USER MOD reduce.3.24.130724 H: found=0, std=0, add=869, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 871 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 5 THR OG1 : rot 180:sc= -1.24 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 12 TYR OH : rot 180:sc= -0.284 USER MOD Single : A 13 SER OG : rot -170:sc= 0 USER MOD Single : A 17 SER OG : rot 180:sc= -0.0101 USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 THR OG1 : rot -88:sc= -0.619 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 THR OG1 : rot -170:sc= -0.292 USER MOD Single : A 40 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0651) USER MOD Single : A 43 HIS : no HD1:sc= -0.739 K(o=-0.74,f=-5!) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 50 TYR OH : rot 180:sc= 0 USER MOD Single : A 56 THR OG1 : rot 153:sc= 0.182 USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 65 SER OG : rot -50:sc= -0.556 USER MOD Single : A 66 GLN : amide:sc= -2.06 K(o=-2.1,f=-4.9!) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 ASN : amide:sc= -0.946 K(o=-0.95,f=-2.4) USER MOD Single : A 76 SER OG : rot 180:sc= 0 USER MOD Single : A 91 TYR OH : rot 180:sc= 0 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 48:sc= 0.084 USER MOD Single : A 98 SER OG : rot 55:sc= 0.44 USER MOD Single : A 100 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= -0.192 (180deg=-0.192) USER MOD Single : A 105 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 111 TYR OH : rot 180:sc= -0.112 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 MET CE :methyl -151:sc= -0.143 (180deg=-0.664) USER MOD Single : A 130 SER OG : rot 96:sc= 1.19 USER MOD ----------------------------------------------------------------- ATOM 18 N LEU A 2 3.911 0.017 -1.973 1.00 0.00 N ATOM 19 CA LEU A 2 5.367 0.056 -1.899 1.00 0.00 C ATOM 20 C LEU A 2 5.866 1.490 -1.746 1.00 0.00 C ATOM 21 O LEU A 2 5.091 2.442 -1.849 1.00 0.00 O ATOM 22 CB LEU A 2 5.979 -0.578 -3.149 1.00 0.00 C ATOM 23 CG LEU A 2 6.782 -1.860 -2.927 1.00 0.00 C ATOM 24 CD1 LEU A 2 8.094 -1.553 -2.223 1.00 0.00 C ATOM 25 CD2 LEU A 2 5.968 -2.867 -2.128 1.00 0.00 C ATOM 0 HA LEU A 2 5.677 -0.513 -1.022 1.00 0.00 H new ATOM 0 HB2 LEU A 2 5.175 -0.794 -3.853 1.00 0.00 H new ATOM 0 HB3 LEU A 2 6.630 0.157 -3.623 1.00 0.00 H new ATOM 0 HG LEU A 2 7.009 -2.297 -3.899 1.00 0.00 H new ATOM 0 HD11 LEU A 2 8.652 -2.477 -2.074 1.00 0.00 H new ATOM 0 HD12 LEU A 2 8.683 -0.868 -2.833 1.00 0.00 H new ATOM 0 HD13 LEU A 2 7.889 -1.093 -1.256 1.00 0.00 H new ATOM 0 HD21 LEU A 2 6.555 -3.773 -1.979 1.00 0.00 H new ATOM 0 HD22 LEU A 2 5.709 -2.439 -1.159 1.00 0.00 H new ATOM 0 HD23 LEU A 2 5.056 -3.111 -2.672 1.00 0.00 H new ATOM 37 N LEU A 3 7.163 1.636 -1.501 1.00 0.00 N ATOM 38 CA LEU A 3 7.767 2.954 -1.336 1.00 0.00 C ATOM 39 C LEU A 3 9.157 2.998 -1.960 1.00 0.00 C ATOM 40 O LEU A 3 10.007 3.792 -1.553 1.00 0.00 O ATOM 41 CB LEU A 3 7.849 3.317 0.148 1.00 0.00 C ATOM 42 CG LEU A 3 6.665 2.882 1.012 1.00 0.00 C ATOM 43 CD1 LEU A 3 6.874 1.468 1.531 1.00 0.00 C ATOM 44 CD2 LEU A 3 6.464 3.852 2.168 1.00 0.00 C ATOM 0 H LEU A 3 7.817 0.858 -1.412 1.00 0.00 H new ATOM 0 HA LEU A 3 7.137 3.682 -1.847 1.00 0.00 H new ATOM 0 HB2 LEU A 3 8.756 2.874 0.560 1.00 0.00 H new ATOM 0 HB3 LEU A 3 7.956 4.399 0.232 1.00 0.00 H new ATOM 0 HG LEU A 3 5.767 2.891 0.395 1.00 0.00 H new ATOM 0 HD11 LEU A 3 6.021 1.176 2.144 1.00 0.00 H new ATOM 0 HD12 LEU A 3 6.968 0.782 0.689 1.00 0.00 H new ATOM 0 HD13 LEU A 3 7.782 1.432 2.132 1.00 0.00 H new ATOM 0 HD21 LEU A 3 5.617 3.527 2.773 1.00 0.00 H new ATOM 0 HD22 LEU A 3 7.363 3.875 2.785 1.00 0.00 H new ATOM 0 HD23 LEU A 3 6.268 4.850 1.776 1.00 0.00 H new ATOM 56 N ILE A 4 9.382 2.143 -2.952 1.00 0.00 N ATOM 57 CA ILE A 4 10.669 2.087 -3.634 1.00 0.00 C ATOM 58 C ILE A 4 10.633 2.873 -4.940 1.00 0.00 C ATOM 59 O ILE A 4 9.581 3.358 -5.358 1.00 0.00 O ATOM 60 CB ILE A 4 11.085 0.634 -3.934 1.00 0.00 C ATOM 61 CG1 ILE A 4 10.057 -0.034 -4.850 1.00 0.00 C ATOM 62 CG2 ILE A 4 11.239 -0.150 -2.640 1.00 0.00 C ATOM 63 CD1 ILE A 4 10.679 -0.805 -5.994 1.00 0.00 C ATOM 0 H ILE A 4 8.690 1.480 -3.301 1.00 0.00 H new ATOM 0 HA ILE A 4 11.402 2.535 -2.963 1.00 0.00 H new ATOM 0 HB ILE A 4 12.047 0.644 -4.446 1.00 0.00 H new ATOM 0 HG12 ILE A 4 9.441 -0.711 -4.258 1.00 0.00 H new ATOM 0 HG13 ILE A 4 9.393 0.729 -5.255 1.00 0.00 H new ATOM 0 HG21 ILE A 4 11.533 -1.174 -2.868 1.00 0.00 H new ATOM 0 HG22 ILE A 4 12.004 0.318 -2.020 1.00 0.00 H new ATOM 0 HG23 ILE A 4 10.290 -0.156 -2.103 1.00 0.00 H new ATOM 0 HD11 ILE A 4 9.892 -1.252 -6.602 1.00 0.00 H new ATOM 0 HD12 ILE A 4 11.272 -0.128 -6.609 1.00 0.00 H new ATOM 0 HD13 ILE A 4 11.321 -1.591 -5.596 1.00 0.00 H new ATOM 75 N THR A 5 11.791 2.996 -5.583 1.00 0.00 N ATOM 76 CA THR A 5 11.892 3.723 -6.842 1.00 0.00 C ATOM 77 C THR A 5 12.262 2.788 -7.988 1.00 0.00 C ATOM 78 O THR A 5 13.052 1.856 -7.831 1.00 0.00 O ATOM 79 CB THR A 5 12.938 4.850 -6.757 1.00 0.00 C ATOM 80 OG1 THR A 5 12.930 5.619 -7.965 1.00 0.00 O ATOM 81 CG2 THR A 5 14.329 4.282 -6.521 1.00 0.00 C ATOM 0 H THR A 5 12.671 2.601 -5.252 1.00 0.00 H new ATOM 0 HA THR A 5 10.912 4.160 -7.034 1.00 0.00 H new ATOM 0 HB THR A 5 12.678 5.493 -5.916 1.00 0.00 H new ATOM 0 HG1 THR A 5 13.597 6.334 -7.902 1.00 0.00 H new ATOM 0 HG21 THR A 5 15.050 5.097 -6.465 1.00 0.00 H new ATOM 0 HG22 THR A 5 14.340 3.723 -5.585 1.00 0.00 H new ATOM 0 HG23 THR A 5 14.595 3.618 -7.344 1.00 0.00 H new ATOM 89 N PRO A 6 11.681 3.040 -9.170 1.00 0.00 N ATOM 90 CA PRO A 6 11.935 2.233 -10.366 1.00 0.00 C ATOM 91 C PRO A 6 13.347 2.429 -10.909 1.00 0.00 C ATOM 92 O PRO A 6 13.800 1.678 -11.773 1.00 0.00 O ATOM 93 CB PRO A 6 10.901 2.748 -11.370 1.00 0.00 C ATOM 94 CG PRO A 6 10.606 4.140 -10.928 1.00 0.00 C ATOM 95 CD PRO A 6 10.730 4.134 -9.430 1.00 0.00 C ATOM 0 HA PRO A 6 11.854 1.166 -10.161 1.00 0.00 H new ATOM 0 HB2 PRO A 6 11.293 2.730 -12.387 1.00 0.00 H new ATOM 0 HB3 PRO A 6 10.002 2.132 -11.364 1.00 0.00 H new ATOM 0 HG2 PRO A 6 11.305 4.847 -11.375 1.00 0.00 H new ATOM 0 HG3 PRO A 6 9.605 4.443 -11.235 1.00 0.00 H new ATOM 0 HD2 PRO A 6 11.102 5.087 -9.054 1.00 0.00 H new ATOM 0 HD3 PRO A 6 9.769 3.954 -8.948 1.00 0.00 H new ATOM 103 N ASP A 7 14.038 3.441 -10.395 1.00 0.00 N ATOM 104 CA ASP A 7 15.399 3.735 -10.827 1.00 0.00 C ATOM 105 C ASP A 7 16.396 2.790 -10.162 1.00 0.00 C ATOM 106 O ASP A 7 17.435 2.467 -10.735 1.00 0.00 O ATOM 107 CB ASP A 7 15.758 5.186 -10.503 1.00 0.00 C ATOM 108 CG ASP A 7 16.908 5.700 -11.346 1.00 0.00 C ATOM 109 OD1 ASP A 7 16.652 6.475 -12.291 1.00 0.00 O ATOM 110 OD2 ASP A 7 18.065 5.328 -11.060 1.00 0.00 O ATOM 0 H ASP A 7 13.678 4.071 -9.679 1.00 0.00 H new ATOM 0 HA ASP A 7 15.451 3.589 -11.906 1.00 0.00 H new ATOM 0 HB2 ASP A 7 14.884 5.818 -10.662 1.00 0.00 H new ATOM 0 HB3 ASP A 7 16.021 5.265 -9.448 1.00 0.00 H new ATOM 115 N GLU A 8 16.071 2.353 -8.949 1.00 0.00 N ATOM 116 CA GLU A 8 16.939 1.448 -8.206 1.00 0.00 C ATOM 117 C GLU A 8 16.851 0.030 -8.763 1.00 0.00 C ATOM 118 O GLU A 8 17.824 -0.725 -8.728 1.00 0.00 O ATOM 119 CB GLU A 8 16.564 1.449 -6.723 1.00 0.00 C ATOM 120 CG GLU A 8 17.590 2.134 -5.836 1.00 0.00 C ATOM 121 CD GLU A 8 18.922 1.410 -5.818 1.00 0.00 C ATOM 122 OE1 GLU A 8 19.021 0.368 -5.136 1.00 0.00 O ATOM 123 OE2 GLU A 8 19.865 1.884 -6.485 1.00 0.00 O ATOM 0 H GLU A 8 15.213 2.611 -8.461 1.00 0.00 H new ATOM 0 HA GLU A 8 17.965 1.799 -8.314 1.00 0.00 H new ATOM 0 HB2 GLU A 8 15.601 1.945 -6.601 1.00 0.00 H new ATOM 0 HB3 GLU A 8 16.437 0.419 -6.388 1.00 0.00 H new ATOM 0 HG2 GLU A 8 17.741 3.156 -6.184 1.00 0.00 H new ATOM 0 HG3 GLU A 8 17.201 2.197 -4.820 1.00 0.00 H new ATOM 130 N LEU A 9 15.679 -0.326 -9.277 1.00 0.00 N ATOM 131 CA LEU A 9 15.462 -1.653 -9.842 1.00 0.00 C ATOM 132 C LEU A 9 16.427 -1.919 -10.993 1.00 0.00 C ATOM 133 O LEU A 9 17.046 -2.981 -11.066 1.00 0.00 O ATOM 134 CB LEU A 9 14.018 -1.792 -10.329 1.00 0.00 C ATOM 135 CG LEU A 9 13.756 -2.907 -11.343 1.00 0.00 C ATOM 136 CD1 LEU A 9 14.126 -4.260 -10.756 1.00 0.00 C ATOM 137 CD2 LEU A 9 12.300 -2.895 -11.784 1.00 0.00 C ATOM 0 H LEU A 9 14.864 0.286 -9.314 1.00 0.00 H new ATOM 0 HA LEU A 9 15.647 -2.389 -9.060 1.00 0.00 H new ATOM 0 HB2 LEU A 9 13.378 -1.958 -9.463 1.00 0.00 H new ATOM 0 HB3 LEU A 9 13.713 -0.845 -10.774 1.00 0.00 H new ATOM 0 HG LEU A 9 14.381 -2.731 -12.218 1.00 0.00 H new ATOM 0 HD11 LEU A 9 13.933 -5.041 -11.492 1.00 0.00 H new ATOM 0 HD12 LEU A 9 15.183 -4.265 -10.491 1.00 0.00 H new ATOM 0 HD13 LEU A 9 13.527 -4.446 -9.864 1.00 0.00 H new ATOM 0 HD21 LEU A 9 12.132 -3.695 -12.505 1.00 0.00 H new ATOM 0 HD22 LEU A 9 11.656 -3.046 -10.918 1.00 0.00 H new ATOM 0 HD23 LEU A 9 12.068 -1.935 -12.246 1.00 0.00 H new ATOM 149 N LYS A 10 16.552 -0.947 -11.890 1.00 0.00 N ATOM 150 CA LYS A 10 17.444 -1.074 -13.036 1.00 0.00 C ATOM 151 C LYS A 10 18.904 -1.002 -12.600 1.00 0.00 C ATOM 152 O LYS A 10 19.770 -1.649 -13.189 1.00 0.00 O ATOM 153 CB LYS A 10 17.153 0.027 -14.059 1.00 0.00 C ATOM 154 CG LYS A 10 17.151 1.425 -13.465 1.00 0.00 C ATOM 155 CD LYS A 10 17.039 2.489 -14.544 1.00 0.00 C ATOM 156 CE LYS A 10 17.992 3.646 -14.287 1.00 0.00 C ATOM 157 NZ LYS A 10 19.400 3.288 -14.614 1.00 0.00 N ATOM 0 H LYS A 10 16.047 -0.062 -11.845 1.00 0.00 H new ATOM 0 HA LYS A 10 17.267 -2.046 -13.496 1.00 0.00 H new ATOM 0 HB2 LYS A 10 17.898 -0.020 -14.853 1.00 0.00 H new ATOM 0 HB3 LYS A 10 16.184 -0.164 -14.520 1.00 0.00 H new ATOM 0 HG2 LYS A 10 16.319 1.524 -12.768 1.00 0.00 H new ATOM 0 HG3 LYS A 10 18.066 1.580 -12.894 1.00 0.00 H new ATOM 0 HD2 LYS A 10 17.256 2.047 -15.516 1.00 0.00 H new ATOM 0 HD3 LYS A 10 16.015 2.861 -14.584 1.00 0.00 H new ATOM 0 HE2 LYS A 10 17.688 4.506 -14.884 1.00 0.00 H new ATOM 0 HE3 LYS A 10 17.927 3.945 -13.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 20.018 4.103 -14.425 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 19.699 2.483 -14.027 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 19.468 3.028 -15.619 1.00 0.00 H new ATOM 171 N SER A 11 19.170 -0.214 -11.563 1.00 0.00 N ATOM 172 CA SER A 11 20.525 -0.057 -11.049 1.00 0.00 C ATOM 173 C SER A 11 21.011 -1.347 -10.395 1.00 0.00 C ATOM 174 O SER A 11 22.195 -1.680 -10.456 1.00 0.00 O ATOM 175 CB SER A 11 20.581 1.092 -10.041 1.00 0.00 C ATOM 176 OG SER A 11 21.569 2.041 -10.404 1.00 0.00 O ATOM 0 H SER A 11 18.464 0.326 -11.062 1.00 0.00 H new ATOM 0 HA SER A 11 21.181 0.174 -11.888 1.00 0.00 H new ATOM 0 HB2 SER A 11 19.607 1.579 -9.985 1.00 0.00 H new ATOM 0 HB3 SER A 11 20.798 0.698 -9.048 1.00 0.00 H new ATOM 0 HG SER A 11 21.584 2.766 -9.745 1.00 0.00 H new ATOM 182 N TYR A 12 20.088 -2.068 -9.769 1.00 0.00 N ATOM 183 CA TYR A 12 20.421 -3.321 -9.101 1.00 0.00 C ATOM 184 C TYR A 12 20.357 -4.493 -10.076 1.00 0.00 C ATOM 185 O TYR A 12 21.281 -5.302 -10.153 1.00 0.00 O ATOM 186 CB TYR A 12 19.470 -3.566 -7.928 1.00 0.00 C ATOM 187 CG TYR A 12 19.652 -4.917 -7.273 1.00 0.00 C ATOM 188 CD1 TYR A 12 18.609 -5.834 -7.227 1.00 0.00 C ATOM 189 CD2 TYR A 12 20.865 -5.276 -6.700 1.00 0.00 C ATOM 190 CE1 TYR A 12 18.769 -7.069 -6.630 1.00 0.00 C ATOM 191 CE2 TYR A 12 21.036 -6.509 -6.102 1.00 0.00 C ATOM 192 CZ TYR A 12 19.985 -7.402 -6.069 1.00 0.00 C ATOM 193 OH TYR A 12 20.150 -8.631 -5.472 1.00 0.00 O ATOM 0 H TYR A 12 19.104 -1.807 -9.710 1.00 0.00 H new ATOM 0 HA TYR A 12 21.440 -3.242 -8.724 1.00 0.00 H new ATOM 0 HB2 TYR A 12 19.619 -2.786 -7.181 1.00 0.00 H new ATOM 0 HB3 TYR A 12 18.442 -3.478 -8.280 1.00 0.00 H new ATOM 0 HD1 TYR A 12 17.656 -5.576 -7.666 1.00 0.00 H new ATOM 0 HD2 TYR A 12 21.689 -4.579 -6.722 1.00 0.00 H new ATOM 0 HE1 TYR A 12 17.948 -7.770 -6.602 1.00 0.00 H new ATOM 0 HE2 TYR A 12 21.987 -6.773 -5.663 1.00 0.00 H new ATOM 0 HH TYR A 12 21.064 -8.707 -5.128 1.00 0.00 H new ATOM 203 N SER A 13 19.258 -4.576 -10.819 1.00 0.00 N ATOM 204 CA SER A 13 19.070 -5.649 -11.788 1.00 0.00 C ATOM 205 C SER A 13 20.025 -5.491 -12.967 1.00 0.00 C ATOM 206 O SER A 13 20.587 -4.417 -13.186 1.00 0.00 O ATOM 207 CB SER A 13 17.624 -5.667 -12.287 1.00 0.00 C ATOM 208 OG SER A 13 17.489 -4.926 -13.487 1.00 0.00 O ATOM 0 H SER A 13 18.484 -3.913 -10.768 1.00 0.00 H new ATOM 0 HA SER A 13 19.287 -6.595 -11.292 1.00 0.00 H new ATOM 0 HB2 SER A 13 17.306 -6.696 -12.454 1.00 0.00 H new ATOM 0 HB3 SER A 13 16.967 -5.251 -11.523 1.00 0.00 H new ATOM 0 HG SER A 13 16.538 -4.819 -13.700 1.00 0.00 H new ATOM 214 N VAL A 14 20.204 -6.568 -13.724 1.00 0.00 N ATOM 215 CA VAL A 14 21.089 -6.550 -14.882 1.00 0.00 C ATOM 216 C VAL A 14 20.297 -6.644 -16.181 1.00 0.00 C ATOM 217 O VAL A 14 20.771 -6.234 -17.241 1.00 0.00 O ATOM 218 CB VAL A 14 22.106 -7.706 -14.829 1.00 0.00 C ATOM 219 CG1 VAL A 14 22.899 -7.660 -13.532 1.00 0.00 C ATOM 220 CG2 VAL A 14 21.400 -9.044 -14.985 1.00 0.00 C ATOM 0 H VAL A 14 19.748 -7.465 -13.556 1.00 0.00 H new ATOM 0 HA VAL A 14 21.626 -5.602 -14.855 1.00 0.00 H new ATOM 0 HB VAL A 14 22.804 -7.591 -15.658 1.00 0.00 H new ATOM 0 HG11 VAL A 14 23.612 -8.484 -13.512 1.00 0.00 H new ATOM 0 HG12 VAL A 14 23.436 -6.714 -13.467 1.00 0.00 H new ATOM 0 HG13 VAL A 14 22.218 -7.749 -12.686 1.00 0.00 H new ATOM 0 HG21 VAL A 14 22.134 -9.849 -14.945 1.00 0.00 H new ATOM 0 HG22 VAL A 14 20.678 -9.171 -14.178 1.00 0.00 H new ATOM 0 HG23 VAL A 14 20.882 -9.072 -15.944 1.00 0.00 H new ATOM 230 N PHE A 15 19.088 -7.188 -16.093 1.00 0.00 N ATOM 231 CA PHE A 15 18.228 -7.336 -17.261 1.00 0.00 C ATOM 232 C PHE A 15 18.076 -6.008 -17.997 1.00 0.00 C ATOM 233 O PHE A 15 17.385 -5.104 -17.529 1.00 0.00 O ATOM 234 CB PHE A 15 16.853 -7.863 -16.846 1.00 0.00 C ATOM 235 CG PHE A 15 16.652 -9.320 -17.152 1.00 0.00 C ATOM 236 CD1 PHE A 15 16.356 -10.219 -16.141 1.00 0.00 C ATOM 237 CD2 PHE A 15 16.759 -9.790 -18.451 1.00 0.00 C ATOM 238 CE1 PHE A 15 16.170 -11.560 -16.419 1.00 0.00 C ATOM 239 CE2 PHE A 15 16.574 -11.130 -18.735 1.00 0.00 C ATOM 240 CZ PHE A 15 16.280 -12.016 -17.718 1.00 0.00 C ATOM 0 H PHE A 15 18.681 -7.534 -15.224 1.00 0.00 H new ATOM 0 HA PHE A 15 18.695 -8.053 -17.936 1.00 0.00 H new ATOM 0 HB2 PHE A 15 16.719 -7.703 -15.776 1.00 0.00 H new ATOM 0 HB3 PHE A 15 16.082 -7.284 -17.354 1.00 0.00 H new ATOM 0 HD1 PHE A 15 16.269 -9.868 -15.123 1.00 0.00 H new ATOM 0 HD2 PHE A 15 16.990 -9.102 -19.251 1.00 0.00 H new ATOM 0 HE1 PHE A 15 15.939 -12.250 -15.621 1.00 0.00 H new ATOM 0 HE2 PHE A 15 16.659 -11.484 -19.752 1.00 0.00 H new ATOM 0 HZ PHE A 15 16.136 -13.064 -17.938 1.00 0.00 H new ATOM 250 N GLU A 16 18.727 -5.899 -19.151 1.00 0.00 N ATOM 251 CA GLU A 16 18.665 -4.681 -19.950 1.00 0.00 C ATOM 252 C GLU A 16 17.218 -4.301 -20.252 1.00 0.00 C ATOM 253 O GLU A 16 16.903 -3.130 -20.462 1.00 0.00 O ATOM 254 CB GLU A 16 19.440 -4.862 -21.257 1.00 0.00 C ATOM 255 CG GLU A 16 19.610 -3.575 -22.047 1.00 0.00 C ATOM 256 CD GLU A 16 20.365 -3.783 -23.345 1.00 0.00 C ATOM 257 OE1 GLU A 16 21.578 -4.074 -23.286 1.00 0.00 O ATOM 258 OE2 GLU A 16 19.743 -3.655 -24.421 1.00 0.00 O ATOM 0 H GLU A 16 19.303 -6.639 -19.553 1.00 0.00 H new ATOM 0 HA GLU A 16 19.121 -3.876 -19.374 1.00 0.00 H new ATOM 0 HB2 GLU A 16 20.424 -5.273 -21.032 1.00 0.00 H new ATOM 0 HB3 GLU A 16 18.923 -5.594 -21.878 1.00 0.00 H new ATOM 0 HG2 GLU A 16 18.628 -3.155 -22.265 1.00 0.00 H new ATOM 0 HG3 GLU A 16 20.140 -2.845 -21.435 1.00 0.00 H new ATOM 265 N SER A 17 16.342 -5.301 -20.272 1.00 0.00 N ATOM 266 CA SER A 17 14.930 -5.074 -20.553 1.00 0.00 C ATOM 267 C SER A 17 14.287 -4.227 -19.458 1.00 0.00 C ATOM 268 O SER A 17 13.454 -3.364 -19.734 1.00 0.00 O ATOM 269 CB SER A 17 14.192 -6.408 -20.680 1.00 0.00 C ATOM 270 OG SER A 17 14.115 -7.069 -19.429 1.00 0.00 O ATOM 0 H SER A 17 16.586 -6.276 -20.097 1.00 0.00 H new ATOM 0 HA SER A 17 14.856 -4.534 -21.497 1.00 0.00 H new ATOM 0 HB2 SER A 17 13.187 -6.236 -21.067 1.00 0.00 H new ATOM 0 HB3 SER A 17 14.706 -7.045 -21.400 1.00 0.00 H new ATOM 0 HG SER A 17 13.637 -7.918 -19.536 1.00 0.00 H new ATOM 276 N VAL A 18 14.681 -4.482 -18.214 1.00 0.00 N ATOM 277 CA VAL A 18 14.146 -3.743 -17.077 1.00 0.00 C ATOM 278 C VAL A 18 14.739 -2.341 -17.004 1.00 0.00 C ATOM 279 O VAL A 18 14.076 -1.395 -16.577 1.00 0.00 O ATOM 280 CB VAL A 18 14.424 -4.476 -15.751 1.00 0.00 C ATOM 281 CG1 VAL A 18 13.853 -3.693 -14.578 1.00 0.00 C ATOM 282 CG2 VAL A 18 13.852 -5.885 -15.791 1.00 0.00 C ATOM 0 H VAL A 18 15.368 -5.194 -17.969 1.00 0.00 H new ATOM 0 HA VAL A 18 13.069 -3.671 -17.225 1.00 0.00 H new ATOM 0 HB VAL A 18 15.503 -4.550 -15.616 1.00 0.00 H new ATOM 0 HG11 VAL A 18 14.059 -4.226 -13.650 1.00 0.00 H new ATOM 0 HG12 VAL A 18 14.315 -2.706 -14.540 1.00 0.00 H new ATOM 0 HG13 VAL A 18 12.776 -3.585 -14.703 1.00 0.00 H new ATOM 0 HG21 VAL A 18 14.058 -6.388 -14.846 1.00 0.00 H new ATOM 0 HG22 VAL A 18 12.775 -5.836 -15.949 1.00 0.00 H new ATOM 0 HG23 VAL A 18 14.313 -6.442 -16.607 1.00 0.00 H new ATOM 292 N LYS A 19 15.993 -2.212 -17.424 1.00 0.00 N ATOM 293 CA LYS A 19 16.677 -0.925 -17.409 1.00 0.00 C ATOM 294 C LYS A 19 16.270 -0.078 -18.610 1.00 0.00 C ATOM 295 O LYS A 19 16.374 1.149 -18.583 1.00 0.00 O ATOM 296 CB LYS A 19 18.194 -1.130 -17.407 1.00 0.00 C ATOM 297 CG LYS A 19 18.685 -2.024 -16.282 1.00 0.00 C ATOM 298 CD LYS A 19 19.697 -3.042 -16.780 1.00 0.00 C ATOM 299 CE LYS A 19 20.959 -3.035 -15.930 1.00 0.00 C ATOM 300 NZ LYS A 19 21.898 -1.954 -16.341 1.00 0.00 N ATOM 0 H LYS A 19 16.557 -2.984 -17.779 1.00 0.00 H new ATOM 0 HA LYS A 19 16.386 -0.398 -16.500 1.00 0.00 H new ATOM 0 HB2 LYS A 19 18.495 -1.562 -18.361 1.00 0.00 H new ATOM 0 HB3 LYS A 19 18.683 -0.159 -17.328 1.00 0.00 H new ATOM 0 HG2 LYS A 19 19.137 -1.413 -15.501 1.00 0.00 H new ATOM 0 HG3 LYS A 19 17.838 -2.542 -15.832 1.00 0.00 H new ATOM 0 HD2 LYS A 19 19.252 -4.037 -16.764 1.00 0.00 H new ATOM 0 HD3 LYS A 19 19.954 -2.824 -17.817 1.00 0.00 H new ATOM 0 HE2 LYS A 19 20.690 -2.904 -14.882 1.00 0.00 H new ATOM 0 HE3 LYS A 19 21.458 -4.001 -16.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 22.745 -1.982 -15.738 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 22.175 -2.093 -17.334 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 21.431 -1.031 -16.238 1.00 0.00 H new ATOM 314 N THR A 20 15.804 -0.740 -19.665 1.00 0.00 N ATOM 315 CA THR A 20 15.380 -0.048 -20.876 1.00 0.00 C ATOM 316 C THR A 20 13.990 0.553 -20.707 1.00 0.00 C ATOM 317 O THR A 20 13.747 1.697 -21.094 1.00 0.00 O ATOM 318 CB THR A 20 15.374 -0.995 -22.091 1.00 0.00 C ATOM 319 OG1 THR A 20 14.807 -2.258 -21.725 1.00 0.00 O ATOM 320 CG2 THR A 20 16.785 -1.202 -22.622 1.00 0.00 C ATOM 0 H THR A 20 15.711 -1.755 -19.705 1.00 0.00 H new ATOM 0 HA THR A 20 16.099 0.752 -21.052 1.00 0.00 H new ATOM 0 HB THR A 20 14.770 -0.540 -22.876 1.00 0.00 H new ATOM 0 HG1 THR A 20 15.510 -2.842 -21.372 1.00 0.00 H new ATOM 0 HG21 THR A 20 16.756 -1.874 -23.480 1.00 0.00 H new ATOM 0 HG22 THR A 20 17.203 -0.243 -22.927 1.00 0.00 H new ATOM 0 HG23 THR A 20 17.408 -1.638 -21.841 1.00 0.00 H new ATOM 328 N ARG A 21 13.080 -0.223 -20.128 1.00 0.00 N ATOM 329 CA ARG A 21 11.713 0.233 -19.909 1.00 0.00 C ATOM 330 C ARG A 21 11.698 1.579 -19.189 1.00 0.00 C ATOM 331 O ARG A 21 12.654 1.960 -18.514 1.00 0.00 O ATOM 332 CB ARG A 21 10.931 -0.801 -19.098 1.00 0.00 C ATOM 333 CG ARG A 21 9.912 -1.575 -19.918 1.00 0.00 C ATOM 334 CD ARG A 21 9.732 -2.990 -19.391 1.00 0.00 C ATOM 335 NE ARG A 21 8.393 -3.507 -19.658 1.00 0.00 N ATOM 336 CZ ARG A 21 7.944 -3.792 -20.875 1.00 0.00 C ATOM 337 NH1 ARG A 21 8.724 -3.612 -21.932 1.00 0.00 N ATOM 338 NH2 ARG A 21 6.713 -4.260 -21.038 1.00 0.00 N ATOM 0 H ARG A 21 13.265 -1.172 -19.802 1.00 0.00 H new ATOM 0 HA ARG A 21 11.237 0.356 -20.882 1.00 0.00 H new ATOM 0 HB2 ARG A 21 11.633 -1.504 -18.649 1.00 0.00 H new ATOM 0 HB3 ARG A 21 10.418 -0.296 -18.280 1.00 0.00 H new ATOM 0 HG2 ARG A 21 8.955 -1.053 -19.898 1.00 0.00 H new ATOM 0 HG3 ARG A 21 10.233 -1.611 -20.959 1.00 0.00 H new ATOM 0 HD2 ARG A 21 10.472 -3.645 -19.851 1.00 0.00 H new ATOM 0 HD3 ARG A 21 9.918 -3.003 -18.317 1.00 0.00 H new ATOM 0 HE ARG A 21 7.768 -3.658 -18.866 1.00 0.00 H new ATOM 0 HH11 ARG A 21 9.671 -3.254 -21.812 1.00 0.00 H new ATOM 0 HH12 ARG A 21 8.377 -3.832 -22.866 1.00 0.00 H new ATOM 0 HH21 ARG A 21 6.110 -4.401 -20.228 1.00 0.00 H new ATOM 0 HH22 ARG A 21 6.370 -4.478 -21.974 1.00 0.00 H new ATOM 352 N PRO A 22 10.587 2.316 -19.336 1.00 0.00 N ATOM 353 CA PRO A 22 10.421 3.630 -18.707 1.00 0.00 C ATOM 354 C PRO A 22 10.274 3.533 -17.193 1.00 0.00 C ATOM 355 O PRO A 22 10.427 2.458 -16.612 1.00 0.00 O ATOM 356 CB PRO A 22 9.131 4.163 -19.337 1.00 0.00 C ATOM 357 CG PRO A 22 8.375 2.945 -19.740 1.00 0.00 C ATOM 358 CD PRO A 22 9.409 1.924 -20.127 1.00 0.00 C ATOM 0 HA PRO A 22 11.287 4.272 -18.867 1.00 0.00 H new ATOM 0 HB2 PRO A 22 8.563 4.765 -18.627 1.00 0.00 H new ATOM 0 HB3 PRO A 22 9.344 4.799 -20.196 1.00 0.00 H new ATOM 0 HG2 PRO A 22 7.755 2.581 -18.920 1.00 0.00 H new ATOM 0 HG3 PRO A 22 7.707 3.159 -20.574 1.00 0.00 H new ATOM 0 HD2 PRO A 22 9.083 0.912 -19.888 1.00 0.00 H new ATOM 0 HD3 PRO A 22 9.617 1.948 -21.197 1.00 0.00 H new ATOM 366 N ASP A 23 9.975 4.661 -16.559 1.00 0.00 N ATOM 367 CA ASP A 23 9.806 4.703 -15.111 1.00 0.00 C ATOM 368 C ASP A 23 8.343 4.505 -14.729 1.00 0.00 C ATOM 369 O ASP A 23 8.036 3.893 -13.706 1.00 0.00 O ATOM 370 CB ASP A 23 10.316 6.034 -14.554 1.00 0.00 C ATOM 371 CG ASP A 23 9.832 7.222 -15.362 1.00 0.00 C ATOM 372 OD1 ASP A 23 10.622 7.752 -16.171 1.00 0.00 O ATOM 373 OD2 ASP A 23 8.662 7.622 -15.184 1.00 0.00 O ATOM 0 H ASP A 23 9.845 5.559 -17.025 1.00 0.00 H new ATOM 0 HA ASP A 23 10.389 3.890 -14.678 1.00 0.00 H new ATOM 0 HB2 ASP A 23 9.987 6.142 -13.521 1.00 0.00 H new ATOM 0 HB3 ASP A 23 11.406 6.026 -14.542 1.00 0.00 H new ATOM 378 N GLU A 24 7.444 5.028 -15.557 1.00 0.00 N ATOM 379 CA GLU A 24 6.013 4.910 -15.304 1.00 0.00 C ATOM 380 C GLU A 24 5.577 3.448 -15.316 1.00 0.00 C ATOM 381 O GLU A 24 4.772 3.021 -14.487 1.00 0.00 O ATOM 382 CB GLU A 24 5.221 5.698 -16.349 1.00 0.00 C ATOM 383 CG GLU A 24 5.509 5.273 -17.779 1.00 0.00 C ATOM 384 CD GLU A 24 4.814 6.152 -18.800 1.00 0.00 C ATOM 385 OE1 GLU A 24 5.376 7.211 -19.152 1.00 0.00 O ATOM 386 OE2 GLU A 24 3.709 5.782 -19.248 1.00 0.00 O ATOM 0 H GLU A 24 7.681 5.537 -16.408 1.00 0.00 H new ATOM 0 HA GLU A 24 5.810 5.324 -14.316 1.00 0.00 H new ATOM 0 HB2 GLU A 24 4.156 5.579 -16.151 1.00 0.00 H new ATOM 0 HB3 GLU A 24 5.449 6.759 -16.241 1.00 0.00 H new ATOM 0 HG2 GLU A 24 6.585 5.301 -17.953 1.00 0.00 H new ATOM 0 HG3 GLU A 24 5.191 4.240 -17.918 1.00 0.00 H new ATOM 393 N LEU A 25 6.115 2.684 -16.260 1.00 0.00 N ATOM 394 CA LEU A 25 5.783 1.269 -16.382 1.00 0.00 C ATOM 395 C LEU A 25 6.363 0.471 -15.218 1.00 0.00 C ATOM 396 O LEU A 25 5.673 -0.343 -14.604 1.00 0.00 O ATOM 397 CB LEU A 25 6.306 0.714 -17.707 1.00 0.00 C ATOM 398 CG LEU A 25 5.589 1.198 -18.968 1.00 0.00 C ATOM 399 CD1 LEU A 25 6.180 0.539 -20.205 1.00 0.00 C ATOM 400 CD2 LEU A 25 4.096 0.916 -18.874 1.00 0.00 C ATOM 0 H LEU A 25 6.784 3.021 -16.953 1.00 0.00 H new ATOM 0 HA LEU A 25 4.697 1.173 -16.359 1.00 0.00 H new ATOM 0 HB2 LEU A 25 7.362 0.970 -17.793 1.00 0.00 H new ATOM 0 HB3 LEU A 25 6.243 -0.374 -17.672 1.00 0.00 H new ATOM 0 HG LEU A 25 5.731 2.275 -19.052 1.00 0.00 H new ATOM 0 HD11 LEU A 25 5.657 0.896 -21.092 1.00 0.00 H new ATOM 0 HD12 LEU A 25 7.238 0.791 -20.281 1.00 0.00 H new ATOM 0 HD13 LEU A 25 6.069 -0.543 -20.129 1.00 0.00 H new ATOM 0 HD21 LEU A 25 3.602 1.267 -19.780 1.00 0.00 H new ATOM 0 HD22 LEU A 25 3.934 -0.156 -18.765 1.00 0.00 H new ATOM 0 HD23 LEU A 25 3.681 1.435 -18.010 1.00 0.00 H new ATOM 412 N LEU A 26 7.635 0.712 -14.920 1.00 0.00 N ATOM 413 CA LEU A 26 8.309 0.018 -13.828 1.00 0.00 C ATOM 414 C LEU A 26 7.502 0.121 -12.537 1.00 0.00 C ATOM 415 O LEU A 26 7.319 -0.868 -11.826 1.00 0.00 O ATOM 416 CB LEU A 26 9.709 0.597 -13.615 1.00 0.00 C ATOM 417 CG LEU A 26 10.788 0.119 -14.588 1.00 0.00 C ATOM 418 CD1 LEU A 26 12.117 0.793 -14.283 1.00 0.00 C ATOM 419 CD2 LEU A 26 10.928 -1.395 -14.525 1.00 0.00 C ATOM 0 H LEU A 26 8.220 1.382 -15.419 1.00 0.00 H new ATOM 0 HA LEU A 26 8.395 -1.034 -14.098 1.00 0.00 H new ATOM 0 HB2 LEU A 26 9.645 1.683 -13.680 1.00 0.00 H new ATOM 0 HB3 LEU A 26 10.030 0.356 -12.601 1.00 0.00 H new ATOM 0 HG LEU A 26 10.488 0.395 -15.599 1.00 0.00 H new ATOM 0 HD11 LEU A 26 12.873 0.441 -14.985 1.00 0.00 H new ATOM 0 HD12 LEU A 26 12.008 1.873 -14.379 1.00 0.00 H new ATOM 0 HD13 LEU A 26 12.424 0.548 -13.266 1.00 0.00 H new ATOM 0 HD21 LEU A 26 11.700 -1.718 -15.223 1.00 0.00 H new ATOM 0 HD22 LEU A 26 11.206 -1.693 -13.514 1.00 0.00 H new ATOM 0 HD23 LEU A 26 9.979 -1.860 -14.792 1.00 0.00 H new ATOM 431 N LYS A 27 7.021 1.323 -12.241 1.00 0.00 N ATOM 432 CA LYS A 27 6.230 1.556 -11.038 1.00 0.00 C ATOM 433 C LYS A 27 5.038 0.606 -10.978 1.00 0.00 C ATOM 434 O LYS A 27 4.780 -0.015 -9.948 1.00 0.00 O ATOM 435 CB LYS A 27 5.743 3.006 -10.995 1.00 0.00 C ATOM 436 CG LYS A 27 6.638 3.924 -10.180 1.00 0.00 C ATOM 437 CD LYS A 27 6.959 5.203 -10.935 1.00 0.00 C ATOM 438 CE LYS A 27 6.048 6.345 -10.510 1.00 0.00 C ATOM 439 NZ LYS A 27 6.822 7.547 -10.094 1.00 0.00 N ATOM 0 H LYS A 27 7.165 2.152 -12.818 1.00 0.00 H new ATOM 0 HA LYS A 27 6.866 1.368 -10.173 1.00 0.00 H new ATOM 0 HB2 LYS A 27 5.676 3.388 -12.014 1.00 0.00 H new ATOM 0 HB3 LYS A 27 4.736 3.030 -10.578 1.00 0.00 H new ATOM 0 HG2 LYS A 27 6.148 4.170 -9.238 1.00 0.00 H new ATOM 0 HG3 LYS A 27 7.564 3.405 -9.932 1.00 0.00 H new ATOM 0 HD2 LYS A 27 7.998 5.480 -10.758 1.00 0.00 H new ATOM 0 HD3 LYS A 27 6.853 5.031 -12.006 1.00 0.00 H new ATOM 0 HE2 LYS A 27 5.386 6.607 -11.335 1.00 0.00 H new ATOM 0 HE3 LYS A 27 5.415 6.017 -9.685 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 6.165 8.302 -9.812 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 7.436 7.304 -9.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 7.407 7.876 -10.889 1.00 0.00 H new ATOM 453 N GLN A 28 4.316 0.499 -12.089 1.00 0.00 N ATOM 454 CA GLN A 28 3.152 -0.376 -12.162 1.00 0.00 C ATOM 455 C GLN A 28 3.518 -1.803 -11.769 1.00 0.00 C ATOM 456 O GLN A 28 2.799 -2.453 -11.011 1.00 0.00 O ATOM 457 CB GLN A 28 2.562 -0.358 -13.573 1.00 0.00 C ATOM 458 CG GLN A 28 1.501 0.712 -13.775 1.00 0.00 C ATOM 459 CD GLN A 28 0.497 0.342 -14.850 1.00 0.00 C ATOM 460 OE1 GLN A 28 -0.541 -0.256 -14.566 1.00 0.00 O ATOM 461 NE2 GLN A 28 0.802 0.698 -16.092 1.00 0.00 N ATOM 0 H GLN A 28 4.517 1.007 -12.950 1.00 0.00 H new ATOM 0 HA GLN A 28 2.406 -0.006 -11.459 1.00 0.00 H new ATOM 0 HB2 GLN A 28 3.366 -0.201 -14.292 1.00 0.00 H new ATOM 0 HB3 GLN A 28 2.128 -1.334 -13.789 1.00 0.00 H new ATOM 0 HG2 GLN A 28 0.976 0.880 -12.835 1.00 0.00 H new ATOM 0 HG3 GLN A 28 1.984 1.652 -14.042 1.00 0.00 H new ATOM 0 HE21 GLN A 28 1.674 1.193 -16.281 1.00 0.00 H new ATOM 0 HE22 GLN A 28 0.165 0.477 -16.857 1.00 0.00 H new ATOM 470 N ASP A 29 4.641 -2.285 -12.291 1.00 0.00 N ATOM 471 CA ASP A 29 5.104 -3.636 -11.994 1.00 0.00 C ATOM 472 C ASP A 29 5.417 -3.789 -10.509 1.00 0.00 C ATOM 473 O ASP A 29 5.037 -4.779 -9.883 1.00 0.00 O ATOM 474 CB ASP A 29 6.343 -3.969 -12.827 1.00 0.00 C ATOM 475 CG ASP A 29 6.038 -4.055 -14.309 1.00 0.00 C ATOM 476 OD1 ASP A 29 6.959 -4.382 -15.087 1.00 0.00 O ATOM 477 OD2 ASP A 29 4.878 -3.796 -14.692 1.00 0.00 O ATOM 0 H ASP A 29 5.247 -1.760 -12.922 1.00 0.00 H new ATOM 0 HA ASP A 29 4.306 -4.332 -12.252 1.00 0.00 H new ATOM 0 HB2 ASP A 29 7.105 -3.208 -12.659 1.00 0.00 H new ATOM 0 HB3 ASP A 29 6.760 -4.918 -12.489 1.00 0.00 H new ATOM 482 N ILE A 30 6.114 -2.804 -9.952 1.00 0.00 N ATOM 483 CA ILE A 30 6.479 -2.830 -8.541 1.00 0.00 C ATOM 484 C ILE A 30 5.251 -3.029 -7.659 1.00 0.00 C ATOM 485 O ILE A 30 5.335 -3.624 -6.584 1.00 0.00 O ATOM 486 CB ILE A 30 7.194 -1.532 -8.121 1.00 0.00 C ATOM 487 CG1 ILE A 30 8.468 -1.336 -8.945 1.00 0.00 C ATOM 488 CG2 ILE A 30 7.518 -1.564 -6.635 1.00 0.00 C ATOM 489 CD1 ILE A 30 8.883 0.112 -9.080 1.00 0.00 C ATOM 0 H ILE A 30 6.437 -1.978 -10.456 1.00 0.00 H new ATOM 0 HA ILE A 30 7.160 -3.670 -8.406 1.00 0.00 H new ATOM 0 HB ILE A 30 6.528 -0.690 -8.310 1.00 0.00 H new ATOM 0 HG12 ILE A 30 9.280 -1.897 -8.482 1.00 0.00 H new ATOM 0 HG13 ILE A 30 8.316 -1.756 -9.939 1.00 0.00 H new ATOM 0 HG21 ILE A 30 8.023 -0.640 -6.353 1.00 0.00 H new ATOM 0 HG22 ILE A 30 6.595 -1.662 -6.063 1.00 0.00 H new ATOM 0 HG23 ILE A 30 8.168 -2.413 -6.423 1.00 0.00 H new ATOM 0 HD11 ILE A 30 9.793 0.176 -9.676 1.00 0.00 H new ATOM 0 HD12 ILE A 30 8.088 0.674 -9.570 1.00 0.00 H new ATOM 0 HD13 ILE A 30 9.067 0.531 -8.091 1.00 0.00 H new ATOM 501 N LEU A 31 4.110 -2.530 -8.122 1.00 0.00 N ATOM 502 CA LEU A 31 2.863 -2.655 -7.376 1.00 0.00 C ATOM 503 C LEU A 31 2.277 -4.056 -7.525 1.00 0.00 C ATOM 504 O LEU A 31 1.584 -4.546 -6.634 1.00 0.00 O ATOM 505 CB LEU A 31 1.851 -1.614 -7.859 1.00 0.00 C ATOM 506 CG LEU A 31 2.251 -0.150 -7.666 1.00 0.00 C ATOM 507 CD1 LEU A 31 1.090 0.770 -8.012 1.00 0.00 C ATOM 508 CD2 LEU A 31 2.717 0.091 -6.237 1.00 0.00 C ATOM 0 H LEU A 31 4.023 -2.035 -9.010 1.00 0.00 H new ATOM 0 HA LEU A 31 3.080 -2.482 -6.322 1.00 0.00 H new ATOM 0 HB2 LEU A 31 1.665 -1.782 -8.920 1.00 0.00 H new ATOM 0 HB3 LEU A 31 0.908 -1.784 -7.339 1.00 0.00 H new ATOM 0 HG LEU A 31 3.078 0.073 -8.340 1.00 0.00 H new ATOM 0 HD11 LEU A 31 1.393 1.807 -7.869 1.00 0.00 H new ATOM 0 HD12 LEU A 31 0.801 0.616 -9.052 1.00 0.00 H new ATOM 0 HD13 LEU A 31 0.243 0.546 -7.364 1.00 0.00 H new ATOM 0 HD21 LEU A 31 2.998 1.137 -6.117 1.00 0.00 H new ATOM 0 HD22 LEU A 31 1.909 -0.149 -5.546 1.00 0.00 H new ATOM 0 HD23 LEU A 31 3.578 -0.542 -6.023 1.00 0.00 H new ATOM 520 N GLU A 32 2.564 -4.695 -8.655 1.00 0.00 N ATOM 521 CA GLU A 32 2.067 -6.040 -8.918 1.00 0.00 C ATOM 522 C GLU A 32 2.919 -7.085 -8.202 1.00 0.00 C ATOM 523 O GLU A 32 2.454 -8.186 -7.911 1.00 0.00 O ATOM 524 CB GLU A 32 2.056 -6.319 -10.422 1.00 0.00 C ATOM 525 CG GLU A 32 1.055 -7.384 -10.837 1.00 0.00 C ATOM 526 CD GLU A 32 1.404 -8.027 -12.165 1.00 0.00 C ATOM 527 OE1 GLU A 32 0.851 -9.106 -12.465 1.00 0.00 O ATOM 528 OE2 GLU A 32 2.229 -7.451 -12.905 1.00 0.00 O ATOM 0 H GLU A 32 3.137 -4.303 -9.402 1.00 0.00 H new ATOM 0 HA GLU A 32 1.048 -6.104 -8.537 1.00 0.00 H new ATOM 0 HB2 GLU A 32 1.830 -5.394 -10.953 1.00 0.00 H new ATOM 0 HB3 GLU A 32 3.054 -6.630 -10.733 1.00 0.00 H new ATOM 0 HG2 GLU A 32 1.008 -8.153 -10.066 1.00 0.00 H new ATOM 0 HG3 GLU A 32 0.062 -6.938 -10.903 1.00 0.00 H new ATOM 535 N ALA A 33 4.169 -6.730 -7.923 1.00 0.00 N ATOM 536 CA ALA A 33 5.085 -7.635 -7.240 1.00 0.00 C ATOM 537 C ALA A 33 4.785 -7.697 -5.747 1.00 0.00 C ATOM 538 O ALA A 33 4.833 -8.766 -5.137 1.00 0.00 O ATOM 539 CB ALA A 33 6.525 -7.201 -7.473 1.00 0.00 C ATOM 0 H ALA A 33 4.570 -5.823 -8.159 1.00 0.00 H new ATOM 0 HA ALA A 33 4.945 -8.634 -7.653 1.00 0.00 H new ATOM 0 HB1 ALA A 33 7.199 -7.885 -6.958 1.00 0.00 H new ATOM 0 HB2 ALA A 33 6.741 -7.215 -8.541 1.00 0.00 H new ATOM 0 HB3 ALA A 33 6.668 -6.192 -7.087 1.00 0.00 H new ATOM 545 N THR A 34 4.475 -6.545 -5.161 1.00 0.00 N ATOM 546 CA THR A 34 4.168 -6.468 -3.738 1.00 0.00 C ATOM 547 C THR A 34 3.023 -7.405 -3.371 1.00 0.00 C ATOM 548 O THR A 34 2.880 -7.803 -2.216 1.00 0.00 O ATOM 549 CB THR A 34 3.797 -5.033 -3.320 1.00 0.00 C ATOM 550 OG1 THR A 34 3.797 -4.924 -1.892 1.00 0.00 O ATOM 551 CG2 THR A 34 2.429 -4.648 -3.863 1.00 0.00 C ATOM 0 H THR A 34 4.430 -5.651 -5.651 1.00 0.00 H new ATOM 0 HA THR A 34 5.068 -6.772 -3.204 1.00 0.00 H new ATOM 0 HB THR A 34 4.540 -4.353 -3.736 1.00 0.00 H new ATOM 0 HG1 THR A 34 3.410 -4.063 -1.630 1.00 0.00 H new ATOM 0 HG21 THR A 34 2.188 -3.630 -3.555 1.00 0.00 H new ATOM 0 HG22 THR A 34 2.441 -4.704 -4.951 1.00 0.00 H new ATOM 0 HG23 THR A 34 1.676 -5.333 -3.472 1.00 0.00 H new ATOM 559 N ALA A 35 2.210 -7.755 -4.363 1.00 0.00 N ATOM 560 CA ALA A 35 1.079 -8.647 -4.144 1.00 0.00 C ATOM 561 C ALA A 35 1.549 -10.043 -3.747 1.00 0.00 C ATOM 562 O ALA A 35 0.852 -10.763 -3.032 1.00 0.00 O ATOM 563 CB ALA A 35 0.212 -8.716 -5.393 1.00 0.00 C ATOM 0 H ALA A 35 2.314 -7.434 -5.326 1.00 0.00 H new ATOM 0 HA ALA A 35 0.485 -8.245 -3.323 1.00 0.00 H new ATOM 0 HB1 ALA A 35 -0.629 -9.386 -5.215 1.00 0.00 H new ATOM 0 HB2 ALA A 35 -0.161 -7.720 -5.632 1.00 0.00 H new ATOM 0 HB3 ALA A 35 0.805 -9.091 -6.227 1.00 0.00 H new ATOM 569 N ASP A 36 2.734 -10.418 -4.216 1.00 0.00 N ATOM 570 CA ASP A 36 3.298 -11.727 -3.910 1.00 0.00 C ATOM 571 C ASP A 36 3.862 -11.758 -2.493 1.00 0.00 C ATOM 572 O ASP A 36 3.524 -12.636 -1.698 1.00 0.00 O ATOM 573 CB ASP A 36 4.393 -12.083 -4.916 1.00 0.00 C ATOM 574 CG ASP A 36 4.666 -13.573 -4.972 1.00 0.00 C ATOM 575 OD1 ASP A 36 3.697 -14.350 -5.107 1.00 0.00 O ATOM 576 OD2 ASP A 36 5.849 -13.963 -4.882 1.00 0.00 O ATOM 0 H ASP A 36 3.323 -9.834 -4.810 1.00 0.00 H new ATOM 0 HA ASP A 36 2.498 -12.465 -3.980 1.00 0.00 H new ATOM 0 HB2 ASP A 36 4.101 -11.733 -5.906 1.00 0.00 H new ATOM 0 HB3 ASP A 36 5.311 -11.558 -4.650 1.00 0.00 H new ATOM 581 N ILE A 37 4.724 -10.795 -2.184 1.00 0.00 N ATOM 582 CA ILE A 37 5.334 -10.712 -0.863 1.00 0.00 C ATOM 583 C ILE A 37 4.273 -10.626 0.229 1.00 0.00 C ATOM 584 O ILE A 37 4.291 -11.398 1.188 1.00 0.00 O ATOM 585 CB ILE A 37 6.270 -9.493 -0.751 1.00 0.00 C ATOM 586 CG1 ILE A 37 7.308 -9.515 -1.875 1.00 0.00 C ATOM 587 CG2 ILE A 37 6.953 -9.474 0.609 1.00 0.00 C ATOM 588 CD1 ILE A 37 8.263 -8.342 -1.838 1.00 0.00 C ATOM 0 H ILE A 37 5.015 -10.062 -2.830 1.00 0.00 H new ATOM 0 HA ILE A 37 5.918 -11.622 -0.727 1.00 0.00 H new ATOM 0 HB ILE A 37 5.675 -8.585 -0.850 1.00 0.00 H new ATOM 0 HG12 ILE A 37 7.880 -10.441 -1.813 1.00 0.00 H new ATOM 0 HG13 ILE A 37 6.792 -9.523 -2.835 1.00 0.00 H new ATOM 0 HG21 ILE A 37 7.611 -8.607 0.674 1.00 0.00 H new ATOM 0 HG22 ILE A 37 6.199 -9.416 1.394 1.00 0.00 H new ATOM 0 HG23 ILE A 37 7.539 -10.385 0.735 1.00 0.00 H new ATOM 0 HD11 ILE A 37 8.971 -8.423 -2.663 1.00 0.00 H new ATOM 0 HD12 ILE A 37 7.701 -7.412 -1.931 1.00 0.00 H new ATOM 0 HD13 ILE A 37 8.806 -8.345 -0.893 1.00 0.00 H new ATOM 600 N ILE A 38 3.350 -9.683 0.076 1.00 0.00 N ATOM 601 CA ILE A 38 2.279 -9.499 1.048 1.00 0.00 C ATOM 602 C ILE A 38 1.455 -10.772 1.206 1.00 0.00 C ATOM 603 O ILE A 38 0.979 -11.085 2.298 1.00 0.00 O ATOM 604 CB ILE A 38 1.344 -8.343 0.643 1.00 0.00 C ATOM 605 CG1 ILE A 38 2.126 -7.030 0.566 1.00 0.00 C ATOM 606 CG2 ILE A 38 0.192 -8.223 1.629 1.00 0.00 C ATOM 607 CD1 ILE A 38 1.353 -5.904 -0.086 1.00 0.00 C ATOM 0 H ILE A 38 3.322 -9.035 -0.711 1.00 0.00 H new ATOM 0 HA ILE A 38 2.754 -9.256 1.999 1.00 0.00 H new ATOM 0 HB ILE A 38 0.931 -8.557 -0.343 1.00 0.00 H new ATOM 0 HG12 ILE A 38 2.413 -6.728 1.573 1.00 0.00 H new ATOM 0 HG13 ILE A 38 3.048 -7.197 0.009 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -0.459 -7.402 1.329 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -0.377 -9.153 1.639 1.00 0.00 H new ATOM 0 HG23 ILE A 38 0.586 -8.028 2.627 1.00 0.00 H new ATOM 0 HD11 ILE A 38 1.968 -5.004 -0.106 1.00 0.00 H new ATOM 0 HD12 ILE A 38 1.089 -6.186 -1.105 1.00 0.00 H new ATOM 0 HD13 ILE A 38 0.444 -5.709 0.483 1.00 0.00 H new ATOM 619 N LEU A 39 1.291 -11.504 0.109 1.00 0.00 N ATOM 620 CA LEU A 39 0.525 -12.746 0.126 1.00 0.00 C ATOM 621 C LEU A 39 1.208 -13.795 0.998 1.00 0.00 C ATOM 622 O LEU A 39 0.567 -14.726 1.485 1.00 0.00 O ATOM 623 CB LEU A 39 0.354 -13.281 -1.297 1.00 0.00 C ATOM 624 CG LEU A 39 -1.034 -13.112 -1.915 1.00 0.00 C ATOM 625 CD1 LEU A 39 -0.951 -13.157 -3.433 1.00 0.00 C ATOM 626 CD2 LEU A 39 -1.982 -14.185 -1.399 1.00 0.00 C ATOM 0 H LEU A 39 1.678 -11.259 -0.803 1.00 0.00 H new ATOM 0 HA LEU A 39 -0.457 -12.534 0.548 1.00 0.00 H new ATOM 0 HB2 LEU A 39 1.079 -12.783 -1.941 1.00 0.00 H new ATOM 0 HB3 LEU A 39 0.603 -14.342 -1.297 1.00 0.00 H new ATOM 0 HG LEU A 39 -1.425 -12.138 -1.621 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -1.948 -13.035 -3.856 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -0.306 -12.352 -3.786 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -0.539 -14.116 -3.747 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -2.965 -14.049 -1.850 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -1.595 -15.169 -1.662 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -2.066 -14.106 -0.315 1.00 0.00 H new ATOM 638 N LYS A 40 2.513 -13.636 1.192 1.00 0.00 N ATOM 639 CA LYS A 40 3.284 -14.567 2.008 1.00 0.00 C ATOM 640 C LYS A 40 3.152 -14.229 3.490 1.00 0.00 C ATOM 641 O LYS A 40 2.911 -15.108 4.318 1.00 0.00 O ATOM 642 CB LYS A 40 4.757 -14.538 1.596 1.00 0.00 C ATOM 643 CG LYS A 40 5.146 -15.660 0.649 1.00 0.00 C ATOM 644 CD LYS A 40 6.453 -15.360 -0.065 1.00 0.00 C ATOM 645 CE LYS A 40 6.389 -15.751 -1.533 1.00 0.00 C ATOM 646 NZ LYS A 40 6.049 -17.190 -1.710 1.00 0.00 N ATOM 0 H LYS A 40 3.059 -12.871 0.795 1.00 0.00 H new ATOM 0 HA LYS A 40 2.887 -15.569 1.845 1.00 0.00 H new ATOM 0 HB2 LYS A 40 4.974 -13.581 1.121 1.00 0.00 H new ATOM 0 HB3 LYS A 40 5.377 -14.597 2.491 1.00 0.00 H new ATOM 0 HG2 LYS A 40 5.241 -16.592 1.207 1.00 0.00 H new ATOM 0 HG3 LYS A 40 4.355 -15.808 -0.086 1.00 0.00 H new ATOM 0 HD2 LYS A 40 6.679 -14.297 0.020 1.00 0.00 H new ATOM 0 HD3 LYS A 40 7.266 -15.899 0.421 1.00 0.00 H new ATOM 0 HE2 LYS A 40 5.645 -15.137 -2.040 1.00 0.00 H new ATOM 0 HE3 LYS A 40 7.349 -15.544 -2.006 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 6.164 -17.453 -2.709 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 6.682 -17.771 -1.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 5.063 -17.352 -1.420 1.00 0.00 H new ATOM 660 N VAL A 41 3.311 -12.951 3.817 1.00 0.00 N ATOM 661 CA VAL A 41 3.208 -12.497 5.199 1.00 0.00 C ATOM 662 C VAL A 41 1.757 -12.483 5.665 1.00 0.00 C ATOM 663 O VAL A 41 1.477 -12.562 6.861 1.00 0.00 O ATOM 664 CB VAL A 41 3.805 -11.087 5.373 1.00 0.00 C ATOM 665 CG1 VAL A 41 5.265 -11.070 4.949 1.00 0.00 C ATOM 666 CG2 VAL A 41 3.000 -10.067 4.582 1.00 0.00 C ATOM 0 H VAL A 41 3.512 -12.211 3.144 1.00 0.00 H new ATOM 0 HA VAL A 41 3.776 -13.201 5.807 1.00 0.00 H new ATOM 0 HB VAL A 41 3.754 -10.817 6.428 1.00 0.00 H new ATOM 0 HG11 VAL A 41 5.670 -10.066 5.079 1.00 0.00 H new ATOM 0 HG12 VAL A 41 5.830 -11.771 5.563 1.00 0.00 H new ATOM 0 HG13 VAL A 41 5.343 -11.360 3.901 1.00 0.00 H new ATOM 0 HG21 VAL A 41 3.435 -9.077 4.716 1.00 0.00 H new ATOM 0 HG22 VAL A 41 3.017 -10.331 3.525 1.00 0.00 H new ATOM 0 HG23 VAL A 41 1.970 -10.062 4.938 1.00 0.00 H new ATOM 676 N GLY A 42 0.835 -12.384 4.712 1.00 0.00 N ATOM 677 CA GLY A 42 -0.577 -12.362 5.046 1.00 0.00 C ATOM 678 C GLY A 42 -1.019 -11.028 5.615 1.00 0.00 C ATOM 679 O GLY A 42 -1.891 -10.974 6.482 1.00 0.00 O ATOM 0 H GLY A 42 1.041 -12.319 3.715 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -1.162 -12.584 4.153 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -0.788 -13.150 5.769 1.00 0.00 H new ATOM 683 N HIS A 43 -0.414 -9.950 5.128 1.00 0.00 N ATOM 684 CA HIS A 43 -0.749 -8.609 5.595 1.00 0.00 C ATOM 685 C HIS A 43 -0.014 -7.550 4.779 1.00 0.00 C ATOM 686 O HIS A 43 1.142 -7.736 4.400 1.00 0.00 O ATOM 687 CB HIS A 43 -0.402 -8.460 7.076 1.00 0.00 C ATOM 688 CG HIS A 43 1.071 -8.460 7.349 1.00 0.00 C ATOM 689 ND1 HIS A 43 1.883 -7.374 7.095 1.00 0.00 N ATOM 690 CD2 HIS A 43 1.878 -9.420 7.858 1.00 0.00 C ATOM 691 CE1 HIS A 43 3.125 -7.668 7.434 1.00 0.00 C ATOM 692 NE2 HIS A 43 3.149 -8.903 7.900 1.00 0.00 N ATOM 0 H HIS A 43 0.310 -9.978 4.411 1.00 0.00 H new ATOM 0 HA HIS A 43 -1.821 -8.463 5.465 1.00 0.00 H new ATOM 0 HB2 HIS A 43 -0.832 -7.531 7.450 1.00 0.00 H new ATOM 0 HB3 HIS A 43 -0.866 -9.274 7.633 1.00 0.00 H new ATOM 0 HD2 HIS A 43 1.578 -10.409 8.173 1.00 0.00 H new ATOM 0 HE1 HIS A 43 3.977 -7.010 7.345 1.00 0.00 H new ATOM 0 HE2 HIS A 43 3.978 -9.393 8.237 1.00 0.00 H new ATOM 700 N ASP A 44 -0.693 -6.440 4.511 1.00 0.00 N ATOM 701 CA ASP A 44 -0.104 -5.351 3.741 1.00 0.00 C ATOM 702 C ASP A 44 0.309 -4.200 4.653 1.00 0.00 C ATOM 703 O ASP A 44 0.041 -4.220 5.855 1.00 0.00 O ATOM 704 CB ASP A 44 -1.093 -4.851 2.686 1.00 0.00 C ATOM 705 CG ASP A 44 -2.314 -4.197 3.301 1.00 0.00 C ATOM 706 OD1 ASP A 44 -3.039 -3.488 2.571 1.00 0.00 O ATOM 707 OD2 ASP A 44 -2.546 -4.395 4.512 1.00 0.00 O ATOM 0 H ASP A 44 -1.652 -6.271 4.816 1.00 0.00 H new ATOM 0 HA ASP A 44 0.787 -5.733 3.242 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -0.592 -4.137 2.032 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -1.408 -5.687 2.062 1.00 0.00 H new ATOM 712 N PHE A 45 0.964 -3.199 4.075 1.00 0.00 N ATOM 713 CA PHE A 45 1.417 -2.041 4.837 1.00 0.00 C ATOM 714 C PHE A 45 0.647 -0.788 4.430 1.00 0.00 C ATOM 715 O PHE A 45 1.238 0.212 4.023 1.00 0.00 O ATOM 716 CB PHE A 45 2.917 -1.821 4.629 1.00 0.00 C ATOM 717 CG PHE A 45 3.727 -3.082 4.733 1.00 0.00 C ATOM 718 CD1 PHE A 45 4.241 -3.686 3.597 1.00 0.00 C ATOM 719 CD2 PHE A 45 3.973 -3.663 5.967 1.00 0.00 C ATOM 720 CE1 PHE A 45 4.988 -4.846 3.690 1.00 0.00 C ATOM 721 CE2 PHE A 45 4.719 -4.822 6.065 1.00 0.00 C ATOM 722 CZ PHE A 45 5.226 -5.415 4.925 1.00 0.00 C ATOM 0 H PHE A 45 1.193 -3.166 3.082 1.00 0.00 H new ATOM 0 HA PHE A 45 1.229 -2.236 5.893 1.00 0.00 H new ATOM 0 HB2 PHE A 45 3.078 -1.375 3.648 1.00 0.00 H new ATOM 0 HB3 PHE A 45 3.277 -1.105 5.368 1.00 0.00 H new ATOM 0 HD1 PHE A 45 4.056 -3.246 2.628 1.00 0.00 H new ATOM 0 HD2 PHE A 45 3.577 -3.205 6.862 1.00 0.00 H new ATOM 0 HE1 PHE A 45 5.385 -5.306 2.797 1.00 0.00 H new ATOM 0 HE2 PHE A 45 4.906 -5.264 7.033 1.00 0.00 H new ATOM 0 HZ PHE A 45 5.807 -6.322 5.000 1.00 0.00 H new ATOM 732 N SER A 46 -0.676 -0.851 4.542 1.00 0.00 N ATOM 733 CA SER A 46 -1.528 0.276 4.181 1.00 0.00 C ATOM 734 C SER A 46 -1.571 1.307 5.306 1.00 0.00 C ATOM 735 O SER A 46 -1.437 2.507 5.068 1.00 0.00 O ATOM 736 CB SER A 46 -2.944 -0.208 3.865 1.00 0.00 C ATOM 737 OG SER A 46 -3.842 0.882 3.747 1.00 0.00 O ATOM 0 H SER A 46 -1.181 -1.670 4.880 1.00 0.00 H new ATOM 0 HA SER A 46 -1.106 0.748 3.294 1.00 0.00 H new ATOM 0 HB2 SER A 46 -2.937 -0.780 2.937 1.00 0.00 H new ATOM 0 HB3 SER A 46 -3.286 -0.881 4.652 1.00 0.00 H new ATOM 0 HG SER A 46 -4.740 0.546 3.543 1.00 0.00 H new ATOM 743 N ASP A 47 -1.757 0.829 6.531 1.00 0.00 N ATOM 744 CA ASP A 47 -1.817 1.707 7.694 1.00 0.00 C ATOM 745 C ASP A 47 -0.606 2.634 7.737 1.00 0.00 C ATOM 746 O ASP A 47 0.530 2.181 7.879 1.00 0.00 O ATOM 747 CB ASP A 47 -1.889 0.882 8.979 1.00 0.00 C ATOM 748 CG ASP A 47 -3.295 0.808 9.542 1.00 0.00 C ATOM 749 OD1 ASP A 47 -3.652 1.677 10.364 1.00 0.00 O ATOM 750 OD2 ASP A 47 -4.039 -0.119 9.159 1.00 0.00 O ATOM 0 H ASP A 47 -1.869 -0.162 6.745 1.00 0.00 H new ATOM 0 HA ASP A 47 -2.717 2.317 7.613 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -1.527 -0.127 8.780 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -1.225 1.318 9.725 1.00 0.00 H new ATOM 755 N ALA A 48 -0.857 3.933 7.612 1.00 0.00 N ATOM 756 CA ALA A 48 0.212 4.923 7.638 1.00 0.00 C ATOM 757 C ALA A 48 0.994 4.853 8.945 1.00 0.00 C ATOM 758 O ALA A 48 2.137 5.303 9.019 1.00 0.00 O ATOM 759 CB ALA A 48 -0.357 6.320 7.435 1.00 0.00 C ATOM 0 H ALA A 48 -1.791 4.324 7.492 1.00 0.00 H new ATOM 0 HA ALA A 48 0.899 4.700 6.822 1.00 0.00 H new ATOM 0 HB1 ALA A 48 0.453 7.049 7.457 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -0.864 6.370 6.472 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -1.067 6.543 8.231 1.00 0.00 H new ATOM 765 N GLU A 49 0.370 4.288 9.973 1.00 0.00 N ATOM 766 CA GLU A 49 1.008 4.161 11.278 1.00 0.00 C ATOM 767 C GLU A 49 1.655 2.788 11.437 1.00 0.00 C ATOM 768 O GLU A 49 1.834 2.300 12.553 1.00 0.00 O ATOM 769 CB GLU A 49 -0.013 4.388 12.395 1.00 0.00 C ATOM 770 CG GLU A 49 -1.215 3.461 12.319 1.00 0.00 C ATOM 771 CD GLU A 49 -1.855 3.224 13.672 1.00 0.00 C ATOM 772 OE1 GLU A 49 -2.921 3.819 13.937 1.00 0.00 O ATOM 773 OE2 GLU A 49 -1.291 2.443 14.467 1.00 0.00 O ATOM 0 H GLU A 49 -0.577 3.911 9.928 1.00 0.00 H new ATOM 0 HA GLU A 49 1.787 4.921 11.348 1.00 0.00 H new ATOM 0 HB2 GLU A 49 0.479 4.253 13.358 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -0.358 5.421 12.356 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -1.955 3.886 11.641 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -0.906 2.506 11.895 1.00 0.00 H new ATOM 780 N TYR A 50 2.001 2.171 10.313 1.00 0.00 N ATOM 781 CA TYR A 50 2.625 0.853 10.326 1.00 0.00 C ATOM 782 C TYR A 50 3.127 0.475 8.936 1.00 0.00 C ATOM 783 O TYR A 50 2.697 -0.524 8.359 1.00 0.00 O ATOM 784 CB TYR A 50 1.633 -0.199 10.825 1.00 0.00 C ATOM 785 CG TYR A 50 2.244 -1.570 11.007 1.00 0.00 C ATOM 786 CD1 TYR A 50 1.622 -2.703 10.497 1.00 0.00 C ATOM 787 CD2 TYR A 50 3.444 -1.733 11.689 1.00 0.00 C ATOM 788 CE1 TYR A 50 2.176 -3.957 10.661 1.00 0.00 C ATOM 789 CE2 TYR A 50 4.006 -2.983 11.856 1.00 0.00 C ATOM 790 CZ TYR A 50 3.368 -4.092 11.341 1.00 0.00 C ATOM 791 OH TYR A 50 3.925 -5.340 11.507 1.00 0.00 O ATOM 0 H TYR A 50 1.860 2.562 9.382 1.00 0.00 H new ATOM 0 HA TYR A 50 3.478 0.889 11.004 1.00 0.00 H new ATOM 0 HB2 TYR A 50 1.213 0.131 11.775 1.00 0.00 H new ATOM 0 HB3 TYR A 50 0.806 -0.270 10.119 1.00 0.00 H new ATOM 0 HD1 TYR A 50 0.689 -2.601 9.963 1.00 0.00 H new ATOM 0 HD2 TYR A 50 3.945 -0.867 12.095 1.00 0.00 H new ATOM 0 HE1 TYR A 50 1.679 -4.827 10.259 1.00 0.00 H new ATOM 0 HE2 TYR A 50 4.940 -3.092 12.387 1.00 0.00 H new ATOM 0 HH TYR A 50 4.764 -5.260 12.007 1.00 0.00 H new ATOM 801 N ILE A 51 4.041 1.280 8.405 1.00 0.00 N ATOM 802 CA ILE A 51 4.604 1.029 7.084 1.00 0.00 C ATOM 803 C ILE A 51 6.096 0.722 7.172 1.00 0.00 C ATOM 804 O ILE A 51 6.943 1.519 6.768 1.00 0.00 O ATOM 805 CB ILE A 51 4.394 2.232 6.145 1.00 0.00 C ATOM 806 CG1 ILE A 51 2.910 2.598 6.075 1.00 0.00 C ATOM 807 CG2 ILE A 51 4.934 1.921 4.757 1.00 0.00 C ATOM 808 CD1 ILE A 51 2.617 3.758 5.150 1.00 0.00 C ATOM 0 H ILE A 51 4.407 2.111 8.869 1.00 0.00 H new ATOM 0 HA ILE A 51 4.080 0.164 6.677 1.00 0.00 H new ATOM 0 HB ILE A 51 4.942 3.086 6.544 1.00 0.00 H new ATOM 0 HG12 ILE A 51 2.345 1.727 5.743 1.00 0.00 H new ATOM 0 HG13 ILE A 51 2.557 2.844 7.076 1.00 0.00 H new ATOM 0 HG21 ILE A 51 4.778 2.781 4.105 1.00 0.00 H new ATOM 0 HG22 ILE A 51 6.000 1.703 4.822 1.00 0.00 H new ATOM 0 HG23 ILE A 51 4.411 1.056 4.348 1.00 0.00 H new ATOM 0 HD11 ILE A 51 1.546 3.962 5.150 1.00 0.00 H new ATOM 0 HD12 ILE A 51 3.155 4.642 5.493 1.00 0.00 H new ATOM 0 HD13 ILE A 51 2.939 3.508 4.139 1.00 0.00 H new ATOM 820 N PRO A 52 6.425 -0.461 7.710 1.00 0.00 N ATOM 821 CA PRO A 52 7.815 -0.903 7.861 1.00 0.00 C ATOM 822 C PRO A 52 8.472 -1.218 6.521 1.00 0.00 C ATOM 823 O PRO A 52 7.805 -1.640 5.575 1.00 0.00 O ATOM 824 CB PRO A 52 7.694 -2.171 8.709 1.00 0.00 C ATOM 825 CG PRO A 52 6.320 -2.678 8.439 1.00 0.00 C ATOM 826 CD PRO A 52 5.467 -1.460 8.212 1.00 0.00 C ATOM 0 HA PRO A 52 8.441 -0.132 8.310 1.00 0.00 H new ATOM 0 HB2 PRO A 52 8.449 -2.906 8.431 1.00 0.00 H new ATOM 0 HB3 PRO A 52 7.835 -1.954 9.768 1.00 0.00 H new ATOM 0 HG2 PRO A 52 6.309 -3.330 7.566 1.00 0.00 H new ATOM 0 HG3 PRO A 52 5.948 -3.264 9.279 1.00 0.00 H new ATOM 0 HD2 PRO A 52 4.674 -1.654 7.490 1.00 0.00 H new ATOM 0 HD3 PRO A 52 4.986 -1.129 9.133 1.00 0.00 H new ATOM 834 N LEU A 53 9.782 -1.011 6.447 1.00 0.00 N ATOM 835 CA LEU A 53 10.530 -1.274 5.222 1.00 0.00 C ATOM 836 C LEU A 53 11.962 -1.694 5.538 1.00 0.00 C ATOM 837 O LEU A 53 12.905 -0.911 5.419 1.00 0.00 O ATOM 838 CB LEU A 53 10.536 -0.033 4.328 1.00 0.00 C ATOM 839 CG LEU A 53 10.682 -0.287 2.827 1.00 0.00 C ATOM 840 CD1 LEU A 53 9.575 -1.203 2.331 1.00 0.00 C ATOM 841 CD2 LEU A 53 10.674 1.027 2.060 1.00 0.00 C ATOM 0 H LEU A 53 10.348 -0.662 7.220 1.00 0.00 H new ATOM 0 HA LEU A 53 10.039 -2.092 4.694 1.00 0.00 H new ATOM 0 HB2 LEU A 53 9.609 0.515 4.495 1.00 0.00 H new ATOM 0 HB3 LEU A 53 11.351 0.616 4.647 1.00 0.00 H new ATOM 0 HG LEU A 53 11.638 -0.780 2.653 1.00 0.00 H new ATOM 0 HD11 LEU A 53 9.695 -1.373 1.261 1.00 0.00 H new ATOM 0 HD12 LEU A 53 9.628 -2.156 2.858 1.00 0.00 H new ATOM 0 HD13 LEU A 53 8.607 -0.738 2.518 1.00 0.00 H new ATOM 0 HD21 LEU A 53 10.779 0.827 0.994 1.00 0.00 H new ATOM 0 HD22 LEU A 53 9.734 1.548 2.241 1.00 0.00 H new ATOM 0 HD23 LEU A 53 11.504 1.649 2.396 1.00 0.00 H new ATOM 853 N PRO A 54 12.131 -2.959 5.949 1.00 0.00 N ATOM 854 CA PRO A 54 13.445 -3.513 6.288 1.00 0.00 C ATOM 855 C PRO A 54 14.334 -3.689 5.062 1.00 0.00 C ATOM 856 O PRO A 54 14.002 -3.223 3.972 1.00 0.00 O ATOM 857 CB PRO A 54 13.109 -4.873 6.905 1.00 0.00 C ATOM 858 CG PRO A 54 11.792 -5.241 6.315 1.00 0.00 C ATOM 859 CD PRO A 54 11.052 -3.947 6.115 1.00 0.00 C ATOM 0 HA PRO A 54 14.005 -2.855 6.953 1.00 0.00 H new ATOM 0 HB2 PRO A 54 13.871 -5.615 6.667 1.00 0.00 H new ATOM 0 HB3 PRO A 54 13.053 -4.812 7.992 1.00 0.00 H new ATOM 0 HG2 PRO A 54 11.921 -5.767 5.369 1.00 0.00 H new ATOM 0 HG3 PRO A 54 11.240 -5.908 6.978 1.00 0.00 H new ATOM 0 HD2 PRO A 54 10.404 -3.986 5.239 1.00 0.00 H new ATOM 0 HD3 PRO A 54 10.418 -3.710 6.970 1.00 0.00 H new ATOM 867 N GLU A 55 15.463 -4.366 5.247 1.00 0.00 N ATOM 868 CA GLU A 55 16.399 -4.603 4.154 1.00 0.00 C ATOM 869 C GLU A 55 15.995 -5.835 3.350 1.00 0.00 C ATOM 870 O GLU A 55 16.379 -5.988 2.190 1.00 0.00 O ATOM 871 CB GLU A 55 17.818 -4.776 4.697 1.00 0.00 C ATOM 872 CG GLU A 55 18.844 -5.107 3.626 1.00 0.00 C ATOM 873 CD GLU A 55 20.270 -4.917 4.105 1.00 0.00 C ATOM 874 OE1 GLU A 55 20.940 -3.983 3.617 1.00 0.00 O ATOM 875 OE2 GLU A 55 20.716 -5.703 4.967 1.00 0.00 O ATOM 0 H GLU A 55 15.752 -4.760 6.143 1.00 0.00 H new ATOM 0 HA GLU A 55 16.375 -3.736 3.494 1.00 0.00 H new ATOM 0 HB2 GLU A 55 18.118 -3.859 5.204 1.00 0.00 H new ATOM 0 HB3 GLU A 55 17.817 -5.569 5.445 1.00 0.00 H new ATOM 0 HG2 GLU A 55 18.707 -6.139 3.304 1.00 0.00 H new ATOM 0 HG3 GLU A 55 18.670 -4.476 2.754 1.00 0.00 H new ATOM 882 N THR A 56 15.219 -6.714 3.975 1.00 0.00 N ATOM 883 CA THR A 56 14.764 -7.935 3.320 1.00 0.00 C ATOM 884 C THR A 56 13.660 -7.639 2.312 1.00 0.00 C ATOM 885 O THR A 56 13.695 -8.119 1.179 1.00 0.00 O ATOM 886 CB THR A 56 14.247 -8.962 4.344 1.00 0.00 C ATOM 887 OG1 THR A 56 12.980 -8.542 4.863 1.00 0.00 O ATOM 888 CG2 THR A 56 15.236 -9.133 5.487 1.00 0.00 C ATOM 0 H THR A 56 14.892 -6.604 4.935 1.00 0.00 H new ATOM 0 HA THR A 56 15.625 -8.354 2.799 1.00 0.00 H new ATOM 0 HB THR A 56 14.133 -9.920 3.837 1.00 0.00 H new ATOM 0 HG1 THR A 56 12.468 -9.326 5.151 1.00 0.00 H new ATOM 0 HG21 THR A 56 14.848 -9.863 6.197 1.00 0.00 H new ATOM 0 HG22 THR A 56 16.191 -9.481 5.093 1.00 0.00 H new ATOM 0 HG23 THR A 56 15.378 -8.177 5.991 1.00 0.00 H new ATOM 896 N VAL A 57 12.680 -6.845 2.731 1.00 0.00 N ATOM 897 CA VAL A 57 11.565 -6.483 1.863 1.00 0.00 C ATOM 898 C VAL A 57 12.052 -5.735 0.626 1.00 0.00 C ATOM 899 O VAL A 57 11.699 -6.083 -0.501 1.00 0.00 O ATOM 900 CB VAL A 57 10.536 -5.611 2.605 1.00 0.00 C ATOM 901 CG1 VAL A 57 9.424 -5.178 1.662 1.00 0.00 C ATOM 902 CG2 VAL A 57 9.969 -6.359 3.803 1.00 0.00 C ATOM 0 H VAL A 57 12.635 -6.440 3.666 1.00 0.00 H new ATOM 0 HA VAL A 57 11.087 -7.414 1.557 1.00 0.00 H new ATOM 0 HB VAL A 57 11.040 -4.716 2.969 1.00 0.00 H new ATOM 0 HG11 VAL A 57 8.706 -4.563 2.204 1.00 0.00 H new ATOM 0 HG12 VAL A 57 9.848 -4.602 0.840 1.00 0.00 H new ATOM 0 HG13 VAL A 57 8.920 -6.059 1.265 1.00 0.00 H new ATOM 0 HG21 VAL A 57 9.243 -5.728 4.316 1.00 0.00 H new ATOM 0 HG22 VAL A 57 9.480 -7.272 3.464 1.00 0.00 H new ATOM 0 HG23 VAL A 57 10.777 -6.614 4.489 1.00 0.00 H new ATOM 912 N ARG A 58 12.864 -4.706 0.846 1.00 0.00 N ATOM 913 CA ARG A 58 13.398 -3.908 -0.251 1.00 0.00 C ATOM 914 C ARG A 58 14.051 -4.799 -1.304 1.00 0.00 C ATOM 915 O ARG A 58 13.867 -4.595 -2.505 1.00 0.00 O ATOM 916 CB ARG A 58 14.416 -2.895 0.277 1.00 0.00 C ATOM 917 CG ARG A 58 14.148 -1.469 -0.177 1.00 0.00 C ATOM 918 CD ARG A 58 15.262 -0.529 0.253 1.00 0.00 C ATOM 919 NE ARG A 58 14.751 0.628 0.982 1.00 0.00 N ATOM 920 CZ ARG A 58 15.441 1.750 1.158 1.00 0.00 C ATOM 921 NH1 ARG A 58 16.664 1.865 0.658 1.00 0.00 N ATOM 922 NH2 ARG A 58 14.908 2.760 1.834 1.00 0.00 N ATOM 0 H ARG A 58 13.166 -4.406 1.773 1.00 0.00 H new ATOM 0 HA ARG A 58 12.570 -3.373 -0.716 1.00 0.00 H new ATOM 0 HB2 ARG A 58 14.416 -2.927 1.367 1.00 0.00 H new ATOM 0 HB3 ARG A 58 15.413 -3.190 -0.050 1.00 0.00 H new ATOM 0 HG2 ARG A 58 14.048 -1.444 -1.262 1.00 0.00 H new ATOM 0 HG3 ARG A 58 13.200 -1.126 0.238 1.00 0.00 H new ATOM 0 HD2 ARG A 58 15.970 -1.069 0.881 1.00 0.00 H new ATOM 0 HD3 ARG A 58 15.810 -0.190 -0.626 1.00 0.00 H new ATOM 0 HE ARG A 58 13.813 0.572 1.378 1.00 0.00 H new ATOM 0 HH11 ARG A 58 17.077 1.091 0.137 1.00 0.00 H new ATOM 0 HH12 ARG A 58 17.192 2.727 0.794 1.00 0.00 H new ATOM 0 HH21 ARG A 58 13.967 2.676 2.219 1.00 0.00 H new ATOM 0 HH22 ARG A 58 15.439 3.620 1.968 1.00 0.00 H new ATOM 936 N LEU A 59 14.813 -5.786 -0.847 1.00 0.00 N ATOM 937 CA LEU A 59 15.493 -6.709 -1.749 1.00 0.00 C ATOM 938 C LEU A 59 14.502 -7.678 -2.386 1.00 0.00 C ATOM 939 O LEU A 59 14.600 -7.991 -3.572 1.00 0.00 O ATOM 940 CB LEU A 59 16.573 -7.487 -0.995 1.00 0.00 C ATOM 941 CG LEU A 59 17.478 -8.376 -1.849 1.00 0.00 C ATOM 942 CD1 LEU A 59 18.074 -7.582 -3.000 1.00 0.00 C ATOM 943 CD2 LEU A 59 18.579 -8.991 -0.996 1.00 0.00 C ATOM 0 H LEU A 59 14.976 -5.968 0.143 1.00 0.00 H new ATOM 0 HA LEU A 59 15.961 -6.125 -2.541 1.00 0.00 H new ATOM 0 HB2 LEU A 59 17.199 -6.774 -0.459 1.00 0.00 H new ATOM 0 HB3 LEU A 59 16.087 -8.111 -0.245 1.00 0.00 H new ATOM 0 HG LEU A 59 16.875 -9.183 -2.266 1.00 0.00 H new ATOM 0 HD11 LEU A 59 18.715 -8.231 -3.596 1.00 0.00 H new ATOM 0 HD12 LEU A 59 17.272 -7.190 -3.625 1.00 0.00 H new ATOM 0 HD13 LEU A 59 18.663 -6.755 -2.605 1.00 0.00 H new ATOM 0 HD21 LEU A 59 19.214 -9.621 -1.620 1.00 0.00 H new ATOM 0 HD22 LEU A 59 19.180 -8.198 -0.551 1.00 0.00 H new ATOM 0 HD23 LEU A 59 18.133 -9.595 -0.206 1.00 0.00 H new ATOM 955 N ALA A 60 13.548 -8.148 -1.590 1.00 0.00 N ATOM 956 CA ALA A 60 12.536 -9.078 -2.077 1.00 0.00 C ATOM 957 C ALA A 60 11.747 -8.474 -3.234 1.00 0.00 C ATOM 958 O ALA A 60 11.475 -9.145 -4.231 1.00 0.00 O ATOM 959 CB ALA A 60 11.599 -9.477 -0.947 1.00 0.00 C ATOM 0 H ALA A 60 13.454 -7.900 -0.605 1.00 0.00 H new ATOM 0 HA ALA A 60 13.044 -9.970 -2.445 1.00 0.00 H new ATOM 0 HB1 ALA A 60 10.849 -10.171 -1.325 1.00 0.00 H new ATOM 0 HB2 ALA A 60 12.171 -9.957 -0.153 1.00 0.00 H new ATOM 0 HB3 ALA A 60 11.105 -8.589 -0.553 1.00 0.00 H new ATOM 965 N LEU A 61 11.380 -7.205 -3.095 1.00 0.00 N ATOM 966 CA LEU A 61 10.620 -6.511 -4.128 1.00 0.00 C ATOM 967 C LEU A 61 11.497 -6.213 -5.341 1.00 0.00 C ATOM 968 O LEU A 61 11.034 -6.259 -6.481 1.00 0.00 O ATOM 969 CB LEU A 61 10.038 -5.210 -3.574 1.00 0.00 C ATOM 970 CG LEU A 61 8.663 -4.808 -4.108 1.00 0.00 C ATOM 971 CD1 LEU A 61 8.657 -4.822 -5.629 1.00 0.00 C ATOM 972 CD2 LEU A 61 7.586 -5.733 -3.560 1.00 0.00 C ATOM 0 H LEU A 61 11.597 -6.636 -2.277 1.00 0.00 H new ATOM 0 HA LEU A 61 9.804 -7.161 -4.443 1.00 0.00 H new ATOM 0 HB2 LEU A 61 9.973 -5.298 -2.489 1.00 0.00 H new ATOM 0 HB3 LEU A 61 10.738 -4.403 -3.787 1.00 0.00 H new ATOM 0 HG LEU A 61 8.447 -3.794 -3.773 1.00 0.00 H new ATOM 0 HD11 LEU A 61 7.670 -4.533 -5.992 1.00 0.00 H new ATOM 0 HD12 LEU A 61 9.401 -4.118 -6.002 1.00 0.00 H new ATOM 0 HD13 LEU A 61 8.895 -5.824 -5.985 1.00 0.00 H new ATOM 0 HD21 LEU A 61 6.614 -5.432 -3.951 1.00 0.00 H new ATOM 0 HD22 LEU A 61 7.797 -6.758 -3.864 1.00 0.00 H new ATOM 0 HD23 LEU A 61 7.574 -5.673 -2.472 1.00 0.00 H new ATOM 984 N LEU A 62 12.765 -5.908 -5.087 1.00 0.00 N ATOM 985 CA LEU A 62 13.708 -5.605 -6.158 1.00 0.00 C ATOM 986 C LEU A 62 13.889 -6.806 -7.081 1.00 0.00 C ATOM 987 O LEU A 62 13.969 -6.659 -8.300 1.00 0.00 O ATOM 988 CB LEU A 62 15.058 -5.189 -5.572 1.00 0.00 C ATOM 989 CG LEU A 62 15.171 -3.735 -5.111 1.00 0.00 C ATOM 990 CD1 LEU A 62 16.228 -3.600 -4.026 1.00 0.00 C ATOM 991 CD2 LEU A 62 15.492 -2.825 -6.287 1.00 0.00 C ATOM 0 H LEU A 62 13.164 -5.864 -4.149 1.00 0.00 H new ATOM 0 HA LEU A 62 13.303 -4.779 -6.743 1.00 0.00 H new ATOM 0 HB2 LEU A 62 15.278 -5.836 -4.723 1.00 0.00 H new ATOM 0 HB3 LEU A 62 15.829 -5.373 -6.321 1.00 0.00 H new ATOM 0 HG LEU A 62 14.211 -3.431 -4.694 1.00 0.00 H new ATOM 0 HD11 LEU A 62 16.294 -2.559 -3.710 1.00 0.00 H new ATOM 0 HD12 LEU A 62 15.955 -4.221 -3.173 1.00 0.00 H new ATOM 0 HD13 LEU A 62 17.193 -3.923 -4.416 1.00 0.00 H new ATOM 0 HD21 LEU A 62 15.568 -1.795 -5.940 1.00 0.00 H new ATOM 0 HD22 LEU A 62 16.439 -3.128 -6.734 1.00 0.00 H new ATOM 0 HD23 LEU A 62 14.699 -2.899 -7.031 1.00 0.00 H new ATOM 1003 N LYS A 63 13.951 -7.994 -6.490 1.00 0.00 N ATOM 1004 CA LYS A 63 14.119 -9.223 -7.258 1.00 0.00 C ATOM 1005 C LYS A 63 12.834 -9.581 -7.998 1.00 0.00 C ATOM 1006 O LYS A 63 12.873 -10.106 -9.112 1.00 0.00 O ATOM 1007 CB LYS A 63 14.527 -10.373 -6.336 1.00 0.00 C ATOM 1008 CG LYS A 63 16.020 -10.435 -6.064 1.00 0.00 C ATOM 1009 CD LYS A 63 16.690 -11.531 -6.875 1.00 0.00 C ATOM 1010 CE LYS A 63 17.841 -12.166 -6.110 1.00 0.00 C ATOM 1011 NZ LYS A 63 18.241 -13.475 -6.696 1.00 0.00 N ATOM 0 H LYS A 63 13.887 -8.133 -5.481 1.00 0.00 H new ATOM 0 HA LYS A 63 14.907 -9.058 -7.993 1.00 0.00 H new ATOM 0 HB2 LYS A 63 13.998 -10.273 -5.388 1.00 0.00 H new ATOM 0 HB3 LYS A 63 14.208 -11.315 -6.782 1.00 0.00 H new ATOM 0 HG2 LYS A 63 16.475 -9.474 -6.304 1.00 0.00 H new ATOM 0 HG3 LYS A 63 16.190 -10.611 -5.002 1.00 0.00 H new ATOM 0 HD2 LYS A 63 15.957 -12.295 -7.131 1.00 0.00 H new ATOM 0 HD3 LYS A 63 17.060 -11.117 -7.813 1.00 0.00 H new ATOM 0 HE2 LYS A 63 18.696 -11.490 -6.113 1.00 0.00 H new ATOM 0 HE3 LYS A 63 17.551 -12.308 -5.069 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 19.028 -13.875 -6.146 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 17.433 -14.129 -6.670 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 18.542 -13.337 -7.682 1.00 0.00 H new ATOM 1025 N LEU A 64 11.697 -9.294 -7.374 1.00 0.00 N ATOM 1026 CA LEU A 64 10.400 -9.585 -7.975 1.00 0.00 C ATOM 1027 C LEU A 64 10.103 -8.624 -9.122 1.00 0.00 C ATOM 1028 O LEU A 64 9.563 -9.022 -10.154 1.00 0.00 O ATOM 1029 CB LEU A 64 9.296 -9.494 -6.920 1.00 0.00 C ATOM 1030 CG LEU A 64 8.675 -10.822 -6.483 1.00 0.00 C ATOM 1031 CD1 LEU A 64 8.218 -10.746 -5.034 1.00 0.00 C ATOM 1032 CD2 LEU A 64 7.513 -11.192 -7.392 1.00 0.00 C ATOM 0 H LEU A 64 11.647 -8.860 -6.452 1.00 0.00 H new ATOM 0 HA LEU A 64 10.431 -10.599 -8.374 1.00 0.00 H new ATOM 0 HB2 LEU A 64 9.703 -8.999 -6.039 1.00 0.00 H new ATOM 0 HB3 LEU A 64 8.503 -8.855 -7.307 1.00 0.00 H new ATOM 0 HG LEU A 64 9.434 -11.600 -6.563 1.00 0.00 H new ATOM 0 HD11 LEU A 64 7.779 -11.699 -4.740 1.00 0.00 H new ATOM 0 HD12 LEU A 64 9.073 -10.528 -4.394 1.00 0.00 H new ATOM 0 HD13 LEU A 64 7.474 -9.956 -4.928 1.00 0.00 H new ATOM 0 HD21 LEU A 64 7.084 -12.139 -7.066 1.00 0.00 H new ATOM 0 HD22 LEU A 64 6.752 -10.413 -7.345 1.00 0.00 H new ATOM 0 HD23 LEU A 64 7.870 -11.289 -8.417 1.00 0.00 H new ATOM 1044 N SER A 65 10.462 -7.358 -8.934 1.00 0.00 N ATOM 1045 CA SER A 65 10.233 -6.340 -9.953 1.00 0.00 C ATOM 1046 C SER A 65 10.898 -6.729 -11.269 1.00 0.00 C ATOM 1047 O SER A 65 10.373 -6.452 -12.347 1.00 0.00 O ATOM 1048 CB SER A 65 10.766 -4.986 -9.479 1.00 0.00 C ATOM 1049 OG SER A 65 9.852 -3.945 -9.780 1.00 0.00 O ATOM 0 H SER A 65 10.912 -7.013 -8.086 1.00 0.00 H new ATOM 0 HA SER A 65 9.159 -6.262 -10.119 1.00 0.00 H new ATOM 0 HB2 SER A 65 10.945 -5.018 -8.404 1.00 0.00 H new ATOM 0 HB3 SER A 65 11.725 -4.782 -9.956 1.00 0.00 H new ATOM 0 HG SER A 65 9.588 -4.003 -10.722 1.00 0.00 H new ATOM 1055 N GLN A 66 12.057 -7.373 -11.172 1.00 0.00 N ATOM 1056 CA GLN A 66 12.795 -7.799 -12.355 1.00 0.00 C ATOM 1057 C GLN A 66 12.162 -9.042 -12.972 1.00 0.00 C ATOM 1058 O GLN A 66 12.209 -9.237 -14.187 1.00 0.00 O ATOM 1059 CB GLN A 66 14.255 -8.080 -11.997 1.00 0.00 C ATOM 1060 CG GLN A 66 15.041 -8.740 -13.119 1.00 0.00 C ATOM 1061 CD GLN A 66 16.469 -9.059 -12.722 1.00 0.00 C ATOM 1062 OE1 GLN A 66 17.412 -8.746 -13.450 1.00 0.00 O ATOM 1063 NE2 GLN A 66 16.636 -9.684 -11.563 1.00 0.00 N ATOM 0 H GLN A 66 12.505 -7.611 -10.287 1.00 0.00 H new ATOM 0 HA GLN A 66 12.757 -6.992 -13.087 1.00 0.00 H new ATOM 0 HB2 GLN A 66 14.741 -7.142 -11.727 1.00 0.00 H new ATOM 0 HB3 GLN A 66 14.287 -8.721 -11.116 1.00 0.00 H new ATOM 0 HG2 GLN A 66 14.537 -9.659 -13.418 1.00 0.00 H new ATOM 0 HG3 GLN A 66 15.048 -8.082 -13.988 1.00 0.00 H new ATOM 0 HE21 GLN A 66 15.826 -9.924 -10.992 1.00 0.00 H new ATOM 0 HE22 GLN A 66 17.574 -9.924 -11.244 1.00 0.00 H new ATOM 1072 N PHE A 67 11.571 -9.881 -12.128 1.00 0.00 N ATOM 1073 CA PHE A 67 10.930 -11.106 -12.590 1.00 0.00 C ATOM 1074 C PHE A 67 9.741 -10.790 -13.494 1.00 0.00 C ATOM 1075 O PHE A 67 9.629 -11.322 -14.599 1.00 0.00 O ATOM 1076 CB PHE A 67 10.469 -11.947 -11.398 1.00 0.00 C ATOM 1077 CG PHE A 67 9.632 -13.132 -11.788 1.00 0.00 C ATOM 1078 CD1 PHE A 67 8.258 -13.012 -11.923 1.00 0.00 C ATOM 1079 CD2 PHE A 67 10.219 -14.365 -12.019 1.00 0.00 C ATOM 1080 CE1 PHE A 67 7.485 -14.100 -12.282 1.00 0.00 C ATOM 1081 CE2 PHE A 67 9.451 -15.457 -12.379 1.00 0.00 C ATOM 1082 CZ PHE A 67 8.082 -15.324 -12.510 1.00 0.00 C ATOM 0 H PHE A 67 11.523 -9.735 -11.120 1.00 0.00 H new ATOM 0 HA PHE A 67 11.661 -11.674 -13.165 1.00 0.00 H new ATOM 0 HB2 PHE A 67 11.344 -12.295 -10.849 1.00 0.00 H new ATOM 0 HB3 PHE A 67 9.897 -11.316 -10.718 1.00 0.00 H new ATOM 0 HD1 PHE A 67 7.786 -12.057 -11.746 1.00 0.00 H new ATOM 0 HD2 PHE A 67 11.289 -14.475 -11.917 1.00 0.00 H new ATOM 0 HE1 PHE A 67 6.415 -13.993 -12.384 1.00 0.00 H new ATOM 0 HE2 PHE A 67 9.921 -16.413 -12.558 1.00 0.00 H new ATOM 0 HZ PHE A 67 7.480 -16.176 -12.790 1.00 0.00 H new ATOM 1092 N TYR A 68 8.857 -9.922 -13.016 1.00 0.00 N ATOM 1093 CA TYR A 68 7.675 -9.537 -13.778 1.00 0.00 C ATOM 1094 C TYR A 68 8.058 -8.681 -14.981 1.00 0.00 C ATOM 1095 O TYR A 68 7.652 -8.959 -16.109 1.00 0.00 O ATOM 1096 CB TYR A 68 6.694 -8.774 -12.887 1.00 0.00 C ATOM 1097 CG TYR A 68 5.586 -9.638 -12.327 1.00 0.00 C ATOM 1098 CD1 TYR A 68 4.513 -10.025 -13.120 1.00 0.00 C ATOM 1099 CD2 TYR A 68 5.612 -10.066 -11.006 1.00 0.00 C ATOM 1100 CE1 TYR A 68 3.498 -10.814 -12.613 1.00 0.00 C ATOM 1101 CE2 TYR A 68 4.603 -10.856 -10.491 1.00 0.00 C ATOM 1102 CZ TYR A 68 3.548 -11.227 -11.298 1.00 0.00 C ATOM 1103 OH TYR A 68 2.540 -12.013 -10.788 1.00 0.00 O ATOM 0 H TYR A 68 8.936 -9.471 -12.104 1.00 0.00 H new ATOM 0 HA TYR A 68 7.195 -10.446 -14.140 1.00 0.00 H new ATOM 0 HB2 TYR A 68 7.243 -8.321 -12.061 1.00 0.00 H new ATOM 0 HB3 TYR A 68 6.253 -7.959 -13.461 1.00 0.00 H new ATOM 0 HD1 TYR A 68 4.471 -9.704 -14.150 1.00 0.00 H new ATOM 0 HD2 TYR A 68 6.436 -9.776 -10.370 1.00 0.00 H new ATOM 0 HE1 TYR A 68 2.670 -11.106 -13.243 1.00 0.00 H new ATOM 0 HE2 TYR A 68 4.640 -11.181 -9.462 1.00 0.00 H new ATOM 0 HH TYR A 68 2.728 -12.217 -9.848 1.00 0.00 H new ATOM 1113 N ALA A 69 8.842 -7.638 -14.732 1.00 0.00 N ATOM 1114 CA ALA A 69 9.283 -6.742 -15.793 1.00 0.00 C ATOM 1115 C ALA A 69 9.950 -7.517 -16.924 1.00 0.00 C ATOM 1116 O ALA A 69 9.940 -7.085 -18.078 1.00 0.00 O ATOM 1117 CB ALA A 69 10.235 -5.693 -15.237 1.00 0.00 C ATOM 0 H ALA A 69 9.185 -7.392 -13.803 1.00 0.00 H new ATOM 0 HA ALA A 69 8.405 -6.241 -16.199 1.00 0.00 H new ATOM 0 HB1 ALA A 69 10.556 -5.031 -16.041 1.00 0.00 H new ATOM 0 HB2 ALA A 69 9.726 -5.111 -14.469 1.00 0.00 H new ATOM 0 HB3 ALA A 69 11.105 -6.185 -14.803 1.00 0.00 H new ATOM 1123 N LEU A 70 10.531 -8.664 -16.587 1.00 0.00 N ATOM 1124 CA LEU A 70 11.204 -9.500 -17.575 1.00 0.00 C ATOM 1125 C LEU A 70 10.194 -10.162 -18.507 1.00 0.00 C ATOM 1126 O LEU A 70 10.359 -10.149 -19.727 1.00 0.00 O ATOM 1127 CB LEU A 70 12.048 -10.568 -16.878 1.00 0.00 C ATOM 1128 CG LEU A 70 12.508 -11.736 -17.751 1.00 0.00 C ATOM 1129 CD1 LEU A 70 13.391 -11.239 -18.886 1.00 0.00 C ATOM 1130 CD2 LEU A 70 13.245 -12.770 -16.914 1.00 0.00 C ATOM 0 H LEU A 70 10.549 -9.036 -15.637 1.00 0.00 H new ATOM 0 HA LEU A 70 11.856 -8.862 -18.171 1.00 0.00 H new ATOM 0 HB2 LEU A 70 12.930 -10.087 -16.456 1.00 0.00 H new ATOM 0 HB3 LEU A 70 11.473 -10.969 -16.043 1.00 0.00 H new ATOM 0 HG LEU A 70 11.627 -12.210 -18.184 1.00 0.00 H new ATOM 0 HD11 LEU A 70 13.709 -12.084 -19.497 1.00 0.00 H new ATOM 0 HD12 LEU A 70 12.830 -10.537 -19.502 1.00 0.00 H new ATOM 0 HD13 LEU A 70 14.268 -10.740 -18.473 1.00 0.00 H new ATOM 0 HD21 LEU A 70 13.565 -13.594 -17.552 1.00 0.00 H new ATOM 0 HD22 LEU A 70 14.118 -12.309 -16.452 1.00 0.00 H new ATOM 0 HD23 LEU A 70 12.581 -13.149 -16.137 1.00 0.00 H new ATOM 1142 N ILE A 71 9.148 -10.738 -17.924 1.00 0.00 N ATOM 1143 CA ILE A 71 8.110 -11.402 -18.703 1.00 0.00 C ATOM 1144 C ILE A 71 6.943 -10.460 -18.980 1.00 0.00 C ATOM 1145 O ILE A 71 5.825 -10.901 -19.244 1.00 0.00 O ATOM 1146 CB ILE A 71 7.582 -12.657 -17.983 1.00 0.00 C ATOM 1147 CG1 ILE A 71 6.990 -12.281 -16.624 1.00 0.00 C ATOM 1148 CG2 ILE A 71 8.696 -13.680 -17.817 1.00 0.00 C ATOM 1149 CD1 ILE A 71 6.431 -13.461 -15.861 1.00 0.00 C ATOM 0 H ILE A 71 8.997 -10.758 -16.915 1.00 0.00 H new ATOM 0 HA ILE A 71 8.566 -11.699 -19.647 1.00 0.00 H new ATOM 0 HB ILE A 71 6.794 -13.102 -18.591 1.00 0.00 H new ATOM 0 HG12 ILE A 71 7.761 -11.801 -16.021 1.00 0.00 H new ATOM 0 HG13 ILE A 71 6.198 -11.547 -16.772 1.00 0.00 H new ATOM 0 HG21 ILE A 71 8.308 -14.561 -17.307 1.00 0.00 H new ATOM 0 HG22 ILE A 71 9.076 -13.967 -18.798 1.00 0.00 H new ATOM 0 HG23 ILE A 71 9.504 -13.246 -17.228 1.00 0.00 H new ATOM 0 HD11 ILE A 71 6.028 -13.120 -14.907 1.00 0.00 H new ATOM 0 HD12 ILE A 71 5.637 -13.928 -16.444 1.00 0.00 H new ATOM 0 HD13 ILE A 71 7.224 -14.187 -15.681 1.00 0.00 H new ATOM 1161 N ASN A 72 7.212 -9.160 -18.919 1.00 0.00 N ATOM 1162 CA ASN A 72 6.185 -8.155 -19.165 1.00 0.00 C ATOM 1163 C ASN A 72 6.411 -7.461 -20.505 1.00 0.00 C ATOM 1164 O ASN A 72 5.473 -6.956 -21.120 1.00 0.00 O ATOM 1165 CB ASN A 72 6.175 -7.120 -18.038 1.00 0.00 C ATOM 1166 CG ASN A 72 5.321 -7.554 -16.862 1.00 0.00 C ATOM 1167 OD1 ASN A 72 5.021 -8.737 -16.701 1.00 0.00 O ATOM 1168 ND2 ASN A 72 4.925 -6.595 -16.033 1.00 0.00 N ATOM 0 H ASN A 72 8.132 -8.778 -18.701 1.00 0.00 H new ATOM 0 HA ASN A 72 5.219 -8.659 -19.196 1.00 0.00 H new ATOM 0 HB2 ASN A 72 7.196 -6.947 -17.698 1.00 0.00 H new ATOM 0 HB3 ASN A 72 5.803 -6.171 -18.423 1.00 0.00 H new ATOM 0 HD21 ASN A 72 4.348 -6.826 -15.224 1.00 0.00 H new ATOM 0 HD22 ASN A 72 5.197 -5.627 -16.205 1.00 0.00 H new ATOM 1175 N GLY A 73 7.663 -7.442 -20.951 1.00 0.00 N ATOM 1176 CA GLY A 73 7.990 -6.809 -22.216 1.00 0.00 C ATOM 1177 C GLY A 73 8.455 -7.805 -23.259 1.00 0.00 C ATOM 1178 O GLY A 73 8.412 -7.525 -24.457 1.00 0.00 O ATOM 0 H GLY A 73 8.457 -7.853 -20.460 1.00 0.00 H new ATOM 0 HA2 GLY A 73 7.115 -6.278 -22.590 1.00 0.00 H new ATOM 0 HA3 GLY A 73 8.770 -6.065 -22.055 1.00 0.00 H new ATOM 1182 N ASP A 74 8.902 -8.971 -22.805 1.00 0.00 N ATOM 1183 CA ASP A 74 9.378 -10.012 -23.708 1.00 0.00 C ATOM 1184 C ASP A 74 8.346 -10.304 -24.793 1.00 0.00 C ATOM 1185 O ASP A 74 7.167 -10.507 -24.503 1.00 0.00 O ATOM 1186 CB ASP A 74 9.691 -11.290 -22.928 1.00 0.00 C ATOM 1187 CG ASP A 74 10.214 -12.399 -23.820 1.00 0.00 C ATOM 1188 OD1 ASP A 74 10.216 -13.567 -23.376 1.00 0.00 O ATOM 1189 OD2 ASP A 74 10.621 -12.100 -24.962 1.00 0.00 O ATOM 0 H ASP A 74 8.945 -9.219 -21.816 1.00 0.00 H new ATOM 0 HA ASP A 74 10.290 -9.654 -24.186 1.00 0.00 H new ATOM 0 HB2 ASP A 74 10.429 -11.070 -22.156 1.00 0.00 H new ATOM 0 HB3 ASP A 74 8.790 -11.632 -22.419 1.00 0.00 H new ATOM 1194 N GLU A 75 8.797 -10.321 -26.043 1.00 0.00 N ATOM 1195 CA GLU A 75 7.912 -10.585 -27.171 1.00 0.00 C ATOM 1196 C GLU A 75 7.945 -12.062 -27.554 1.00 0.00 C ATOM 1197 O GLU A 75 7.898 -12.409 -28.734 1.00 0.00 O ATOM 1198 CB GLU A 75 8.309 -9.726 -28.373 1.00 0.00 C ATOM 1199 CG GLU A 75 7.124 -9.197 -29.162 1.00 0.00 C ATOM 1200 CD GLU A 75 7.486 -8.841 -30.591 1.00 0.00 C ATOM 1201 OE1 GLU A 75 7.260 -9.682 -31.487 1.00 0.00 O ATOM 1202 OE2 GLU A 75 7.995 -7.723 -30.814 1.00 0.00 O ATOM 0 H GLU A 75 9.770 -10.155 -26.300 1.00 0.00 H new ATOM 0 HA GLU A 75 6.896 -10.328 -26.870 1.00 0.00 H new ATOM 0 HB2 GLU A 75 8.908 -8.884 -28.025 1.00 0.00 H new ATOM 0 HB3 GLU A 75 8.942 -10.315 -29.036 1.00 0.00 H new ATOM 0 HG2 GLU A 75 6.333 -9.946 -29.168 1.00 0.00 H new ATOM 0 HG3 GLU A 75 6.724 -8.315 -28.662 1.00 0.00 H new ATOM 1209 N SER A 76 8.026 -12.927 -26.548 1.00 0.00 N ATOM 1210 CA SER A 76 8.070 -14.366 -26.779 1.00 0.00 C ATOM 1211 C SER A 76 7.302 -15.114 -25.694 1.00 0.00 C ATOM 1212 O SER A 76 7.583 -16.278 -25.409 1.00 0.00 O ATOM 1213 CB SER A 76 9.520 -14.853 -26.821 1.00 0.00 C ATOM 1214 OG SER A 76 10.148 -14.480 -28.035 1.00 0.00 O ATOM 0 H SER A 76 8.062 -12.656 -25.565 1.00 0.00 H new ATOM 0 HA SER A 76 7.598 -14.569 -27.740 1.00 0.00 H new ATOM 0 HB2 SER A 76 10.072 -14.435 -25.979 1.00 0.00 H new ATOM 0 HB3 SER A 76 9.546 -15.937 -26.713 1.00 0.00 H new ATOM 0 HG SER A 76 11.074 -14.801 -28.037 1.00 0.00 H new ATOM 1220 N ILE A 77 6.330 -14.436 -25.092 1.00 0.00 N ATOM 1221 CA ILE A 77 5.520 -15.036 -24.039 1.00 0.00 C ATOM 1222 C ILE A 77 4.040 -14.733 -24.245 1.00 0.00 C ATOM 1223 O ILE A 77 3.674 -13.646 -24.691 1.00 0.00 O ATOM 1224 CB ILE A 77 5.946 -14.534 -22.646 1.00 0.00 C ATOM 1225 CG1 ILE A 77 7.464 -14.637 -22.485 1.00 0.00 C ATOM 1226 CG2 ILE A 77 5.237 -15.328 -21.558 1.00 0.00 C ATOM 1227 CD1 ILE A 77 7.964 -14.144 -21.146 1.00 0.00 C ATOM 0 H ILE A 77 6.085 -13.472 -25.315 1.00 0.00 H new ATOM 0 HA ILE A 77 5.679 -16.113 -24.093 1.00 0.00 H new ATOM 0 HB ILE A 77 5.660 -13.487 -22.550 1.00 0.00 H new ATOM 0 HG12 ILE A 77 7.765 -15.676 -22.616 1.00 0.00 H new ATOM 0 HG13 ILE A 77 7.945 -14.063 -23.277 1.00 0.00 H new ATOM 0 HG21 ILE A 77 5.548 -14.962 -20.579 1.00 0.00 H new ATOM 0 HG22 ILE A 77 4.159 -15.208 -21.664 1.00 0.00 H new ATOM 0 HG23 ILE A 77 5.496 -16.383 -21.650 1.00 0.00 H new ATOM 0 HD11 ILE A 77 9.048 -14.247 -21.102 1.00 0.00 H new ATOM 0 HD12 ILE A 77 7.693 -13.096 -21.020 1.00 0.00 H new ATOM 0 HD13 ILE A 77 7.511 -14.734 -20.349 1.00 0.00 H new ATOM 1443 N TYR A 91 2.377 -17.160 -17.123 1.00 0.00 N ATOM 1444 CA TYR A 91 3.363 -16.567 -18.020 1.00 0.00 C ATOM 1445 C TYR A 91 4.260 -17.641 -18.628 1.00 0.00 C ATOM 1446 O TYR A 91 5.459 -17.693 -18.356 1.00 0.00 O ATOM 1447 CB TYR A 91 4.214 -15.541 -17.269 1.00 0.00 C ATOM 1448 CG TYR A 91 3.514 -14.218 -17.051 1.00 0.00 C ATOM 1449 CD1 TYR A 91 2.540 -14.079 -16.071 1.00 0.00 C ATOM 1450 CD2 TYR A 91 3.828 -13.108 -17.826 1.00 0.00 C ATOM 1451 CE1 TYR A 91 1.898 -12.873 -15.868 1.00 0.00 C ATOM 1452 CE2 TYR A 91 3.192 -11.898 -17.629 1.00 0.00 C ATOM 1453 CZ TYR A 91 2.228 -11.785 -16.650 1.00 0.00 C ATOM 1454 OH TYR A 91 1.591 -10.581 -16.452 1.00 0.00 O ATOM 0 HA TYR A 91 2.829 -16.065 -18.827 1.00 0.00 H new ATOM 0 HB2 TYR A 91 4.499 -15.956 -16.302 1.00 0.00 H new ATOM 0 HB3 TYR A 91 5.135 -15.368 -17.826 1.00 0.00 H new ATOM 0 HD1 TYR A 91 2.280 -14.929 -15.457 1.00 0.00 H new ATOM 0 HD2 TYR A 91 4.582 -13.193 -18.595 1.00 0.00 H new ATOM 0 HE1 TYR A 91 1.142 -12.782 -15.102 1.00 0.00 H new ATOM 0 HE2 TYR A 91 3.449 -11.044 -18.239 1.00 0.00 H new ATOM 0 HH TYR A 91 1.940 -9.918 -17.084 1.00 0.00 H new ATOM 1464 N THR A 92 3.669 -18.497 -19.457 1.00 0.00 N ATOM 1465 CA THR A 92 4.412 -19.570 -20.105 1.00 0.00 C ATOM 1466 C THR A 92 5.379 -19.018 -21.146 1.00 0.00 C ATOM 1467 O THR A 92 4.965 -18.546 -22.205 1.00 0.00 O ATOM 1468 CB THR A 92 3.466 -20.578 -20.784 1.00 0.00 C ATOM 1469 OG1 THR A 92 2.458 -21.004 -19.859 1.00 0.00 O ATOM 1470 CG2 THR A 92 4.237 -21.786 -21.293 1.00 0.00 C ATOM 0 H THR A 92 2.678 -18.467 -19.695 1.00 0.00 H new ATOM 0 HA THR A 92 4.975 -20.081 -19.324 1.00 0.00 H new ATOM 0 HB THR A 92 2.994 -20.084 -21.633 1.00 0.00 H new ATOM 0 HG1 THR A 92 1.860 -21.643 -20.299 1.00 0.00 H new ATOM 0 HG21 THR A 92 3.548 -22.484 -21.768 1.00 0.00 H new ATOM 0 HG22 THR A 92 4.983 -21.462 -22.018 1.00 0.00 H new ATOM 0 HG23 THR A 92 4.733 -22.279 -20.457 1.00 0.00 H new ATOM 1478 N LEU A 93 6.670 -19.080 -20.838 1.00 0.00 N ATOM 1479 CA LEU A 93 7.698 -18.587 -21.748 1.00 0.00 C ATOM 1480 C LEU A 93 7.555 -19.223 -23.127 1.00 0.00 C ATOM 1481 O LEU A 93 6.862 -20.226 -23.291 1.00 0.00 O ATOM 1482 CB LEU A 93 9.089 -18.875 -21.182 1.00 0.00 C ATOM 1483 CG LEU A 93 9.316 -18.479 -19.723 1.00 0.00 C ATOM 1484 CD1 LEU A 93 10.749 -18.773 -19.306 1.00 0.00 C ATOM 1485 CD2 LEU A 93 8.988 -17.008 -19.512 1.00 0.00 C ATOM 0 H LEU A 93 7.030 -19.467 -19.965 1.00 0.00 H new ATOM 0 HA LEU A 93 7.571 -17.509 -21.851 1.00 0.00 H new ATOM 0 HB2 LEU A 93 9.286 -19.942 -21.283 1.00 0.00 H new ATOM 0 HB3 LEU A 93 9.824 -18.356 -21.797 1.00 0.00 H new ATOM 0 HG LEU A 93 8.649 -19.073 -19.098 1.00 0.00 H new ATOM 0 HD11 LEU A 93 10.891 -18.484 -18.265 1.00 0.00 H new ATOM 0 HD12 LEU A 93 10.949 -19.839 -19.418 1.00 0.00 H new ATOM 0 HD13 LEU A 93 11.435 -18.207 -19.936 1.00 0.00 H new ATOM 0 HD21 LEU A 93 9.155 -16.744 -18.468 1.00 0.00 H new ATOM 0 HD22 LEU A 93 9.629 -16.397 -20.148 1.00 0.00 H new ATOM 0 HD23 LEU A 93 7.944 -16.827 -19.769 1.00 0.00 H new ATOM 1497 N GLY A 94 8.218 -18.633 -24.117 1.00 0.00 N ATOM 1498 CA GLY A 94 8.154 -19.157 -25.469 1.00 0.00 C ATOM 1499 C GLY A 94 8.806 -20.519 -25.594 1.00 0.00 C ATOM 1500 O GLY A 94 8.541 -21.257 -26.544 1.00 0.00 O ATOM 0 H GLY A 94 8.798 -17.801 -24.007 1.00 0.00 H new ATOM 0 HA2 GLY A 94 7.111 -19.227 -25.779 1.00 0.00 H new ATOM 0 HA3 GLY A 94 8.643 -18.460 -26.149 1.00 0.00 H new ATOM 1504 N ASP A 95 9.661 -20.855 -24.635 1.00 0.00 N ATOM 1505 CA ASP A 95 10.354 -22.138 -24.642 1.00 0.00 C ATOM 1506 C ASP A 95 9.618 -23.157 -23.777 1.00 0.00 C ATOM 1507 O ASP A 95 10.236 -24.024 -23.161 1.00 0.00 O ATOM 1508 CB ASP A 95 11.790 -21.969 -24.143 1.00 0.00 C ATOM 1509 CG ASP A 95 12.555 -20.921 -24.927 1.00 0.00 C ATOM 1510 OD1 ASP A 95 12.371 -19.718 -24.646 1.00 0.00 O ATOM 1511 OD2 ASP A 95 13.340 -21.304 -25.820 1.00 0.00 O ATOM 0 H ASP A 95 9.891 -20.256 -23.842 1.00 0.00 H new ATOM 0 HA ASP A 95 10.375 -22.506 -25.668 1.00 0.00 H new ATOM 0 HB2 ASP A 95 11.775 -21.691 -23.089 1.00 0.00 H new ATOM 0 HB3 ASP A 95 12.311 -22.924 -24.214 1.00 0.00 H new ATOM 1516 N GLY A 96 8.294 -23.045 -23.736 1.00 0.00 N ATOM 1517 CA GLY A 96 7.496 -23.962 -22.943 1.00 0.00 C ATOM 1518 C GLY A 96 7.977 -24.057 -21.508 1.00 0.00 C ATOM 1519 O GLY A 96 7.808 -25.088 -20.857 1.00 0.00 O ATOM 0 H GLY A 96 7.760 -22.336 -24.238 1.00 0.00 H new ATOM 0 HA2 GLY A 96 6.456 -23.636 -22.954 1.00 0.00 H new ATOM 0 HA3 GLY A 96 7.525 -24.952 -23.399 1.00 0.00 H new ATOM 1523 N SER A 97 8.580 -22.980 -21.015 1.00 0.00 N ATOM 1524 CA SER A 97 9.092 -22.949 -19.650 1.00 0.00 C ATOM 1525 C SER A 97 8.133 -22.203 -18.727 1.00 0.00 C ATOM 1526 O SER A 97 7.469 -21.253 -19.140 1.00 0.00 O ATOM 1527 CB SER A 97 10.470 -22.286 -19.615 1.00 0.00 C ATOM 1528 OG SER A 97 11.387 -22.972 -20.449 1.00 0.00 O ATOM 0 H SER A 97 8.726 -22.118 -21.540 1.00 0.00 H new ATOM 0 HA SER A 97 9.182 -23.977 -19.298 1.00 0.00 H new ATOM 0 HB2 SER A 97 10.386 -21.248 -19.938 1.00 0.00 H new ATOM 0 HB3 SER A 97 10.845 -22.272 -18.591 1.00 0.00 H new ATOM 0 HG SER A 97 10.976 -23.134 -21.323 1.00 0.00 H new ATOM 1534 N SER A 98 8.066 -22.641 -17.474 1.00 0.00 N ATOM 1535 CA SER A 98 7.187 -22.019 -16.492 1.00 0.00 C ATOM 1536 C SER A 98 7.984 -21.157 -15.517 1.00 0.00 C ATOM 1537 O SER A 98 8.317 -21.592 -14.414 1.00 0.00 O ATOM 1538 CB SER A 98 6.407 -23.088 -15.724 1.00 0.00 C ATOM 1539 OG SER A 98 7.282 -24.040 -15.144 1.00 0.00 O ATOM 0 H SER A 98 8.611 -23.425 -17.115 1.00 0.00 H new ATOM 0 HA SER A 98 6.484 -21.379 -17.025 1.00 0.00 H new ATOM 0 HB2 SER A 98 5.809 -22.616 -14.944 1.00 0.00 H new ATOM 0 HB3 SER A 98 5.713 -23.590 -16.398 1.00 0.00 H new ATOM 0 HG SER A 98 7.938 -23.580 -14.580 1.00 0.00 H new ATOM 1545 N LEU A 99 8.286 -19.932 -15.932 1.00 0.00 N ATOM 1546 CA LEU A 99 9.044 -19.006 -15.098 1.00 0.00 C ATOM 1547 C LEU A 99 8.408 -18.872 -13.717 1.00 0.00 C ATOM 1548 O LEU A 99 7.310 -18.334 -13.579 1.00 0.00 O ATOM 1549 CB LEU A 99 9.127 -17.634 -15.769 1.00 0.00 C ATOM 1550 CG LEU A 99 10.420 -16.851 -15.537 1.00 0.00 C ATOM 1551 CD1 LEU A 99 11.440 -17.174 -16.618 1.00 0.00 C ATOM 1552 CD2 LEU A 99 10.138 -15.356 -15.498 1.00 0.00 C ATOM 0 H LEU A 99 8.017 -19.557 -16.842 1.00 0.00 H new ATOM 0 HA LEU A 99 10.051 -19.405 -14.977 1.00 0.00 H new ATOM 0 HB2 LEU A 99 8.995 -17.768 -16.843 1.00 0.00 H new ATOM 0 HB3 LEU A 99 8.291 -17.029 -15.418 1.00 0.00 H new ATOM 0 HG LEU A 99 10.835 -17.148 -14.574 1.00 0.00 H new ATOM 0 HD11 LEU A 99 12.354 -16.608 -16.437 1.00 0.00 H new ATOM 0 HD12 LEU A 99 11.664 -18.241 -16.600 1.00 0.00 H new ATOM 0 HD13 LEU A 99 11.034 -16.905 -17.593 1.00 0.00 H new ATOM 0 HD21 LEU A 99 11.069 -14.814 -15.332 1.00 0.00 H new ATOM 0 HD22 LEU A 99 9.700 -15.043 -16.446 1.00 0.00 H new ATOM 0 HD23 LEU A 99 9.442 -15.138 -14.688 1.00 0.00 H new ATOM 1564 N GLN A 100 9.107 -19.364 -12.700 1.00 0.00 N ATOM 1565 CA GLN A 100 8.611 -19.297 -11.330 1.00 0.00 C ATOM 1566 C GLN A 100 9.177 -18.080 -10.605 1.00 0.00 C ATOM 1567 O GLN A 100 10.358 -17.760 -10.735 1.00 0.00 O ATOM 1568 CB GLN A 100 8.977 -20.574 -10.570 1.00 0.00 C ATOM 1569 CG GLN A 100 10.469 -20.865 -10.553 1.00 0.00 C ATOM 1570 CD GLN A 100 11.018 -21.014 -9.148 1.00 0.00 C ATOM 1571 OE1 GLN A 100 11.805 -20.189 -8.685 1.00 0.00 O ATOM 1572 NE2 GLN A 100 10.603 -22.072 -8.459 1.00 0.00 N ATOM 0 H GLN A 100 10.018 -19.813 -12.798 1.00 0.00 H new ATOM 0 HA GLN A 100 7.526 -19.203 -11.367 1.00 0.00 H new ATOM 0 HB2 GLN A 100 8.620 -20.491 -9.544 1.00 0.00 H new ATOM 0 HB3 GLN A 100 8.456 -21.418 -11.022 1.00 0.00 H new ATOM 0 HG2 GLN A 100 10.663 -21.779 -11.114 1.00 0.00 H new ATOM 0 HG3 GLN A 100 10.998 -20.060 -11.062 1.00 0.00 H new ATOM 0 HE21 GLN A 100 9.950 -22.731 -8.882 1.00 0.00 H new ATOM 0 HE22 GLN A 100 10.938 -22.224 -7.508 1.00 0.00 H new ATOM 1581 N LYS A 101 8.325 -17.405 -9.841 1.00 0.00 N ATOM 1582 CA LYS A 101 8.738 -16.223 -9.093 1.00 0.00 C ATOM 1583 C LYS A 101 9.912 -16.544 -8.173 1.00 0.00 C ATOM 1584 O LYS A 101 10.169 -17.700 -7.836 1.00 0.00 O ATOM 1585 CB LYS A 101 7.567 -15.678 -8.273 1.00 0.00 C ATOM 1586 CG LYS A 101 6.670 -14.730 -9.050 1.00 0.00 C ATOM 1587 CD LYS A 101 5.852 -13.849 -8.120 1.00 0.00 C ATOM 1588 CE LYS A 101 4.419 -14.347 -7.999 1.00 0.00 C ATOM 1589 NZ LYS A 101 4.357 -15.734 -7.461 1.00 0.00 N ATOM 0 H LYS A 101 7.343 -17.656 -9.723 1.00 0.00 H new ATOM 0 HA LYS A 101 9.057 -15.464 -9.808 1.00 0.00 H new ATOM 0 HB2 LYS A 101 6.969 -16.514 -7.909 1.00 0.00 H new ATOM 0 HB3 LYS A 101 7.958 -15.160 -7.397 1.00 0.00 H new ATOM 0 HG2 LYS A 101 7.279 -14.105 -9.703 1.00 0.00 H new ATOM 0 HG3 LYS A 101 6.001 -15.304 -9.691 1.00 0.00 H new ATOM 0 HD2 LYS A 101 6.316 -13.829 -7.134 1.00 0.00 H new ATOM 0 HD3 LYS A 101 5.852 -12.825 -8.493 1.00 0.00 H new ATOM 0 HE2 LYS A 101 3.856 -13.679 -7.347 1.00 0.00 H new ATOM 0 HE3 LYS A 101 3.940 -14.315 -8.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 3.364 -16.036 -7.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 4.872 -16.376 -8.096 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 4.791 -15.760 -6.516 1.00 0.00 H new ATOM 1603 N PRO A 102 10.640 -15.499 -7.755 1.00 0.00 N ATOM 1604 CA PRO A 102 11.797 -15.645 -6.866 1.00 0.00 C ATOM 1605 C PRO A 102 11.394 -16.054 -5.453 1.00 0.00 C ATOM 1606 O PRO A 102 10.350 -15.638 -4.950 1.00 0.00 O ATOM 1607 CB PRO A 102 12.419 -14.246 -6.860 1.00 0.00 C ATOM 1608 CG PRO A 102 11.291 -13.329 -7.186 1.00 0.00 C ATOM 1609 CD PRO A 102 10.391 -14.093 -8.117 1.00 0.00 C ATOM 0 HA PRO A 102 12.476 -16.427 -7.206 1.00 0.00 H new ATOM 0 HB2 PRO A 102 12.853 -14.010 -5.888 1.00 0.00 H new ATOM 0 HB3 PRO A 102 13.220 -14.166 -7.595 1.00 0.00 H new ATOM 0 HG2 PRO A 102 10.757 -13.032 -6.284 1.00 0.00 H new ATOM 0 HG3 PRO A 102 11.654 -12.416 -7.657 1.00 0.00 H new ATOM 0 HD2 PRO A 102 9.345 -13.821 -7.977 1.00 0.00 H new ATOM 0 HD3 PRO A 102 10.634 -13.898 -9.161 1.00 0.00 H new ATOM 1617 N ASP A 103 12.227 -16.871 -4.818 1.00 0.00 N ATOM 1618 CA ASP A 103 11.959 -17.336 -3.462 1.00 0.00 C ATOM 1619 C ASP A 103 12.350 -16.276 -2.438 1.00 0.00 C ATOM 1620 O ASP A 103 13.412 -16.356 -1.820 1.00 0.00 O ATOM 1621 CB ASP A 103 12.717 -18.635 -3.186 1.00 0.00 C ATOM 1622 CG ASP A 103 12.068 -19.835 -3.847 1.00 0.00 C ATOM 1623 OD1 ASP A 103 11.486 -19.669 -4.940 1.00 0.00 O ATOM 1624 OD2 ASP A 103 12.143 -20.941 -3.272 1.00 0.00 O ATOM 0 H ASP A 103 13.094 -17.225 -5.221 1.00 0.00 H new ATOM 0 HA ASP A 103 10.889 -17.524 -3.373 1.00 0.00 H new ATOM 0 HB2 ASP A 103 13.742 -18.537 -3.543 1.00 0.00 H new ATOM 0 HB3 ASP A 103 12.769 -18.800 -2.110 1.00 0.00 H new ATOM 1629 N VAL A 104 11.485 -15.281 -2.262 1.00 0.00 N ATOM 1630 CA VAL A 104 11.741 -14.205 -1.312 1.00 0.00 C ATOM 1631 C VAL A 104 11.007 -14.447 0.002 1.00 0.00 C ATOM 1632 O VAL A 104 10.744 -13.512 0.760 1.00 0.00 O ATOM 1633 CB VAL A 104 11.313 -12.840 -1.883 1.00 0.00 C ATOM 1634 CG1 VAL A 104 12.002 -12.578 -3.213 1.00 0.00 C ATOM 1635 CG2 VAL A 104 9.801 -12.776 -2.034 1.00 0.00 C ATOM 0 H VAL A 104 10.601 -15.198 -2.765 1.00 0.00 H new ATOM 0 HA VAL A 104 12.815 -14.193 -1.128 1.00 0.00 H new ATOM 0 HB VAL A 104 11.618 -12.061 -1.184 1.00 0.00 H new ATOM 0 HG11 VAL A 104 11.687 -11.609 -3.601 1.00 0.00 H new ATOM 0 HG12 VAL A 104 13.082 -12.578 -3.069 1.00 0.00 H new ATOM 0 HG13 VAL A 104 11.731 -13.359 -3.923 1.00 0.00 H new ATOM 0 HG21 VAL A 104 9.517 -11.805 -2.439 1.00 0.00 H new ATOM 0 HG22 VAL A 104 9.469 -13.563 -2.712 1.00 0.00 H new ATOM 0 HG23 VAL A 104 9.332 -12.915 -1.060 1.00 0.00 H new ATOM 1645 N TYR A 105 10.679 -15.706 0.267 1.00 0.00 N ATOM 1646 CA TYR A 105 9.974 -16.071 1.490 1.00 0.00 C ATOM 1647 C TYR A 105 10.886 -15.938 2.706 1.00 0.00 C ATOM 1648 O TYR A 105 10.493 -15.386 3.733 1.00 0.00 O ATOM 1649 CB TYR A 105 9.444 -17.503 1.390 1.00 0.00 C ATOM 1650 CG TYR A 105 8.755 -17.983 2.648 1.00 0.00 C ATOM 1651 CD1 TYR A 105 7.784 -17.207 3.270 1.00 0.00 C ATOM 1652 CD2 TYR A 105 9.075 -19.210 3.214 1.00 0.00 C ATOM 1653 CE1 TYR A 105 7.153 -17.641 4.420 1.00 0.00 C ATOM 1654 CE2 TYR A 105 8.447 -19.653 4.362 1.00 0.00 C ATOM 1655 CZ TYR A 105 7.487 -18.865 4.961 1.00 0.00 C ATOM 1656 OH TYR A 105 6.861 -19.301 6.106 1.00 0.00 O ATOM 0 H TYR A 105 10.890 -16.491 -0.349 1.00 0.00 H new ATOM 0 HA TYR A 105 9.134 -15.387 1.612 1.00 0.00 H new ATOM 0 HB2 TYR A 105 8.745 -17.565 0.556 1.00 0.00 H new ATOM 0 HB3 TYR A 105 10.273 -18.173 1.161 1.00 0.00 H new ATOM 0 HD1 TYR A 105 7.518 -16.249 2.848 1.00 0.00 H new ATOM 0 HD2 TYR A 105 9.828 -19.829 2.749 1.00 0.00 H new ATOM 0 HE1 TYR A 105 6.402 -17.025 4.893 1.00 0.00 H new ATOM 0 HE2 TYR A 105 8.706 -20.611 4.788 1.00 0.00 H new ATOM 0 HH TYR A 105 7.210 -20.182 6.354 1.00 0.00 H new ATOM 1666 N ALA A 106 12.107 -16.448 2.580 1.00 0.00 N ATOM 1667 CA ALA A 106 13.077 -16.384 3.666 1.00 0.00 C ATOM 1668 C ALA A 106 13.406 -14.939 4.024 1.00 0.00 C ATOM 1669 O ALA A 106 13.817 -14.645 5.148 1.00 0.00 O ATOM 1670 CB ALA A 106 14.343 -17.138 3.287 1.00 0.00 C ATOM 0 H ALA A 106 12.448 -16.910 1.737 1.00 0.00 H new ATOM 0 HA ALA A 106 12.635 -16.856 4.544 1.00 0.00 H new ATOM 0 HB1 ALA A 106 15.059 -17.082 4.107 1.00 0.00 H new ATOM 0 HB2 ALA A 106 14.099 -18.182 3.089 1.00 0.00 H new ATOM 0 HB3 ALA A 106 14.779 -16.691 2.394 1.00 0.00 H new ATOM 1676 N LEU A 107 13.224 -14.040 3.063 1.00 0.00 N ATOM 1677 CA LEU A 107 13.502 -12.624 3.277 1.00 0.00 C ATOM 1678 C LEU A 107 12.460 -11.997 4.197 1.00 0.00 C ATOM 1679 O LEU A 107 12.801 -11.335 5.178 1.00 0.00 O ATOM 1680 CB LEU A 107 13.531 -11.882 1.940 1.00 0.00 C ATOM 1681 CG LEU A 107 14.689 -12.230 1.004 1.00 0.00 C ATOM 1682 CD1 LEU A 107 14.554 -11.483 -0.314 1.00 0.00 C ATOM 1683 CD2 LEU A 107 16.023 -11.910 1.665 1.00 0.00 C ATOM 0 H LEU A 107 12.885 -14.266 2.128 1.00 0.00 H new ATOM 0 HA LEU A 107 14.478 -12.539 3.754 1.00 0.00 H new ATOM 0 HB2 LEU A 107 12.595 -12.080 1.417 1.00 0.00 H new ATOM 0 HB3 LEU A 107 13.563 -10.811 2.142 1.00 0.00 H new ATOM 0 HG LEU A 107 14.654 -13.300 0.797 1.00 0.00 H new ATOM 0 HD11 LEU A 107 15.387 -11.743 -0.967 1.00 0.00 H new ATOM 0 HD12 LEU A 107 13.616 -11.760 -0.795 1.00 0.00 H new ATOM 0 HD13 LEU A 107 14.562 -10.409 -0.126 1.00 0.00 H new ATOM 0 HD21 LEU A 107 16.836 -12.164 0.985 1.00 0.00 H new ATOM 0 HD22 LEU A 107 16.066 -10.847 1.901 1.00 0.00 H new ATOM 0 HD23 LEU A 107 16.123 -12.490 2.582 1.00 0.00 H new ATOM 1695 N ILE A 108 11.188 -12.212 3.876 1.00 0.00 N ATOM 1696 CA ILE A 108 10.097 -11.671 4.676 1.00 0.00 C ATOM 1697 C ILE A 108 9.612 -12.688 5.704 1.00 0.00 C ATOM 1698 O ILE A 108 8.539 -12.534 6.288 1.00 0.00 O ATOM 1699 CB ILE A 108 8.909 -11.245 3.792 1.00 0.00 C ATOM 1700 CG1 ILE A 108 8.474 -12.403 2.892 1.00 0.00 C ATOM 1701 CG2 ILE A 108 9.280 -10.028 2.958 1.00 0.00 C ATOM 1702 CD1 ILE A 108 7.077 -12.242 2.334 1.00 0.00 C ATOM 0 H ILE A 108 10.888 -12.757 3.068 1.00 0.00 H new ATOM 0 HA ILE A 108 10.488 -10.795 5.192 1.00 0.00 H new ATOM 0 HB ILE A 108 8.072 -10.977 4.437 1.00 0.00 H new ATOM 0 HG12 ILE A 108 9.179 -12.495 2.065 1.00 0.00 H new ATOM 0 HG13 ILE A 108 8.525 -13.332 3.459 1.00 0.00 H new ATOM 0 HG21 ILE A 108 8.431 -9.739 2.339 1.00 0.00 H new ATOM 0 HG22 ILE A 108 9.546 -9.202 3.618 1.00 0.00 H new ATOM 0 HG23 ILE A 108 10.129 -10.270 2.319 1.00 0.00 H new ATOM 0 HD11 ILE A 108 6.835 -13.099 1.705 1.00 0.00 H new ATOM 0 HD12 ILE A 108 6.362 -12.181 3.155 1.00 0.00 H new ATOM 0 HD13 ILE A 108 7.026 -11.330 1.739 1.00 0.00 H new ATOM 1714 N LYS A 109 10.411 -13.727 5.922 1.00 0.00 N ATOM 1715 CA LYS A 109 10.066 -14.769 6.882 1.00 0.00 C ATOM 1716 C LYS A 109 10.061 -14.218 8.305 1.00 0.00 C ATOM 1717 O LYS A 109 9.553 -14.857 9.226 1.00 0.00 O ATOM 1718 CB LYS A 109 11.054 -15.933 6.779 1.00 0.00 C ATOM 1719 CG LYS A 109 10.729 -17.091 7.707 1.00 0.00 C ATOM 1720 CD LYS A 109 10.632 -18.403 6.947 1.00 0.00 C ATOM 1721 CE LYS A 109 12.005 -19.014 6.713 1.00 0.00 C ATOM 1722 NZ LYS A 109 11.961 -20.503 6.732 1.00 0.00 N ATOM 0 H LYS A 109 11.302 -13.870 5.447 1.00 0.00 H new ATOM 0 HA LYS A 109 9.064 -15.128 6.646 1.00 0.00 H new ATOM 0 HB2 LYS A 109 11.070 -16.295 5.751 1.00 0.00 H new ATOM 0 HB3 LYS A 109 12.056 -15.569 7.004 1.00 0.00 H new ATOM 0 HG2 LYS A 109 11.498 -17.170 8.475 1.00 0.00 H new ATOM 0 HG3 LYS A 109 9.787 -16.895 8.219 1.00 0.00 H new ATOM 0 HD2 LYS A 109 10.011 -19.103 7.506 1.00 0.00 H new ATOM 0 HD3 LYS A 109 10.139 -18.234 5.989 1.00 0.00 H new ATOM 0 HE2 LYS A 109 12.395 -18.675 5.753 1.00 0.00 H new ATOM 0 HE3 LYS A 109 12.695 -18.661 7.480 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 12.916 -20.881 6.569 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 11.613 -20.828 7.657 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 11.323 -20.841 5.984 1.00 0.00 H new ATOM 1736 N ASP A 110 10.627 -13.028 8.475 1.00 0.00 N ATOM 1737 CA ASP A 110 10.684 -12.390 9.785 1.00 0.00 C ATOM 1738 C ASP A 110 9.441 -11.541 10.031 1.00 0.00 C ATOM 1739 O ASP A 110 9.055 -11.303 11.176 1.00 0.00 O ATOM 1740 CB ASP A 110 11.939 -11.523 9.899 1.00 0.00 C ATOM 1741 CG ASP A 110 13.188 -12.251 9.442 1.00 0.00 C ATOM 1742 OD1 ASP A 110 13.824 -11.787 8.472 1.00 0.00 O ATOM 1743 OD2 ASP A 110 13.531 -13.283 10.055 1.00 0.00 O ATOM 0 H ASP A 110 11.052 -12.486 7.723 1.00 0.00 H new ATOM 0 HA ASP A 110 10.722 -13.174 10.542 1.00 0.00 H new ATOM 0 HB2 ASP A 110 11.809 -10.620 9.302 1.00 0.00 H new ATOM 0 HB3 ASP A 110 12.065 -11.205 10.934 1.00 0.00 H new ATOM 1748 N TYR A 111 8.819 -11.085 8.949 1.00 0.00 N ATOM 1749 CA TYR A 111 7.621 -10.259 9.047 1.00 0.00 C ATOM 1750 C TYR A 111 6.395 -11.016 8.544 1.00 0.00 C ATOM 1751 O TYR A 111 5.593 -10.481 7.778 1.00 0.00 O ATOM 1752 CB TYR A 111 7.800 -8.967 8.249 1.00 0.00 C ATOM 1753 CG TYR A 111 8.949 -8.111 8.732 1.00 0.00 C ATOM 1754 CD1 TYR A 111 8.718 -6.961 9.478 1.00 0.00 C ATOM 1755 CD2 TYR A 111 10.264 -8.451 8.443 1.00 0.00 C ATOM 1756 CE1 TYR A 111 9.764 -6.176 9.922 1.00 0.00 C ATOM 1757 CE2 TYR A 111 11.317 -7.672 8.883 1.00 0.00 C ATOM 1758 CZ TYR A 111 11.062 -6.535 9.622 1.00 0.00 C ATOM 1759 OH TYR A 111 12.107 -5.756 10.062 1.00 0.00 O ATOM 0 H TYR A 111 9.124 -11.273 7.994 1.00 0.00 H new ATOM 0 HA TYR A 111 7.467 -10.010 10.097 1.00 0.00 H new ATOM 0 HB2 TYR A 111 7.960 -9.217 7.200 1.00 0.00 H new ATOM 0 HB3 TYR A 111 6.879 -8.387 8.301 1.00 0.00 H new ATOM 0 HD1 TYR A 111 7.703 -6.677 9.714 1.00 0.00 H new ATOM 0 HD2 TYR A 111 10.467 -9.340 7.864 1.00 0.00 H new ATOM 0 HE1 TYR A 111 9.567 -5.286 10.501 1.00 0.00 H new ATOM 0 HE2 TYR A 111 12.334 -7.951 8.650 1.00 0.00 H new ATOM 0 HH TYR A 111 12.955 -6.149 9.766 1.00 0.00 H new ATOM 1769 N VAL A 112 6.257 -12.263 8.981 1.00 0.00 N ATOM 1770 CA VAL A 112 5.129 -13.094 8.577 1.00 0.00 C ATOM 1771 C VAL A 112 4.038 -13.094 9.641 1.00 0.00 C ATOM 1772 O VAL A 112 4.133 -13.801 10.645 1.00 0.00 O ATOM 1773 CB VAL A 112 5.569 -14.546 8.309 1.00 0.00 C ATOM 1774 CG1 VAL A 112 4.375 -15.486 8.371 1.00 0.00 C ATOM 1775 CG2 VAL A 112 6.271 -14.650 6.963 1.00 0.00 C ATOM 0 H VAL A 112 6.912 -12.720 9.615 1.00 0.00 H new ATOM 0 HA VAL A 112 4.734 -12.666 7.656 1.00 0.00 H new ATOM 0 HB VAL A 112 6.275 -14.843 9.085 1.00 0.00 H new ATOM 0 HG11 VAL A 112 4.705 -16.507 8.179 1.00 0.00 H new ATOM 0 HG12 VAL A 112 3.920 -15.432 9.360 1.00 0.00 H new ATOM 0 HG13 VAL A 112 3.643 -15.194 7.618 1.00 0.00 H new ATOM 0 HG21 VAL A 112 6.575 -15.682 6.790 1.00 0.00 H new ATOM 0 HG22 VAL A 112 5.590 -14.335 6.172 1.00 0.00 H new ATOM 0 HG23 VAL A 112 7.151 -14.007 6.961 1.00 0.00 H new ATOM 1910 N ILE A 122 -10.128 -1.264 12.671 1.00 0.00 N ATOM 1911 CA ILE A 122 -11.066 -2.097 11.929 1.00 0.00 C ATOM 1912 C ILE A 122 -12.498 -1.605 12.108 1.00 0.00 C ATOM 1913 O ILE A 122 -12.875 -1.141 13.183 1.00 0.00 O ATOM 1914 CB ILE A 122 -10.982 -3.570 12.370 1.00 0.00 C ATOM 1915 CG1 ILE A 122 -9.566 -4.109 12.157 1.00 0.00 C ATOM 1916 CG2 ILE A 122 -11.995 -4.410 11.607 1.00 0.00 C ATOM 1917 CD1 ILE A 122 -8.827 -4.391 13.446 1.00 0.00 C ATOM 0 HA ILE A 122 -10.788 -2.025 10.877 1.00 0.00 H new ATOM 0 HB ILE A 122 -11.217 -3.630 13.433 1.00 0.00 H new ATOM 0 HG12 ILE A 122 -9.619 -5.026 11.570 1.00 0.00 H new ATOM 0 HG13 ILE A 122 -8.996 -3.388 11.571 1.00 0.00 H new ATOM 0 HG21 ILE A 122 -11.923 -5.449 11.930 1.00 0.00 H new ATOM 0 HG22 ILE A 122 -13.000 -4.037 11.805 1.00 0.00 H new ATOM 0 HG23 ILE A 122 -11.789 -4.347 10.539 1.00 0.00 H new ATOM 0 HD11 ILE A 122 -7.831 -4.770 13.219 1.00 0.00 H new ATOM 0 HD12 ILE A 122 -8.742 -3.472 14.025 1.00 0.00 H new ATOM 0 HD13 ILE A 122 -9.375 -5.135 14.024 1.00 0.00 H new ATOM 1929 N GLU A 123 -13.292 -1.711 11.046 1.00 0.00 N ATOM 1930 CA GLU A 123 -14.683 -1.278 11.087 1.00 0.00 C ATOM 1931 C GLU A 123 -14.778 0.226 11.326 1.00 0.00 C ATOM 1932 O GLU A 123 -15.836 0.743 11.684 1.00 0.00 O ATOM 1933 CB GLU A 123 -15.442 -2.028 12.184 1.00 0.00 C ATOM 1934 CG GLU A 123 -16.699 -2.724 11.688 1.00 0.00 C ATOM 1935 CD GLU A 123 -17.951 -2.237 12.391 1.00 0.00 C ATOM 1936 OE1 GLU A 123 -18.911 -1.852 11.691 1.00 0.00 O ATOM 1937 OE2 GLU A 123 -17.971 -2.241 13.639 1.00 0.00 O ATOM 0 H GLU A 123 -12.995 -2.093 10.148 1.00 0.00 H new ATOM 0 HA GLU A 123 -15.135 -1.505 10.122 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -14.779 -2.769 12.631 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -15.713 -1.325 12.972 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -16.802 -2.560 10.615 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -16.598 -3.799 11.837 1.00 0.00 H new ATOM 1944 N ALA A 124 -13.664 0.922 11.125 1.00 0.00 N ATOM 1945 CA ALA A 124 -13.621 2.367 11.316 1.00 0.00 C ATOM 1946 C ALA A 124 -13.794 3.101 9.991 1.00 0.00 C ATOM 1947 O ALA A 124 -14.673 3.953 9.851 1.00 0.00 O ATOM 1948 CB ALA A 124 -12.314 2.772 11.980 1.00 0.00 C ATOM 0 H ALA A 124 -12.779 0.509 10.830 1.00 0.00 H new ATOM 0 HA ALA A 124 -14.449 2.648 11.967 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -12.295 3.853 12.117 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -12.232 2.282 12.950 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -11.477 2.471 11.350 1.00 0.00 H new ATOM 1954 N LYS A 125 -12.951 2.768 9.020 1.00 0.00 N ATOM 1955 CA LYS A 125 -13.010 3.395 7.705 1.00 0.00 C ATOM 1956 C LYS A 125 -14.276 2.981 6.961 1.00 0.00 C ATOM 1957 O LYS A 125 -14.735 3.683 6.060 1.00 0.00 O ATOM 1958 CB LYS A 125 -11.776 3.019 6.882 1.00 0.00 C ATOM 1959 CG LYS A 125 -11.513 3.957 5.717 1.00 0.00 C ATOM 1960 CD LYS A 125 -10.045 3.960 5.324 1.00 0.00 C ATOM 1961 CE LYS A 125 -9.828 4.647 3.984 1.00 0.00 C ATOM 1962 NZ LYS A 125 -8.448 4.433 3.468 1.00 0.00 N ATOM 0 H LYS A 125 -12.218 2.066 9.119 1.00 0.00 H new ATOM 0 HA LYS A 125 -13.030 4.476 7.846 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -10.903 3.010 7.535 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -11.899 2.005 6.501 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -12.119 3.656 4.862 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -11.821 4.968 5.986 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -9.462 4.468 6.093 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -9.679 2.935 5.272 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -10.549 4.267 3.260 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -10.015 5.716 4.089 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -8.340 4.917 2.554 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -7.760 4.818 4.146 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -8.278 3.415 3.343 1.00 0.00 H new ATOM 1976 N VAL A 126 -14.836 1.839 7.346 1.00 0.00 N ATOM 1977 CA VAL A 126 -16.050 1.333 6.717 1.00 0.00 C ATOM 1978 C VAL A 126 -17.293 1.958 7.340 1.00 0.00 C ATOM 1979 O VAL A 126 -18.352 2.016 6.714 1.00 0.00 O ATOM 1980 CB VAL A 126 -16.146 -0.200 6.834 1.00 0.00 C ATOM 1981 CG1 VAL A 126 -17.437 -0.703 6.206 1.00 0.00 C ATOM 1982 CG2 VAL A 126 -14.937 -0.860 6.189 1.00 0.00 C ATOM 0 H VAL A 126 -14.468 1.247 8.091 1.00 0.00 H new ATOM 0 HA VAL A 126 -15.998 1.607 5.663 1.00 0.00 H new ATOM 0 HB VAL A 126 -16.156 -0.467 7.891 1.00 0.00 H new ATOM 0 HG11 VAL A 126 -17.488 -1.788 6.298 1.00 0.00 H new ATOM 0 HG12 VAL A 126 -18.289 -0.255 6.718 1.00 0.00 H new ATOM 0 HG13 VAL A 126 -17.461 -0.427 5.152 1.00 0.00 H new ATOM 0 HG21 VAL A 126 -15.021 -1.943 6.281 1.00 0.00 H new ATOM 0 HG22 VAL A 126 -14.893 -0.588 5.134 1.00 0.00 H new ATOM 0 HG23 VAL A 126 -14.029 -0.523 6.689 1.00 0.00 H new ATOM 1992 N ARG A 127 -17.156 2.427 8.576 1.00 0.00 N ATOM 1993 CA ARG A 127 -18.269 3.048 9.285 1.00 0.00 C ATOM 1994 C ARG A 127 -18.405 4.518 8.901 1.00 0.00 C ATOM 1995 O ARG A 127 -19.474 5.111 9.045 1.00 0.00 O ATOM 1996 CB ARG A 127 -18.072 2.921 10.797 1.00 0.00 C ATOM 1997 CG ARG A 127 -18.586 1.611 11.370 1.00 0.00 C ATOM 1998 CD ARG A 127 -20.106 1.585 11.425 1.00 0.00 C ATOM 1999 NE ARG A 127 -20.606 0.448 12.194 1.00 0.00 N ATOM 2000 CZ ARG A 127 -20.675 0.431 13.520 1.00 0.00 C ATOM 2001 NH1 ARG A 127 -20.278 1.484 14.221 1.00 0.00 N ATOM 2002 NH2 ARG A 127 -21.142 -0.640 14.148 1.00 0.00 N ATOM 0 H ARG A 127 -16.286 2.389 9.107 1.00 0.00 H new ATOM 0 HA ARG A 127 -19.184 2.529 9.000 1.00 0.00 H new ATOM 0 HB2 ARG A 127 -17.011 3.016 11.026 1.00 0.00 H new ATOM 0 HB3 ARG A 127 -18.580 3.749 11.292 1.00 0.00 H new ATOM 0 HG2 ARG A 127 -18.229 0.781 10.761 1.00 0.00 H new ATOM 0 HG3 ARG A 127 -18.182 1.468 12.372 1.00 0.00 H new ATOM 0 HD2 ARG A 127 -20.469 2.511 11.870 1.00 0.00 H new ATOM 0 HD3 ARG A 127 -20.505 1.541 10.412 1.00 0.00 H new ATOM 0 HE ARG A 127 -20.919 -0.378 11.684 1.00 0.00 H new ATOM 0 HH11 ARG A 127 -19.919 2.310 13.742 1.00 0.00 H new ATOM 0 HH12 ARG A 127 -20.332 1.468 15.239 1.00 0.00 H new ATOM 0 HH21 ARG A 127 -21.449 -1.452 13.612 1.00 0.00 H new ATOM 0 HH22 ARG A 127 -21.194 -0.652 15.167 1.00 0.00 H new ATOM 2016 N MET A 128 -17.315 5.100 8.411 1.00 0.00 N ATOM 2017 CA MET A 128 -17.314 6.501 8.005 1.00 0.00 C ATOM 2018 C MET A 128 -17.599 6.635 6.513 1.00 0.00 C ATOM 2019 O MET A 128 -18.134 7.648 6.062 1.00 0.00 O ATOM 2020 CB MET A 128 -15.970 7.150 8.340 1.00 0.00 C ATOM 2021 CG MET A 128 -14.776 6.406 7.764 1.00 0.00 C ATOM 2022 SD MET A 128 -13.525 7.516 7.090 1.00 0.00 S ATOM 2023 CE MET A 128 -14.430 8.266 5.739 1.00 0.00 C ATOM 0 H MET A 128 -16.422 4.624 8.286 1.00 0.00 H new ATOM 0 HA MET A 128 -18.104 7.013 8.555 1.00 0.00 H new ATOM 0 HB2 MET A 128 -15.966 8.173 7.964 1.00 0.00 H new ATOM 0 HB3 MET A 128 -15.864 7.208 9.423 1.00 0.00 H new ATOM 0 HG2 MET A 128 -14.327 5.789 8.543 1.00 0.00 H new ATOM 0 HG3 MET A 128 -15.118 5.731 6.980 1.00 0.00 H new ATOM 0 HE1 MET A 128 -13.735 8.548 4.948 1.00 0.00 H new ATOM 0 HE2 MET A 128 -15.156 7.553 5.348 1.00 0.00 H new ATOM 0 HE3 MET A 128 -14.950 9.154 6.098 1.00 0.00 H new ATOM 2033 N ARG A 129 -17.238 5.607 5.751 1.00 0.00 N ATOM 2034 CA ARG A 129 -17.454 5.612 4.310 1.00 0.00 C ATOM 2035 C ARG A 129 -18.848 5.094 3.967 1.00 0.00 C ATOM 2036 O ARG A 129 -19.407 5.431 2.923 1.00 0.00 O ATOM 2037 CB ARG A 129 -16.395 4.757 3.611 1.00 0.00 C ATOM 2038 CG ARG A 129 -16.616 3.261 3.772 1.00 0.00 C ATOM 2039 CD ARG A 129 -17.274 2.661 2.539 1.00 0.00 C ATOM 2040 NE ARG A 129 -16.821 1.295 2.287 1.00 0.00 N ATOM 2041 CZ ARG A 129 -15.596 0.992 1.875 1.00 0.00 C ATOM 2042 NH1 ARG A 129 -14.705 1.953 1.669 1.00 0.00 N ATOM 2043 NH2 ARG A 129 -15.259 -0.275 1.668 1.00 0.00 N ATOM 0 H ARG A 129 -16.795 4.761 6.108 1.00 0.00 H new ATOM 0 HA ARG A 129 -17.371 6.641 3.959 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -16.385 5.002 2.549 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -15.413 5.015 4.007 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -15.661 2.768 3.953 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -17.241 3.076 4.646 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -18.356 2.666 2.667 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -17.053 3.282 1.671 1.00 0.00 H new ATOM 0 HE ARG A 129 -17.482 0.533 2.436 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -14.960 2.928 1.827 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -13.764 1.717 1.352 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -15.941 -1.017 1.825 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -14.318 -0.507 1.351 1.00 0.00 H new ATOM 2057 N SER A 130 -19.403 4.272 4.852 1.00 0.00 N ATOM 2058 CA SER A 130 -20.729 3.705 4.642 1.00 0.00 C ATOM 2059 C SER A 130 -21.793 4.529 5.359 1.00 0.00 C ATOM 2060 O SER A 130 -22.844 4.011 5.740 1.00 0.00 O ATOM 2061 CB SER A 130 -20.771 2.257 5.135 1.00 0.00 C ATOM 2062 OG SER A 130 -19.746 1.484 4.536 1.00 0.00 O ATOM 0 H SER A 130 -18.954 3.984 5.722 1.00 0.00 H new ATOM 0 HA SER A 130 -20.940 3.724 3.573 1.00 0.00 H new ATOM 0 HB2 SER A 130 -20.660 2.235 6.219 1.00 0.00 H new ATOM 0 HB3 SER A 130 -21.742 1.819 4.905 1.00 0.00 H new ATOM 0 HG SER A 130 -18.974 1.442 5.138 1.00 0.00 H new