USER MOD reduce.3.24.130724 H: found=0, std=0, add=596, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 599 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 129 TYR OH : rot 180:sc= 0 USER MOD Set 1.2: A 173 GLN : amide:sc= -0.145 K(o=-0.14,f=-2!) USER MOD Set 2.1: A 40 THR OG1 : rot -105:sc= 0.485 USER MOD Set 2.2: A 122 HIS : no HE2:sc= -1.02 K(o=-0.53,f=-1.7) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -0.48 X(o=-0.48,f=-0.7) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 42 SER OG : rot 180:sc= -1.91 USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 SER OG : rot 180:sc= 0 USER MOD Single : A 126 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 127 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 131 SER OG : rot 39:sc= 0.641 USER MOD Single : A 143 TYR OH : rot -102:sc= 0.46 USER MOD Single : A 147 CYS SG : rot 61:sc= 0.902 USER MOD Single : A 152 GLN : amide:sc= -0.899 K(o=-0.9,f=-0.24) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 164 SER OG : rot 180:sc= 0 USER MOD Single : A 167 SER OG : rot 180:sc= 0 USER MOD Single : A 175 GLN : amide:sc= -1.33 X(o=-1.3,f=-1) USER MOD ----------------------------------------------------------------- ATOM 89 N PRO A 7 10.885 -9.842 2.259 1.00 0.00 N ATOM 90 CA PRO A 7 11.099 -9.155 0.980 1.00 0.00 C ATOM 91 C PRO A 7 11.283 -7.651 1.155 1.00 0.00 C ATOM 92 O PRO A 7 10.870 -7.077 2.162 1.00 0.00 O ATOM 93 CB PRO A 7 9.816 -9.448 0.197 1.00 0.00 C ATOM 94 CG PRO A 7 8.786 -9.704 1.240 1.00 0.00 C ATOM 95 CD PRO A 7 9.509 -10.357 2.385 1.00 0.00 C ATOM 0 HA PRO A 7 12.005 -9.498 0.481 1.00 0.00 H new ATOM 0 HB2 PRO A 7 9.537 -8.605 -0.436 1.00 0.00 H new ATOM 0 HB3 PRO A 7 9.940 -10.311 -0.457 1.00 0.00 H new ATOM 0 HG2 PRO A 7 8.312 -8.775 1.557 1.00 0.00 H new ATOM 0 HG3 PRO A 7 7.996 -10.350 0.858 1.00 0.00 H new ATOM 0 HD2 PRO A 7 9.066 -10.090 3.344 1.00 0.00 H new ATOM 0 HD3 PRO A 7 9.479 -11.444 2.312 1.00 0.00 H new ATOM 103 N ARG A 8 11.905 -7.018 0.165 1.00 0.00 N ATOM 104 CA ARG A 8 12.144 -5.580 0.209 1.00 0.00 C ATOM 105 C ARG A 8 10.883 -4.810 -0.171 1.00 0.00 C ATOM 106 O ARG A 8 10.144 -5.215 -1.069 1.00 0.00 O ATOM 107 CB ARG A 8 13.288 -5.205 -0.734 1.00 0.00 C ATOM 108 CG ARG A 8 14.209 -4.130 -0.177 1.00 0.00 C ATOM 109 CD ARG A 8 15.577 -4.173 -0.836 1.00 0.00 C ATOM 110 NE ARG A 8 16.649 -3.859 0.106 1.00 0.00 N ATOM 111 CZ ARG A 8 17.928 -4.166 -0.100 1.00 0.00 C ATOM 112 NH1 ARG A 8 18.299 -4.794 -1.208 1.00 0.00 N ATOM 113 NH2 ARG A 8 18.840 -3.843 0.807 1.00 0.00 N ATOM 0 H ARG A 8 12.252 -7.478 -0.677 1.00 0.00 H new ATOM 0 HA ARG A 8 12.420 -5.311 1.229 1.00 0.00 H new ATOM 0 HB2 ARG A 8 13.875 -6.097 -0.952 1.00 0.00 H new ATOM 0 HB3 ARG A 8 12.870 -4.859 -1.679 1.00 0.00 H new ATOM 0 HG2 ARG A 8 13.760 -3.149 -0.332 1.00 0.00 H new ATOM 0 HG3 ARG A 8 14.318 -4.265 0.899 1.00 0.00 H new ATOM 0 HD2 ARG A 8 15.745 -5.164 -1.259 1.00 0.00 H new ATOM 0 HD3 ARG A 8 15.603 -3.464 -1.664 1.00 0.00 H new ATOM 0 HE ARG A 8 16.403 -3.377 0.971 1.00 0.00 H new ATOM 0 HH11 ARG A 8 17.602 -5.045 -1.909 1.00 0.00 H new ATOM 0 HH12 ARG A 8 19.281 -5.026 -1.358 1.00 0.00 H new ATOM 0 HH21 ARG A 8 18.561 -3.360 1.661 1.00 0.00 H new ATOM 0 HH22 ARG A 8 19.820 -4.078 0.651 1.00 0.00 H new ATOM 127 N THR A 9 10.642 -3.701 0.520 1.00 0.00 N ATOM 128 CA THR A 9 9.467 -2.878 0.253 1.00 0.00 C ATOM 129 C THR A 9 9.813 -1.396 0.308 1.00 0.00 C ATOM 130 O THR A 9 10.564 -0.953 1.179 1.00 0.00 O ATOM 131 CB THR A 9 8.358 -3.194 1.257 1.00 0.00 C ATOM 132 OG1 THR A 9 8.690 -2.698 2.543 1.00 0.00 O ATOM 133 CG2 THR A 9 8.078 -4.674 1.396 1.00 0.00 C ATOM 0 H THR A 9 11.242 -3.352 1.267 1.00 0.00 H new ATOM 0 HA THR A 9 9.115 -3.110 -0.752 1.00 0.00 H new ATOM 0 HB THR A 9 7.466 -2.708 0.863 1.00 0.00 H new ATOM 0 HG1 THR A 9 7.968 -2.908 3.171 1.00 0.00 H new ATOM 0 HG21 THR A 9 7.281 -4.827 2.124 1.00 0.00 H new ATOM 0 HG22 THR A 9 7.771 -5.078 0.431 1.00 0.00 H new ATOM 0 HG23 THR A 9 8.980 -5.185 1.733 1.00 0.00 H new ATOM 141 N GLY A 10 9.259 -0.633 -0.628 1.00 0.00 N ATOM 142 CA GLY A 10 9.517 0.794 -0.673 1.00 0.00 C ATOM 143 C GLY A 10 8.318 1.583 -1.159 1.00 0.00 C ATOM 144 O GLY A 10 7.759 1.291 -2.217 1.00 0.00 O ATOM 0 H GLY A 10 8.635 -0.978 -1.357 1.00 0.00 H new ATOM 0 HA2 GLY A 10 9.798 1.141 0.321 1.00 0.00 H new ATOM 0 HA3 GLY A 10 10.366 0.986 -1.330 1.00 0.00 H new ATOM 148 N LEU A 11 7.919 2.586 -0.383 1.00 0.00 N ATOM 149 CA LEU A 11 6.776 3.421 -0.739 1.00 0.00 C ATOM 150 C LEU A 11 6.996 4.103 -2.086 1.00 0.00 C ATOM 151 O LEU A 11 7.749 5.072 -2.186 1.00 0.00 O ATOM 152 CB LEU A 11 6.533 4.473 0.345 1.00 0.00 C ATOM 153 CG LEU A 11 5.574 4.044 1.458 1.00 0.00 C ATOM 154 CD1 LEU A 11 5.623 5.032 2.615 1.00 0.00 C ATOM 155 CD2 LEU A 11 4.157 3.918 0.921 1.00 0.00 C ATOM 0 H LEU A 11 8.370 2.840 0.496 1.00 0.00 H new ATOM 0 HA LEU A 11 5.899 2.779 -0.818 1.00 0.00 H new ATOM 0 HB2 LEU A 11 7.490 4.739 0.793 1.00 0.00 H new ATOM 0 HB3 LEU A 11 6.140 5.374 -0.126 1.00 0.00 H new ATOM 0 HG LEU A 11 5.889 3.068 1.827 1.00 0.00 H new ATOM 0 HD11 LEU A 11 4.935 4.711 3.397 1.00 0.00 H new ATOM 0 HD12 LEU A 11 6.636 5.072 3.017 1.00 0.00 H new ATOM 0 HD13 LEU A 11 5.334 6.021 2.261 1.00 0.00 H new ATOM 0 HD21 LEU A 11 3.489 3.612 1.726 1.00 0.00 H new ATOM 0 HD22 LEU A 11 3.831 4.880 0.525 1.00 0.00 H new ATOM 0 HD23 LEU A 11 4.134 3.172 0.127 1.00 0.00 H new ATOM 167 N LEU A 12 6.332 3.592 -3.118 1.00 0.00 N ATOM 168 CA LEU A 12 6.454 4.157 -4.457 1.00 0.00 C ATOM 169 C LEU A 12 5.228 4.994 -4.803 1.00 0.00 C ATOM 170 O LEU A 12 4.233 4.981 -4.079 1.00 0.00 O ATOM 171 CB LEU A 12 6.642 3.041 -5.489 1.00 0.00 C ATOM 172 CG LEU A 12 8.041 2.971 -6.113 1.00 0.00 C ATOM 173 CD1 LEU A 12 8.654 1.595 -5.903 1.00 0.00 C ATOM 174 CD2 LEU A 12 7.983 3.308 -7.597 1.00 0.00 C ATOM 0 H LEU A 12 5.705 2.790 -3.053 1.00 0.00 H new ATOM 0 HA LEU A 12 7.330 4.806 -4.477 1.00 0.00 H new ATOM 0 HB2 LEU A 12 6.423 2.085 -5.013 1.00 0.00 H new ATOM 0 HB3 LEU A 12 5.910 3.175 -6.286 1.00 0.00 H new ATOM 0 HG LEU A 12 8.673 3.708 -5.617 1.00 0.00 H new ATOM 0 HD11 LEU A 12 9.646 1.566 -6.353 1.00 0.00 H new ATOM 0 HD12 LEU A 12 8.734 1.391 -4.835 1.00 0.00 H new ATOM 0 HD13 LEU A 12 8.022 0.840 -6.370 1.00 0.00 H new ATOM 0 HD21 LEU A 12 8.985 3.253 -8.022 1.00 0.00 H new ATOM 0 HD22 LEU A 12 7.333 2.597 -8.107 1.00 0.00 H new ATOM 0 HD23 LEU A 12 7.589 4.316 -7.726 1.00 0.00 H new ATOM 186 N GLU A 13 5.306 5.725 -5.909 1.00 0.00 N ATOM 187 CA GLU A 13 4.202 6.572 -6.344 1.00 0.00 C ATOM 188 C GLU A 13 3.618 6.079 -7.664 1.00 0.00 C ATOM 189 O GLU A 13 4.314 5.473 -8.478 1.00 0.00 O ATOM 190 CB GLU A 13 4.672 8.020 -6.490 1.00 0.00 C ATOM 191 CG GLU A 13 3.657 9.041 -6.005 1.00 0.00 C ATOM 192 CD GLU A 13 4.263 10.416 -5.805 1.00 0.00 C ATOM 193 OE1 GLU A 13 4.554 11.089 -6.817 1.00 0.00 O ATOM 194 OE2 GLU A 13 4.448 10.819 -4.638 1.00 0.00 O ATOM 0 H GLU A 13 6.122 5.748 -6.521 1.00 0.00 H new ATOM 0 HA GLU A 13 3.421 6.523 -5.585 1.00 0.00 H new ATOM 0 HB2 GLU A 13 5.600 8.150 -5.933 1.00 0.00 H new ATOM 0 HB3 GLU A 13 4.899 8.215 -7.538 1.00 0.00 H new ATOM 0 HG2 GLU A 13 2.842 9.109 -6.726 1.00 0.00 H new ATOM 0 HG3 GLU A 13 3.224 8.699 -5.065 1.00 0.00 H new ATOM 201 N LEU A 14 2.332 6.348 -7.868 1.00 0.00 N ATOM 202 CA LEU A 14 1.644 5.941 -9.087 1.00 0.00 C ATOM 203 C LEU A 14 0.743 7.065 -9.590 1.00 0.00 C ATOM 204 O LEU A 14 0.131 7.778 -8.797 1.00 0.00 O ATOM 205 CB LEU A 14 0.813 4.680 -8.833 1.00 0.00 C ATOM 206 CG LEU A 14 0.014 4.177 -10.039 1.00 0.00 C ATOM 207 CD1 LEU A 14 0.682 2.957 -10.653 1.00 0.00 C ATOM 208 CD2 LEU A 14 -1.418 3.855 -9.634 1.00 0.00 C ATOM 0 H LEU A 14 1.744 6.848 -7.201 1.00 0.00 H new ATOM 0 HA LEU A 14 2.393 5.723 -9.849 1.00 0.00 H new ATOM 0 HB2 LEU A 14 1.480 3.884 -8.501 1.00 0.00 H new ATOM 0 HB3 LEU A 14 0.121 4.878 -8.015 1.00 0.00 H new ATOM 0 HG LEU A 14 -0.010 4.968 -10.789 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.099 2.615 -11.508 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.688 3.219 -10.981 1.00 0.00 H new ATOM 0 HD13 LEU A 14 0.739 2.161 -9.911 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -1.971 3.499 -10.503 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -1.414 3.082 -8.865 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -1.896 4.753 -9.243 1.00 0.00 H new ATOM 220 N ARG A 15 0.673 7.226 -10.907 1.00 0.00 N ATOM 221 CA ARG A 15 -0.151 8.277 -11.497 1.00 0.00 C ATOM 222 C ARG A 15 -1.635 7.975 -11.309 1.00 0.00 C ATOM 223 O ARG A 15 -2.003 6.974 -10.696 1.00 0.00 O ATOM 224 CB ARG A 15 0.155 8.437 -12.989 1.00 0.00 C ATOM 225 CG ARG A 15 0.145 7.131 -13.767 1.00 0.00 C ATOM 226 CD ARG A 15 1.332 7.039 -14.714 1.00 0.00 C ATOM 227 NE ARG A 15 0.918 7.068 -16.114 1.00 0.00 N ATOM 228 CZ ARG A 15 0.434 6.011 -16.765 1.00 0.00 C ATOM 229 NH1 ARG A 15 0.305 4.843 -16.149 1.00 0.00 N ATOM 230 NH2 ARG A 15 0.078 6.126 -18.038 1.00 0.00 N ATOM 0 H ARG A 15 1.172 6.648 -11.583 1.00 0.00 H new ATOM 0 HA ARG A 15 0.088 9.209 -10.985 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -0.576 9.115 -13.428 1.00 0.00 H new ATOM 0 HB3 ARG A 15 1.132 8.907 -13.100 1.00 0.00 H new ATOM 0 HG2 ARG A 15 0.166 6.292 -13.072 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -0.782 7.051 -14.335 1.00 0.00 H new ATOM 0 HD2 ARG A 15 2.015 7.866 -14.521 1.00 0.00 H new ATOM 0 HD3 ARG A 15 1.882 6.119 -14.518 1.00 0.00 H new ATOM 0 HE ARG A 15 1.004 7.948 -16.623 1.00 0.00 H new ATOM 0 HH11 ARG A 15 0.577 4.750 -15.170 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -0.066 4.038 -16.654 1.00 0.00 H new ATOM 0 HH21 ARG A 15 0.175 7.022 -18.516 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -0.293 5.318 -18.539 1.00 0.00 H new ATOM 360 N TRP A 27 -1.273 11.712 -8.972 1.00 0.00 N ATOM 361 CA TRP A 27 -0.254 10.719 -8.648 1.00 0.00 C ATOM 362 C TRP A 27 -0.385 10.260 -7.198 1.00 0.00 C ATOM 363 O TRP A 27 0.133 10.903 -6.284 1.00 0.00 O ATOM 364 CB TRP A 27 1.143 11.298 -8.886 1.00 0.00 C ATOM 365 CG TRP A 27 1.703 10.994 -10.245 1.00 0.00 C ATOM 366 CD1 TRP A 27 1.515 11.713 -11.389 1.00 0.00 C ATOM 367 CD2 TRP A 27 2.548 9.896 -10.598 1.00 0.00 C ATOM 368 NE1 TRP A 27 2.201 11.134 -12.430 1.00 0.00 N ATOM 369 CE2 TRP A 27 2.842 10.016 -11.969 1.00 0.00 C ATOM 370 CE3 TRP A 27 3.084 8.825 -9.886 1.00 0.00 C ATOM 371 CZ2 TRP A 27 3.653 9.103 -12.639 1.00 0.00 C ATOM 372 CZ3 TRP A 27 3.889 7.918 -10.551 1.00 0.00 C ATOM 373 CH2 TRP A 27 4.167 8.063 -11.916 1.00 0.00 C ATOM 0 HA TRP A 27 -0.400 9.857 -9.299 1.00 0.00 H new ATOM 0 HB2 TRP A 27 1.105 12.379 -8.753 1.00 0.00 H new ATOM 0 HB3 TRP A 27 1.822 10.907 -8.128 1.00 0.00 H new ATOM 0 HD1 TRP A 27 0.914 12.607 -11.466 1.00 0.00 H new ATOM 0 HE1 TRP A 27 2.228 11.481 -13.389 1.00 0.00 H new ATOM 0 HE3 TRP A 27 2.875 8.705 -8.833 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 3.868 9.213 -13.692 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 4.310 7.084 -10.009 1.00 0.00 H new ATOM 0 HH2 TRP A 27 4.800 7.339 -12.407 1.00 0.00 H new ATOM 384 N GLN A 28 -1.081 9.146 -6.994 1.00 0.00 N ATOM 385 CA GLN A 28 -1.278 8.602 -5.654 1.00 0.00 C ATOM 386 C GLN A 28 -0.027 7.873 -5.173 1.00 0.00 C ATOM 387 O GLN A 28 0.967 7.785 -5.891 1.00 0.00 O ATOM 388 CB GLN A 28 -2.476 7.651 -5.638 1.00 0.00 C ATOM 389 CG GLN A 28 -3.316 7.751 -4.374 1.00 0.00 C ATOM 390 CD GLN A 28 -3.213 6.514 -3.504 1.00 0.00 C ATOM 391 OE1 GLN A 28 -2.834 6.592 -2.335 1.00 0.00 O ATOM 392 NE2 GLN A 28 -3.549 5.361 -4.071 1.00 0.00 N ATOM 0 H GLN A 28 -1.518 8.602 -7.738 1.00 0.00 H new ATOM 0 HA GLN A 28 -1.474 9.433 -4.977 1.00 0.00 H new ATOM 0 HB2 GLN A 28 -3.107 7.861 -6.501 1.00 0.00 H new ATOM 0 HB3 GLN A 28 -2.118 6.627 -5.746 1.00 0.00 H new ATOM 0 HG2 GLN A 28 -2.999 8.622 -3.800 1.00 0.00 H new ATOM 0 HG3 GLN A 28 -4.359 7.912 -4.647 1.00 0.00 H new ATOM 0 HE21 GLN A 28 -3.858 5.342 -5.043 1.00 0.00 H new ATOM 0 HE22 GLN A 28 -3.498 4.495 -3.535 1.00 0.00 H new ATOM 401 N ARG A 29 -0.086 7.350 -3.951 1.00 0.00 N ATOM 402 CA ARG A 29 1.040 6.628 -3.372 1.00 0.00 C ATOM 403 C ARG A 29 0.711 5.147 -3.209 1.00 0.00 C ATOM 404 O ARG A 29 -0.359 4.789 -2.718 1.00 0.00 O ATOM 405 CB ARG A 29 1.417 7.232 -2.017 1.00 0.00 C ATOM 406 CG ARG A 29 2.672 6.628 -1.411 1.00 0.00 C ATOM 407 CD ARG A 29 3.260 7.530 -0.337 1.00 0.00 C ATOM 408 NE ARG A 29 2.625 7.321 0.961 1.00 0.00 N ATOM 409 CZ ARG A 29 3.152 7.720 2.116 1.00 0.00 C ATOM 410 NH1 ARG A 29 4.320 8.350 2.138 1.00 0.00 N ATOM 411 NH2 ARG A 29 2.509 7.488 3.253 1.00 0.00 N ATOM 0 H ARG A 29 -0.903 7.414 -3.343 1.00 0.00 H new ATOM 0 HA ARG A 29 1.887 6.720 -4.051 1.00 0.00 H new ATOM 0 HB2 ARG A 29 1.561 8.306 -2.135 1.00 0.00 H new ATOM 0 HB3 ARG A 29 0.587 7.096 -1.324 1.00 0.00 H new ATOM 0 HG2 ARG A 29 2.438 5.654 -0.982 1.00 0.00 H new ATOM 0 HG3 ARG A 29 3.412 6.462 -2.194 1.00 0.00 H new ATOM 0 HD2 ARG A 29 4.330 7.342 -0.251 1.00 0.00 H new ATOM 0 HD3 ARG A 29 3.142 8.572 -0.634 1.00 0.00 H new ATOM 0 HE ARG A 29 1.725 6.841 0.984 1.00 0.00 H new ATOM 0 HH11 ARG A 29 4.819 8.531 1.267 1.00 0.00 H new ATOM 0 HH12 ARG A 29 4.719 8.654 3.026 1.00 0.00 H new ATOM 0 HH21 ARG A 29 1.611 7.004 3.242 1.00 0.00 H new ATOM 0 HH22 ARG A 29 2.912 7.794 4.139 1.00 0.00 H new ATOM 425 N VAL A 30 1.639 4.290 -3.626 1.00 0.00 N ATOM 426 CA VAL A 30 1.447 2.848 -3.527 1.00 0.00 C ATOM 427 C VAL A 30 2.733 2.148 -3.093 1.00 0.00 C ATOM 428 O VAL A 30 3.761 2.243 -3.762 1.00 0.00 O ATOM 429 CB VAL A 30 0.984 2.250 -4.872 1.00 0.00 C ATOM 430 CG1 VAL A 30 -0.387 2.788 -5.255 1.00 0.00 C ATOM 431 CG2 VAL A 30 2.003 2.538 -5.963 1.00 0.00 C ATOM 0 H VAL A 30 2.530 4.570 -4.035 1.00 0.00 H new ATOM 0 HA VAL A 30 0.675 2.684 -2.776 1.00 0.00 H new ATOM 0 HB VAL A 30 0.903 1.169 -4.759 1.00 0.00 H new ATOM 0 HG11 VAL A 30 -0.695 2.354 -6.206 1.00 0.00 H new ATOM 0 HG12 VAL A 30 -1.110 2.523 -4.484 1.00 0.00 H new ATOM 0 HG13 VAL A 30 -0.339 3.873 -5.350 1.00 0.00 H new ATOM 0 HG21 VAL A 30 1.660 2.109 -6.904 1.00 0.00 H new ATOM 0 HG22 VAL A 30 2.119 3.616 -6.077 1.00 0.00 H new ATOM 0 HG23 VAL A 30 2.962 2.096 -5.691 1.00 0.00 H new ATOM 441 N LEU A 31 2.663 1.443 -1.969 1.00 0.00 N ATOM 442 CA LEU A 31 3.813 0.722 -1.444 1.00 0.00 C ATOM 443 C LEU A 31 4.124 -0.497 -2.310 1.00 0.00 C ATOM 444 O LEU A 31 3.241 -1.303 -2.603 1.00 0.00 O ATOM 445 CB LEU A 31 3.543 0.293 0.001 1.00 0.00 C ATOM 446 CG LEU A 31 4.575 -0.661 0.610 1.00 0.00 C ATOM 447 CD1 LEU A 31 5.709 0.118 1.256 1.00 0.00 C ATOM 448 CD2 LEU A 31 3.910 -1.578 1.624 1.00 0.00 C ATOM 0 H LEU A 31 1.818 1.356 -1.404 1.00 0.00 H new ATOM 0 HA LEU A 31 4.679 1.384 -1.462 1.00 0.00 H new ATOM 0 HB2 LEU A 31 3.489 1.187 0.623 1.00 0.00 H new ATOM 0 HB3 LEU A 31 2.564 -0.184 0.043 1.00 0.00 H new ATOM 0 HG LEU A 31 4.995 -1.273 -0.188 1.00 0.00 H new ATOM 0 HD11 LEU A 31 6.431 -0.578 1.683 1.00 0.00 H new ATOM 0 HD12 LEU A 31 6.200 0.736 0.504 1.00 0.00 H new ATOM 0 HD13 LEU A 31 5.309 0.755 2.045 1.00 0.00 H new ATOM 0 HD21 LEU A 31 4.655 -2.251 2.049 1.00 0.00 H new ATOM 0 HD22 LEU A 31 3.465 -0.980 2.419 1.00 0.00 H new ATOM 0 HD23 LEU A 31 3.132 -2.162 1.132 1.00 0.00 H new ATOM 460 N LEU A 32 5.383 -0.622 -2.719 1.00 0.00 N ATOM 461 CA LEU A 32 5.807 -1.740 -3.554 1.00 0.00 C ATOM 462 C LEU A 32 6.391 -2.866 -2.706 1.00 0.00 C ATOM 463 O LEU A 32 7.232 -2.632 -1.838 1.00 0.00 O ATOM 464 CB LEU A 32 6.836 -1.270 -4.585 1.00 0.00 C ATOM 465 CG LEU A 32 6.575 -1.736 -6.019 1.00 0.00 C ATOM 466 CD1 LEU A 32 5.710 -0.726 -6.757 1.00 0.00 C ATOM 467 CD2 LEU A 32 7.888 -1.955 -6.754 1.00 0.00 C ATOM 0 H LEU A 32 6.126 0.036 -2.486 1.00 0.00 H new ATOM 0 HA LEU A 32 4.931 -2.125 -4.075 1.00 0.00 H new ATOM 0 HB2 LEU A 32 6.868 -0.181 -4.573 1.00 0.00 H new ATOM 0 HB3 LEU A 32 7.821 -1.621 -4.279 1.00 0.00 H new ATOM 0 HG LEU A 32 6.040 -2.685 -5.983 1.00 0.00 H new ATOM 0 HD11 LEU A 32 5.534 -1.073 -7.775 1.00 0.00 H new ATOM 0 HD12 LEU A 32 4.756 -0.618 -6.241 1.00 0.00 H new ATOM 0 HD13 LEU A 32 6.219 0.237 -6.785 1.00 0.00 H new ATOM 0 HD21 LEU A 32 7.684 -2.286 -7.772 1.00 0.00 H new ATOM 0 HD22 LEU A 32 8.450 -1.021 -6.782 1.00 0.00 H new ATOM 0 HD23 LEU A 32 8.473 -2.715 -6.236 1.00 0.00 H new ATOM 479 N SER A 33 5.942 -4.089 -2.969 1.00 0.00 N ATOM 480 CA SER A 33 6.418 -5.256 -2.236 1.00 0.00 C ATOM 481 C SER A 33 7.302 -6.128 -3.122 1.00 0.00 C ATOM 482 O SER A 33 6.834 -7.088 -3.732 1.00 0.00 O ATOM 483 CB SER A 33 5.236 -6.073 -1.712 1.00 0.00 C ATOM 484 OG SER A 33 5.540 -6.666 -0.461 1.00 0.00 O ATOM 0 H SER A 33 5.247 -4.298 -3.686 1.00 0.00 H new ATOM 0 HA SER A 33 7.011 -4.907 -1.391 1.00 0.00 H new ATOM 0 HB2 SER A 33 4.362 -5.430 -1.610 1.00 0.00 H new ATOM 0 HB3 SER A 33 4.978 -6.849 -2.433 1.00 0.00 H new ATOM 0 HG SER A 33 4.768 -7.181 -0.147 1.00 0.00 H new ATOM 490 N LEU A 34 8.584 -5.782 -3.187 1.00 0.00 N ATOM 491 CA LEU A 34 9.540 -6.527 -3.998 1.00 0.00 C ATOM 492 C LEU A 34 10.036 -7.767 -3.258 1.00 0.00 C ATOM 493 O LEU A 34 10.792 -7.664 -2.292 1.00 0.00 O ATOM 494 CB LEU A 34 10.718 -5.620 -4.371 1.00 0.00 C ATOM 495 CG LEU A 34 11.976 -6.329 -4.879 1.00 0.00 C ATOM 496 CD1 LEU A 34 11.629 -7.315 -5.983 1.00 0.00 C ATOM 497 CD2 LEU A 34 12.995 -5.315 -5.373 1.00 0.00 C ATOM 0 H LEU A 34 8.985 -4.989 -2.687 1.00 0.00 H new ATOM 0 HA LEU A 34 9.040 -6.859 -4.908 1.00 0.00 H new ATOM 0 HB2 LEU A 34 10.384 -4.921 -5.138 1.00 0.00 H new ATOM 0 HB3 LEU A 34 10.987 -5.028 -3.496 1.00 0.00 H new ATOM 0 HG LEU A 34 12.414 -6.884 -4.050 1.00 0.00 H new ATOM 0 HD11 LEU A 34 12.537 -7.808 -6.330 1.00 0.00 H new ATOM 0 HD12 LEU A 34 10.935 -8.062 -5.598 1.00 0.00 H new ATOM 0 HD13 LEU A 34 11.165 -6.783 -6.814 1.00 0.00 H new ATOM 0 HD21 LEU A 34 13.883 -5.836 -5.731 1.00 0.00 H new ATOM 0 HD22 LEU A 34 12.564 -4.733 -6.187 1.00 0.00 H new ATOM 0 HD23 LEU A 34 13.270 -4.648 -4.556 1.00 0.00 H new ATOM 509 N ALA A 35 9.603 -8.935 -3.720 1.00 0.00 N ATOM 510 CA ALA A 35 10.001 -10.197 -3.106 1.00 0.00 C ATOM 511 C ALA A 35 10.759 -11.071 -4.096 1.00 0.00 C ATOM 512 O ALA A 35 10.480 -11.054 -5.296 1.00 0.00 O ATOM 513 CB ALA A 35 8.779 -10.933 -2.575 1.00 0.00 C ATOM 0 H ALA A 35 8.976 -9.034 -4.518 1.00 0.00 H new ATOM 0 HA ALA A 35 10.668 -9.975 -2.273 1.00 0.00 H new ATOM 0 HB1 ALA A 35 9.090 -11.873 -2.119 1.00 0.00 H new ATOM 0 HB2 ALA A 35 8.279 -10.316 -1.829 1.00 0.00 H new ATOM 0 HB3 ALA A 35 8.092 -11.138 -3.396 1.00 0.00 H new ATOM 519 N GLU A 36 11.721 -11.837 -3.590 1.00 0.00 N ATOM 520 CA GLU A 36 12.522 -12.719 -4.433 1.00 0.00 C ATOM 521 C GLU A 36 11.657 -13.770 -5.123 1.00 0.00 C ATOM 522 O GLU A 36 12.084 -14.404 -6.087 1.00 0.00 O ATOM 523 CB GLU A 36 13.612 -13.402 -3.605 1.00 0.00 C ATOM 524 CG GLU A 36 14.341 -12.458 -2.660 1.00 0.00 C ATOM 525 CD GLU A 36 15.615 -13.062 -2.104 1.00 0.00 C ATOM 526 OE1 GLU A 36 16.205 -13.932 -2.779 1.00 0.00 O ATOM 527 OE2 GLU A 36 16.026 -12.663 -0.993 1.00 0.00 O ATOM 0 H GLU A 36 11.965 -11.865 -2.600 1.00 0.00 H new ATOM 0 HA GLU A 36 12.988 -12.105 -5.204 1.00 0.00 H new ATOM 0 HB2 GLU A 36 13.164 -14.209 -3.025 1.00 0.00 H new ATOM 0 HB3 GLU A 36 14.336 -13.859 -4.279 1.00 0.00 H new ATOM 0 HG2 GLU A 36 14.581 -11.535 -3.187 1.00 0.00 H new ATOM 0 HG3 GLU A 36 13.679 -12.192 -1.836 1.00 0.00 H new ATOM 534 N ASP A 37 10.442 -13.947 -4.625 1.00 0.00 N ATOM 535 CA ASP A 37 9.515 -14.918 -5.193 1.00 0.00 C ATOM 536 C ASP A 37 8.574 -14.255 -6.192 1.00 0.00 C ATOM 537 O ASP A 37 8.057 -14.909 -7.100 1.00 0.00 O ATOM 538 CB ASP A 37 8.706 -15.595 -4.083 1.00 0.00 C ATOM 539 CG ASP A 37 8.094 -14.595 -3.123 1.00 0.00 C ATOM 540 OD1 ASP A 37 7.975 -13.409 -3.495 1.00 0.00 O ATOM 541 OD2 ASP A 37 7.733 -14.997 -1.997 1.00 0.00 O ATOM 0 H ASP A 37 10.073 -13.430 -3.827 1.00 0.00 H new ATOM 0 HA ASP A 37 10.099 -15.673 -5.719 1.00 0.00 H new ATOM 0 HB2 ASP A 37 7.915 -16.197 -4.529 1.00 0.00 H new ATOM 0 HB3 ASP A 37 9.352 -16.277 -3.530 1.00 0.00 H new ATOM 546 N ALA A 38 8.353 -12.955 -6.024 1.00 0.00 N ATOM 547 CA ALA A 38 7.473 -12.205 -6.915 1.00 0.00 C ATOM 548 C ALA A 38 7.412 -10.735 -6.516 1.00 0.00 C ATOM 549 O ALA A 38 8.032 -10.319 -5.537 1.00 0.00 O ATOM 550 CB ALA A 38 6.077 -12.814 -6.913 1.00 0.00 C ATOM 0 H ALA A 38 8.771 -12.398 -5.279 1.00 0.00 H new ATOM 0 HA ALA A 38 7.882 -12.264 -7.924 1.00 0.00 H new ATOM 0 HB1 ALA A 38 5.431 -12.245 -7.582 1.00 0.00 H new ATOM 0 HB2 ALA A 38 6.131 -13.848 -7.253 1.00 0.00 H new ATOM 0 HB3 ALA A 38 5.669 -12.785 -5.903 1.00 0.00 H new ATOM 556 N LEU A 39 6.660 -9.950 -7.282 1.00 0.00 N ATOM 557 CA LEU A 39 6.517 -8.524 -7.009 1.00 0.00 C ATOM 558 C LEU A 39 5.047 -8.151 -6.829 1.00 0.00 C ATOM 559 O LEU A 39 4.260 -8.219 -7.771 1.00 0.00 O ATOM 560 CB LEU A 39 7.130 -7.702 -8.147 1.00 0.00 C ATOM 561 CG LEU A 39 8.160 -6.659 -7.710 1.00 0.00 C ATOM 562 CD1 LEU A 39 9.145 -6.379 -8.834 1.00 0.00 C ATOM 563 CD2 LEU A 39 7.466 -5.378 -7.273 1.00 0.00 C ATOM 0 H LEU A 39 6.140 -10.277 -8.096 1.00 0.00 H new ATOM 0 HA LEU A 39 7.046 -8.300 -6.083 1.00 0.00 H new ATOM 0 HB2 LEU A 39 7.603 -8.384 -8.853 1.00 0.00 H new ATOM 0 HB3 LEU A 39 6.327 -7.195 -8.682 1.00 0.00 H new ATOM 0 HG LEU A 39 8.715 -7.056 -6.860 1.00 0.00 H new ATOM 0 HD11 LEU A 39 9.870 -5.635 -8.505 1.00 0.00 H new ATOM 0 HD12 LEU A 39 9.665 -7.299 -9.100 1.00 0.00 H new ATOM 0 HD13 LEU A 39 8.607 -6.002 -9.704 1.00 0.00 H new ATOM 0 HD21 LEU A 39 8.213 -4.646 -6.965 1.00 0.00 H new ATOM 0 HD22 LEU A 39 6.886 -4.977 -8.104 1.00 0.00 H new ATOM 0 HD23 LEU A 39 6.801 -5.592 -6.436 1.00 0.00 H new ATOM 575 N THR A 40 4.685 -7.759 -5.611 1.00 0.00 N ATOM 576 CA THR A 40 3.310 -7.376 -5.308 1.00 0.00 C ATOM 577 C THR A 40 3.231 -5.910 -4.894 1.00 0.00 C ATOM 578 O THR A 40 4.031 -5.440 -4.086 1.00 0.00 O ATOM 579 CB THR A 40 2.746 -8.262 -4.197 1.00 0.00 C ATOM 580 OG1 THR A 40 2.848 -9.631 -4.546 1.00 0.00 O ATOM 581 CG2 THR A 40 1.293 -7.976 -3.882 1.00 0.00 C ATOM 0 H THR A 40 5.324 -7.698 -4.818 1.00 0.00 H new ATOM 0 HA THR A 40 2.714 -7.512 -6.211 1.00 0.00 H new ATOM 0 HB THR A 40 3.344 -8.034 -3.315 1.00 0.00 H new ATOM 0 HG1 THR A 40 1.963 -9.973 -4.792 1.00 0.00 H new ATOM 0 HG21 THR A 40 0.956 -8.639 -3.085 1.00 0.00 H new ATOM 0 HG22 THR A 40 1.188 -6.940 -3.560 1.00 0.00 H new ATOM 0 HG23 THR A 40 0.688 -8.143 -4.773 1.00 0.00 H new ATOM 589 N VAL A 41 2.260 -5.192 -5.454 1.00 0.00 N ATOM 590 CA VAL A 41 2.078 -3.778 -5.138 1.00 0.00 C ATOM 591 C VAL A 41 0.741 -3.536 -4.447 1.00 0.00 C ATOM 592 O VAL A 41 -0.177 -4.350 -4.544 1.00 0.00 O ATOM 593 CB VAL A 41 2.149 -2.902 -6.405 1.00 0.00 C ATOM 594 CG1 VAL A 41 2.258 -1.432 -6.032 1.00 0.00 C ATOM 595 CG2 VAL A 41 3.315 -3.323 -7.287 1.00 0.00 C ATOM 0 H VAL A 41 1.590 -5.565 -6.126 1.00 0.00 H new ATOM 0 HA VAL A 41 2.890 -3.500 -4.466 1.00 0.00 H new ATOM 0 HB VAL A 41 1.229 -3.044 -6.971 1.00 0.00 H new ATOM 0 HG11 VAL A 41 2.307 -0.829 -6.939 1.00 0.00 H new ATOM 0 HG12 VAL A 41 1.385 -1.139 -5.448 1.00 0.00 H new ATOM 0 HG13 VAL A 41 3.160 -1.272 -5.441 1.00 0.00 H new ATOM 0 HG21 VAL A 41 3.346 -2.692 -8.175 1.00 0.00 H new ATOM 0 HG22 VAL A 41 4.248 -3.216 -6.733 1.00 0.00 H new ATOM 0 HG23 VAL A 41 3.188 -4.364 -7.586 1.00 0.00 H new ATOM 605 N SER A 42 0.639 -2.408 -3.752 1.00 0.00 N ATOM 606 CA SER A 42 -0.585 -2.050 -3.045 1.00 0.00 C ATOM 607 C SER A 42 -0.673 -0.538 -2.858 1.00 0.00 C ATOM 608 O SER A 42 0.343 0.157 -2.898 1.00 0.00 O ATOM 609 CB SER A 42 -0.639 -2.750 -1.685 1.00 0.00 C ATOM 610 OG SER A 42 -1.958 -2.755 -1.164 1.00 0.00 O ATOM 0 H SER A 42 1.391 -1.725 -3.663 1.00 0.00 H new ATOM 0 HA SER A 42 -1.435 -2.378 -3.644 1.00 0.00 H new ATOM 0 HB2 SER A 42 -0.281 -3.775 -1.786 1.00 0.00 H new ATOM 0 HB3 SER A 42 0.029 -2.246 -0.987 1.00 0.00 H new ATOM 0 HG SER A 42 -1.965 -3.209 -0.296 1.00 0.00 H new ATOM 616 N PRO A 43 -1.888 -0.001 -2.654 1.00 0.00 N ATOM 617 CA PRO A 43 -2.103 1.438 -2.467 1.00 0.00 C ATOM 618 C PRO A 43 -1.677 1.924 -1.080 1.00 0.00 C ATOM 619 O PRO A 43 -2.392 2.694 -0.440 1.00 0.00 O ATOM 620 CB PRO A 43 -3.622 1.611 -2.645 1.00 0.00 C ATOM 621 CG PRO A 43 -4.142 0.278 -3.081 1.00 0.00 C ATOM 622 CD PRO A 43 -3.152 -0.740 -2.598 1.00 0.00 C ATOM 0 HA PRO A 43 -1.508 2.021 -3.169 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -4.090 1.926 -1.713 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -3.843 2.378 -3.388 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -5.130 0.090 -2.660 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -4.244 0.237 -4.165 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -3.379 -1.080 -1.588 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -3.134 -1.624 -3.236 1.00 0.00 H new ATOM 630 N ALA A 44 -0.509 1.474 -0.623 1.00 0.00 N ATOM 631 CA ALA A 44 0.012 1.866 0.685 1.00 0.00 C ATOM 632 C ALA A 44 -1.070 1.792 1.759 1.00 0.00 C ATOM 633 O ALA A 44 -1.049 2.547 2.731 1.00 0.00 O ATOM 634 CB ALA A 44 0.604 3.264 0.622 1.00 0.00 C ATOM 0 H ALA A 44 0.095 0.836 -1.141 1.00 0.00 H new ATOM 0 HA ALA A 44 0.800 1.163 0.956 1.00 0.00 H new ATOM 0 HB1 ALA A 44 0.988 3.541 1.604 1.00 0.00 H new ATOM 0 HB2 ALA A 44 1.417 3.282 -0.104 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -0.167 3.973 0.321 1.00 0.00 H new ATOM 1699 N ALA A 120 -4.394 -6.261 -5.327 1.00 0.00 N ATOM 1700 CA ALA A 120 -2.981 -5.918 -5.432 1.00 0.00 C ATOM 1701 C ALA A 120 -2.440 -6.242 -6.820 1.00 0.00 C ATOM 1702 O ALA A 120 -3.126 -6.853 -7.638 1.00 0.00 O ATOM 1703 CB ALA A 120 -2.179 -6.647 -4.365 1.00 0.00 C ATOM 0 HA ALA A 120 -2.880 -4.844 -5.274 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -1.126 -6.381 -4.456 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -2.542 -6.360 -3.378 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -2.294 -7.723 -4.495 1.00 0.00 H new ATOM 1709 N LYS A 121 -1.204 -5.826 -7.078 1.00 0.00 N ATOM 1710 CA LYS A 121 -0.567 -6.070 -8.367 1.00 0.00 C ATOM 1711 C LYS A 121 0.584 -7.063 -8.227 1.00 0.00 C ATOM 1712 O LYS A 121 1.732 -6.672 -8.015 1.00 0.00 O ATOM 1713 CB LYS A 121 -0.056 -4.757 -8.960 1.00 0.00 C ATOM 1714 CG LYS A 121 -0.977 -4.174 -10.020 1.00 0.00 C ATOM 1715 CD LYS A 121 -0.190 -3.595 -11.182 1.00 0.00 C ATOM 1716 CE LYS A 121 0.117 -4.652 -12.231 1.00 0.00 C ATOM 1717 NZ LYS A 121 -0.909 -4.676 -13.310 1.00 0.00 N ATOM 0 H LYS A 121 -0.623 -5.318 -6.411 1.00 0.00 H new ATOM 0 HA LYS A 121 -1.311 -6.499 -9.038 1.00 0.00 H new ATOM 0 HB2 LYS A 121 0.069 -4.029 -8.158 1.00 0.00 H new ATOM 0 HB3 LYS A 121 0.929 -4.923 -9.397 1.00 0.00 H new ATOM 0 HG2 LYS A 121 -1.650 -4.950 -10.385 1.00 0.00 H new ATOM 0 HG3 LYS A 121 -1.598 -3.396 -9.576 1.00 0.00 H new ATOM 0 HD2 LYS A 121 -0.757 -2.783 -11.638 1.00 0.00 H new ATOM 0 HD3 LYS A 121 0.742 -3.166 -10.813 1.00 0.00 H new ATOM 0 HE2 LYS A 121 1.097 -4.458 -12.666 1.00 0.00 H new ATOM 0 HE3 LYS A 121 0.167 -5.632 -11.756 1.00 0.00 H new ATOM 0 HZ1 LYS A 121 -0.664 -5.409 -14.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 121 -1.841 -4.886 -12.898 1.00 0.00 H new ATOM 0 HZ3 LYS A 121 -0.940 -3.749 -13.781 1.00 0.00 H new ATOM 1731 N HIS A 122 0.268 -8.347 -8.347 1.00 0.00 N ATOM 1732 CA HIS A 122 1.275 -9.396 -8.233 1.00 0.00 C ATOM 1733 C HIS A 122 1.961 -9.645 -9.572 1.00 0.00 C ATOM 1734 O HIS A 122 1.315 -9.653 -10.619 1.00 0.00 O ATOM 1735 CB HIS A 122 0.638 -10.692 -7.726 1.00 0.00 C ATOM 1736 CG HIS A 122 -0.016 -10.554 -6.386 1.00 0.00 C ATOM 1737 ND1 HIS A 122 0.337 -11.321 -5.295 1.00 0.00 N ATOM 1738 CD2 HIS A 122 -1.005 -9.732 -5.963 1.00 0.00 C ATOM 1739 CE1 HIS A 122 -0.408 -10.978 -4.259 1.00 0.00 C ATOM 1740 NE2 HIS A 122 -1.229 -10.015 -4.638 1.00 0.00 N ATOM 0 H HIS A 122 -0.677 -8.687 -8.523 1.00 0.00 H new ATOM 0 HA HIS A 122 2.027 -9.063 -7.518 1.00 0.00 H new ATOM 0 HB2 HIS A 122 -0.104 -11.030 -8.450 1.00 0.00 H new ATOM 0 HB3 HIS A 122 1.404 -11.466 -7.669 1.00 0.00 H new ATOM 0 HD1 HIS A 122 1.060 -12.040 -5.289 1.00 0.00 H new ATOM 0 HD2 HIS A 122 -1.521 -8.992 -6.557 1.00 0.00 H new ATOM 0 HE1 HIS A 122 -0.355 -11.411 -3.271 1.00 0.00 H new ATOM 1749 N VAL A 123 3.274 -9.851 -9.529 1.00 0.00 N ATOM 1750 CA VAL A 123 4.050 -10.104 -10.737 1.00 0.00 C ATOM 1751 C VAL A 123 4.794 -11.431 -10.637 1.00 0.00 C ATOM 1752 O VAL A 123 5.601 -11.635 -9.731 1.00 0.00 O ATOM 1753 CB VAL A 123 5.065 -8.974 -11.003 1.00 0.00 C ATOM 1754 CG1 VAL A 123 5.648 -9.098 -12.402 1.00 0.00 C ATOM 1755 CG2 VAL A 123 4.416 -7.613 -10.809 1.00 0.00 C ATOM 0 H VAL A 123 3.823 -9.848 -8.669 1.00 0.00 H new ATOM 0 HA VAL A 123 3.344 -10.145 -11.567 1.00 0.00 H new ATOM 0 HB VAL A 123 5.879 -9.068 -10.284 1.00 0.00 H new ATOM 0 HG11 VAL A 123 6.362 -8.292 -12.571 1.00 0.00 H new ATOM 0 HG12 VAL A 123 6.154 -10.058 -12.501 1.00 0.00 H new ATOM 0 HG13 VAL A 123 4.846 -9.033 -13.137 1.00 0.00 H new ATOM 0 HG21 VAL A 123 5.149 -6.830 -11.001 1.00 0.00 H new ATOM 0 HG22 VAL A 123 3.581 -7.506 -11.501 1.00 0.00 H new ATOM 0 HG23 VAL A 123 4.052 -7.526 -9.785 1.00 0.00 H new ATOM 1765 N SER A 124 4.512 -12.334 -11.572 1.00 0.00 N ATOM 1766 CA SER A 124 5.147 -13.649 -11.590 1.00 0.00 C ATOM 1767 C SER A 124 6.668 -13.532 -11.520 1.00 0.00 C ATOM 1768 O SER A 124 7.346 -14.431 -11.021 1.00 0.00 O ATOM 1769 CB SER A 124 4.742 -14.415 -12.850 1.00 0.00 C ATOM 1770 OG SER A 124 4.513 -15.784 -12.565 1.00 0.00 O ATOM 0 H SER A 124 3.846 -12.179 -12.329 1.00 0.00 H new ATOM 0 HA SER A 124 4.807 -14.196 -10.711 1.00 0.00 H new ATOM 0 HB2 SER A 124 3.840 -13.973 -13.274 1.00 0.00 H new ATOM 0 HB3 SER A 124 5.525 -14.323 -13.602 1.00 0.00 H new ATOM 0 HG SER A 124 4.254 -16.250 -13.387 1.00 0.00 H new ATOM 1776 N LEU A 125 7.197 -12.423 -12.024 1.00 0.00 N ATOM 1777 CA LEU A 125 8.639 -12.194 -12.018 1.00 0.00 C ATOM 1778 C LEU A 125 9.357 -13.247 -12.856 1.00 0.00 C ATOM 1779 O LEU A 125 8.721 -14.071 -13.512 1.00 0.00 O ATOM 1780 CB LEU A 125 9.174 -12.210 -10.582 1.00 0.00 C ATOM 1781 CG LEU A 125 9.897 -10.935 -10.147 1.00 0.00 C ATOM 1782 CD1 LEU A 125 9.022 -9.716 -10.394 1.00 0.00 C ATOM 1783 CD2 LEU A 125 10.289 -11.021 -8.680 1.00 0.00 C ATOM 0 H LEU A 125 6.651 -11.669 -12.441 1.00 0.00 H new ATOM 0 HA LEU A 125 8.831 -11.214 -12.456 1.00 0.00 H new ATOM 0 HB2 LEU A 125 8.341 -12.387 -9.902 1.00 0.00 H new ATOM 0 HB3 LEU A 125 9.858 -13.052 -10.474 1.00 0.00 H new ATOM 0 HG LEU A 125 10.805 -10.833 -10.741 1.00 0.00 H new ATOM 0 HD11 LEU A 125 9.552 -8.817 -10.079 1.00 0.00 H new ATOM 0 HD12 LEU A 125 8.788 -9.645 -11.456 1.00 0.00 H new ATOM 0 HD13 LEU A 125 8.097 -9.810 -9.824 1.00 0.00 H new ATOM 0 HD21 LEU A 125 10.803 -10.106 -8.386 1.00 0.00 H new ATOM 0 HD22 LEU A 125 9.394 -11.146 -8.071 1.00 0.00 H new ATOM 0 HD23 LEU A 125 10.952 -11.873 -8.530 1.00 0.00 H new ATOM 1795 N LYS A 126 10.686 -13.211 -12.832 1.00 0.00 N ATOM 1796 CA LYS A 126 11.490 -14.163 -13.592 1.00 0.00 C ATOM 1797 C LYS A 126 11.147 -14.099 -15.077 1.00 0.00 C ATOM 1798 O LYS A 126 11.124 -15.121 -15.764 1.00 0.00 O ATOM 1799 CB LYS A 126 11.271 -15.583 -13.066 1.00 0.00 C ATOM 1800 CG LYS A 126 12.039 -15.883 -11.787 1.00 0.00 C ATOM 1801 CD LYS A 126 13.221 -16.804 -12.047 1.00 0.00 C ATOM 1802 CE LYS A 126 14.433 -16.401 -11.222 1.00 0.00 C ATOM 1803 NZ LYS A 126 15.392 -17.529 -11.056 1.00 0.00 N ATOM 0 H LYS A 126 11.228 -12.534 -12.295 1.00 0.00 H new ATOM 0 HA LYS A 126 12.539 -13.896 -13.468 1.00 0.00 H new ATOM 0 HB2 LYS A 126 10.207 -15.735 -12.885 1.00 0.00 H new ATOM 0 HB3 LYS A 126 11.569 -16.296 -13.835 1.00 0.00 H new ATOM 0 HG2 LYS A 126 12.393 -14.951 -11.347 1.00 0.00 H new ATOM 0 HG3 LYS A 126 11.370 -16.344 -11.060 1.00 0.00 H new ATOM 0 HD2 LYS A 126 12.943 -17.831 -11.809 1.00 0.00 H new ATOM 0 HD3 LYS A 126 13.476 -16.780 -13.106 1.00 0.00 H new ATOM 0 HE2 LYS A 126 14.938 -15.563 -11.703 1.00 0.00 H new ATOM 0 HE3 LYS A 126 14.106 -16.055 -10.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 126 16.204 -17.214 -10.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 126 14.918 -18.319 -10.574 1.00 0.00 H new ATOM 0 HZ3 LYS A 126 15.724 -17.843 -11.990 1.00 0.00 H new ATOM 1817 N MET A 127 10.881 -12.892 -15.564 1.00 0.00 N ATOM 1818 CA MET A 127 10.538 -12.689 -16.969 1.00 0.00 C ATOM 1819 C MET A 127 10.306 -11.211 -17.265 1.00 0.00 C ATOM 1820 O MET A 127 10.658 -10.722 -18.338 1.00 0.00 O ATOM 1821 CB MET A 127 9.293 -13.497 -17.334 1.00 0.00 C ATOM 1822 CG MET A 127 9.301 -14.013 -18.766 1.00 0.00 C ATOM 1823 SD MET A 127 9.058 -15.797 -18.868 1.00 0.00 S ATOM 1824 CE MET A 127 7.290 -15.883 -19.135 1.00 0.00 C ATOM 0 H MET A 127 10.896 -12.038 -15.007 1.00 0.00 H new ATOM 0 HA MET A 127 11.376 -13.034 -17.575 1.00 0.00 H new ATOM 0 HB2 MET A 127 9.206 -14.343 -16.652 1.00 0.00 H new ATOM 0 HB3 MET A 127 8.410 -12.876 -17.185 1.00 0.00 H new ATOM 0 HG2 MET A 127 8.517 -13.511 -19.332 1.00 0.00 H new ATOM 0 HG3 MET A 127 10.250 -13.753 -19.236 1.00 0.00 H new ATOM 0 HE1 MET A 127 6.985 -16.926 -19.219 1.00 0.00 H new ATOM 0 HE2 MET A 127 6.772 -15.420 -18.295 1.00 0.00 H new ATOM 0 HE3 MET A 127 7.035 -15.355 -20.054 1.00 0.00 H new ATOM 1834 N ALA A 128 9.713 -10.507 -16.308 1.00 0.00 N ATOM 1835 CA ALA A 128 9.432 -9.083 -16.464 1.00 0.00 C ATOM 1836 C ALA A 128 10.704 -8.305 -16.785 1.00 0.00 C ATOM 1837 O ALA A 128 11.748 -8.891 -17.069 1.00 0.00 O ATOM 1838 CB ALA A 128 8.781 -8.534 -15.204 1.00 0.00 C ATOM 0 H ALA A 128 9.417 -10.899 -15.414 1.00 0.00 H new ATOM 0 HA ALA A 128 8.742 -8.963 -17.299 1.00 0.00 H new ATOM 0 HB1 ALA A 128 8.577 -7.471 -15.334 1.00 0.00 H new ATOM 0 HB2 ALA A 128 7.846 -9.063 -15.017 1.00 0.00 H new ATOM 0 HB3 ALA A 128 9.453 -8.674 -14.357 1.00 0.00 H new ATOM 1844 N TYR A 129 10.610 -6.979 -16.734 1.00 0.00 N ATOM 1845 CA TYR A 129 11.754 -6.120 -17.018 1.00 0.00 C ATOM 1846 C TYR A 129 11.529 -4.716 -16.474 1.00 0.00 C ATOM 1847 O TYR A 129 10.618 -4.011 -16.906 1.00 0.00 O ATOM 1848 CB TYR A 129 12.012 -6.060 -18.525 1.00 0.00 C ATOM 1849 CG TYR A 129 13.432 -5.682 -18.881 1.00 0.00 C ATOM 1850 CD1 TYR A 129 14.422 -6.650 -18.995 1.00 0.00 C ATOM 1851 CD2 TYR A 129 13.782 -4.356 -19.103 1.00 0.00 C ATOM 1852 CE1 TYR A 129 15.721 -6.308 -19.318 1.00 0.00 C ATOM 1853 CE2 TYR A 129 15.079 -4.006 -19.428 1.00 0.00 C ATOM 1854 CZ TYR A 129 16.043 -4.985 -19.534 1.00 0.00 C ATOM 1855 OH TYR A 129 17.336 -4.641 -19.858 1.00 0.00 O ATOM 0 H TYR A 129 9.754 -6.477 -16.499 1.00 0.00 H new ATOM 0 HA TYR A 129 12.627 -6.546 -16.523 1.00 0.00 H new ATOM 0 HB2 TYR A 129 11.783 -7.031 -18.963 1.00 0.00 H new ATOM 0 HB3 TYR A 129 11.329 -5.338 -18.974 1.00 0.00 H new ATOM 0 HD1 TYR A 129 14.172 -7.687 -18.828 1.00 0.00 H new ATOM 0 HD2 TYR A 129 13.029 -3.587 -19.020 1.00 0.00 H new ATOM 0 HE1 TYR A 129 16.480 -7.072 -19.401 1.00 0.00 H new ATOM 0 HE2 TYR A 129 15.336 -2.971 -19.598 1.00 0.00 H new ATOM 0 HH TYR A 129 17.396 -3.670 -19.978 1.00 0.00 H new ATOM 1865 N VAL A 130 12.366 -4.313 -15.522 1.00 0.00 N ATOM 1866 CA VAL A 130 12.255 -2.990 -14.922 1.00 0.00 C ATOM 1867 C VAL A 130 13.218 -2.008 -15.575 1.00 0.00 C ATOM 1868 O VAL A 130 14.209 -2.401 -16.191 1.00 0.00 O ATOM 1869 CB VAL A 130 12.503 -3.028 -13.394 1.00 0.00 C ATOM 1870 CG1 VAL A 130 13.680 -3.928 -13.049 1.00 0.00 C ATOM 1871 CG2 VAL A 130 12.719 -1.632 -12.825 1.00 0.00 C ATOM 0 H VAL A 130 13.126 -4.883 -15.151 1.00 0.00 H new ATOM 0 HA VAL A 130 11.233 -2.652 -15.094 1.00 0.00 H new ATOM 0 HB VAL A 130 11.606 -3.443 -12.935 1.00 0.00 H new ATOM 0 HG11 VAL A 130 13.829 -3.934 -11.969 1.00 0.00 H new ATOM 0 HG12 VAL A 130 13.476 -4.942 -13.393 1.00 0.00 H new ATOM 0 HG13 VAL A 130 14.580 -3.554 -13.537 1.00 0.00 H new ATOM 0 HG21 VAL A 130 12.890 -1.699 -11.751 1.00 0.00 H new ATOM 0 HG22 VAL A 130 13.586 -1.175 -13.302 1.00 0.00 H new ATOM 0 HG23 VAL A 130 11.836 -1.021 -13.014 1.00 0.00 H new ATOM 1881 N SER A 131 12.911 -0.726 -15.434 1.00 0.00 N ATOM 1882 CA SER A 131 13.736 0.332 -16.005 1.00 0.00 C ATOM 1883 C SER A 131 13.399 1.681 -15.378 1.00 0.00 C ATOM 1884 O SER A 131 12.301 1.878 -14.858 1.00 0.00 O ATOM 1885 CB SER A 131 13.541 0.397 -17.520 1.00 0.00 C ATOM 1886 OG SER A 131 14.503 -0.397 -18.194 1.00 0.00 O ATOM 0 H SER A 131 12.092 -0.391 -14.926 1.00 0.00 H new ATOM 0 HA SER A 131 14.780 0.102 -15.790 1.00 0.00 H new ATOM 0 HB2 SER A 131 12.538 0.054 -17.776 1.00 0.00 H new ATOM 0 HB3 SER A 131 13.619 1.431 -17.856 1.00 0.00 H new ATOM 0 HG SER A 131 14.649 -1.228 -17.695 1.00 0.00 H new ATOM 1892 N ARG A 132 14.353 2.605 -15.429 1.00 0.00 N ATOM 1893 CA ARG A 132 14.160 3.937 -14.867 1.00 0.00 C ATOM 1894 C ARG A 132 14.369 5.012 -15.927 1.00 0.00 C ATOM 1895 O ARG A 132 15.493 5.455 -16.163 1.00 0.00 O ATOM 1896 CB ARG A 132 15.120 4.163 -13.698 1.00 0.00 C ATOM 1897 CG ARG A 132 14.755 5.358 -12.834 1.00 0.00 C ATOM 1898 CD ARG A 132 15.857 5.688 -11.840 1.00 0.00 C ATOM 1899 NE ARG A 132 17.080 6.135 -12.502 1.00 0.00 N ATOM 1900 CZ ARG A 132 18.056 5.319 -12.898 1.00 0.00 C ATOM 1901 NH1 ARG A 132 17.958 4.008 -12.705 1.00 0.00 N ATOM 1902 NH2 ARG A 132 19.134 5.815 -13.491 1.00 0.00 N ATOM 0 H ARG A 132 15.268 2.456 -15.854 1.00 0.00 H new ATOM 0 HA ARG A 132 13.134 4.006 -14.505 1.00 0.00 H new ATOM 0 HB2 ARG A 132 15.139 3.268 -13.076 1.00 0.00 H new ATOM 0 HB3 ARG A 132 16.128 4.302 -14.088 1.00 0.00 H new ATOM 0 HG2 ARG A 132 14.567 6.223 -13.470 1.00 0.00 H new ATOM 0 HG3 ARG A 132 13.830 5.150 -12.296 1.00 0.00 H new ATOM 0 HD2 ARG A 132 15.509 6.465 -11.159 1.00 0.00 H new ATOM 0 HD3 ARG A 132 16.074 4.808 -11.235 1.00 0.00 H new ATOM 0 HE ARG A 132 17.194 7.134 -12.672 1.00 0.00 H new ATOM 0 HH11 ARG A 132 17.131 3.620 -12.251 1.00 0.00 H new ATOM 0 HH12 ARG A 132 18.709 3.390 -13.011 1.00 0.00 H new ATOM 0 HH21 ARG A 132 19.215 6.820 -13.643 1.00 0.00 H new ATOM 0 HH22 ARG A 132 19.882 5.191 -13.794 1.00 0.00 H new ATOM 1916 N ARG A 133 13.278 5.431 -16.563 1.00 0.00 N ATOM 1917 CA ARG A 133 13.342 6.458 -17.596 1.00 0.00 C ATOM 1918 C ARG A 133 12.420 7.623 -17.256 1.00 0.00 C ATOM 1919 O ARG A 133 11.610 7.538 -16.334 1.00 0.00 O ATOM 1920 CB ARG A 133 12.958 5.868 -18.956 1.00 0.00 C ATOM 1921 CG ARG A 133 13.787 6.410 -20.109 1.00 0.00 C ATOM 1922 CD ARG A 133 12.937 6.639 -21.349 1.00 0.00 C ATOM 1923 NE ARG A 133 13.748 6.996 -22.511 1.00 0.00 N ATOM 1924 CZ ARG A 133 13.303 6.960 -23.764 1.00 0.00 C ATOM 1925 NH1 ARG A 133 12.057 6.586 -24.023 1.00 0.00 N ATOM 1926 NH2 ARG A 133 14.106 7.299 -24.762 1.00 0.00 N ATOM 0 H ARG A 133 12.340 5.075 -16.380 1.00 0.00 H new ATOM 0 HA ARG A 133 14.366 6.828 -17.645 1.00 0.00 H new ATOM 0 HB2 ARG A 133 13.069 4.784 -18.917 1.00 0.00 H new ATOM 0 HB3 ARG A 133 11.905 6.074 -19.148 1.00 0.00 H new ATOM 0 HG2 ARG A 133 14.257 7.347 -19.811 1.00 0.00 H new ATOM 0 HG3 ARG A 133 14.590 5.710 -20.341 1.00 0.00 H new ATOM 0 HD2 ARG A 133 12.366 5.737 -21.569 1.00 0.00 H new ATOM 0 HD3 ARG A 133 12.216 7.432 -21.153 1.00 0.00 H new ATOM 0 HE ARG A 133 14.712 7.290 -22.352 1.00 0.00 H new ATOM 0 HH11 ARG A 133 11.434 6.324 -23.259 1.00 0.00 H new ATOM 0 HH12 ARG A 133 11.722 6.561 -24.986 1.00 0.00 H new ATOM 0 HH21 ARG A 133 15.065 7.587 -24.569 1.00 0.00 H new ATOM 0 HH22 ARG A 133 13.765 7.271 -25.723 1.00 0.00 H new ATOM 2072 N TYR A 143 10.784 7.882 -13.920 1.00 0.00 N ATOM 2073 CA TYR A 143 9.640 6.977 -13.940 1.00 0.00 C ATOM 2074 C TYR A 143 10.096 5.522 -13.929 1.00 0.00 C ATOM 2075 O TYR A 143 10.800 5.076 -14.835 1.00 0.00 O ATOM 2076 CB TYR A 143 8.777 7.242 -15.176 1.00 0.00 C ATOM 2077 CG TYR A 143 7.760 8.347 -14.990 1.00 0.00 C ATOM 2078 CD1 TYR A 143 8.030 9.441 -14.176 1.00 0.00 C ATOM 2079 CD2 TYR A 143 6.529 8.297 -15.631 1.00 0.00 C ATOM 2080 CE1 TYR A 143 7.103 10.451 -14.007 1.00 0.00 C ATOM 2081 CE2 TYR A 143 5.597 9.303 -15.468 1.00 0.00 C ATOM 2082 CZ TYR A 143 5.887 10.378 -14.655 1.00 0.00 C ATOM 2083 OH TYR A 143 4.961 11.381 -14.490 1.00 0.00 O ATOM 0 HA TYR A 143 9.048 7.160 -13.043 1.00 0.00 H new ATOM 0 HB2 TYR A 143 9.427 7.497 -16.013 1.00 0.00 H new ATOM 0 HB3 TYR A 143 8.256 6.324 -15.446 1.00 0.00 H new ATOM 0 HD1 TYR A 143 8.981 9.502 -13.667 1.00 0.00 H new ATOM 0 HD2 TYR A 143 6.296 7.457 -16.268 1.00 0.00 H new ATOM 0 HE1 TYR A 143 7.329 11.294 -13.371 1.00 0.00 H new ATOM 0 HE2 TYR A 143 4.645 9.248 -15.975 1.00 0.00 H new ATOM 0 HH TYR A 143 4.266 11.085 -13.866 1.00 0.00 H new ATOM 2093 N LEU A 144 9.688 4.786 -12.901 1.00 0.00 N ATOM 2094 CA LEU A 144 10.052 3.379 -12.773 1.00 0.00 C ATOM 2095 C LEU A 144 9.011 2.490 -13.448 1.00 0.00 C ATOM 2096 O LEU A 144 7.963 2.200 -12.874 1.00 0.00 O ATOM 2097 CB LEU A 144 10.189 2.998 -11.297 1.00 0.00 C ATOM 2098 CG LEU A 144 11.619 3.018 -10.753 1.00 0.00 C ATOM 2099 CD1 LEU A 144 11.636 3.502 -9.312 1.00 0.00 C ATOM 2100 CD2 LEU A 144 12.246 1.636 -10.860 1.00 0.00 C ATOM 0 H LEU A 144 9.104 5.141 -12.143 1.00 0.00 H new ATOM 0 HA LEU A 144 11.011 3.227 -13.268 1.00 0.00 H new ATOM 0 HB2 LEU A 144 9.581 3.681 -10.703 1.00 0.00 H new ATOM 0 HB3 LEU A 144 9.777 1.999 -11.156 1.00 0.00 H new ATOM 0 HG LEU A 144 12.207 3.712 -11.354 1.00 0.00 H new ATOM 0 HD11 LEU A 144 12.662 3.509 -8.943 1.00 0.00 H new ATOM 0 HD12 LEU A 144 11.225 4.510 -9.262 1.00 0.00 H new ATOM 0 HD13 LEU A 144 11.034 2.834 -8.697 1.00 0.00 H new ATOM 0 HD21 LEU A 144 13.263 1.667 -10.469 1.00 0.00 H new ATOM 0 HD22 LEU A 144 11.657 0.923 -10.283 1.00 0.00 H new ATOM 0 HD23 LEU A 144 12.268 1.326 -11.905 1.00 0.00 H new ATOM 2112 N GLU A 145 9.308 2.065 -14.672 1.00 0.00 N ATOM 2113 CA GLU A 145 8.395 1.212 -15.426 1.00 0.00 C ATOM 2114 C GLU A 145 8.864 -0.239 -15.409 1.00 0.00 C ATOM 2115 O GLU A 145 10.033 -0.529 -15.661 1.00 0.00 O ATOM 2116 CB GLU A 145 8.279 1.706 -16.869 1.00 0.00 C ATOM 2117 CG GLU A 145 7.002 1.263 -17.562 1.00 0.00 C ATOM 2118 CD GLU A 145 7.120 -0.119 -18.173 1.00 0.00 C ATOM 2119 OE1 GLU A 145 8.149 -0.396 -18.825 1.00 0.00 O ATOM 2120 OE2 GLU A 145 6.182 -0.928 -18.000 1.00 0.00 O ATOM 0 H GLU A 145 10.172 2.297 -15.162 1.00 0.00 H new ATOM 0 HA GLU A 145 7.415 1.262 -14.951 1.00 0.00 H new ATOM 0 HB2 GLU A 145 8.328 2.795 -16.877 1.00 0.00 H new ATOM 0 HB3 GLU A 145 9.136 1.345 -17.438 1.00 0.00 H new ATOM 0 HG2 GLU A 145 6.182 1.270 -16.844 1.00 0.00 H new ATOM 0 HG3 GLU A 145 6.749 1.981 -18.342 1.00 0.00 H new ATOM 2127 N ILE A 146 7.939 -1.147 -15.113 1.00 0.00 N ATOM 2128 CA ILE A 146 8.252 -2.570 -15.066 1.00 0.00 C ATOM 2129 C ILE A 146 7.171 -3.389 -15.767 1.00 0.00 C ATOM 2130 O ILE A 146 6.040 -3.480 -15.288 1.00 0.00 O ATOM 2131 CB ILE A 146 8.397 -3.066 -13.612 1.00 0.00 C ATOM 2132 CG1 ILE A 146 9.445 -2.233 -12.872 1.00 0.00 C ATOM 2133 CG2 ILE A 146 8.771 -4.540 -13.584 1.00 0.00 C ATOM 2134 CD1 ILE A 146 8.873 -1.015 -12.179 1.00 0.00 C ATOM 0 H ILE A 146 6.967 -0.922 -14.902 1.00 0.00 H new ATOM 0 HA ILE A 146 9.202 -2.706 -15.583 1.00 0.00 H new ATOM 0 HB ILE A 146 7.438 -2.948 -13.108 1.00 0.00 H new ATOM 0 HG12 ILE A 146 9.941 -2.862 -12.133 1.00 0.00 H new ATOM 0 HG13 ILE A 146 10.208 -1.912 -13.581 1.00 0.00 H new ATOM 0 HG21 ILE A 146 8.869 -4.871 -12.550 1.00 0.00 H new ATOM 0 HG22 ILE A 146 7.994 -5.122 -14.080 1.00 0.00 H new ATOM 0 HG23 ILE A 146 9.719 -4.685 -14.102 1.00 0.00 H new ATOM 0 HD11 ILE A 146 9.674 -0.473 -11.676 1.00 0.00 H new ATOM 0 HD12 ILE A 146 8.402 -0.365 -12.916 1.00 0.00 H new ATOM 0 HD13 ILE A 146 8.130 -1.329 -11.445 1.00 0.00 H new ATOM 2146 N CYS A 147 7.526 -3.983 -16.902 1.00 0.00 N ATOM 2147 CA CYS A 147 6.584 -4.792 -17.665 1.00 0.00 C ATOM 2148 C CYS A 147 6.813 -6.278 -17.410 1.00 0.00 C ATOM 2149 O CYS A 147 7.948 -6.753 -17.423 1.00 0.00 O ATOM 2150 CB CYS A 147 6.715 -4.493 -19.161 1.00 0.00 C ATOM 2151 SG CYS A 147 5.600 -3.198 -19.752 1.00 0.00 S ATOM 0 H CYS A 147 8.458 -3.919 -17.312 1.00 0.00 H new ATOM 0 HA CYS A 147 5.576 -4.536 -17.338 1.00 0.00 H new ATOM 0 HB2 CYS A 147 7.743 -4.198 -19.374 1.00 0.00 H new ATOM 0 HB3 CYS A 147 6.523 -5.408 -19.722 1.00 0.00 H new ATOM 0 HG CYS A 147 5.854 -2.087 -19.126 1.00 0.00 H new ATOM 2157 N ALA A 148 5.725 -7.006 -17.176 1.00 0.00 N ATOM 2158 CA ALA A 148 5.807 -8.437 -16.913 1.00 0.00 C ATOM 2159 C ALA A 148 5.282 -9.247 -18.092 1.00 0.00 C ATOM 2160 O ALA A 148 4.342 -8.836 -18.773 1.00 0.00 O ATOM 2161 CB ALA A 148 5.039 -8.787 -15.647 1.00 0.00 C ATOM 0 H ALA A 148 4.778 -6.628 -17.163 1.00 0.00 H new ATOM 0 HA ALA A 148 6.857 -8.693 -16.771 1.00 0.00 H new ATOM 0 HB1 ALA A 148 5.109 -9.859 -15.463 1.00 0.00 H new ATOM 0 HB2 ALA A 148 5.464 -8.246 -14.802 1.00 0.00 H new ATOM 0 HB3 ALA A 148 3.992 -8.507 -15.767 1.00 0.00 H new ATOM 2167 N ALA A 149 5.898 -10.401 -18.323 1.00 0.00 N ATOM 2168 CA ALA A 149 5.502 -11.276 -19.416 1.00 0.00 C ATOM 2169 C ALA A 149 4.557 -12.370 -18.929 1.00 0.00 C ATOM 2170 O ALA A 149 4.547 -13.481 -19.462 1.00 0.00 O ATOM 2171 CB ALA A 149 6.735 -11.886 -20.070 1.00 0.00 C ATOM 0 H ALA A 149 6.676 -10.752 -17.765 1.00 0.00 H new ATOM 0 HA ALA A 149 4.968 -10.680 -20.156 1.00 0.00 H new ATOM 0 HB1 ALA A 149 6.428 -12.539 -20.887 1.00 0.00 H new ATOM 0 HB2 ALA A 149 7.371 -11.091 -20.460 1.00 0.00 H new ATOM 0 HB3 ALA A 149 7.290 -12.465 -19.332 1.00 0.00 H new ATOM 2177 N ASP A 150 3.760 -12.044 -17.917 1.00 0.00 N ATOM 2178 CA ASP A 150 2.805 -12.989 -17.356 1.00 0.00 C ATOM 2179 C ASP A 150 1.403 -12.391 -17.364 1.00 0.00 C ATOM 2180 O ASP A 150 0.703 -12.396 -16.351 1.00 0.00 O ATOM 2181 CB ASP A 150 3.207 -13.370 -15.931 1.00 0.00 C ATOM 2182 CG ASP A 150 4.583 -14.004 -15.869 1.00 0.00 C ATOM 2183 OD1 ASP A 150 4.674 -15.243 -15.998 1.00 0.00 O ATOM 2184 OD2 ASP A 150 5.571 -13.261 -15.691 1.00 0.00 O ATOM 0 H ASP A 150 3.758 -11.128 -17.468 1.00 0.00 H new ATOM 0 HA ASP A 150 2.806 -13.889 -17.971 1.00 0.00 H new ATOM 0 HB2 ASP A 150 3.191 -12.480 -15.302 1.00 0.00 H new ATOM 0 HB3 ASP A 150 2.472 -14.063 -15.522 1.00 0.00 H new ATOM 2189 N GLY A 151 1.002 -11.872 -18.519 1.00 0.00 N ATOM 2190 CA GLY A 151 -0.309 -11.268 -18.653 1.00 0.00 C ATOM 2191 C GLY A 151 -0.248 -9.853 -19.199 1.00 0.00 C ATOM 2192 O GLY A 151 -1.227 -9.110 -19.127 1.00 0.00 O ATOM 0 H GLY A 151 1.566 -11.859 -19.369 1.00 0.00 H new ATOM 0 HA2 GLY A 151 -0.922 -11.882 -19.313 1.00 0.00 H new ATOM 0 HA3 GLY A 151 -0.801 -11.257 -17.680 1.00 0.00 H new ATOM 2196 N GLN A 152 0.905 -9.477 -19.751 1.00 0.00 N ATOM 2197 CA GLN A 152 1.088 -8.147 -20.312 1.00 0.00 C ATOM 2198 C GLN A 152 0.904 -7.075 -19.242 1.00 0.00 C ATOM 2199 O GLN A 152 0.000 -6.243 -19.325 1.00 0.00 O ATOM 2200 CB GLN A 152 0.113 -7.925 -21.468 1.00 0.00 C ATOM 2201 CG GLN A 152 0.764 -8.031 -22.839 1.00 0.00 C ATOM 2202 CD GLN A 152 1.541 -9.322 -23.016 1.00 0.00 C ATOM 2203 OE1 GLN A 152 1.001 -10.326 -23.479 1.00 0.00 O ATOM 2204 NE2 GLN A 152 2.818 -9.301 -22.649 1.00 0.00 N ATOM 0 H GLN A 152 1.726 -10.079 -19.820 1.00 0.00 H new ATOM 0 HA GLN A 152 2.106 -8.071 -20.693 1.00 0.00 H new ATOM 0 HB2 GLN A 152 -0.692 -8.656 -21.399 1.00 0.00 H new ATOM 0 HB3 GLN A 152 -0.342 -6.940 -21.365 1.00 0.00 H new ATOM 0 HG2 GLN A 152 -0.005 -7.965 -23.609 1.00 0.00 H new ATOM 0 HG3 GLN A 152 1.435 -7.184 -22.985 1.00 0.00 H new ATOM 0 HE21 GLN A 152 3.226 -8.446 -22.270 1.00 0.00 H new ATOM 0 HE22 GLN A 152 3.391 -10.139 -22.747 1.00 0.00 H new ATOM 2213 N ASP A 153 1.774 -7.100 -18.238 1.00 0.00 N ATOM 2214 CA ASP A 153 1.716 -6.131 -17.152 1.00 0.00 C ATOM 2215 C ASP A 153 2.602 -4.927 -17.454 1.00 0.00 C ATOM 2216 O ASP A 153 3.598 -5.041 -18.169 1.00 0.00 O ATOM 2217 CB ASP A 153 2.147 -6.781 -15.835 1.00 0.00 C ATOM 2218 CG ASP A 153 1.179 -7.854 -15.375 1.00 0.00 C ATOM 2219 OD1 ASP A 153 -0.033 -7.712 -15.641 1.00 0.00 O ATOM 2220 OD2 ASP A 153 1.634 -8.835 -14.752 1.00 0.00 O ATOM 0 H ASP A 153 2.528 -7.782 -18.155 1.00 0.00 H new ATOM 0 HA ASP A 153 0.686 -5.788 -17.057 1.00 0.00 H new ATOM 0 HB2 ASP A 153 3.138 -7.218 -15.956 1.00 0.00 H new ATOM 0 HB3 ASP A 153 2.228 -6.014 -15.064 1.00 0.00 H new ATOM 2225 N ALA A 154 2.234 -3.774 -16.905 1.00 0.00 N ATOM 2226 CA ALA A 154 2.996 -2.548 -17.117 1.00 0.00 C ATOM 2227 C ALA A 154 2.729 -1.538 -16.007 1.00 0.00 C ATOM 2228 O ALA A 154 1.796 -0.742 -16.090 1.00 0.00 O ATOM 2229 CB ALA A 154 2.660 -1.946 -18.473 1.00 0.00 C ATOM 0 H ALA A 154 1.413 -3.663 -16.310 1.00 0.00 H new ATOM 0 HA ALA A 154 4.056 -2.800 -17.096 1.00 0.00 H new ATOM 0 HB1 ALA A 154 3.236 -1.032 -18.618 1.00 0.00 H new ATOM 0 HB2 ALA A 154 2.908 -2.659 -19.259 1.00 0.00 H new ATOM 0 HB3 ALA A 154 1.596 -1.715 -18.515 1.00 0.00 H new ATOM 2235 N VAL A 155 3.554 -1.579 -14.968 1.00 0.00 N ATOM 2236 CA VAL A 155 3.406 -0.669 -13.838 1.00 0.00 C ATOM 2237 C VAL A 155 4.288 0.565 -14.001 1.00 0.00 C ATOM 2238 O VAL A 155 5.515 0.467 -14.012 1.00 0.00 O ATOM 2239 CB VAL A 155 3.757 -1.362 -12.507 1.00 0.00 C ATOM 2240 CG1 VAL A 155 2.686 -2.376 -12.137 1.00 0.00 C ATOM 2241 CG2 VAL A 155 5.126 -2.024 -12.591 1.00 0.00 C ATOM 0 H VAL A 155 4.333 -2.233 -14.884 1.00 0.00 H new ATOM 0 HA VAL A 155 2.360 -0.364 -13.817 1.00 0.00 H new ATOM 0 HB VAL A 155 3.796 -0.606 -11.723 1.00 0.00 H new ATOM 0 HG11 VAL A 155 2.950 -2.856 -11.195 1.00 0.00 H new ATOM 0 HG12 VAL A 155 1.727 -1.870 -12.030 1.00 0.00 H new ATOM 0 HG13 VAL A 155 2.613 -3.130 -12.920 1.00 0.00 H new ATOM 0 HG21 VAL A 155 5.355 -2.508 -11.641 1.00 0.00 H new ATOM 0 HG22 VAL A 155 5.121 -2.770 -13.386 1.00 0.00 H new ATOM 0 HG23 VAL A 155 5.883 -1.269 -12.806 1.00 0.00 H new ATOM 2251 N PHE A 156 3.654 1.725 -14.122 1.00 0.00 N ATOM 2252 CA PHE A 156 4.377 2.983 -14.279 1.00 0.00 C ATOM 2253 C PHE A 156 4.342 3.786 -12.983 1.00 0.00 C ATOM 2254 O PHE A 156 3.437 4.592 -12.765 1.00 0.00 O ATOM 2255 CB PHE A 156 3.777 3.802 -15.422 1.00 0.00 C ATOM 2256 CG PHE A 156 3.686 3.049 -16.719 1.00 0.00 C ATOM 2257 CD1 PHE A 156 2.783 2.008 -16.869 1.00 0.00 C ATOM 2258 CD2 PHE A 156 4.505 3.380 -17.787 1.00 0.00 C ATOM 2259 CE1 PHE A 156 2.697 1.314 -18.060 1.00 0.00 C ATOM 2260 CE2 PHE A 156 4.424 2.687 -18.980 1.00 0.00 C ATOM 2261 CZ PHE A 156 3.519 1.653 -19.116 1.00 0.00 C ATOM 0 H PHE A 156 2.639 1.822 -14.114 1.00 0.00 H new ATOM 0 HA PHE A 156 5.416 2.755 -14.518 1.00 0.00 H new ATOM 0 HB2 PHE A 156 2.780 4.135 -15.134 1.00 0.00 H new ATOM 0 HB3 PHE A 156 4.381 4.697 -15.573 1.00 0.00 H new ATOM 0 HD1 PHE A 156 2.139 1.737 -16.045 1.00 0.00 H new ATOM 0 HD2 PHE A 156 5.214 4.188 -17.686 1.00 0.00 H new ATOM 0 HE1 PHE A 156 1.987 0.507 -18.165 1.00 0.00 H new ATOM 0 HE2 PHE A 156 5.068 2.954 -19.805 1.00 0.00 H new ATOM 0 HZ PHE A 156 3.454 1.110 -20.047 1.00 0.00 H new ATOM 2271 N LEU A 157 5.329 3.556 -12.123 1.00 0.00 N ATOM 2272 CA LEU A 157 5.408 4.253 -10.845 1.00 0.00 C ATOM 2273 C LEU A 157 6.488 5.330 -10.867 1.00 0.00 C ATOM 2274 O LEU A 157 7.311 5.380 -11.782 1.00 0.00 O ATOM 2275 CB LEU A 157 5.692 3.255 -9.719 1.00 0.00 C ATOM 2276 CG LEU A 157 4.649 2.144 -9.561 1.00 0.00 C ATOM 2277 CD1 LEU A 157 5.293 0.775 -9.724 1.00 0.00 C ATOM 2278 CD2 LEU A 157 3.954 2.250 -8.212 1.00 0.00 C ATOM 0 H LEU A 157 6.085 2.892 -12.288 1.00 0.00 H new ATOM 0 HA LEU A 157 4.448 4.738 -10.667 1.00 0.00 H new ATOM 0 HB2 LEU A 157 6.665 2.797 -9.897 1.00 0.00 H new ATOM 0 HB3 LEU A 157 5.764 3.802 -8.779 1.00 0.00 H new ATOM 0 HG LEU A 157 3.900 2.265 -10.344 1.00 0.00 H new ATOM 0 HD11 LEU A 157 4.535 0.000 -9.608 1.00 0.00 H new ATOM 0 HD12 LEU A 157 5.741 0.699 -10.715 1.00 0.00 H new ATOM 0 HD13 LEU A 157 6.065 0.644 -8.966 1.00 0.00 H new ATOM 0 HD21 LEU A 157 3.217 1.452 -8.119 1.00 0.00 H new ATOM 0 HD22 LEU A 157 4.691 2.158 -7.415 1.00 0.00 H new ATOM 0 HD23 LEU A 157 3.455 3.216 -8.135 1.00 0.00 H new ATOM 2290 N ARG A 158 6.481 6.187 -9.851 1.00 0.00 N ATOM 2291 CA ARG A 158 7.459 7.263 -9.745 1.00 0.00 C ATOM 2292 C ARG A 158 8.143 7.235 -8.381 1.00 0.00 C ATOM 2293 O ARG A 158 7.566 7.656 -7.377 1.00 0.00 O ATOM 2294 CB ARG A 158 6.788 8.621 -9.970 1.00 0.00 C ATOM 2295 CG ARG A 158 7.737 9.801 -9.830 1.00 0.00 C ATOM 2296 CD ARG A 158 7.263 10.995 -10.643 1.00 0.00 C ATOM 2297 NE ARG A 158 8.370 11.862 -11.040 1.00 0.00 N ATOM 2298 CZ ARG A 158 9.010 12.678 -10.205 1.00 0.00 C ATOM 2299 NH1 ARG A 158 8.656 12.739 -8.927 1.00 0.00 N ATOM 2300 NH2 ARG A 158 10.004 13.434 -10.649 1.00 0.00 N ATOM 0 H ARG A 158 5.806 6.156 -9.087 1.00 0.00 H new ATOM 0 HA ARG A 158 8.215 7.114 -10.516 1.00 0.00 H new ATOM 0 HB2 ARG A 158 6.346 8.638 -10.966 1.00 0.00 H new ATOM 0 HB3 ARG A 158 5.972 8.736 -9.257 1.00 0.00 H new ATOM 0 HG2 ARG A 158 7.817 10.083 -8.780 1.00 0.00 H new ATOM 0 HG3 ARG A 158 8.734 9.508 -10.158 1.00 0.00 H new ATOM 0 HD2 ARG A 158 6.741 10.643 -11.533 1.00 0.00 H new ATOM 0 HD3 ARG A 158 6.545 11.569 -10.058 1.00 0.00 H new ATOM 0 HE ARG A 158 8.670 11.841 -12.015 1.00 0.00 H new ATOM 0 HH11 ARG A 158 7.891 12.159 -8.581 1.00 0.00 H new ATOM 0 HH12 ARG A 158 9.149 13.365 -8.291 1.00 0.00 H new ATOM 0 HH21 ARG A 158 10.279 13.391 -11.630 1.00 0.00 H new ATOM 0 HH22 ARG A 158 10.494 14.059 -10.009 1.00 0.00 H new ATOM 2314 N ALA A 159 9.375 6.737 -8.351 1.00 0.00 N ATOM 2315 CA ALA A 159 10.140 6.652 -7.112 1.00 0.00 C ATOM 2316 C ALA A 159 10.241 8.012 -6.429 1.00 0.00 C ATOM 2317 O ALA A 159 9.817 9.028 -6.979 1.00 0.00 O ATOM 2318 CB ALA A 159 11.526 6.092 -7.389 1.00 0.00 C ATOM 0 H ALA A 159 9.866 6.385 -9.173 1.00 0.00 H new ATOM 0 HA ALA A 159 9.615 5.978 -6.435 1.00 0.00 H new ATOM 0 HB1 ALA A 159 12.088 6.033 -6.457 1.00 0.00 H new ATOM 0 HB2 ALA A 159 11.436 5.096 -7.822 1.00 0.00 H new ATOM 0 HB3 ALA A 159 12.049 6.745 -8.087 1.00 0.00 H new ATOM 2324 N LYS A 160 10.804 8.021 -5.226 1.00 0.00 N ATOM 2325 CA LYS A 160 10.959 9.254 -4.462 1.00 0.00 C ATOM 2326 C LYS A 160 12.128 10.081 -4.987 1.00 0.00 C ATOM 2327 O LYS A 160 11.937 11.146 -5.570 1.00 0.00 O ATOM 2328 CB LYS A 160 11.167 8.937 -2.980 1.00 0.00 C ATOM 2329 CG LYS A 160 11.170 10.169 -2.089 1.00 0.00 C ATOM 2330 CD LYS A 160 10.796 9.821 -0.656 1.00 0.00 C ATOM 2331 CE LYS A 160 12.011 9.379 0.143 1.00 0.00 C ATOM 2332 NZ LYS A 160 12.833 10.536 0.593 1.00 0.00 N ATOM 0 H LYS A 160 11.161 7.188 -4.758 1.00 0.00 H new ATOM 0 HA LYS A 160 10.046 9.839 -4.578 1.00 0.00 H new ATOM 0 HB2 LYS A 160 10.380 8.260 -2.648 1.00 0.00 H new ATOM 0 HB3 LYS A 160 12.113 8.409 -2.859 1.00 0.00 H new ATOM 0 HG2 LYS A 160 12.158 10.630 -2.107 1.00 0.00 H new ATOM 0 HG3 LYS A 160 10.468 10.905 -2.481 1.00 0.00 H new ATOM 0 HD2 LYS A 160 10.339 10.687 -0.177 1.00 0.00 H new ATOM 0 HD3 LYS A 160 10.050 9.026 -0.656 1.00 0.00 H new ATOM 0 HE2 LYS A 160 11.685 8.806 1.011 1.00 0.00 H new ATOM 0 HE3 LYS A 160 12.623 8.714 -0.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 13.651 10.191 1.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 13.166 11.069 -0.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 12.257 11.158 1.196 1.00 0.00 H new ATOM 2346 N ASP A 161 13.337 9.582 -4.770 1.00 0.00 N ATOM 2347 CA ASP A 161 14.543 10.271 -5.216 1.00 0.00 C ATOM 2348 C ASP A 161 15.213 9.517 -6.361 1.00 0.00 C ATOM 2349 O ASP A 161 14.756 8.448 -6.765 1.00 0.00 O ATOM 2350 CB ASP A 161 15.524 10.430 -4.054 1.00 0.00 C ATOM 2351 CG ASP A 161 16.299 11.731 -4.125 1.00 0.00 C ATOM 2352 OD1 ASP A 161 15.820 12.739 -3.565 1.00 0.00 O ATOM 2353 OD2 ASP A 161 17.387 11.742 -4.739 1.00 0.00 O ATOM 0 H ASP A 161 13.510 8.701 -4.287 1.00 0.00 H new ATOM 0 HA ASP A 161 14.252 11.258 -5.577 1.00 0.00 H new ATOM 0 HB2 ASP A 161 14.977 10.387 -3.112 1.00 0.00 H new ATOM 0 HB3 ASP A 161 16.223 9.594 -4.055 1.00 0.00 H new ATOM 2358 N GLU A 162 16.299 10.085 -6.880 1.00 0.00 N ATOM 2359 CA GLU A 162 17.033 9.469 -7.978 1.00 0.00 C ATOM 2360 C GLU A 162 17.794 8.235 -7.503 1.00 0.00 C ATOM 2361 O GLU A 162 17.808 7.206 -8.176 1.00 0.00 O ATOM 2362 CB GLU A 162 18.006 10.475 -8.598 1.00 0.00 C ATOM 2363 CG GLU A 162 19.021 11.030 -7.613 1.00 0.00 C ATOM 2364 CD GLU A 162 20.318 10.244 -7.605 1.00 0.00 C ATOM 2365 OE1 GLU A 162 20.322 9.099 -8.103 1.00 0.00 O ATOM 2366 OE2 GLU A 162 21.330 10.774 -7.098 1.00 0.00 O ATOM 0 H GLU A 162 16.689 10.971 -6.557 1.00 0.00 H new ATOM 0 HA GLU A 162 16.311 9.159 -8.733 1.00 0.00 H new ATOM 0 HB2 GLU A 162 18.536 9.995 -9.420 1.00 0.00 H new ATOM 0 HB3 GLU A 162 17.437 11.301 -9.025 1.00 0.00 H new ATOM 0 HG2 GLU A 162 19.232 12.070 -7.862 1.00 0.00 H new ATOM 0 HG3 GLU A 162 18.591 11.024 -6.612 1.00 0.00 H new ATOM 2373 N ALA A 163 18.423 8.345 -6.338 1.00 0.00 N ATOM 2374 CA ALA A 163 19.185 7.236 -5.775 1.00 0.00 C ATOM 2375 C ALA A 163 18.276 6.054 -5.459 1.00 0.00 C ATOM 2376 O ALA A 163 18.549 4.925 -5.865 1.00 0.00 O ATOM 2377 CB ALA A 163 19.927 7.685 -4.526 1.00 0.00 C ATOM 0 H ALA A 163 18.420 9.189 -5.766 1.00 0.00 H new ATOM 0 HA ALA A 163 19.914 6.912 -6.518 1.00 0.00 H new ATOM 0 HB1 ALA A 163 20.491 6.847 -4.117 1.00 0.00 H new ATOM 0 HB2 ALA A 163 20.612 8.494 -4.781 1.00 0.00 H new ATOM 0 HB3 ALA A 163 19.210 8.037 -3.784 1.00 0.00 H new ATOM 2383 N SER A 164 17.192 6.323 -4.738 1.00 0.00 N ATOM 2384 CA SER A 164 16.242 5.278 -4.376 1.00 0.00 C ATOM 2385 C SER A 164 15.665 4.622 -5.625 1.00 0.00 C ATOM 2386 O SER A 164 15.600 3.398 -5.720 1.00 0.00 O ATOM 2387 CB SER A 164 15.114 5.859 -3.519 1.00 0.00 C ATOM 2388 OG SER A 164 15.242 5.456 -2.166 1.00 0.00 O ATOM 0 H SER A 164 16.950 7.252 -4.394 1.00 0.00 H new ATOM 0 HA SER A 164 16.770 4.520 -3.798 1.00 0.00 H new ATOM 0 HB2 SER A 164 15.130 6.947 -3.581 1.00 0.00 H new ATOM 0 HB3 SER A 164 14.151 5.532 -3.910 1.00 0.00 H new ATOM 0 HG SER A 164 14.511 5.841 -1.639 1.00 0.00 H new ATOM 2394 N ALA A 165 15.255 5.447 -6.583 1.00 0.00 N ATOM 2395 CA ALA A 165 14.691 4.948 -7.827 1.00 0.00 C ATOM 2396 C ALA A 165 15.703 4.097 -8.581 1.00 0.00 C ATOM 2397 O ALA A 165 15.350 3.089 -9.195 1.00 0.00 O ATOM 2398 CB ALA A 165 14.220 6.105 -8.696 1.00 0.00 C ATOM 0 H ALA A 165 15.304 6.464 -6.519 1.00 0.00 H new ATOM 0 HA ALA A 165 13.834 4.320 -7.584 1.00 0.00 H new ATOM 0 HB1 ALA A 165 13.800 5.716 -9.624 1.00 0.00 H new ATOM 0 HB2 ALA A 165 13.458 6.673 -8.163 1.00 0.00 H new ATOM 0 HB3 ALA A 165 15.064 6.756 -8.924 1.00 0.00 H new ATOM 2404 N ARG A 166 16.966 4.505 -8.528 1.00 0.00 N ATOM 2405 CA ARG A 166 18.029 3.774 -9.202 1.00 0.00 C ATOM 2406 C ARG A 166 18.290 2.449 -8.501 1.00 0.00 C ATOM 2407 O ARG A 166 18.363 1.400 -9.143 1.00 0.00 O ATOM 2408 CB ARG A 166 19.309 4.614 -9.242 1.00 0.00 C ATOM 2409 CG ARG A 166 20.489 3.902 -9.887 1.00 0.00 C ATOM 2410 CD ARG A 166 21.769 4.118 -9.096 1.00 0.00 C ATOM 2411 NE ARG A 166 22.690 2.989 -9.223 1.00 0.00 N ATOM 2412 CZ ARG A 166 22.569 1.854 -8.538 1.00 0.00 C ATOM 2413 NH1 ARG A 166 21.569 1.691 -7.681 1.00 0.00 N ATOM 2414 NH2 ARG A 166 23.450 0.879 -8.712 1.00 0.00 N ATOM 0 H ARG A 166 17.277 5.337 -8.026 1.00 0.00 H new ATOM 0 HA ARG A 166 17.713 3.569 -10.225 1.00 0.00 H new ATOM 0 HB2 ARG A 166 19.111 5.537 -9.788 1.00 0.00 H new ATOM 0 HB3 ARG A 166 19.579 4.897 -8.225 1.00 0.00 H new ATOM 0 HG2 ARG A 166 20.278 2.835 -9.956 1.00 0.00 H new ATOM 0 HG3 ARG A 166 20.623 4.267 -10.905 1.00 0.00 H new ATOM 0 HD2 ARG A 166 22.260 5.027 -9.443 1.00 0.00 H new ATOM 0 HD3 ARG A 166 21.524 4.269 -8.045 1.00 0.00 H new ATOM 0 HE ARG A 166 23.470 3.076 -9.874 1.00 0.00 H new ATOM 0 HH11 ARG A 166 20.888 2.438 -7.544 1.00 0.00 H new ATOM 0 HH12 ARG A 166 21.482 0.819 -7.159 1.00 0.00 H new ATOM 0 HH21 ARG A 166 24.220 0.999 -9.370 1.00 0.00 H new ATOM 0 HH22 ARG A 166 23.358 0.009 -8.188 1.00 0.00 H new ATOM 2428 N SER A 167 18.418 2.498 -7.180 1.00 0.00 N ATOM 2429 CA SER A 167 18.656 1.295 -6.398 1.00 0.00 C ATOM 2430 C SER A 167 17.457 0.360 -6.499 1.00 0.00 C ATOM 2431 O SER A 167 17.604 -0.863 -6.482 1.00 0.00 O ATOM 2432 CB SER A 167 18.922 1.654 -4.934 1.00 0.00 C ATOM 2433 OG SER A 167 20.174 2.301 -4.786 1.00 0.00 O ATOM 0 H SER A 167 18.361 3.356 -6.631 1.00 0.00 H new ATOM 0 HA SER A 167 19.535 0.788 -6.797 1.00 0.00 H new ATOM 0 HB2 SER A 167 18.128 2.304 -4.566 1.00 0.00 H new ATOM 0 HB3 SER A 167 18.902 0.750 -4.325 1.00 0.00 H new ATOM 0 HG SER A 167 20.319 2.521 -3.842 1.00 0.00 H new ATOM 2439 N TRP A 168 16.270 0.949 -6.613 1.00 0.00 N ATOM 2440 CA TRP A 168 15.043 0.173 -6.723 1.00 0.00 C ATOM 2441 C TRP A 168 14.929 -0.462 -8.103 1.00 0.00 C ATOM 2442 O TRP A 168 14.702 -1.664 -8.224 1.00 0.00 O ATOM 2443 CB TRP A 168 13.826 1.055 -6.445 1.00 0.00 C ATOM 2444 CG TRP A 168 13.311 0.917 -5.047 1.00 0.00 C ATOM 2445 CD1 TRP A 168 13.307 1.874 -4.072 1.00 0.00 C ATOM 2446 CD2 TRP A 168 12.732 -0.254 -4.464 1.00 0.00 C ATOM 2447 NE1 TRP A 168 12.755 1.369 -2.919 1.00 0.00 N ATOM 2448 CE2 TRP A 168 12.394 0.064 -3.134 1.00 0.00 C ATOM 2449 CE3 TRP A 168 12.464 -1.541 -4.938 1.00 0.00 C ATOM 2450 CZ2 TRP A 168 11.803 -0.860 -2.276 1.00 0.00 C ATOM 2451 CZ3 TRP A 168 11.879 -2.455 -4.086 1.00 0.00 C ATOM 2452 CH2 TRP A 168 11.553 -2.112 -2.768 1.00 0.00 C ATOM 0 H TRP A 168 16.134 1.960 -6.631 1.00 0.00 H new ATOM 0 HA TRP A 168 15.075 -0.623 -5.979 1.00 0.00 H new ATOM 0 HB2 TRP A 168 14.090 2.097 -6.628 1.00 0.00 H new ATOM 0 HB3 TRP A 168 13.031 0.800 -7.146 1.00 0.00 H new ATOM 0 HD1 TRP A 168 13.682 2.880 -4.190 1.00 0.00 H new ATOM 0 HE1 TRP A 168 12.634 1.882 -2.046 1.00 0.00 H new ATOM 0 HE3 TRP A 168 12.710 -1.815 -5.953 1.00 0.00 H new ATOM 0 HZ2 TRP A 168 11.551 -0.598 -1.259 1.00 0.00 H new ATOM 0 HZ3 TRP A 168 11.669 -3.453 -4.442 1.00 0.00 H new ATOM 0 HH2 TRP A 168 11.095 -2.851 -2.127 1.00 0.00 H new ATOM 2463 N ALA A 169 15.096 0.348 -9.145 1.00 0.00 N ATOM 2464 CA ALA A 169 15.015 -0.154 -10.510 1.00 0.00 C ATOM 2465 C ALA A 169 16.023 -1.275 -10.726 1.00 0.00 C ATOM 2466 O ALA A 169 15.700 -2.329 -11.279 1.00 0.00 O ATOM 2467 CB ALA A 169 15.252 0.972 -11.504 1.00 0.00 C ATOM 0 H ALA A 169 15.287 1.347 -9.070 1.00 0.00 H new ATOM 0 HA ALA A 169 14.014 -0.554 -10.672 1.00 0.00 H new ATOM 0 HB1 ALA A 169 15.188 0.581 -12.519 1.00 0.00 H new ATOM 0 HB2 ALA A 169 14.496 1.745 -11.365 1.00 0.00 H new ATOM 0 HB3 ALA A 169 16.242 1.399 -11.341 1.00 0.00 H new ATOM 2473 N GLY A 170 17.245 -1.039 -10.277 1.00 0.00 N ATOM 2474 CA GLY A 170 18.291 -2.028 -10.419 1.00 0.00 C ATOM 2475 C GLY A 170 17.969 -3.325 -9.714 1.00 0.00 C ATOM 2476 O GLY A 170 18.199 -4.404 -10.259 1.00 0.00 O ATOM 0 H GLY A 170 17.532 -0.176 -9.815 1.00 0.00 H new ATOM 0 HA2 GLY A 170 18.456 -2.226 -11.478 1.00 0.00 H new ATOM 0 HA3 GLY A 170 19.222 -1.625 -10.021 1.00 0.00 H new ATOM 2480 N ALA A 171 17.439 -3.231 -8.499 1.00 0.00 N ATOM 2481 CA ALA A 171 17.100 -4.427 -7.744 1.00 0.00 C ATOM 2482 C ALA A 171 15.905 -5.122 -8.349 1.00 0.00 C ATOM 2483 O ALA A 171 15.881 -6.348 -8.464 1.00 0.00 O ATOM 2484 CB ALA A 171 16.854 -4.103 -6.278 1.00 0.00 C ATOM 0 H ALA A 171 17.238 -2.351 -8.023 1.00 0.00 H new ATOM 0 HA ALA A 171 17.951 -5.106 -7.795 1.00 0.00 H new ATOM 0 HB1 ALA A 171 16.603 -5.017 -5.740 1.00 0.00 H new ATOM 0 HB2 ALA A 171 17.753 -3.664 -5.847 1.00 0.00 H new ATOM 0 HB3 ALA A 171 16.029 -3.395 -6.195 1.00 0.00 H new ATOM 2490 N ILE A 172 14.932 -4.341 -8.774 1.00 0.00 N ATOM 2491 CA ILE A 172 13.762 -4.905 -9.411 1.00 0.00 C ATOM 2492 C ILE A 172 14.198 -5.644 -10.668 1.00 0.00 C ATOM 2493 O ILE A 172 13.521 -6.557 -11.141 1.00 0.00 O ATOM 2494 CB ILE A 172 12.747 -3.812 -9.786 1.00 0.00 C ATOM 2495 CG1 ILE A 172 12.321 -3.034 -8.538 1.00 0.00 C ATOM 2496 CG2 ILE A 172 11.534 -4.420 -10.477 1.00 0.00 C ATOM 2497 CD1 ILE A 172 12.028 -1.573 -8.806 1.00 0.00 C ATOM 0 H ILE A 172 14.928 -3.324 -8.691 1.00 0.00 H new ATOM 0 HA ILE A 172 13.279 -5.588 -8.712 1.00 0.00 H new ATOM 0 HB ILE A 172 13.224 -3.121 -10.481 1.00 0.00 H new ATOM 0 HG12 ILE A 172 11.433 -3.502 -8.114 1.00 0.00 H new ATOM 0 HG13 ILE A 172 13.109 -3.106 -7.788 1.00 0.00 H new ATOM 0 HG21 ILE A 172 10.828 -3.630 -10.734 1.00 0.00 H new ATOM 0 HG22 ILE A 172 11.851 -4.933 -11.385 1.00 0.00 H new ATOM 0 HG23 ILE A 172 11.053 -5.133 -9.807 1.00 0.00 H new ATOM 0 HD11 ILE A 172 11.732 -1.085 -7.877 1.00 0.00 H new ATOM 0 HD12 ILE A 172 12.921 -1.089 -9.202 1.00 0.00 H new ATOM 0 HD13 ILE A 172 11.219 -1.491 -9.532 1.00 0.00 H new ATOM 2509 N GLN A 173 15.356 -5.241 -11.193 1.00 0.00 N ATOM 2510 CA GLN A 173 15.913 -5.857 -12.390 1.00 0.00 C ATOM 2511 C GLN A 173 16.583 -7.178 -12.046 1.00 0.00 C ATOM 2512 O GLN A 173 16.454 -8.162 -12.774 1.00 0.00 O ATOM 2513 CB GLN A 173 16.919 -4.916 -13.057 1.00 0.00 C ATOM 2514 CG GLN A 173 17.161 -5.227 -14.525 1.00 0.00 C ATOM 2515 CD GLN A 173 17.569 -4.002 -15.320 1.00 0.00 C ATOM 2516 OE1 GLN A 173 17.660 -2.900 -14.779 1.00 0.00 O ATOM 2517 NE2 GLN A 173 17.815 -4.190 -16.611 1.00 0.00 N ATOM 0 H GLN A 173 15.925 -4.489 -10.804 1.00 0.00 H new ATOM 0 HA GLN A 173 15.098 -6.049 -13.087 1.00 0.00 H new ATOM 0 HB2 GLN A 173 16.561 -3.891 -12.966 1.00 0.00 H new ATOM 0 HB3 GLN A 173 17.867 -4.972 -12.521 1.00 0.00 H new ATOM 0 HG2 GLN A 173 17.939 -5.986 -14.609 1.00 0.00 H new ATOM 0 HG3 GLN A 173 16.255 -5.651 -14.957 1.00 0.00 H new ATOM 0 HE21 GLN A 173 17.727 -5.122 -17.017 1.00 0.00 H new ATOM 0 HE22 GLN A 173 18.092 -3.403 -17.197 1.00 0.00 H new ATOM 2526 N ALA A 174 17.291 -7.195 -10.923 1.00 0.00 N ATOM 2527 CA ALA A 174 17.977 -8.397 -10.471 1.00 0.00 C ATOM 2528 C ALA A 174 16.971 -9.491 -10.142 1.00 0.00 C ATOM 2529 O ALA A 174 17.130 -10.641 -10.553 1.00 0.00 O ATOM 2530 CB ALA A 174 18.849 -8.090 -9.264 1.00 0.00 C ATOM 0 H ALA A 174 17.404 -6.389 -10.309 1.00 0.00 H new ATOM 0 HA ALA A 174 18.620 -8.752 -11.276 1.00 0.00 H new ATOM 0 HB1 ALA A 174 19.354 -9.000 -8.939 1.00 0.00 H new ATOM 0 HB2 ALA A 174 19.591 -7.339 -9.533 1.00 0.00 H new ATOM 0 HB3 ALA A 174 18.227 -7.711 -8.453 1.00 0.00 H new ATOM 2536 N GLN A 175 15.926 -9.122 -9.411 1.00 0.00 N ATOM 2537 CA GLN A 175 14.885 -10.070 -9.042 1.00 0.00 C ATOM 2538 C GLN A 175 14.136 -10.532 -10.285 1.00 0.00 C ATOM 2539 O GLN A 175 13.785 -11.705 -10.414 1.00 0.00 O ATOM 2540 CB GLN A 175 13.915 -9.437 -8.040 1.00 0.00 C ATOM 2541 CG GLN A 175 13.880 -10.147 -6.697 1.00 0.00 C ATOM 2542 CD GLN A 175 14.820 -9.523 -5.684 1.00 0.00 C ATOM 2543 OE1 GLN A 175 15.886 -9.018 -6.038 1.00 0.00 O ATOM 2544 NE2 GLN A 175 14.428 -9.556 -4.415 1.00 0.00 N ATOM 0 H GLN A 175 15.778 -8.175 -9.063 1.00 0.00 H new ATOM 0 HA GLN A 175 15.351 -10.935 -8.570 1.00 0.00 H new ATOM 0 HB2 GLN A 175 14.195 -8.395 -7.884 1.00 0.00 H new ATOM 0 HB3 GLN A 175 12.912 -9.437 -8.468 1.00 0.00 H new ATOM 0 HG2 GLN A 175 12.863 -10.126 -6.305 1.00 0.00 H new ATOM 0 HG3 GLN A 175 14.146 -11.195 -6.837 1.00 0.00 H new ATOM 0 HE21 GLN A 175 13.536 -9.985 -4.168 1.00 0.00 H new ATOM 0 HE22 GLN A 175 15.019 -9.152 -3.688 1.00 0.00 H new ATOM 2553 N ILE A 176 13.903 -9.601 -11.204 1.00 0.00 N ATOM 2554 CA ILE A 176 13.207 -9.907 -12.447 1.00 0.00 C ATOM 2555 C ILE A 176 13.970 -10.965 -13.244 1.00 0.00 C ATOM 2556 O ILE A 176 13.369 -11.817 -13.898 1.00 0.00 O ATOM 2557 CB ILE A 176 13.009 -8.629 -13.302 1.00 0.00 C ATOM 2558 CG1 ILE A 176 11.557 -8.153 -13.211 1.00 0.00 C ATOM 2559 CG2 ILE A 176 13.401 -8.856 -14.758 1.00 0.00 C ATOM 2560 CD1 ILE A 176 11.153 -7.699 -11.826 1.00 0.00 C ATOM 0 H ILE A 176 14.187 -8.626 -11.110 1.00 0.00 H new ATOM 0 HA ILE A 176 12.224 -10.303 -12.193 1.00 0.00 H new ATOM 0 HB ILE A 176 13.666 -7.857 -12.901 1.00 0.00 H new ATOM 0 HG12 ILE A 176 11.409 -7.331 -13.911 1.00 0.00 H new ATOM 0 HG13 ILE A 176 10.898 -8.962 -13.525 1.00 0.00 H new ATOM 0 HG21 ILE A 176 13.248 -7.937 -15.324 1.00 0.00 H new ATOM 0 HG22 ILE A 176 14.451 -9.144 -14.811 1.00 0.00 H new ATOM 0 HG23 ILE A 176 12.785 -9.649 -15.181 1.00 0.00 H new ATOM 0 HD11 ILE A 176 10.112 -7.376 -11.838 1.00 0.00 H new ATOM 0 HD12 ILE A 176 11.268 -8.525 -11.124 1.00 0.00 H new ATOM 0 HD13 ILE A 176 11.787 -6.868 -11.516 1.00 0.00 H new ATOM 2572 N GLY A 177 15.298 -10.900 -13.187 1.00 0.00 N ATOM 2573 CA GLY A 177 16.118 -11.855 -13.908 1.00 0.00 C ATOM 2574 C GLY A 177 17.191 -11.184 -14.741 1.00 0.00 C ATOM 2575 O GLY A 177 17.272 -11.397 -15.951 1.00 0.00 O ATOM 0 H GLY A 177 15.819 -10.203 -12.655 1.00 0.00 H new ATOM 0 HA2 GLY A 177 16.587 -12.536 -13.198 1.00 0.00 H new ATOM 0 HA3 GLY A 177 15.483 -12.458 -14.557 1.00 0.00 H new