.00 H new ATOM 0 HA VAL A 46 36.082 -14.917 -8.801 1.00 0.00 H new ATOM 0 HB VAL A 46 37.402 -12.539 -10.099 1.00 0.00 H new ATOM 0 HG11 VAL A 46 35.607 -11.139 -9.077 1.00 0.00 H new ATOM 0 HG12 VAL A 46 34.950 -12.257 -10.295 1.00 0.00 H new ATOM 0 HG13 VAL A 46 34.762 -12.618 -8.563 1.00 0.00 H new ATOM 0 HG21 VAL A 46 37.504 -11.749 -7.710 1.00 0.00 H new ATOM 0 HG22 VAL A 46 36.694 -13.248 -7.199 1.00 0.00 H new ATOM 0 HG23 VAL A 46 38.323 -13.316 -7.911 1.00 0.00 H new ATOM 747 N PRO A 47 35.953 -14.314 -12.089 1.00 0.00 N ATOM 748 CA PRO A 47 35.009 -14.363 -13.197 1.00 0.00 C ATOM 749 C PRO A 47 34.551 -15.786 -13.508 1.00 0.00 C ATOM 750 O PRO A 47 33.483 -15.970 -14.092 1.00 0.00 O ATOM 751 CB PRO A 47 35.758 -13.750 -14.382 1.00 0.00 C ATOM 752 CG PRO A 47 37.222 -14.051 -14.066 1.00 0.00 C ATOM 753 CD PRO A 47 37.267 -13.905 -12.548 1.00 0.00 C ATOM 0 HA PRO A 47 34.094 -13.820 -12.960 1.00 0.00 H new ATOM 0 HB2 PRO A 47 35.450 -14.197 -15.327 1.00 0.00 H new ATOM 0 HB3 PRO A 47 35.576 -12.678 -14.462 1.00 0.00 H new ATOM 0 HG2 PRO A 47 37.509 -15.053 -14.386 1.00 0.00 H new ATOM 0 HG3 PRO A 47 37.896 -13.352 -14.561 1.00 0.00 H new ATOM 0 HD2 PRO A 47 38.048 -14.530 -12.115 1.00 0.00 H new ATOM 0 HD3 PRO A 47 37.484 -12.877 -12.257 1.00 0.00 H new ATOM 761 N ASP A 48 35.338 -16.798 -13.129 1.00 0.00 N ATOM 762 CA ASP A 48 34.958 -18.186 -13.359 1.00 0.00 C ATOM 763 C ASP A 48 34.100 -18.718 -12.210 1.00 0.00 C ATOM 764 O ASP A 48 33.305 -19.635 -12.401 1.00 0.00 O ATOM 765 CB ASP A 48 36.222 -19.024 -13.539 1.00 0.00 C ATOM 766 CG ASP A 48 35.885 -20.478 -13.866 1.00 0.00 C ATOM 767 OD1 ASP A 48 35.365 -20.707 -14.980 1.00 0.00 O ATOM 768 OD2 ASP A 48 36.153 -21.346 -13.004 1.00 0.00 O ATOM 0 H ASP A 48 36.238 -16.678 -12.664 1.00 0.00 H new ATOM 0 HA ASP A 48 34.354 -18.250 -14.264 1.00 0.00 H new ATOM 0 HB2 ASP A 48 36.830 -18.601 -14.339 1.00 0.00 H new ATOM 0 HB3 ASP A 48 36.820 -18.983 -12.629 1.00 0.00 H new ATOM 773 N VAL A 49 34.247 -18.145 -11.012 1.00 0.00 N ATOM 774 CA VAL A 49 33.436 -18.522 -9.865 1.00 0.00 C ATOM 775 C VAL A 49 32.119 -17.756 -9.892 1.00 0.00 C ATOM 776 O VAL A 49 31.115 -18.231 -9.362 1.00 0.00 O ATOM 777 CB VAL A 49 34.236 -18.268 -8.586 1.00 0.00 C ATOM 778 CG1 VAL A 49 33.377 -18.429 -7.336 1.00 0.00 C ATOM 779 CG2 VAL A 49 35.381 -19.277 -8.494 1.00 0.00 C ATOM 0 H VAL A 49 34.929 -17.412 -10.817 1.00 0.00 H new ATOM 0 HA VAL A 49 33.189 -19.583 -9.899 1.00 0.00 H new ATOM 0 HB VAL A 49 34.607 -17.244 -8.634 1.00 0.00 H new ATOM 0 HG11 VAL A 49 33.984 -18.240 -6.451 1.00 0.00 H new ATOM 0 HG12 VAL A 49 32.551 -17.719 -7.368 1.00 0.00 H new ATOM 0 HG13 VAL A 49 32.981 -19.444 -7.295 1.00 0.00 H new ATOM 0 HG21 VAL A 49 35.952 -19.097 -7.583 1.00 0.00 H new ATOM 0 HG22 VAL A 49 34.974 -20.288 -8.474 1.00 0.00 H new ATOM 0 HG23 VAL A 49 36.034 -19.166 -9.360 1.00 0.00 H new ATOM 789 N VAL A 50 32.109 -16.569 -10.506 1.00 0.00 N ATOM 790 CA VAL A 50 30.896 -15.780 -10.648 1.00 0.00 C ATOM 791 C VAL A 50 29.992 -16.398 -11.705 1.00 0.00 C ATOM 792 O VAL A 50 28.774 -16.430 -11.528 1.00 0.00 O ATOM 793 CB VAL A 50 31.261 -14.341 -11.030 1.00 0.00 C ATOM 794 CG1 VAL A 50 30.047 -13.608 -11.594 1.00 0.00 C ATOM 795 CG2 VAL A 50 31.770 -13.586 -9.805 1.00 0.00 C ATOM 0 H VAL A 50 32.938 -16.136 -10.913 1.00 0.00 H new ATOM 0 HA VAL A 50 30.360 -15.769 -9.699 1.00 0.00 H new ATOM 0 HB VAL A 50 32.041 -14.381 -11.790 1.00 0.00 H new ATOM 0 HG11 VAL A 50 30.328 -12.589 -11.859 1.00 0.00 H new ATOM 0 HG12 VAL A 50 29.688 -14.128 -12.482 1.00 0.00 H new ATOM 0 HG13 VAL A 50 29.256 -13.583 -10.844 1.00 0.00 H new ATOM 0 HG21 VAL A 50 32.026 -12.565 -10.088 1.00 0.00 H new ATOM 0 HG22 VAL A 50 30.993 -13.567 -9.041 1.00 0.00 H new ATOM 0 HG23 VAL A 50 32.654 -14.086 -9.411 1.00 0.00 H new ATOM 805 N GLN A 51 30.564 -16.892 -12.806 1.00 0.00 N ATOM 806 CA GLN A 51 29.749 -17.488 -13.853 1.00 0.00 C ATOM 807 C GLN A 51 29.219 -18.837 -13.384 1.00 0.00 C ATOM 808 O GLN A 51 28.126 -19.242 -13.766 1.00 0.00 O ATOM 809 CB GLN A 51 30.554 -17.576 -15.151 1.00 0.00 C ATOM 810 CG GLN A 51 31.564 -18.718 -15.145 1.00 0.00 C ATOM 811 CD GLN A 51 32.438 -18.658 -16.392 1.00 0.00 C ATOM 812 OE1 GLN A 51 32.369 -19.533 -17.250 1.00 0.00 O ATOM 813 NE2 GLN A 51 33.268 -17.622 -16.494 1.00 0.00 N ATOM 0 H GLN A 51 31.567 -16.890 -12.989 1.00 0.00 H new ATOM 0 HA GLN A 51 28.882 -16.862 -14.063 1.00 0.00 H new ATOM 0 HB2 GLN A 51 29.870 -17.707 -15.989 1.00 0.00 H new ATOM 0 HB3 GLN A 51 31.079 -16.634 -15.312 1.00 0.00 H new ATOM 0 HG2 GLN A 51 32.187 -18.657 -14.253 1.00 0.00 H new ATOM 0 HG3 GLN A 51 31.042 -19.674 -15.104 1.00 0.00 H new ATOM 0 HE21 GLN A 51 33.295 -16.916 -15.759 1.00 0.00 H new ATOM 0 HE22 GLN A 51 33.877 -17.535 -17.308 1.00 0.00 H new ATOM 822 N GLU A 52 29.987 -19.541 -12.550 1.00 0.00 N ATOM 823 CA GLU A 52 29.537 -20.802 -11.994 1.00 0.00 C ATOM 824 C GLU A 52 28.448 -20.564 -10.945 1.00 0.00 C ATOM 825 O GLU A 52 27.633 -21.447 -10.694 1.00 0.00 O ATOM 826 CB GLU A 52 30.739 -21.547 -11.402 1.00 0.00 C ATOM 827 CG GLU A 52 30.347 -22.950 -10.937 1.00 0.00 C ATOM 828 CD GLU A 52 31.583 -23.751 -10.537 1.00 0.00 C ATOM 829 OE1 GLU A 52 32.049 -23.569 -9.390 1.00 0.00 O ATOM 830 OE2 GLU A 52 32.055 -24.547 -11.381 1.00 0.00 O ATOM 0 H GLU A 52 30.919 -19.254 -12.250 1.00 0.00 H new ATOM 0 HA GLU A 52 29.100 -21.418 -12.780 1.00 0.00 H new ATOM 0 HB2 GLU A 52 31.530 -21.616 -12.148 1.00 0.00 H new ATOM 0 HB3 GLU A 52 31.142 -20.982 -10.562 1.00 0.00 H new ATOM 0 HG2 GLU A 52 29.663 -22.880 -10.091 1.00 0.00 H new ATOM 0 HG3 GLU A 52 29.815 -23.468 -11.735 1.00 0.00 H new ATOM 837 N ALA A 53 28.424 -19.377 -10.334 1.00 0.00 N ATOM 838 CA ALA A 53 27.422 -19.049 -9.329 1.00 0.00 C ATOM 839 C ALA A 53 26.071 -18.771 -9.983 1.00 0.00 C ATOM 840 O ALA A 53 25.032 -19.066 -9.392 1.00 0.00 O ATOM 841 CB ALA A 53 27.898 -17.836 -8.529 1.00 0.00 C ATOM 0 H ALA A 53 29.091 -18.628 -10.522 1.00 0.00 H new ATOM 0 HA ALA A 53 27.293 -19.897 -8.656 1.00 0.00 H new ATOM 0 HB1 ALA A 53 27.154 -17.583 -7.774 1.00 0.00 H new ATOM 0 HB2 ALA A 53 28.844 -18.070 -8.041 1.00 0.00 H new ATOM 0 HB3 ALA A 53 28.036 -16.989 -9.201 1.00 0.00 H new ATOM 847 N PHE A 54 26.070 -18.209 -11.195 1.00 0.00 N ATOM 848 CA PHE A 54 24.827 -17.950 -11.909 1.00 0.00 C ATOM 849 C PHE A 54 24.361 -19.184 -12.671 1.00 0.00 C ATOM 850 O PHE A 54 23.161 -19.426 -12.756 1.00 0.00 O ATOM 851 CB PHE A 54 25.000 -16.762 -12.854 1.00 0.00 C ATOM 852 CG PHE A 54 25.035 -15.414 -12.171 1.00 0.00 C ATOM 853 CD1 PHE A 54 23.930 -14.970 -11.425 1.00 0.00 C ATOM 854 CD2 PHE A 54 26.166 -14.594 -12.292 1.00 0.00 C ATOM 855 CE1 PHE A 54 23.957 -13.712 -10.804 1.00 0.00 C ATOM 856 CE2 PHE A 54 26.191 -13.338 -11.675 1.00 0.00 C ATOM 857 CZ PHE A 54 25.088 -12.899 -10.929 1.00 0.00 C ATOM 0 H PHE A 54 26.913 -17.928 -11.696 1.00 0.00 H new ATOM 0 HA PHE A 54 24.058 -17.705 -11.177 1.00 0.00 H new ATOM 0 HB2 PHE A 54 25.924 -16.894 -13.416 1.00 0.00 H new ATOM 0 HB3 PHE A 54 24.184 -16.767 -13.576 1.00 0.00 H new ATOM 0 HD1 PHE A 54 23.057 -15.599 -11.329 1.00 0.00 H new ATOM 0 HD2 PHE A 54 27.019 -14.932 -12.862 1.00 0.00 H new ATOM 0 HE1 PHE A 54 23.107 -13.373 -10.231 1.00 0.00 H new ATOM 0 HE2 PHE A 54 27.061 -12.706 -11.774 1.00 0.00 H new ATOM 0 HZ PHE A 54 25.112 -11.931 -10.450 1.00 0.00 H new ATOM 867 N ILE A 55 25.275 -19.983 -13.228 1.00 0.00 N ATOM 868 CA ILE A 55 24.864 -21.198 -13.924 1.00 0.00 C ATOM 869 C ILE A 55 24.338 -22.219 -12.915 1.00 0.00 C ATOM 870 O ILE A 55 23.477 -23.028 -13.258 1.00 0.00 O ATOM 871 CB ILE A 55 26.031 -21.740 -14.767 1.00 0.00 C ATOM 872 CG1 ILE A 55 26.002 -21.148 -16.185 1.00 0.00 C ATOM 873 CG2 ILE A 55 25.938 -23.259 -14.922 1.00 0.00 C ATOM 874 CD1 ILE A 55 26.131 -19.623 -16.229 1.00 0.00 C ATOM 0 H ILE A 55 26.281 -19.814 -13.211 1.00 0.00 H new ATOM 0 HA ILE A 55 24.049 -20.978 -14.614 1.00 0.00 H new ATOM 0 HB ILE A 55 26.947 -21.461 -14.247 1.00 0.00 H new ATOM 0 HG12 ILE A 55 26.812 -21.587 -16.767 1.00 0.00 H new ATOM 0 HG13 ILE A 55 25.069 -21.437 -16.669 1.00 0.00 H new ATOM 0 HG21 ILE A 55 26.775 -23.615 -15.522 1.00 0.00 H new ATOM 0 HG22 ILE A 55 25.971 -23.728 -13.939 1.00 0.00 H new ATOM 0 HG23 ILE A 55 25.001 -23.518 -15.416 1.00 0.00 H new ATOM 0 HD11 ILE A 55 26.102 -19.285 -17.265 1.00 0.00 H new ATOM 0 HD12 ILE A 55 25.307 -19.172 -15.677 1.00 0.00 H new ATOM 0 HD13 ILE A 55 27.077 -19.325 -15.777 1.00 0.00 H new ATOM 886 N LYS A 56 24.836 -22.197 -11.672 1.00 0.00 N ATOM 887 CA LYS A 56 24.333 -23.088 -10.634 1.00 0.00 C ATOM 888 C LYS A 56 22.970 -22.608 -10.151 1.00 0.00 C ATOM 889 O LYS A 56 22.125 -23.413 -9.767 1.00 0.00 O ATOM 890 CB LYS A 56 25.348 -23.144 -9.490 1.00 0.00 C ATOM 891 CG LYS A 56 24.969 -24.173 -8.421 1.00 0.00 C ATOM 892 CD LYS A 56 24.837 -25.584 -9.007 1.00 0.00 C ATOM 893 CE LYS A 56 24.571 -26.608 -7.901 1.00 0.00 C ATOM 894 NZ LYS A 56 25.662 -26.635 -6.907 1.00 0.00 N ATOM 0 H LYS A 56 25.583 -21.573 -11.368 1.00 0.00 H new ATOM 0 HA LYS A 56 24.204 -24.094 -11.033 1.00 0.00 H new ATOM 0 HB2 LYS A 56 26.331 -23.388 -9.892 1.00 0.00 H new ATOM 0 HB3 LYS A 56 25.427 -22.159 -9.030 1.00 0.00 H new ATOM 0 HG2 LYS A 56 25.725 -24.175 -7.635 1.00 0.00 H new ATOM 0 HG3 LYS A 56 24.027 -23.883 -7.956 1.00 0.00 H new ATOM 0 HD2 LYS A 56 24.024 -25.607 -9.733 1.00 0.00 H new ATOM 0 HD3 LYS A 56 25.750 -25.848 -9.541 1.00 0.00 H new ATOM 0 HE2 LYS A 56 23.631 -26.370 -7.403 1.00 0.00 H new ATOM 0 HE3 LYS A 56 24.456 -27.598 -8.342 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 25.934 -27.621 -6.717 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 26.483 -26.115 -7.278 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 25.339 -26.189 -6.025 1.00 0.00 H new ATOM 908 N ALA A 57 22.749 -21.292 -10.175 1.00 0.00 N ATOM 909 CA ALA A 57 21.463 -20.735 -9.807 1.00 0.00 C ATOM 910 C ALA A 57 20.444 -20.990 -10.914 1.00 0.00 C ATOM 911 O ALA A 57 19.267 -21.180 -10.625 1.00 0.00 O ATOM 912 CB ALA A 57 21.622 -19.237 -9.555 1.00 0.00 C ATOM 0 H ALA A 57 23.448 -20.600 -10.446 1.00 0.00 H new ATOM 0 HA ALA A 57 21.101 -21.214 -8.897 1.00 0.00 H new ATOM 0 HB1 ALA A 57 20.658 -18.810 -9.277 1.00 0.00 H new ATOM 0 HB2 ALA A 57 22.336 -19.078 -8.747 1.00 0.00 H new ATOM 0 HB3 ALA A 57 21.986 -18.752 -10.461 1.00 0.00 H new ATOM 918 N TYR A 58 20.878 -21.002 -12.177 1.00 0.00 N ATOM 919 CA TYR A 58 19.974 -21.192 -13.302 1.00 0.00 C ATOM 920 C TYR A 58 19.310 -22.565 -13.257 1.00 0.00 C ATOM 921 O TYR A 58 18.135 -22.698 -13.593 1.00 0.00 O ATOM 922 CB TYR A 58 20.771 -21.049 -14.597 1.00 0.00 C ATOM 923 CG TYR A 58 19.935 -21.266 -15.836 1.00 0.00 C ATOM 924 CD1 TYR A 58 19.038 -20.273 -16.260 1.00 0.00 C ATOM 925 CD2 TYR A 58 20.058 -22.462 -16.559 1.00 0.00 C ATOM 926 CE1 TYR A 58 18.253 -20.476 -17.403 1.00 0.00 C ATOM 927 CE2 TYR A 58 19.276 -22.673 -17.705 1.00 0.00 C ATOM 928 CZ TYR A 58 18.369 -21.679 -18.130 1.00 0.00 C ATOM 929 OH TYR A 58 17.606 -21.878 -19.243 1.00 0.00 O ATOM 0 H TYR A 58 21.856 -20.881 -12.441 1.00 0.00 H new ATOM 0 HA TYR A 58 19.187 -20.440 -13.251 1.00 0.00 H new ATOM 0 HB2 TYR A 58 21.215 -20.054 -14.635 1.00 0.00 H new ATOM 0 HB3 TYR A 58 21.593 -21.765 -14.591 1.00 0.00 H new ATOM 0 HD1 TYR A 58 18.953 -19.351 -15.704 1.00 0.00 H new ATOM 0 HD2 TYR A 58 20.755 -23.220 -16.234 1.00 0.00 H new ATOM 0 HE1 TYR A 58 17.561 -19.713 -17.726 1.00 0.00 H new ATOM 0 HE2 TYR A 58 19.368 -23.594 -18.261 1.00 0.00 H new ATOM 0 HH TYR A 58 17.809 -22.757 -19.626 1.00 0.00 H new ATOM 939 N ARG A 59 20.063 -23.588 -12.842 1.00 0.00 N ATOM 940 CA ARG A 59 19.558 -24.956 -12.772 1.00 0.00 C ATOM 941 C ARG A 59 18.881 -25.260 -11.438 1.00 0.00 C ATOM 942 O ARG A 59 18.215 -26.286 -11.314 1.00 0.00 O ATOM 943 CB ARG A 59 20.704 -25.931 -13.058 1.00 0.00 C ATOM 944 CG ARG A 59 21.840 -25.765 -12.047 1.00 0.00 C ATOM 945 CD ARG A 59 23.008 -26.671 -12.430 1.00 0.00 C ATOM 946 NE ARG A 59 22.676 -28.081 -12.193 1.00 0.00 N ATOM 947 CZ ARG A 59 23.217 -29.116 -12.838 1.00 0.00 C ATOM 948 NH1 ARG A 59 24.131 -28.935 -13.790 1.00 0.00 N ATOM 949 NH2 ARG A 59 22.835 -30.347 -12.528 1.00 0.00 N ATOM 0 H ARG A 59 21.034 -23.489 -12.547 1.00 0.00 H new ATOM 0 HA ARG A 59 18.785 -25.076 -13.531 1.00 0.00 H new ATOM 0 HB2 ARG A 59 20.331 -26.954 -13.024 1.00 0.00 H new ATOM 0 HB3 ARG A 59 21.084 -25.764 -14.066 1.00 0.00 H new ATOM 0 HG2 ARG A 59 22.167 -24.726 -12.021 1.00 0.00 H new ATOM 0 HG3 ARG A 59 21.488 -26.014 -11.046 1.00 0.00 H new ATOM 0 HD2 ARG A 59 23.259 -26.524 -13.481 1.00 0.00 H new ATOM 0 HD3 ARG A 59 23.890 -26.398 -11.851 1.00 0.00 H new ATOM 0 HE ARG A 59 21.977 -28.286 -11.479 1.00 0.00 H new ATOM 0 HH11 ARG A 59 24.429 -27.992 -14.038 1.00 0.00 H new ATOM 0 HH12 ARG A 59 24.532 -29.740 -14.271 1.00 0.00 H new ATOM 0 HH21 ARG A 59 22.134 -30.496 -11.802 1.00 0.00 H new ATOM 0 HH22 ARG A 59 23.242 -31.145 -13.015 1.00 0.00 H new ATOM 963 N ALA A 60 19.040 -24.381 -10.440 1.00 0.00 N ATOM 964 CA ALA A 60 18.423 -24.566 -9.135 1.00 0.00 C ATOM 965 C ALA A 60 17.265 -23.587 -8.892 1.00 0.00 C ATOM 966 O ALA A 60 16.554 -23.706 -7.898 1.00 0.00 O ATOM 967 CB ALA A 60 19.505 -24.428 -8.066 1.00 0.00 C ATOM 0 H ALA A 60 19.597 -23.530 -10.520 1.00 0.00 H new ATOM 0 HA ALA A 60 17.982 -25.562 -9.090 1.00 0.00 H new ATOM 0 HB1 ALA A 60 19.061 -24.564 -7.080 1.00 0.00 H new ATOM 0 HB2 ALA A 60 20.273 -25.185 -8.226 1.00 0.00 H new ATOM 0 HB3 ALA A 60 19.954 -23.437 -8.129 1.00 0.00 H new ATOM 973 N LEU A 61 17.072 -22.620 -9.796 1.00 0.00 N ATOM 974 CA LEU A 61 16.029 -21.609 -9.685 1.00 0.00 C ATOM 975 C LEU A 61 14.667 -22.211 -10.021 1.00 0.00 C ATOM 976 O LEU A 61 13.636 -21.677 -9.612 1.00 0.00 O ATOM 977 CB LEU A 61 16.428 -20.434 -10.584 1.00 0.00 C ATOM 978 CG LEU A 61 15.402 -19.299 -10.677 1.00 0.00 C ATOM 979 CD1 LEU A 61 16.160 -18.015 -11.000 1.00 0.00 C ATOM 980 CD2 LEU A 61 14.402 -19.534 -11.809 1.00 0.00 C ATOM 0 H LEU A 61 17.646 -22.521 -10.633 1.00 0.00 H new ATOM 0 HA LEU A 61 15.932 -21.238 -8.665 1.00 0.00 H new ATOM 0 HB2 LEU A 61 17.368 -20.022 -10.218 1.00 0.00 H new ATOM 0 HB3 LEU A 61 16.616 -20.814 -11.588 1.00 0.00 H new ATOM 0 HG LEU A 61 14.860 -19.243 -9.733 1.00 0.00 H new ATOM 0 HD11 LEU A 61 15.456 -17.186 -11.073 1.00 0.00 H new ATOM 0 HD12 LEU A 61 16.882 -17.810 -10.209 1.00 0.00 H new ATOM 0 HD13 LEU A 61 16.684 -18.131 -11.949 1.00 0.00 H new ATOM 0 HD21 LEU A 61 13.691 -18.709 -11.843 1.00 0.00 H new ATOM 0 HD22 LEU A 61 14.934 -19.594 -12.758 1.00 0.00 H new ATOM 0 HD23 LEU A 61 13.867 -20.467 -11.634 1.00 0.00 H new ATOM 992 N ASP A 62 14.651 -23.327 -10.759 1.00 0.00 N ATOM 993 CA ASP A 62 13.424 -24.050 -11.048 1.00 0.00 C ATOM 994 C ASP A 62 12.943 -24.796 -9.797 1.00 0.00 C ATOM 995 O ASP A 62 11.837 -25.337 -9.780 1.00 0.00 O ATOM 996 CB ASP A 62 13.674 -25.009 -12.214 1.00 0.00 C ATOM 997 CG ASP A 62 12.393 -25.710 -12.661 1.00 0.00 C ATOM 998 OD1 ASP A 62 11.459 -24.991 -13.082 1.00 0.00 O ATOM 999 OD2 ASP A 62 12.361 -26.957 -12.574 1.00 0.00 O ATOM 0 H ASP A 62 15.487 -23.746 -11.167 1.00 0.00 H new ATOM 0 HA ASP A 62 12.637 -23.352 -11.334 1.00 0.00 H new ATOM 0 HB2 ASP A 62 14.097 -24.457 -13.053 1.00 0.00 H new ATOM 0 HB3 ASP A 62 14.412 -25.755 -11.918 1.00 0.00 H new ATOM 1004 N SER A 63 13.785 -24.816 -8.757 1.00 0.00 N ATOM 1005 CA SER A 63 13.485 -25.444 -7.480 1.00 0.00 C ATOM 1006 C SER A 63 13.404 -24.405 -6.367 1.00 0.00 C ATOM 1007 O SER A 63 13.387 -24.759 -5.188 1.00 0.00 O ATOM 1008 CB SER A 63 14.531 -26.516 -7.169 1.00 0.00 C ATOM 1009 OG SER A 63 14.564 -27.481 -8.203 1.00 0.00 O ATOM 0 H SER A 63 14.709 -24.386 -8.788 1.00 0.00 H new ATOM 0 HA SER A 63 12.509 -25.925 -7.544 1.00 0.00 H new ATOM 0 HB2 SER A 63 15.513 -26.056 -7.060 1.00 0.00 H new ATOM 0 HB3 SER A 63 14.298 -26.998 -6.219 1.00 0.00 H new ATOM 0 HG SER A 63 15.238 -28.161 -7.994 1.00 0.00 H new ATOM 1015 N PHE A 64 13.355 -23.117 -6.724 1.00 0.00 N ATOM 1016 CA PHE A 64 13.270 -22.038 -5.752 1.00 0.00 C ATOM 1017 C PHE A 64 11.923 -22.105 -5.033 1.00 0.00 C ATOM 1018 O PHE A 64 10.885 -22.242 -5.678 1.00 0.00 O ATOM 1019 CB PHE A 64 13.476 -20.702 -6.466 1.00 0.00 C ATOM 1020 CG PHE A 64 13.459 -19.500 -5.549 1.00 0.00 C ATOM 1021 CD1 PHE A 64 14.397 -19.395 -4.513 1.00 0.00 C ATOM 1022 CD2 PHE A 64 12.506 -18.488 -5.738 1.00 0.00 C ATOM 1023 CE1 PHE A 64 14.378 -18.280 -3.662 1.00 0.00 C ATOM 1024 CE2 PHE A 64 12.489 -17.375 -4.887 1.00 0.00 C ATOM 1025 CZ PHE A 64 13.424 -17.271 -3.849 1.00 0.00 C ATOM 0 H PHE A 64 13.373 -22.801 -7.694 1.00 0.00 H new ATOM 0 HA PHE A 64 14.051 -22.138 -4.998 1.00 0.00 H new ATOM 0 HB2 PHE A 64 14.429 -20.728 -6.994 1.00 0.00 H new ATOM 0 HB3 PHE A 64 12.697 -20.581 -7.219 1.00 0.00 H new ATOM 0 HD1 PHE A 64 15.134 -20.172 -4.370 1.00 0.00 H new ATOM 0 HD2 PHE A 64 11.786 -18.567 -6.539 1.00 0.00 H new ATOM 0 HE1 PHE A 64 15.099 -18.199 -2.862 1.00 0.00 H new ATOM 0 HE2 PHE A 64 11.754 -16.597 -5.031 1.00 0.00 H new ATOM 0 HZ PHE A 64 13.409 -16.413 -3.193 1.00 0.00 H new ATOM 1035 N ARG A 65 11.943 -22.014 -3.699 1.00 0.00 N ATOM 1036 CA ARG A 65 10.752 -22.182 -2.872 1.00 0.00 C ATOM 1037 C ARG A 65 10.157 -20.845 -2.444 1.00 0.00 C ATOM 1038 O ARG A 65 8.993 -20.791 -2.052 1.00 0.00 O ATOM 1039 CB ARG A 65 11.100 -23.034 -1.647 1.00 0.00 C ATOM 1040 CG ARG A 65 11.600 -24.419 -2.059 1.00 0.00 C ATOM 1041 CD ARG A 65 12.048 -25.199 -0.822 1.00 0.00 C ATOM 1042 NE ARG A 65 12.629 -26.490 -1.210 1.00 0.00 N ATOM 1043 CZ ARG A 65 13.918 -26.821 -1.065 1.00 0.00 C ATOM 1044 NH1 ARG A 65 14.796 -25.982 -0.522 1.00 0.00 N ATOM 1045 NH2 ARG A 65 14.350 -28.011 -1.469 1.00 0.00 N ATOM 0 H ARG A 65 12.790 -21.821 -3.165 1.00 0.00 H new ATOM 0 HA ARG A 65 9.993 -22.688 -3.469 1.00 0.00 H new ATOM 0 HB2 ARG A 65 11.864 -22.530 -1.056 1.00 0.00 H new ATOM 0 HB3 ARG A 65 10.221 -23.137 -1.011 1.00 0.00 H new ATOM 0 HG2 ARG A 65 10.809 -24.962 -2.576 1.00 0.00 H new ATOM 0 HG3 ARG A 65 12.430 -24.322 -2.759 1.00 0.00 H new ATOM 0 HD2 ARG A 65 12.781 -24.617 -0.264 1.00 0.00 H new ATOM 0 HD3 ARG A 65 11.198 -25.361 -0.159 1.00 0.00 H new ATOM 0 HE ARG A 65 12.005 -27.185 -1.620 1.00 0.00 H new ATOM 0 HH11 ARG A 65 14.493 -25.061 -0.204 1.00 0.00 H new ATOM 0 HH12 ARG A 65 15.773 -26.259 -0.423 1.00 0.00 H new ATOM 0 HH21 ARG A 65 13.699 -28.674 -1.890 1.00 0.00 H new ATOM 0 HH22 ARG A 65 15.332 -28.262 -1.358 1.00 0.00 H new ATOM 1059 N GLY A 66 10.938 -19.762 -2.515 1.00 0.00 N ATOM 1060 CA GLY A 66 10.446 -18.438 -2.164 1.00 0.00 C ATOM 1061 C GLY A 66 10.316 -18.266 -0.651 1.00 0.00 C ATOM 1062 O GLY A 66 9.587 -17.389 -0.190 1.00 0.00 O ATOM 0 H GLY A 66 11.913 -19.783 -2.813 1.00 0.00 H new ATOM 0 HA2 GLY A 66 11.124 -17.681 -2.559 1.00 0.00 H new ATOM 0 HA3 GLY A 66 9.476 -18.274 -2.634 1.00 0.00 H new ATOM 1066 N ASP A 67 11.017 -19.101 0.123 1.00 0.00 N ATOM 1067 CA ASP A 67 10.999 -19.034 1.578 1.00 0.00 C ATOM 1068 C ASP A 67 11.692 -17.764 2.082 1.00 0.00 C ATOM 1069 O ASP A 67 11.612 -17.439 3.266 1.00 0.00 O ATOM 1070 CB ASP A 67 11.679 -20.287 2.138 1.00 0.00 C ATOM 1071 CG ASP A 67 10.804 -21.529 1.990 1.00 0.00 C ATOM 1072 OD1 ASP A 67 9.601 -21.438 2.328 1.00 0.00 O ATOM 1073 OD2 ASP A 67 11.347 -22.565 1.539 1.00 0.00 O ATOM 0 H ASP A 67 11.612 -19.842 -0.248 1.00 0.00 H new ATOM 0 HA ASP A 67 9.966 -18.994 1.924 1.00 0.00 H new ATOM 0 HB2 ASP A 67 12.625 -20.447 1.621 1.00 0.00 H new ATOM 0 HB3 ASP A 67 11.913 -20.132 3.191 1.00 0.00 H new ATOM 1078 N SER A 68 12.371 -17.049 1.180 1.00 0.00 N ATOM 1079 CA SER A 68 13.011 -15.773 1.457 1.00 0.00 C ATOM 1080 C SER A 68 13.123 -14.988 0.155 1.00 0.00 C ATOM 1081 O SER A 68 12.833 -15.517 -0.919 1.00 0.00 O ATOM 1082 CB SER A 68 14.388 -16.022 2.072 1.00 0.00 C ATOM 1083 OG SER A 68 15.057 -14.800 2.292 1.00 0.00 O ATOM 0 H SER A 68 12.490 -17.355 0.214 1.00 0.00 H new ATOM 0 HA SER A 68 12.421 -15.193 2.166 1.00 0.00 H new ATOM 0 HB2 SER A 68 14.281 -16.560 3.014 1.00 0.00 H new ATOM 0 HB3 SER A 68 14.980 -16.654 1.410 1.00 0.00 H new ATOM 0 HG SER A 68 15.254 -14.702 3.247 1.00 0.00 H new ATOM 1089 N ALA A 69 13.546 -13.725 0.236 1.00 0.00 N ATOM 1090 CA ALA A 69 13.773 -12.897 -0.938 1.00 0.00 C ATOM 1091 C ALA A 69 14.808 -13.562 -1.841 1.00 0.00 C ATOM 1092 O ALA A 69 15.659 -14.317 -1.371 1.00 0.00 O ATOM 1093 CB ALA A 69 14.231 -11.507 -0.495 1.00 0.00 C ATOM 0 H ALA A 69 13.739 -13.253 1.119 1.00 0.00 H new ATOM 0 HA ALA A 69 12.849 -12.789 -1.506 1.00 0.00 H new ATOM 0 HB1 ALA A 69 14.402 -10.883 -1.373 1.00 0.00 H new ATOM 0 HB2 ALA A 69 13.462 -11.052 0.129 1.00 0.00 H new ATOM 0 HB3 ALA A 69 15.156 -11.593 0.075 1.00 0.00 H new ATOM 1099 N PHE A 70 14.743 -13.285 -3.147 1.00 0.00 N ATOM 1100 CA PHE A 70 15.601 -13.960 -4.107 1.00 0.00 C ATOM 1101 C PHE A 70 17.081 -13.659 -3.864 1.00 0.00 C ATOM 1102 O PHE A 70 17.928 -14.508 -4.132 1.00 0.00 O ATOM 1103 CB PHE A 70 15.198 -13.546 -5.520 1.00 0.00 C ATOM 1104 CG PHE A 70 16.064 -14.179 -6.584 1.00 0.00 C ATOM 1105 CD1 PHE A 70 15.973 -15.557 -6.826 1.00 0.00 C ATOM 1106 CD2 PHE A 70 16.965 -13.395 -7.320 1.00 0.00 C ATOM 1107 CE1 PHE A 70 16.795 -16.155 -7.795 1.00 0.00 C ATOM 1108 CE2 PHE A 70 17.786 -13.997 -8.282 1.00 0.00 C ATOM 1109 CZ PHE A 70 17.709 -15.377 -8.517 1.00 0.00 C ATOM 0 H PHE A 70 14.106 -12.601 -3.555 1.00 0.00 H new ATOM 0 HA PHE A 70 15.470 -15.035 -3.984 1.00 0.00 H new ATOM 0 HB2 PHE A 70 14.158 -13.823 -5.692 1.00 0.00 H new ATOM 0 HB3 PHE A 70 15.258 -12.461 -5.607 1.00 0.00 H new ATOM 0 HD1 PHE A 70 15.271 -16.158 -6.267 1.00 0.00 H new ATOM 0 HD2 PHE A 70 17.025 -12.331 -7.145 1.00 0.00 H new ATOM 0 HE1 PHE A 70 16.722 -17.216 -7.984 1.00 0.00 H new ATOM 0 HE2 PHE A 70 18.483 -13.394 -8.846 1.00 0.00 H new ATOM 0 HZ PHE A 70 18.352 -15.838 -9.252 1.00 0.00 H new ATOM 1119 N TYR A 71 17.406 -12.464 -3.357 1.00 0.00 N ATOM 1120 CA TYR A 71 18.796 -12.094 -3.127 1.00 0.00 C ATOM 1121 C TYR A 71 19.383 -12.875 -1.953 1.00 0.00 C ATOM 1122 O TYR A 71 20.587 -13.124 -1.918 1.00 0.00 O ATOM 1123 CB TYR A 71 18.867 -10.599 -2.839 1.00 0.00 C ATOM 1124 CG TYR A 71 20.279 -10.089 -2.667 1.00 0.00 C ATOM 1125 CD1 TYR A 71 21.010 -9.694 -3.794 1.00 0.00 C ATOM 1126 CD2 TYR A 71 20.859 -10.006 -1.391 1.00 0.00 C ATOM 1127 CE1 TYR A 71 22.301 -9.162 -3.655 1.00 0.00 C ATOM 1128 CE2 TYR A 71 22.145 -9.476 -1.242 1.00 0.00 C ATOM 1129 CZ TYR A 71 22.863 -9.028 -2.366 1.00 0.00 C ATOM 1130 OH TYR A 71 24.096 -8.477 -2.193 1.00 0.00 O ATOM 0 H TYR A 71 16.728 -11.746 -3.102 1.00 0.00 H new ATOM 0 HA TYR A 71 19.378 -12.334 -4.017 1.00 0.00 H new ATOM 0 HB2 TYR A 71 18.389 -10.056 -3.654 1.00 0.00 H new ATOM 0 HB3 TYR A 71 18.298 -10.383 -1.935 1.00 0.00 H new ATOM 0 HD1 TYR A 71 20.577 -9.800 -4.778 1.00 0.00 H new ATOM 0 HD2 TYR A 71 20.313 -10.351 -0.525 1.00 0.00 H new ATOM 0 HE1 TYR A 71 22.861 -8.857 -4.527 1.00 0.00 H new ATOM 0 HE2 TYR A 71 22.589 -9.410 -0.260 1.00 0.00 H new ATOM 0 HH TYR A 71 24.318 -8.466 -1.239 1.00 0.00 H new ATOM 1140 N THR A 72 18.543 -13.270 -0.992 1.00 0.00 N ATOM 1141 CA THR A 72 19.010 -14.016 0.166 1.00 0.00 C ATOM 1142 C THR A 72 19.490 -15.390 -0.279 1.00 0.00 C ATOM 1143 O THR A 72 20.440 -15.938 0.281 1.00 0.00 O ATOM 1144 CB THR A 72 17.866 -14.157 1.171 1.00 0.00 C ATOM 1145 OG1 THR A 72 17.259 -12.906 1.402 1.00 0.00 O ATOM 1146 CG2 THR A 72 18.370 -14.711 2.500 1.00 0.00 C ATOM 0 H THR A 72 17.540 -13.083 -0.998 1.00 0.00 H new ATOM 0 HA THR A 72 19.837 -13.487 0.639 1.00 0.00 H new ATOM 0 HB THR A 72 17.139 -14.849 0.747 1.00 0.00 H new ATOM 0 HG1 THR A 72 16.363 -13.041 1.774 1.00 0.00 H new ATOM 0 HG21 THR A 72 17.536 -14.801 3.196 1.00 0.00 H new ATOM 0 HG22 THR A 72 18.816 -15.692 2.339 1.00 0.00 H new ATOM 0 HG23 THR A 72 19.118 -14.036 2.915 1.00 0.00 H new ATOM 1154 N TRP A 73 18.829 -15.950 -1.296 1.00 0.00 N ATOM 1155 CA TRP A 73 19.169 -17.242 -1.862 1.00 0.00 C ATOM 1156 C TRP A 73 20.314 -17.116 -2.869 1.00 0.00 C ATOM 1157 O TRP A 73 21.114 -18.039 -3.009 1.00 0.00 O ATOM 1158 CB TRP A 73 17.904 -17.800 -2.510 1.00 0.00 C ATOM 1159 CG TRP A 73 18.037 -19.140 -3.157 1.00 0.00 C ATOM 1160 CD1 TRP A 73 18.052 -20.328 -2.513 1.00 0.00 C ATOM 1161 CD2 TRP A 73 18.168 -19.456 -4.578 1.00 0.00 C ATOM 1162 NE1 TRP A 73 18.149 -21.353 -3.433 1.00 0.00 N ATOM 1163 CE2 TRP A 73 18.219 -20.872 -4.726 1.00 0.00 C ATOM 1164 CE3 TRP A 73 18.242 -18.689 -5.753 1.00 0.00 C ATOM 1165 CZ2 TRP A 73 18.328 -21.492 -5.975 1.00 0.00 C ATOM 1166 CZ3 TRP A 73 18.361 -19.299 -7.011 1.00 0.00 C ATOM 1167 CH2 TRP A 73 18.399 -20.697 -7.125 1.00 0.00 C ATOM 0 H TRP A 73 18.032 -15.505 -1.751 1.00 0.00 H new ATOM 0 HA TRP A 73 19.521 -17.922 -1.086 1.00 0.00 H new ATOM 0 HB2 TRP A 73 17.126 -17.862 -1.749 1.00 0.00 H new ATOM 0 HB3 TRP A 73 17.560 -17.089 -3.261 1.00 0.00 H new ATOM 0 HD1 TRP A 73 17.997 -20.456 -1.442 1.00 0.00 H new ATOM 0 HE1 TRP A 73 18.167 -22.343 -3.188 1.00 0.00 H new ATOM 0 HE3 TRP A 73 18.207 -17.612 -5.687 1.00 0.00 H new ATOM 0 HZ2 TRP A 73 18.357 -22.569 -6.051 1.00 0.00 H new ATOM 0 HZ3 TRP A 73 18.424 -18.687 -7.899 1.00 0.00 H new ATOM 0 HH2 TRP A 73 18.483 -21.159 -8.098 1.00 0.00 H new ATOM 1178 N LEU A 74 20.407 -15.979 -3.575 1.00 0.00 N ATOM 1179 CA LEU A 74 21.470 -15.753 -4.545 1.00 0.00 C ATOM 1180 C LEU A 74 22.796 -15.552 -3.809 1.00 0.00 C ATOM 1181 O LEU A 74 23.845 -16.016 -4.251 1.00 0.00 O ATOM 1182 CB LEU A 74 21.113 -14.518 -5.381 1.00 0.00 C ATOM 1183 CG LEU A 74 21.622 -14.583 -6.828 1.00 0.00 C ATOM 1184 CD1 LEU A 74 21.374 -13.234 -7.495 1.00 0.00 C ATOM 1185 CD2 LEU A 74 23.112 -14.905 -6.932 1.00 0.00 C ATOM 0 H LEU A 74 19.751 -15.203 -3.486 1.00 0.00 H new ATOM 0 HA LEU A 74 21.575 -16.613 -5.207 1.00 0.00 H new ATOM 0 HB2 LEU A 74 20.030 -14.398 -5.392 1.00 0.00 H new ATOM 0 HB3 LEU A 74 21.527 -13.632 -4.899 1.00 0.00 H new ATOM 0 HG LEU A 74 21.080 -15.390 -7.321 1.00 0.00 H new ATOM 0 HD11 LEU A 74 21.731 -13.266 -8.524 1.00 0.00 H new ATOM 0 HD12 LEU A 74 20.306 -13.015 -7.488 1.00 0.00 H new ATOM 0 HD13 LEU A 74 21.907 -12.455 -6.950 1.00 0.00 H new ATOM 0 HD21 LEU A 74 23.405 -14.936 -7.981 1.00 0.00 H new ATOM 0 HD22 LEU A 74 23.687 -14.136 -6.417 1.00 0.00 H new ATOM 0 HD23 LEU A 74 23.308 -15.874 -6.472 1.00 0.00 H new ATOM 1197 N TYR A 75 22.744 -14.854 -2.671 1.00 0.00 N ATOM 1198 CA TYR A 75 23.919 -14.595 -1.859 1.00 0.00 C ATOM 1199 C TYR A 75 24.427 -15.901 -1.257 1.00 0.00 C ATOM 1200 O TYR A 75 25.632 -16.123 -1.178 1.00 0.00 O ATOM 1201 CB TYR A 75 23.520 -13.594 -0.769 1.00 0.00 C ATOM 1202 CG TYR A 75 24.656 -13.019 0.051 1.00 0.00 C ATOM 1203 CD1 TYR A 75 25.463 -13.852 0.841 1.00 0.00 C ATOM 1204 CD2 TYR A 75 24.890 -11.635 0.033 1.00 0.00 C ATOM 1205 CE1 TYR A 75 26.508 -13.313 1.603 1.00 0.00 C ATOM 1206 CE2 TYR A 75 25.925 -11.082 0.802 1.00 0.00 C ATOM 1207 CZ TYR A 75 26.742 -11.921 1.590 1.00 0.00 C ATOM 1208 OH TYR A 75 27.751 -11.389 2.337 1.00 0.00 O ATOM 0 H TYR A 75 21.884 -14.456 -2.294 1.00 0.00 H new ATOM 0 HA TYR A 75 24.727 -14.176 -2.459 1.00 0.00 H new ATOM 0 HB2 TYR A 75 22.984 -12.770 -1.239 1.00 0.00 H new ATOM 0 HB3 TYR A 75 22.821 -14.084 -0.092 1.00 0.00 H new ATOM 0 HD1 TYR A 75 25.277 -14.916 0.862 1.00 0.00 H new ATOM 0 HD2 TYR A 75 24.270 -10.993 -0.576 1.00 0.00 H new ATOM 0 HE1 TYR A 75 27.133 -13.961 2.199 1.00 0.00 H new ATOM 0 HE2 TYR A 75 26.096 -10.016 0.791 1.00 0.00 H new ATOM 0 HH TYR A 75 27.774 -10.417 2.211 1.00 0.00 H new ATOM 1218 N ARG A 76 23.501 -16.769 -0.832 1.00 0.00 N ATOM 1219 CA ARG A 76 23.821 -18.034 -0.189 1.00 0.00 C ATOM 1220 C ARG A 76 24.529 -18.985 -1.152 1.00 0.00 C ATOM 1221 O ARG A 76 25.409 -19.736 -0.733 1.00 0.00 O ATOM 1222 CB ARG A 76 22.510 -18.642 0.320 1.00 0.00 C ATOM 1223 CG ARG A 76 22.705 -19.916 1.141 1.00 0.00 C ATOM 1224 CD ARG A 76 23.535 -19.654 2.398 1.00 0.00 C ATOM 1225 NE ARG A 76 23.398 -20.768 3.341 1.00 0.00 N ATOM 1226 CZ ARG A 76 24.394 -21.303 4.051 1.00 0.00 C ATOM 1227 NH1 ARG A 76 25.641 -20.853 3.931 1.00 0.00 N ATOM 1228 NH2 ARG A 76 24.142 -22.302 4.892 1.00 0.00 N ATOM 0 H ARG A 76 22.499 -16.604 -0.929 1.00 0.00 H new ATOM 0 HA ARG A 76 24.507 -17.866 0.641 1.00 0.00 H new ATOM 0 HB2 ARG A 76 21.989 -17.903 0.929 1.00 0.00 H new ATOM 0 HB3 ARG A 76 21.867 -18.863 -0.532 1.00 0.00 H new ATOM 0 HG2 ARG A 76 21.733 -20.320 1.424 1.00 0.00 H new ATOM 0 HG3 ARG A 76 23.198 -20.672 0.530 1.00 0.00 H new ATOM 0 HD2 ARG A 76 24.583 -19.524 2.129 1.00 0.00 H new ATOM 0 HD3 ARG A 76 23.209 -18.727 2.870 1.00 0.00 H new ATOM 0 HE ARG A 76 22.467 -21.166 3.465 1.00 0.00 H new ATOM 0 HH11 ARG A 76 25.847 -20.088 3.289 1.00 0.00 H new ATOM 0 HH12 ARG A 76 26.390 -21.273 4.481 1.00 0.00 H new ATOM 0 HH21 ARG A 76 23.191 -22.656 4.993 1.00 0.00 H new ATOM 0 HH22 ARG A 76 24.900 -22.714 5.436 1.00 0.00 H new ATOM 1242 N ILE A 77 24.157 -18.958 -2.433 1.00 0.00 N ATOM 1243 CA ILE A 77 24.793 -19.810 -3.431 1.00 0.00 C ATOM 1244 C ILE A 77 26.165 -19.257 -3.797 1.00 0.00 C ATOM 1245 O ILE A 77 27.080 -20.028 -4.068 1.00 0.00 O ATOM 1246 CB ILE A 77 23.891 -19.924 -4.670 1.00 0.00 C ATOM 1247 CG1 ILE A 77 22.671 -20.784 -4.317 1.00 0.00 C ATOM 1248 CG2 ILE A 77 24.657 -20.556 -5.838 1.00 0.00 C ATOM 1249 CD1 ILE A 77 21.712 -20.935 -5.496 1.00 0.00 C ATOM 0 H ILE A 77 23.420 -18.356 -2.800 1.00 0.00 H new ATOM 0 HA ILE A 77 24.933 -20.808 -3.017 1.00 0.00 H new ATOM 0 HB ILE A 77 23.568 -18.928 -4.974 1.00 0.00 H new ATOM 0 HG12 ILE A 77 23.005 -21.770 -3.994 1.00 0.00 H new ATOM 0 HG13 ILE A 77 22.143 -20.335 -3.476 1.00 0.00 H new ATOM 0 HG21 ILE A 77 24.002 -20.628 -6.706 1.00 0.00 H new ATOM 0 HG22 ILE A 77 25.519 -19.937 -6.085 1.00 0.00 H new ATOM 0 HG23 ILE A 77 24.995 -21.553 -5.555 1.00 0.00 H new ATOM 0 HD11 ILE A 77 20.864 -21.552 -5.198 1.00 0.00 H new ATOM 0 HD12 ILE A 77 21.356 -19.952 -5.803 1.00 0.00 H new ATOM 0 HD13 ILE A 77 22.231 -21.409 -6.329 1.00 0.00 H new ATOM 1261 N ALA A 78 26.324 -17.931 -3.812 1.00 0.00 N ATOM 1262 CA ALA A 78 27.576 -17.328 -4.237 1.00 0.00 C ATOM 1263 C ALA A 78 28.712 -17.622 -3.259 1.00 0.00 C ATOM 1264 O ALA A 78 29.830 -17.898 -3.686 1.00 0.00 O ATOM 1265 CB ALA A 78 27.365 -15.824 -4.371 1.00 0.00 C ATOM 0 H ALA A 78 25.603 -17.264 -3.536 1.00 0.00 H new ATOM 0 HA ALA A 78 27.867 -17.758 -5.195 1.00 0.00 H new ATOM 0 HB1 ALA A 78 28.295 -15.353 -4.690 1.00 0.00 H new ATOM 0 HB2 ALA A 78 26.588 -15.630 -5.111 1.00 0.00 H new ATOM 0 HB3 ALA A 78 27.061 -15.412 -3.409 1.00 0.00 H new ATOM 1271 N VAL A 79 28.440 -17.572 -1.952 1.00 0.00 N ATOM 1272 CA VAL A 79 29.465 -17.855 -0.953 1.00 0.00 C ATOM 1273 C VAL A 79 29.756 -19.352 -0.895 1.00 0.00 C ATOM 1274 O VAL A 79 30.885 -19.754 -0.621 1.00 0.00 O ATOM 1275 CB VAL A 79 29.038 -17.303 0.411 1.00 0.00 C ATOM 1276 CG1 VAL A 79 27.678 -17.840 0.857 1.00 0.00 C ATOM 1277 CG2 VAL A 79 30.060 -17.674 1.482 1.00 0.00 C ATOM 0 H VAL A 79 27.525 -17.340 -1.567 1.00 0.00 H new ATOM 0 HA VAL A 79 30.391 -17.355 -1.238 1.00 0.00 H new ATOM 0 HB VAL A 79 28.971 -16.221 0.294 1.00 0.00 H new ATOM 0 HG11 VAL A 79 27.421 -17.419 1.829 1.00 0.00 H new ATOM 0 HG12 VAL A 79 26.919 -17.558 0.128 1.00 0.00 H new ATOM 0 HG13 VAL A 79 27.723 -18.926 0.933 1.00 0.00 H new ATOM 0 HG21 VAL A 79 29.740 -17.274 2.444 1.00 0.00 H new ATOM 0 HG22 VAL A 79 30.139 -18.759 1.549 1.00 0.00 H new ATOM 0 HG23 VAL A 79 31.031 -17.255 1.219 1.00 0.00 H new ATOM 1287 N ASN A 80 28.741 -20.182 -1.157 1.00 0.00 N ATOM 1288 CA ASN A 80 28.910 -21.623 -1.126 1.00 0.00 C ATOM 1289 C ASN A 80 29.490 -22.154 -2.440 1.00 0.00 C ATOM 1290 O ASN A 80 29.998 -23.272 -2.468 1.00 0.00 O ATOM 1291 CB ASN A 80 27.574 -22.275 -0.771 1.00 0.00 C ATOM 1292 CG ASN A 80 27.198 -22.055 0.688 1.00 0.00 C ATOM 1293 OD1 ASN A 80 27.947 -21.455 1.456 1.00 0.00 O ATOM 1294 ND2 ASN A 80 26.031 -22.542 1.089 1.00 0.00 N ATOM 0 H ASN A 80 27.798 -19.873 -1.392 1.00 0.00 H new ATOM 0 HA ASN A 80 29.637 -21.884 -0.357 1.00 0.00 H new ATOM 0 HB2 ASN A 80 26.791 -21.869 -1.412 1.00 0.00 H new ATOM 0 HB3 ASN A 80 27.628 -23.345 -0.973 1.00 0.00 H new ATOM 0 HD21 ASN A 80 25.734 -22.423 2.058 1.00 0.00 H new ATOM 0 HD22 ASN A 80 25.430 -23.036 0.429 1.00 0.00 H new ATOM 1301 N THR A 81 29.427 -21.378 -3.525 1.00 0.00 N ATOM 1302 CA THR A 81 30.026 -21.781 -4.793 1.00 0.00 C ATOM 1303 C THR A 81 31.514 -21.463 -4.787 1.00 0.00 C ATOM 1304 O THR A 81 32.317 -22.247 -5.286 1.00 0.00 O ATOM 1305 CB THR A 81 29.324 -21.074 -5.954 1.00 0.00 C ATOM 1306 OG1 THR A 81 27.994 -21.528 -6.047 1.00 0.00 O ATOM 1307 CG2 THR A 81 30.018 -21.363 -7.283 1.00 0.00 C ATOM 0 H THR A 81 28.967 -20.468 -3.548 1.00 0.00 H new ATOM 0 HA THR A 81 29.903 -22.856 -4.922 1.00 0.00 H new ATOM 0 HB THR A 81 29.358 -20.002 -5.759 1.00 0.00 H new ATOM 0 HG1 THR A 81 27.454 -21.105 -5.347 1.00 0.00 H new ATOM 0 HG21 THR A 81 29.494 -20.846 -8.087 1.00 0.00 H new ATOM 0 HG22 THR A 81 31.050 -21.014 -7.238 1.00 0.00 H new ATOM 0 HG23 THR A 81 30.006 -22.436 -7.474 1.00 0.00 H new ATOM 1315 N ALA A 82 31.897 -20.315 -4.218 1.00 0.00 N ATOM 1316 CA ALA A 82 33.296 -19.931 -4.148 1.00 0.00 C ATOM 1317 C ALA A 82 34.043 -20.781 -3.122 1.00 0.00 C ATOM 1318 O ALA A 82 35.248 -20.986 -3.252 1.00 0.00 O ATOM 1319 CB ALA A 82 33.375 -18.445 -3.804 1.00 0.00 C ATOM 0 H ALA A 82 31.253 -19.642 -3.802 1.00 0.00 H new ATOM 0 HA ALA A 82 33.776 -20.104 -5.111 1.00 0.00 H new ATOM 0 HB1 ALA A 82 34.420 -18.140 -3.747 1.00 0.00 H new ATOM 0 HB2 ALA A 82 32.869 -17.865 -4.576 1.00 0.00 H new ATOM 0 HB3 ALA A 82 32.893 -18.268 -2.843 1.00 0.00 H new ATOM 1325 N LYS A 83 33.339 -21.283 -2.102 1.00 0.00 N ATOM 1326 CA LYS A 83 33.957 -22.115 -1.082 1.00 0.00 C ATOM 1327 C LYS A 83 34.026 -23.571 -1.542 1.00 0.00 C ATOM 1328 O LYS A 83 34.949 -24.297 -1.171 1.00 0.00 O ATOM 1329 CB LYS A 83 33.174 -21.957 0.222 1.00 0.00 C ATOM 1330 CG LYS A 83 33.954 -22.563 1.390 1.00 0.00 C ATOM 1331 CD LYS A 83 33.174 -22.424 2.699 1.00 0.00 C ATOM 1332 CE LYS A 83 32.940 -20.949 3.033 1.00 0.00 C ATOM 1333 NZ LYS A 83 32.213 -20.803 4.308 1.00 0.00 N ATOM 0 H LYS A 83 32.341 -21.124 -1.967 1.00 0.00 H new ATOM 0 HA LYS A 83 34.985 -21.796 -0.910 1.00 0.00 H new ATOM 0 HB2 LYS A 83 32.983 -20.901 0.413 1.00 0.00 H new ATOM 0 HB3 LYS A 83 32.204 -22.445 0.132 1.00 0.00 H new ATOM 0 HG2 LYS A 83 34.154 -23.616 1.191 1.00 0.00 H new ATOM 0 HG3 LYS A 83 34.920 -22.067 1.483 1.00 0.00 H new ATOM 0 HD2 LYS A 83 32.217 -22.940 2.615 1.00 0.00 H new ATOM 0 HD3 LYS A 83 33.724 -22.903 3.509 1.00 0.00 H new ATOM 0 HE2 LYS A 83 33.897 -20.431 3.095 1.00 0.00 H new ATOM 0 HE3 LYS A 83 32.373 -20.477 2.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 32.067 -19.793 4.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 31.291 -21.279 4.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 32.768 -21.234 5.075 1.00 0.00 H new ATOM 1347 N ASN A 84 33.058 -24.009 -2.357 1.00 0.00 N ATOM 1348 CA ASN A 84 33.076 -25.355 -2.910 1.00 0.00 C ATOM 1349 C ASN A 84 34.161 -25.442 -3.988 1.00 0.00 C ATOM 1350 O ASN A 84 34.642 -26.529 -4.301 1.00 0.00 O ATOM 1351 CB ASN A 84 31.681 -25.690 -3.452 1.00 0.00 C ATOM 1352 CG ASN A 84 31.503 -27.165 -3.798 1.00 0.00 C ATOM 1353 OD1 ASN A 84 32.389 -27.986 -3.587 1.00 0.00 O ATOM 1354 ND2 ASN A 84 30.337 -27.512 -4.336 1.00 0.00 N ATOM 0 H ASN A 84 32.257 -23.446 -2.643 1.00 0.00 H new ATOM 0 HA ASN A 84 33.318 -26.091 -2.143 1.00 0.00 H new ATOM 0 HB2 ASN A 84 30.934 -25.406 -2.711 1.00 0.00 H new ATOM 0 HB3 ASN A 84 31.492 -25.090 -4.342 1.00 0.00 H new ATOM 0 HD21 ASN A 84 30.160 -28.485 -4.586 1.00 0.00 H new ATOM 0 HD22 ASN A 84 29.620 -26.805 -4.499 1.00 0.00 H new ATOM 1361 N TYR A 85 34.558 -24.301 -4.557 1.00 0.00 N ATOM 1362 CA TYR A 85 35.646 -24.257 -5.523 1.00 0.00 C ATOM 1363 C TYR A 85 36.996 -24.436 -4.826 1.00 0.00 C ATOM 1364 O TYR A 85 37.919 -25.007 -5.406 1.00 0.00 O ATOM 1365 CB TYR A 85 35.597 -22.916 -6.262 1.00 0.00 C ATOM 1366 CG TYR A 85 36.812 -22.658 -7.122 1.00 0.00 C ATOM 1367 CD1 TYR A 85 36.908 -23.238 -8.395 1.00 0.00 C ATOM 1368 CD2 TYR A 85 37.847 -21.844 -6.637 1.00 0.00 C ATOM 1369 CE1 TYR A 85 38.046 -23.014 -9.181 1.00 0.00 C ATOM 1370 CE2 TYR A 85 38.987 -21.613 -7.420 1.00 0.00 C ATOM 1371 CZ TYR A 85 39.092 -22.203 -8.694 1.00 0.00 C ATOM 1372 OH TYR A 85 40.199 -21.998 -9.458 1.00 0.00 O ATOM 0 H TYR A 85 34.136 -23.393 -4.360 1.00 0.00 H new ATOM 0 HA TYR A 85 35.531 -25.073 -6.237 1.00 0.00 H new ATOM 0 HB2 TYR A 85 34.705 -22.888 -6.888 1.00 0.00 H new ATOM 0 HB3 TYR A 85 35.500 -22.112 -5.533 1.00 0.00 H new ATOM 0 HD1 TYR A 85 36.106 -23.857 -8.769 1.00 0.00 H new ATOM 0 HD2 TYR A 85 37.765 -21.394 -5.658 1.00 0.00 H new ATOM 0 HE1 TYR A 85 38.122 -23.463 -10.160 1.00 0.00 H new ATOM 0 HE2 TYR A 85 39.782 -20.984 -7.047 1.00 0.00 H new ATOM 0 HH TYR A 85 40.824 -21.416 -8.978 1.00 0.00 H new ATOM 1382 N LEU A 86 37.127 -23.958 -3.583 1.00 0.00 N ATOM 1383 CA LEU A 86 38.373 -24.087 -2.840 1.00 0.00 C ATOM 1384 C LEU A 86 38.658 -25.542 -2.473 1.00 0.00 C ATOM 1385 O LEU A 86 39.813 -25.899 -2.247 1.00 0.00 O ATOM 1386 CB LEU A 86 38.309 -23.236 -1.571 1.00 0.00 C ATOM 1387 CG LEU A 86 38.320 -21.734 -1.871 1.00 0.00 C ATOM 1388 CD1 LEU A 86 38.164 -20.974 -0.559 1.00 0.00 C ATOM 1389 CD2 LEU A 86 39.632 -21.308 -2.532 1.00 0.00 C ATOM 0 H LEU A 86 36.382 -23.480 -3.076 1.00 0.00 H new ATOM 0 HA LEU A 86 39.184 -23.736 -3.479 1.00 0.00 H new ATOM 0 HB2 LEU A 86 37.405 -23.486 -1.015 1.00 0.00 H new ATOM 0 HB3 LEU A 86 39.156 -23.481 -0.930 1.00 0.00 H new ATOM 0 HG LEU A 86 37.501 -21.511 -2.555 1.00 0.00 H new ATOM 0 HD11 LEU A 86 38.170 -19.902 -0.757 1.00 0.00 H new ATOM 0 HD12 LEU A 86 37.221 -21.251 -0.088 1.00 0.00 H new ATOM 0 HD13 LEU A 86 38.989 -21.225 0.107 1.00 0.00 H new ATOM 0 HD21 LEU A 86 39.608 -20.237 -2.732 1.00 0.00 H new ATOM 0 HD22 LEU A 86 40.465 -21.534 -1.866 1.00 0.00 H new ATOM 0 HD23 LEU A 86 39.760 -21.849 -3.470 1.00 0.00 H new ATOM 1401 N VAL A 87 37.623 -26.384 -2.413 1.00 0.00 N ATOM 1402 CA VAL A 87 37.798 -27.799 -2.096 1.00 0.00 C ATOM 1403 C VAL A 87 37.734 -28.678 -3.342 1.00 0.00 C ATOM 1404 O VAL A 87 38.130 -29.838 -3.288 1.00 0.00 O ATOM 1405 CB VAL A 87 36.775 -28.251 -1.052 1.00 0.00 C ATOM 1406 CG1 VAL A 87 37.004 -27.511 0.267 1.00 0.00 C ATOM 1407 CG2 VAL A 87 35.344 -28.002 -1.523 1.00 0.00 C ATOM 0 H VAL A 87 36.656 -26.108 -2.580 1.00 0.00 H new ATOM 0 HA VAL A 87 38.796 -27.916 -1.674 1.00 0.00 H new ATOM 0 HB VAL A 87 36.910 -29.323 -0.906 1.00 0.00 H new ATOM 0 HG11 VAL A 87 36.270 -27.841 1.002 1.00 0.00 H new ATOM 0 HG12 VAL A 87 38.007 -27.725 0.635 1.00 0.00 H new ATOM 0 HG13 VAL A 87 36.898 -26.438 0.105 1.00 0.00 H new ATOM 0 HG21 VAL A 87 34.645 -28.335 -0.756 1.00 0.00 H new ATOM 0 HG22 VAL A 87 35.201 -26.937 -1.706 1.00 0.00 H new ATOM 0 HG23 VAL A 87 35.163 -28.556 -2.444 1.00 0.00 H new