USER MOD reduce.3.24.130724 H: found=0, std=0, add=1062, rem=0, adj=30 USER MOD reduce.3.24.130724 removed 1060 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 12 SER OG : rot 24:sc= 0.62 USER MOD Set 1.2: A 96 THR OG1 : rot 140:sc= 0.429 USER MOD Set 2.1: A 69 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 114 THR OG1 : rot -82:sc= 0.318 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -173:sc= -0.267 (180deg=-0.428) USER MOD Single : A 8 SER OG : rot 180:sc= 0 USER MOD Single : A 14 SER OG : rot -22:sc= 0.85 USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 27 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 MET CE :methyl 162:sc= -0.0932 (180deg=-0.475) USER MOD Single : A 38 GLN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 41 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 43 ASN : amide:sc= 0 X(o=0,f=-0.056) USER MOD Single : A 45 MET CE :methyl -113:sc= -0.778 (180deg=-1.43!) USER MOD Single : A 47 LYS NZ :NH3+ 167:sc= -0.0369 (180deg=-0.225) USER MOD Single : A 48 TYR OH : rot 100:sc= -0.537 USER MOD Single : A 49 TYR OH : rot 130:sc= -0.783 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= -0.174 K(o=-0.17,f=-1.8) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 62 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 ASN : amide:sc= -0.487 K(o=-0.49,f=-1) USER MOD Single : A 71 SER OG : rot -5:sc= -0.0856 USER MOD Single : A 75 LYS NZ :NH3+ 170:sc= -0.0201 (180deg=-0.149) USER MOD Single : A 76 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 GLN : amide:sc= -0.384 X(o=-0.38,f=-0.13) USER MOD Single : A 83 GLN : amide:sc= -0.0766 K(o=-0.077,f=-0.67) USER MOD Single : A 89 ASN : amide:sc= -2.97! K(o=-3!,f=-1.2) USER MOD Single : A 90 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 94 THR OG1 : rot -83:sc= 0.834 USER MOD Single : A 95 THR OG1 : rot 76:sc= 0.61 USER MOD Single : A 98 GLN : amide:sc= 0 X(o=0,f=-0.5) USER MOD Single : A 99 HIS : no HE2:sc= -2.45 K(o=-2.5,f=-5.1!) USER MOD Single : A 100 HIS : no HD1:sc= -0.509 K(o=-0.51,f=-2.5) USER MOD Single : A 101 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.000578) USER MOD Single : A 111 MET CE :methyl -108:sc= -0.62 (180deg=-3.44!) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 122 LYS NZ :NH3+ -150:sc= -0.706 (180deg=-0.963) USER MOD Single : A 124 MET CE :methyl 159:sc= -0.153 (180deg=-0.756) USER MOD Single : A 128 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 2.550 -14.304 -13.305 1.00 0.00 N ATOM 2 CA MET A 1 1.668 -13.944 -14.444 1.00 0.00 C ATOM 3 C MET A 1 2.093 -12.616 -15.062 1.00 0.00 C ATOM 4 O MET A 1 1.470 -12.133 -16.007 1.00 0.00 O ATOM 5 CB MET A 1 0.214 -13.853 -13.978 1.00 0.00 C ATOM 6 CG MET A 1 -0.333 -15.157 -13.422 1.00 0.00 C ATOM 7 SD MET A 1 -0.404 -16.466 -14.661 1.00 0.00 S ATOM 8 CE MET A 1 -1.119 -17.798 -13.702 1.00 0.00 C ATOM 0 H1 MET A 1 2.318 -15.263 -12.976 1.00 0.00 H new ATOM 0 H2 MET A 1 3.543 -14.274 -13.612 1.00 0.00 H new ATOM 0 H3 MET A 1 2.407 -13.628 -12.528 1.00 0.00 H new ATOM 0 HA MET A 1 1.756 -14.724 -15.200 1.00 0.00 H new ATOM 0 HB2 MET A 1 0.135 -13.081 -13.213 1.00 0.00 H new ATOM 0 HB3 MET A 1 -0.407 -13.537 -14.816 1.00 0.00 H new ATOM 0 HG2 MET A 1 0.291 -15.483 -12.590 1.00 0.00 H new ATOM 0 HG3 MET A 1 -1.333 -14.986 -13.022 1.00 0.00 H new ATOM 0 HE1 MET A 1 -1.227 -18.682 -14.331 1.00 0.00 H new ATOM 0 HE2 MET A 1 -0.468 -18.030 -12.859 1.00 0.00 H new ATOM 0 HE3 MET A 1 -2.098 -17.495 -13.331 1.00 0.00 H new ATOM 18 N ASP A 2 3.157 -12.032 -14.521 1.00 0.00 N ATOM 19 CA ASP A 2 3.668 -10.759 -15.017 1.00 0.00 C ATOM 20 C ASP A 2 5.167 -10.843 -15.282 1.00 0.00 C ATOM 21 O ASP A 2 5.920 -11.382 -14.469 1.00 0.00 O ATOM 22 CB ASP A 2 3.379 -9.646 -14.010 1.00 0.00 C ATOM 23 CG ASP A 2 4.045 -9.889 -12.670 1.00 0.00 C ATOM 24 OD1 ASP A 2 5.206 -9.460 -12.497 1.00 0.00 O ATOM 25 OD2 ASP A 2 3.408 -10.509 -11.793 1.00 0.00 O ATOM 0 H ASP A 2 3.683 -12.420 -13.738 1.00 0.00 H new ATOM 0 HA ASP A 2 3.163 -10.532 -15.956 1.00 0.00 H new ATOM 0 HB2 ASP A 2 3.723 -8.695 -14.416 1.00 0.00 H new ATOM 0 HB3 ASP A 2 2.302 -9.561 -13.867 1.00 0.00 H new ATOM 30 N ALA A 3 5.592 -10.306 -16.423 1.00 0.00 N ATOM 31 CA ALA A 3 7.002 -10.319 -16.800 1.00 0.00 C ATOM 32 C ALA A 3 7.550 -11.742 -16.832 1.00 0.00 C ATOM 33 O ALA A 3 6.792 -12.711 -16.775 1.00 0.00 O ATOM 34 CB ALA A 3 7.812 -9.460 -15.840 1.00 0.00 C ATOM 0 H ALA A 3 4.979 -9.856 -17.103 1.00 0.00 H new ATOM 0 HA ALA A 3 7.088 -9.903 -17.804 1.00 0.00 H new ATOM 0 HB1 ALA A 3 8.862 -9.478 -16.133 1.00 0.00 H new ATOM 0 HB2 ALA A 3 7.445 -8.434 -15.871 1.00 0.00 H new ATOM 0 HB3 ALA A 3 7.711 -9.851 -14.828 1.00 0.00 H new ATOM 40 N LEU A 4 8.870 -11.862 -16.928 1.00 0.00 N ATOM 41 CA LEU A 4 9.517 -13.168 -16.965 1.00 0.00 C ATOM 42 C LEU A 4 9.770 -13.684 -15.552 1.00 0.00 C ATOM 43 O LEU A 4 10.347 -14.756 -15.366 1.00 0.00 O ATOM 44 CB LEU A 4 10.838 -13.088 -17.732 1.00 0.00 C ATOM 45 CG LEU A 4 10.722 -12.646 -19.193 1.00 0.00 C ATOM 46 CD1 LEU A 4 12.102 -12.531 -19.824 1.00 0.00 C ATOM 47 CD2 LEU A 4 9.859 -13.622 -19.980 1.00 0.00 C ATOM 0 H LEU A 4 9.512 -11.071 -16.982 1.00 0.00 H new ATOM 0 HA LEU A 4 8.851 -13.862 -17.477 1.00 0.00 H new ATOM 0 HB2 LEU A 4 11.499 -12.395 -17.212 1.00 0.00 H new ATOM 0 HB3 LEU A 4 11.316 -14.067 -17.703 1.00 0.00 H new ATOM 0 HG LEU A 4 10.245 -11.666 -19.219 1.00 0.00 H new ATOM 0 HD11 LEU A 4 12.002 -12.216 -20.863 1.00 0.00 H new ATOM 0 HD12 LEU A 4 12.692 -11.796 -19.277 1.00 0.00 H new ATOM 0 HD13 LEU A 4 12.602 -13.499 -19.785 1.00 0.00 H new ATOM 0 HD21 LEU A 4 9.788 -13.291 -21.016 1.00 0.00 H new ATOM 0 HD22 LEU A 4 10.308 -14.614 -19.946 1.00 0.00 H new ATOM 0 HD23 LEU A 4 8.861 -13.660 -19.542 1.00 0.00 H new ATOM 59 N GLU A 5 9.336 -12.912 -14.560 1.00 0.00 N ATOM 60 CA GLU A 5 9.519 -13.289 -13.163 1.00 0.00 C ATOM 61 C GLU A 5 8.310 -14.059 -12.643 1.00 0.00 C ATOM 62 O GLU A 5 7.298 -14.187 -13.333 1.00 0.00 O ATOM 63 CB GLU A 5 9.753 -12.043 -12.306 1.00 0.00 C ATOM 64 CG GLU A 5 11.004 -11.267 -12.687 1.00 0.00 C ATOM 65 CD GLU A 5 12.266 -12.101 -12.571 1.00 0.00 C ATOM 66 OE1 GLU A 5 12.754 -12.286 -11.437 1.00 0.00 O ATOM 67 OE2 GLU A 5 12.767 -12.566 -13.616 1.00 0.00 O ATOM 0 H GLU A 5 8.856 -12.023 -14.698 1.00 0.00 H new ATOM 0 HA GLU A 5 10.393 -13.937 -13.098 1.00 0.00 H new ATOM 0 HB2 GLU A 5 8.888 -11.386 -12.392 1.00 0.00 H new ATOM 0 HB3 GLU A 5 9.825 -12.340 -11.260 1.00 0.00 H new ATOM 0 HG2 GLU A 5 10.905 -10.905 -13.710 1.00 0.00 H new ATOM 0 HG3 GLU A 5 11.092 -10.390 -12.046 1.00 0.00 H new ATOM 74 N GLY A 6 8.424 -14.572 -11.422 1.00 0.00 N ATOM 75 CA GLY A 6 7.334 -15.323 -10.828 1.00 0.00 C ATOM 76 C GLY A 6 7.045 -14.893 -9.403 1.00 0.00 C ATOM 77 O GLY A 6 7.069 -15.713 -8.486 1.00 0.00 O ATOM 0 H GLY A 6 9.252 -14.481 -10.833 1.00 0.00 H new ATOM 0 HA2 GLY A 6 6.436 -15.195 -11.433 1.00 0.00 H new ATOM 0 HA3 GLY A 6 7.578 -16.385 -10.842 1.00 0.00 H new ATOM 81 N GLU A 7 6.771 -13.601 -9.222 1.00 0.00 N ATOM 82 CA GLU A 7 6.475 -13.044 -7.902 1.00 0.00 C ATOM 83 C GLU A 7 7.670 -13.190 -6.961 1.00 0.00 C ATOM 84 O GLU A 7 8.446 -12.251 -6.782 1.00 0.00 O ATOM 85 CB GLU A 7 5.239 -13.717 -7.298 1.00 0.00 C ATOM 86 CG GLU A 7 3.976 -13.524 -8.122 1.00 0.00 C ATOM 87 CD GLU A 7 2.760 -14.169 -7.485 1.00 0.00 C ATOM 88 OE1 GLU A 7 2.110 -13.511 -6.647 1.00 0.00 O ATOM 89 OE2 GLU A 7 2.460 -15.333 -7.826 1.00 0.00 O ATOM 0 H GLU A 7 6.748 -12.917 -9.978 1.00 0.00 H new ATOM 0 HA GLU A 7 6.269 -11.981 -8.027 1.00 0.00 H new ATOM 0 HB2 GLU A 7 5.433 -14.784 -7.191 1.00 0.00 H new ATOM 0 HB3 GLU A 7 5.073 -13.321 -6.296 1.00 0.00 H new ATOM 0 HG2 GLU A 7 3.791 -12.458 -8.252 1.00 0.00 H new ATOM 0 HG3 GLU A 7 4.127 -13.945 -9.116 1.00 0.00 H new ATOM 96 N SER A 8 7.811 -14.368 -6.360 1.00 0.00 N ATOM 97 CA SER A 8 8.911 -14.630 -5.438 1.00 0.00 C ATOM 98 C SER A 8 9.894 -15.631 -6.035 1.00 0.00 C ATOM 99 O SER A 8 9.497 -16.682 -6.538 1.00 0.00 O ATOM 100 CB SER A 8 8.377 -15.161 -4.106 1.00 0.00 C ATOM 101 OG SER A 8 7.484 -14.237 -3.510 1.00 0.00 O ATOM 0 H SER A 8 7.177 -15.156 -6.495 1.00 0.00 H new ATOM 0 HA SER A 8 9.434 -13.690 -5.263 1.00 0.00 H new ATOM 0 HB2 SER A 8 7.868 -16.111 -4.268 1.00 0.00 H new ATOM 0 HB3 SER A 8 9.209 -15.356 -3.429 1.00 0.00 H new ATOM 0 HG SER A 8 7.156 -14.600 -2.661 1.00 0.00 H new ATOM 107 N PHE A 9 11.180 -15.299 -5.976 1.00 0.00 N ATOM 108 CA PHE A 9 12.220 -16.171 -6.510 1.00 0.00 C ATOM 109 C PHE A 9 13.547 -15.944 -5.790 1.00 0.00 C ATOM 110 O PHE A 9 14.226 -16.897 -5.409 1.00 0.00 O ATOM 111 CB PHE A 9 12.391 -15.934 -8.012 1.00 0.00 C ATOM 112 CG PHE A 9 13.315 -16.916 -8.674 1.00 0.00 C ATOM 113 CD1 PHE A 9 12.853 -18.158 -9.078 1.00 0.00 C ATOM 114 CD2 PHE A 9 14.645 -16.596 -8.896 1.00 0.00 C ATOM 115 CE1 PHE A 9 13.700 -19.062 -9.690 1.00 0.00 C ATOM 116 CE2 PHE A 9 15.497 -17.497 -9.506 1.00 0.00 C ATOM 117 CZ PHE A 9 15.023 -18.731 -9.903 1.00 0.00 C ATOM 0 H PHE A 9 11.527 -14.433 -5.564 1.00 0.00 H new ATOM 0 HA PHE A 9 11.913 -17.204 -6.345 1.00 0.00 H new ATOM 0 HB2 PHE A 9 11.414 -15.986 -8.493 1.00 0.00 H new ATOM 0 HB3 PHE A 9 12.772 -14.925 -8.171 1.00 0.00 H new ATOM 0 HD1 PHE A 9 11.819 -18.423 -8.913 1.00 0.00 H new ATOM 0 HD2 PHE A 9 15.020 -15.631 -8.589 1.00 0.00 H new ATOM 0 HE1 PHE A 9 13.327 -20.027 -10.001 1.00 0.00 H new ATOM 0 HE2 PHE A 9 16.532 -17.236 -9.672 1.00 0.00 H new ATOM 0 HZ PHE A 9 15.687 -19.437 -10.380 1.00 0.00 H new ATOM 127 N ALA A 10 13.907 -14.677 -5.608 1.00 0.00 N ATOM 128 CA ALA A 10 15.154 -14.327 -4.937 1.00 0.00 C ATOM 129 C ALA A 10 14.903 -13.414 -3.740 1.00 0.00 C ATOM 130 O ALA A 10 13.844 -12.796 -3.629 1.00 0.00 O ATOM 131 CB ALA A 10 16.109 -13.664 -5.918 1.00 0.00 C ATOM 0 H ALA A 10 13.354 -13.877 -5.915 1.00 0.00 H new ATOM 0 HA ALA A 10 15.607 -15.246 -4.566 1.00 0.00 H new ATOM 0 HB1 ALA A 10 17.036 -13.407 -5.406 1.00 0.00 H new ATOM 0 HB2 ALA A 10 16.325 -14.351 -6.736 1.00 0.00 H new ATOM 0 HB3 ALA A 10 15.651 -12.758 -6.316 1.00 0.00 H new ATOM 137 N LEU A 11 15.886 -13.337 -2.849 1.00 0.00 N ATOM 138 CA LEU A 11 15.777 -12.503 -1.657 1.00 0.00 C ATOM 139 C LEU A 11 16.465 -11.157 -1.865 1.00 0.00 C ATOM 140 O LEU A 11 17.507 -11.076 -2.515 1.00 0.00 O ATOM 141 CB LEU A 11 16.392 -13.218 -0.451 1.00 0.00 C ATOM 142 CG LEU A 11 15.729 -14.545 -0.072 1.00 0.00 C ATOM 143 CD1 LEU A 11 16.517 -15.237 1.029 1.00 0.00 C ATOM 144 CD2 LEU A 11 14.289 -14.315 0.365 1.00 0.00 C ATOM 0 H LEU A 11 16.768 -13.843 -2.930 1.00 0.00 H new ATOM 0 HA LEU A 11 14.719 -12.324 -1.468 1.00 0.00 H new ATOM 0 HB2 LEU A 11 17.446 -13.403 -0.657 1.00 0.00 H new ATOM 0 HB3 LEU A 11 16.348 -12.550 0.409 1.00 0.00 H new ATOM 0 HG LEU A 11 15.723 -15.192 -0.949 1.00 0.00 H new ATOM 0 HD11 LEU A 11 16.032 -16.179 1.287 1.00 0.00 H new ATOM 0 HD12 LEU A 11 17.531 -15.434 0.682 1.00 0.00 H new ATOM 0 HD13 LEU A 11 16.553 -14.595 1.909 1.00 0.00 H new ATOM 0 HD21 LEU A 11 13.833 -15.269 0.631 1.00 0.00 H new ATOM 0 HD22 LEU A 11 14.273 -13.651 1.230 1.00 0.00 H new ATOM 0 HD23 LEU A 11 13.729 -13.860 -0.452 1.00 0.00 H new ATOM 156 N SER A 12 15.873 -10.105 -1.311 1.00 0.00 N ATOM 157 CA SER A 12 16.428 -8.762 -1.433 1.00 0.00 C ATOM 158 C SER A 12 16.974 -8.279 -0.093 1.00 0.00 C ATOM 159 O SER A 12 16.277 -8.311 0.921 1.00 0.00 O ATOM 160 CB SER A 12 15.364 -7.789 -1.944 1.00 0.00 C ATOM 161 OG SER A 12 14.235 -7.772 -1.088 1.00 0.00 O ATOM 0 H SER A 12 15.008 -10.156 -0.773 1.00 0.00 H new ATOM 0 HA SER A 12 17.248 -8.798 -2.150 1.00 0.00 H new ATOM 0 HB2 SER A 12 15.787 -6.787 -2.013 1.00 0.00 H new ATOM 0 HB3 SER A 12 15.057 -8.076 -2.950 1.00 0.00 H new ATOM 0 HG SER A 12 14.498 -8.072 -0.193 1.00 0.00 H new ATOM 167 N PHE A 13 18.227 -7.832 -0.097 1.00 0.00 N ATOM 168 CA PHE A 13 18.867 -7.343 1.117 1.00 0.00 C ATOM 169 C PHE A 13 19.863 -6.231 0.799 1.00 0.00 C ATOM 170 O PHE A 13 20.558 -5.735 1.686 1.00 0.00 O ATOM 171 CB PHE A 13 19.574 -8.489 1.845 1.00 0.00 C ATOM 172 CG PHE A 13 20.545 -9.243 0.979 1.00 0.00 C ATOM 173 CD1 PHE A 13 20.122 -10.325 0.223 1.00 0.00 C ATOM 174 CD2 PHE A 13 21.877 -8.868 0.922 1.00 0.00 C ATOM 175 CE1 PHE A 13 21.012 -11.020 -0.574 1.00 0.00 C ATOM 176 CE2 PHE A 13 22.772 -9.561 0.127 1.00 0.00 C ATOM 177 CZ PHE A 13 22.338 -10.637 -0.621 1.00 0.00 C ATOM 0 H PHE A 13 18.818 -7.799 -0.928 1.00 0.00 H new ATOM 0 HA PHE A 13 18.092 -6.935 1.766 1.00 0.00 H new ATOM 0 HB2 PHE A 13 20.105 -8.087 2.708 1.00 0.00 H new ATOM 0 HB3 PHE A 13 18.825 -9.183 2.226 1.00 0.00 H new ATOM 0 HD1 PHE A 13 19.086 -10.628 0.257 1.00 0.00 H new ATOM 0 HD2 PHE A 13 22.220 -8.026 1.504 1.00 0.00 H new ATOM 0 HE1 PHE A 13 20.671 -11.861 -1.159 1.00 0.00 H new ATOM 0 HE2 PHE A 13 23.809 -9.261 0.092 1.00 0.00 H new ATOM 0 HZ PHE A 13 23.035 -11.179 -1.243 1.00 0.00 H new ATOM 187 N SER A 14 19.927 -5.845 -0.473 1.00 0.00 N ATOM 188 CA SER A 14 20.836 -4.790 -0.905 1.00 0.00 C ATOM 189 C SER A 14 20.236 -3.413 -0.636 1.00 0.00 C ATOM 190 O SER A 14 20.799 -2.392 -1.031 1.00 0.00 O ATOM 191 CB SER A 14 21.155 -4.939 -2.394 1.00 0.00 C ATOM 192 OG SER A 14 22.063 -3.939 -2.825 1.00 0.00 O ATOM 0 H SER A 14 19.361 -6.247 -1.220 1.00 0.00 H new ATOM 0 HA SER A 14 21.759 -4.883 -0.333 1.00 0.00 H new ATOM 0 HB2 SER A 14 21.580 -5.925 -2.581 1.00 0.00 H new ATOM 0 HB3 SER A 14 20.235 -4.873 -2.974 1.00 0.00 H new ATOM 0 HG SER A 14 22.026 -3.177 -2.210 1.00 0.00 H new ATOM 198 N SER A 15 19.092 -3.395 0.040 1.00 0.00 N ATOM 199 CA SER A 15 18.414 -2.145 0.363 1.00 0.00 C ATOM 200 C SER A 15 17.544 -2.302 1.606 1.00 0.00 C ATOM 201 O SER A 15 17.357 -1.355 2.369 1.00 0.00 O ATOM 202 CB SER A 15 17.558 -1.686 -0.819 1.00 0.00 C ATOM 203 OG SER A 15 16.585 -2.661 -1.150 1.00 0.00 O ATOM 0 H SER A 15 18.615 -4.232 0.375 1.00 0.00 H new ATOM 0 HA SER A 15 19.174 -1.391 0.568 1.00 0.00 H new ATOM 0 HB2 SER A 15 17.066 -0.745 -0.573 1.00 0.00 H new ATOM 0 HB3 SER A 15 18.196 -1.496 -1.682 1.00 0.00 H new ATOM 0 HG SER A 15 16.049 -2.344 -1.907 1.00 0.00 H new ATOM 209 N ALA A 16 17.014 -3.507 1.801 1.00 0.00 N ATOM 210 CA ALA A 16 16.162 -3.793 2.951 1.00 0.00 C ATOM 211 C ALA A 16 16.932 -3.645 4.258 1.00 0.00 C ATOM 212 O ALA A 16 16.525 -2.898 5.149 1.00 0.00 O ATOM 213 CB ALA A 16 15.583 -5.194 2.835 1.00 0.00 C ATOM 0 H ALA A 16 17.160 -4.301 1.177 1.00 0.00 H new ATOM 0 HA ALA A 16 15.347 -3.070 2.959 1.00 0.00 H new ATOM 0 HB1 ALA A 16 14.949 -5.398 3.698 1.00 0.00 H new ATOM 0 HB2 ALA A 16 14.990 -5.268 1.923 1.00 0.00 H new ATOM 0 HB3 ALA A 16 16.394 -5.921 2.801 1.00 0.00 H new ATOM 219 N SER A 17 18.046 -4.362 4.369 1.00 0.00 N ATOM 220 CA SER A 17 18.874 -4.308 5.569 1.00 0.00 C ATOM 221 C SER A 17 19.775 -3.077 5.554 1.00 0.00 C ATOM 222 O SER A 17 20.624 -2.906 6.428 1.00 0.00 O ATOM 223 CB SER A 17 19.724 -5.575 5.685 1.00 0.00 C ATOM 224 OG SER A 17 20.584 -5.717 4.567 1.00 0.00 O ATOM 0 H SER A 17 18.396 -4.987 3.643 1.00 0.00 H new ATOM 0 HA SER A 17 18.213 -4.242 6.433 1.00 0.00 H new ATOM 0 HB2 SER A 17 20.315 -5.537 6.600 1.00 0.00 H new ATOM 0 HB3 SER A 17 19.074 -6.447 5.761 1.00 0.00 H new ATOM 0 HG SER A 17 21.117 -6.533 4.666 1.00 0.00 H new ATOM 230 N ASP A 18 19.581 -2.222 4.554 1.00 0.00 N ATOM 231 CA ASP A 18 20.375 -1.005 4.425 1.00 0.00 C ATOM 232 C ASP A 18 19.573 0.216 4.868 1.00 0.00 C ATOM 233 O ASP A 18 18.394 0.109 5.205 1.00 0.00 O ATOM 234 CB ASP A 18 20.846 -0.828 2.980 1.00 0.00 C ATOM 235 CG ASP A 18 21.788 -1.933 2.540 1.00 0.00 C ATOM 236 OD1 ASP A 18 21.296 -2.990 2.092 1.00 0.00 O ATOM 237 OD2 ASP A 18 23.018 -1.741 2.642 1.00 0.00 O ATOM 0 H ASP A 18 18.882 -2.349 3.822 1.00 0.00 H new ATOM 0 HA ASP A 18 21.247 -1.098 5.072 1.00 0.00 H new ATOM 0 HB2 ASP A 18 19.980 -0.807 2.318 1.00 0.00 H new ATOM 0 HB3 ASP A 18 21.347 0.135 2.879 1.00 0.00 H new ATOM 242 N ALA A 19 20.224 1.375 4.865 1.00 0.00 N ATOM 243 CA ALA A 19 19.581 2.620 5.270 1.00 0.00 C ATOM 244 C ALA A 19 18.504 3.043 4.275 1.00 0.00 C ATOM 245 O ALA A 19 17.584 3.785 4.623 1.00 0.00 O ATOM 246 CB ALA A 19 20.619 3.720 5.423 1.00 0.00 C ATOM 0 H ALA A 19 21.200 1.478 4.586 1.00 0.00 H new ATOM 0 HA ALA A 19 19.096 2.449 6.231 1.00 0.00 H new ATOM 0 HB1 ALA A 19 20.127 4.645 5.726 1.00 0.00 H new ATOM 0 HB2 ALA A 19 21.346 3.431 6.181 1.00 0.00 H new ATOM 0 HB3 ALA A 19 21.128 3.874 4.472 1.00 0.00 H new ATOM 252 N GLU A 20 18.624 2.570 3.039 1.00 0.00 N ATOM 253 CA GLU A 20 17.666 2.910 1.992 1.00 0.00 C ATOM 254 C GLU A 20 16.242 2.536 2.399 1.00 0.00 C ATOM 255 O GLU A 20 15.309 3.310 2.183 1.00 0.00 O ATOM 256 CB GLU A 20 18.038 2.210 0.683 1.00 0.00 C ATOM 257 CG GLU A 20 17.172 2.627 -0.496 1.00 0.00 C ATOM 258 CD GLU A 20 17.575 1.942 -1.786 1.00 0.00 C ATOM 259 OE1 GLU A 20 18.586 2.360 -2.390 1.00 0.00 O ATOM 260 OE2 GLU A 20 16.882 0.987 -2.193 1.00 0.00 O ATOM 0 H GLU A 20 19.375 1.950 2.737 1.00 0.00 H new ATOM 0 HA GLU A 20 17.704 3.989 1.844 1.00 0.00 H new ATOM 0 HB2 GLU A 20 19.081 2.423 0.450 1.00 0.00 H new ATOM 0 HB3 GLU A 20 17.956 1.132 0.821 1.00 0.00 H new ATOM 0 HG2 GLU A 20 16.130 2.396 -0.276 1.00 0.00 H new ATOM 0 HG3 GLU A 20 17.238 3.707 -0.626 1.00 0.00 H new ATOM 267 N PHE A 21 16.081 1.351 2.984 1.00 0.00 N ATOM 268 CA PHE A 21 14.766 0.888 3.421 1.00 0.00 C ATOM 269 C PHE A 21 14.089 1.939 4.298 1.00 0.00 C ATOM 270 O PHE A 21 12.927 2.284 4.083 1.00 0.00 O ATOM 271 CB PHE A 21 14.892 -0.434 4.188 1.00 0.00 C ATOM 272 CG PHE A 21 13.571 -1.044 4.572 1.00 0.00 C ATOM 273 CD1 PHE A 21 12.916 -0.646 5.726 1.00 0.00 C ATOM 274 CD2 PHE A 21 12.985 -2.020 3.779 1.00 0.00 C ATOM 275 CE1 PHE A 21 11.703 -1.206 6.082 1.00 0.00 C ATOM 276 CE2 PHE A 21 11.772 -2.584 4.130 1.00 0.00 C ATOM 277 CZ PHE A 21 11.132 -2.176 5.283 1.00 0.00 C ATOM 0 H PHE A 21 16.842 0.696 3.166 1.00 0.00 H new ATOM 0 HA PHE A 21 14.151 0.725 2.536 1.00 0.00 H new ATOM 0 HB2 PHE A 21 15.446 -1.146 3.576 1.00 0.00 H new ATOM 0 HB3 PHE A 21 15.479 -0.265 5.091 1.00 0.00 H new ATOM 0 HD1 PHE A 21 13.359 0.112 6.356 1.00 0.00 H new ATOM 0 HD2 PHE A 21 13.482 -2.343 2.876 1.00 0.00 H new ATOM 0 HE1 PHE A 21 11.203 -0.885 6.984 1.00 0.00 H new ATOM 0 HE2 PHE A 21 11.326 -3.342 3.503 1.00 0.00 H new ATOM 0 HZ PHE A 21 10.185 -2.615 5.560 1.00 0.00 H new ATOM 287 N ASP A 22 14.826 2.446 5.282 1.00 0.00 N ATOM 288 CA ASP A 22 14.300 3.459 6.190 1.00 0.00 C ATOM 289 C ASP A 22 13.850 4.696 5.419 1.00 0.00 C ATOM 290 O ASP A 22 12.795 5.267 5.701 1.00 0.00 O ATOM 291 CB ASP A 22 15.355 3.844 7.228 1.00 0.00 C ATOM 292 CG ASP A 22 14.865 4.913 8.186 1.00 0.00 C ATOM 293 OD1 ASP A 22 14.214 4.557 9.190 1.00 0.00 O ATOM 294 OD2 ASP A 22 15.133 6.106 7.933 1.00 0.00 O ATOM 0 H ASP A 22 15.790 2.171 5.471 1.00 0.00 H new ATOM 0 HA ASP A 22 13.436 3.038 6.704 1.00 0.00 H new ATOM 0 HB2 ASP A 22 15.643 2.958 7.794 1.00 0.00 H new ATOM 0 HB3 ASP A 22 16.249 4.201 6.717 1.00 0.00 H new ATOM 299 N ALA A 23 14.657 5.102 4.444 1.00 0.00 N ATOM 300 CA ALA A 23 14.341 6.268 3.630 1.00 0.00 C ATOM 301 C ALA A 23 12.995 6.097 2.933 1.00 0.00 C ATOM 302 O ALA A 23 12.178 7.018 2.907 1.00 0.00 O ATOM 303 CB ALA A 23 15.441 6.511 2.609 1.00 0.00 C ATOM 0 H ALA A 23 15.533 4.641 4.199 1.00 0.00 H new ATOM 0 HA ALA A 23 14.274 7.135 4.287 1.00 0.00 H new ATOM 0 HB1 ALA A 23 15.192 7.385 2.007 1.00 0.00 H new ATOM 0 HB2 ALA A 23 16.385 6.683 3.126 1.00 0.00 H new ATOM 0 HB3 ALA A 23 15.535 5.639 1.961 1.00 0.00 H new ATOM 309 N VAL A 24 12.771 4.911 2.373 1.00 0.00 N ATOM 310 CA VAL A 24 11.523 4.616 1.677 1.00 0.00 C ATOM 311 C VAL A 24 10.329 4.747 2.614 1.00 0.00 C ATOM 312 O VAL A 24 9.292 5.295 2.238 1.00 0.00 O ATOM 313 CB VAL A 24 11.534 3.199 1.074 1.00 0.00 C ATOM 314 CG1 VAL A 24 10.236 2.924 0.326 1.00 0.00 C ATOM 315 CG2 VAL A 24 12.731 3.016 0.156 1.00 0.00 C ATOM 0 H VAL A 24 13.438 4.139 2.388 1.00 0.00 H new ATOM 0 HA VAL A 24 11.432 5.344 0.870 1.00 0.00 H new ATOM 0 HB VAL A 24 11.617 2.481 1.890 1.00 0.00 H new ATOM 0 HG11 VAL A 24 10.263 1.918 -0.093 1.00 0.00 H new ATOM 0 HG12 VAL A 24 9.395 3.008 1.014 1.00 0.00 H new ATOM 0 HG13 VAL A 24 10.120 3.649 -0.479 1.00 0.00 H new ATOM 0 HG21 VAL A 24 12.720 2.008 -0.260 1.00 0.00 H new ATOM 0 HG22 VAL A 24 12.683 3.743 -0.654 1.00 0.00 H new ATOM 0 HG23 VAL A 24 13.650 3.165 0.723 1.00 0.00 H new ATOM 325 N VAL A 25 10.480 4.239 3.835 1.00 0.00 N ATOM 326 CA VAL A 25 9.413 4.302 4.827 1.00 0.00 C ATOM 327 C VAL A 25 8.964 5.741 5.052 1.00 0.00 C ATOM 328 O VAL A 25 7.770 6.019 5.170 1.00 0.00 O ATOM 329 CB VAL A 25 9.854 3.692 6.173 1.00 0.00 C ATOM 330 CG1 VAL A 25 8.737 3.792 7.202 1.00 0.00 C ATOM 331 CG2 VAL A 25 10.285 2.245 5.988 1.00 0.00 C ATOM 0 H VAL A 25 11.331 3.780 4.160 1.00 0.00 H new ATOM 0 HA VAL A 25 8.579 3.719 4.435 1.00 0.00 H new ATOM 0 HB VAL A 25 10.708 4.260 6.542 1.00 0.00 H new ATOM 0 HG11 VAL A 25 9.070 3.356 8.144 1.00 0.00 H new ATOM 0 HG12 VAL A 25 8.479 4.839 7.358 1.00 0.00 H new ATOM 0 HG13 VAL A 25 7.861 3.253 6.842 1.00 0.00 H new ATOM 0 HG21 VAL A 25 10.593 1.831 6.948 1.00 0.00 H new ATOM 0 HG22 VAL A 25 9.451 1.665 5.593 1.00 0.00 H new ATOM 0 HG23 VAL A 25 11.121 2.201 5.289 1.00 0.00 H new ATOM 341 N GLY A 26 9.929 6.654 5.111 1.00 0.00 N ATOM 342 CA GLY A 26 9.613 8.055 5.316 1.00 0.00 C ATOM 343 C GLY A 26 8.825 8.641 4.160 1.00 0.00 C ATOM 344 O GLY A 26 7.858 9.376 4.367 1.00 0.00 O ATOM 0 H GLY A 26 10.924 6.448 5.020 1.00 0.00 H new ATOM 0 HA2 GLY A 26 9.040 8.165 6.237 1.00 0.00 H new ATOM 0 HA3 GLY A 26 10.537 8.619 5.446 1.00 0.00 H new ATOM 348 N TYR A 27 9.238 8.312 2.939 1.00 0.00 N ATOM 349 CA TYR A 27 8.564 8.809 1.744 1.00 0.00 C ATOM 350 C TYR A 27 7.121 8.318 1.692 1.00 0.00 C ATOM 351 O TYR A 27 6.228 9.034 1.239 1.00 0.00 O ATOM 352 CB TYR A 27 9.311 8.365 0.482 1.00 0.00 C ATOM 353 CG TYR A 27 10.708 8.935 0.359 1.00 0.00 C ATOM 354 CD1 TYR A 27 10.945 10.294 0.532 1.00 0.00 C ATOM 355 CD2 TYR A 27 11.791 8.113 0.070 1.00 0.00 C ATOM 356 CE1 TYR A 27 12.220 10.816 0.419 1.00 0.00 C ATOM 357 CE2 TYR A 27 13.067 8.627 -0.045 1.00 0.00 C ATOM 358 CZ TYR A 27 13.277 9.978 0.130 1.00 0.00 C ATOM 359 OH TYR A 27 14.547 10.494 0.018 1.00 0.00 O ATOM 0 H TYR A 27 10.035 7.704 2.752 1.00 0.00 H new ATOM 0 HA TYR A 27 8.560 9.898 1.788 1.00 0.00 H new ATOM 0 HB2 TYR A 27 9.372 7.277 0.473 1.00 0.00 H new ATOM 0 HB3 TYR A 27 8.732 8.659 -0.393 1.00 0.00 H new ATOM 0 HD1 TYR A 27 10.120 10.953 0.758 1.00 0.00 H new ATOM 0 HD2 TYR A 27 11.631 7.054 -0.067 1.00 0.00 H new ATOM 0 HE1 TYR A 27 12.388 11.874 0.556 1.00 0.00 H new ATOM 0 HE2 TYR A 27 13.897 7.974 -0.271 1.00 0.00 H new ATOM 0 HH TYR A 27 15.177 9.772 -0.187 1.00 0.00 H new ATOM 369 N LEU A 28 6.899 7.092 2.162 1.00 0.00 N ATOM 370 CA LEU A 28 5.563 6.505 2.169 1.00 0.00 C ATOM 371 C LEU A 28 4.631 7.277 3.098 1.00 0.00 C ATOM 372 O LEU A 28 3.492 7.573 2.740 1.00 0.00 O ATOM 373 CB LEU A 28 5.626 5.037 2.596 1.00 0.00 C ATOM 374 CG LEU A 28 6.345 4.102 1.619 1.00 0.00 C ATOM 375 CD1 LEU A 28 6.454 2.703 2.204 1.00 0.00 C ATOM 376 CD2 LEU A 28 5.620 4.064 0.281 1.00 0.00 C ATOM 0 H LEU A 28 7.627 6.487 2.542 1.00 0.00 H new ATOM 0 HA LEU A 28 5.166 6.564 1.156 1.00 0.00 H new ATOM 0 HB2 LEU A 28 6.125 4.978 3.563 1.00 0.00 H new ATOM 0 HB3 LEU A 28 4.609 4.673 2.739 1.00 0.00 H new ATOM 0 HG LEU A 28 7.351 4.487 1.454 1.00 0.00 H new ATOM 0 HD11 LEU A 28 6.967 2.052 1.497 1.00 0.00 H new ATOM 0 HD12 LEU A 28 7.017 2.741 3.136 1.00 0.00 H new ATOM 0 HD13 LEU A 28 5.456 2.311 2.399 1.00 0.00 H new ATOM 0 HD21 LEU A 28 6.146 3.394 -0.399 1.00 0.00 H new ATOM 0 HD22 LEU A 28 4.602 3.704 0.429 1.00 0.00 H new ATOM 0 HD23 LEU A 28 5.592 5.066 -0.146 1.00 0.00 H new ATOM 388 N GLU A 29 5.123 7.600 4.290 1.00 0.00 N ATOM 389 CA GLU A 29 4.333 8.339 5.269 1.00 0.00 C ATOM 390 C GLU A 29 3.869 9.675 4.698 1.00 0.00 C ATOM 391 O GLU A 29 2.720 10.076 4.887 1.00 0.00 O ATOM 392 CB GLU A 29 5.148 8.570 6.544 1.00 0.00 C ATOM 393 CG GLU A 29 5.504 7.287 7.278 1.00 0.00 C ATOM 394 CD GLU A 29 6.288 7.541 8.551 1.00 0.00 C ATOM 395 OE1 GLU A 29 5.654 7.749 9.607 1.00 0.00 O ATOM 396 OE2 GLU A 29 7.535 7.533 8.491 1.00 0.00 O ATOM 0 H GLU A 29 6.065 7.362 4.601 1.00 0.00 H new ATOM 0 HA GLU A 29 3.453 7.744 5.512 1.00 0.00 H new ATOM 0 HB2 GLU A 29 6.066 9.099 6.288 1.00 0.00 H new ATOM 0 HB3 GLU A 29 4.583 9.218 7.214 1.00 0.00 H new ATOM 0 HG2 GLU A 29 4.589 6.746 7.521 1.00 0.00 H new ATOM 0 HG3 GLU A 29 6.088 6.645 6.618 1.00 0.00 H new ATOM 403 N ASP A 30 4.770 10.360 4.000 1.00 0.00 N ATOM 404 CA ASP A 30 4.453 11.650 3.395 1.00 0.00 C ATOM 405 C ASP A 30 3.257 11.533 2.456 1.00 0.00 C ATOM 406 O ASP A 30 2.468 12.468 2.317 1.00 0.00 O ATOM 407 CB ASP A 30 5.665 12.191 2.632 1.00 0.00 C ATOM 408 CG ASP A 30 5.363 13.493 1.915 1.00 0.00 C ATOM 409 OD1 ASP A 30 5.510 14.563 2.542 1.00 0.00 O ATOM 410 OD2 ASP A 30 4.981 13.441 0.728 1.00 0.00 O ATOM 0 H ASP A 30 5.726 10.043 3.839 1.00 0.00 H new ATOM 0 HA ASP A 30 4.196 12.344 4.195 1.00 0.00 H new ATOM 0 HB2 ASP A 30 6.490 12.345 3.328 1.00 0.00 H new ATOM 0 HB3 ASP A 30 5.995 11.448 1.906 1.00 0.00 H new ATOM 415 N ILE A 31 3.129 10.376 1.813 1.00 0.00 N ATOM 416 CA ILE A 31 2.032 10.133 0.886 1.00 0.00 C ATOM 417 C ILE A 31 0.740 9.821 1.634 1.00 0.00 C ATOM 418 O ILE A 31 -0.343 10.243 1.226 1.00 0.00 O ATOM 419 CB ILE A 31 2.355 8.967 -0.069 1.00 0.00 C ATOM 420 CG1 ILE A 31 3.675 9.229 -0.799 1.00 0.00 C ATOM 421 CG2 ILE A 31 1.219 8.766 -1.064 1.00 0.00 C ATOM 422 CD1 ILE A 31 4.175 8.043 -1.596 1.00 0.00 C ATOM 0 H ILE A 31 3.773 9.592 1.918 1.00 0.00 H new ATOM 0 HA ILE A 31 1.899 11.045 0.304 1.00 0.00 H new ATOM 0 HB ILE A 31 2.462 8.054 0.517 1.00 0.00 H new ATOM 0 HG12 ILE A 31 3.547 10.078 -1.470 1.00 0.00 H new ATOM 0 HG13 ILE A 31 4.434 9.511 -0.069 1.00 0.00 H new ATOM 0 HG21 ILE A 31 1.462 7.939 -1.731 1.00 0.00 H new ATOM 0 HG22 ILE A 31 0.299 8.539 -0.525 1.00 0.00 H new ATOM 0 HG23 ILE A 31 1.082 9.676 -1.648 1.00 0.00 H new ATOM 0 HD11 ILE A 31 5.114 8.303 -2.085 1.00 0.00 H new ATOM 0 HD12 ILE A 31 4.336 7.197 -0.927 1.00 0.00 H new ATOM 0 HD13 ILE A 31 3.435 7.773 -2.350 1.00 0.00 H new ATOM 434 N ILE A 32 0.862 9.083 2.733 1.00 0.00 N ATOM 435 CA ILE A 32 -0.295 8.709 3.539 1.00 0.00 C ATOM 436 C ILE A 32 -0.970 9.940 4.141 1.00 0.00 C ATOM 437 O ILE A 32 -2.193 9.985 4.275 1.00 0.00 O ATOM 438 CB ILE A 32 0.100 7.741 4.672 1.00 0.00 C ATOM 439 CG1 ILE A 32 0.755 6.485 4.090 1.00 0.00 C ATOM 440 CG2 ILE A 32 -1.118 7.372 5.506 1.00 0.00 C ATOM 441 CD1 ILE A 32 1.306 5.543 5.140 1.00 0.00 C ATOM 0 H ILE A 32 1.752 8.732 3.086 1.00 0.00 H new ATOM 0 HA ILE A 32 -0.997 8.207 2.873 1.00 0.00 H new ATOM 0 HB ILE A 32 0.820 8.239 5.321 1.00 0.00 H new ATOM 0 HG12 ILE A 32 0.022 5.951 3.485 1.00 0.00 H new ATOM 0 HG13 ILE A 32 1.563 6.784 3.423 1.00 0.00 H new ATOM 0 HG21 ILE A 32 -0.821 6.688 6.301 1.00 0.00 H new ATOM 0 HG22 ILE A 32 -1.546 8.274 5.944 1.00 0.00 H new ATOM 0 HG23 ILE A 32 -1.861 6.889 4.871 1.00 0.00 H new ATOM 0 HD11 ILE A 32 1.754 4.677 4.653 1.00 0.00 H new ATOM 0 HD12 ILE A 32 2.063 6.059 5.731 1.00 0.00 H new ATOM 0 HD13 ILE A 32 0.498 5.214 5.793 1.00 0.00 H new ATOM 453 N MET A 33 -0.166 10.937 4.498 1.00 0.00 N ATOM 454 CA MET A 33 -0.687 12.167 5.087 1.00 0.00 C ATOM 455 C MET A 33 -0.806 13.270 4.037 1.00 0.00 C ATOM 456 O MET A 33 -0.868 14.453 4.374 1.00 0.00 O ATOM 457 CB MET A 33 0.222 12.628 6.230 1.00 0.00 C ATOM 458 CG MET A 33 0.329 11.625 7.366 1.00 0.00 C ATOM 459 SD MET A 33 1.489 12.141 8.646 1.00 0.00 S ATOM 460 CE MET A 33 0.716 13.653 9.219 1.00 0.00 C ATOM 0 H MET A 33 0.848 10.918 4.390 1.00 0.00 H new ATOM 0 HA MET A 33 -1.683 11.961 5.480 1.00 0.00 H new ATOM 0 HB2 MET A 33 1.219 12.823 5.834 1.00 0.00 H new ATOM 0 HB3 MET A 33 -0.155 13.572 6.624 1.00 0.00 H new ATOM 0 HG2 MET A 33 -0.655 11.480 7.811 1.00 0.00 H new ATOM 0 HG3 MET A 33 0.642 10.661 6.965 1.00 0.00 H new ATOM 0 HE1 MET A 33 1.117 13.919 10.197 1.00 0.00 H new ATOM 0 HE2 MET A 33 0.921 14.457 8.512 1.00 0.00 H new ATOM 0 HE3 MET A 33 -0.361 13.504 9.297 1.00 0.00 H new ATOM 470 N ASP A 34 -0.842 12.876 2.767 1.00 0.00 N ATOM 471 CA ASP A 34 -0.953 13.835 1.671 1.00 0.00 C ATOM 472 C ASP A 34 -2.414 14.191 1.402 1.00 0.00 C ATOM 473 O ASP A 34 -3.275 13.313 1.329 1.00 0.00 O ATOM 474 CB ASP A 34 -0.311 13.268 0.403 1.00 0.00 C ATOM 475 CG ASP A 34 -0.152 14.311 -0.685 1.00 0.00 C ATOM 476 OD1 ASP A 34 -1.137 14.570 -1.407 1.00 0.00 O ATOM 477 OD2 ASP A 34 0.959 14.868 -0.816 1.00 0.00 O ATOM 0 H ASP A 34 -0.796 11.901 2.471 1.00 0.00 H new ATOM 0 HA ASP A 34 -0.426 14.744 1.962 1.00 0.00 H new ATOM 0 HB2 ASP A 34 0.666 12.853 0.649 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -0.921 12.446 0.027 1.00 0.00 H new ATOM 482 N ASP A 35 -2.683 15.487 1.249 1.00 0.00 N ATOM 483 CA ASP A 35 -4.037 15.972 0.992 1.00 0.00 C ATOM 484 C ASP A 35 -4.633 15.325 -0.256 1.00 0.00 C ATOM 485 O ASP A 35 -5.777 14.871 -0.244 1.00 0.00 O ATOM 486 CB ASP A 35 -4.031 17.494 0.832 1.00 0.00 C ATOM 487 CG ASP A 35 -3.474 18.204 2.051 1.00 0.00 C ATOM 488 OD1 ASP A 35 -2.234 18.315 2.159 1.00 0.00 O ATOM 489 OD2 ASP A 35 -4.277 18.651 2.897 1.00 0.00 O ATOM 0 H ASP A 35 -1.978 16.222 1.299 1.00 0.00 H new ATOM 0 HA ASP A 35 -4.656 15.698 1.847 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -3.438 17.762 -0.043 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -5.048 17.841 0.647 1.00 0.00 H new ATOM 494 N GLU A 36 -3.852 15.287 -1.331 1.00 0.00 N ATOM 495 CA GLU A 36 -4.306 14.699 -2.588 1.00 0.00 C ATOM 496 C GLU A 36 -4.599 13.211 -2.426 1.00 0.00 C ATOM 497 O GLU A 36 -5.447 12.656 -3.125 1.00 0.00 O ATOM 498 CB GLU A 36 -3.253 14.905 -3.680 1.00 0.00 C ATOM 499 CG GLU A 36 -3.650 14.324 -5.028 1.00 0.00 C ATOM 500 CD GLU A 36 -4.929 14.931 -5.570 1.00 0.00 C ATOM 501 OE1 GLU A 36 -4.844 15.950 -6.288 1.00 0.00 O ATOM 502 OE2 GLU A 36 -6.015 14.389 -5.278 1.00 0.00 O ATOM 0 H GLU A 36 -2.902 15.656 -1.358 1.00 0.00 H new ATOM 0 HA GLU A 36 -5.229 15.201 -2.878 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -3.066 15.973 -3.795 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -2.316 14.450 -3.360 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -2.843 14.488 -5.742 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -3.776 13.246 -4.932 1.00 0.00 H new ATOM 509 N PHE A 37 -3.893 12.570 -1.501 1.00 0.00 N ATOM 510 CA PHE A 37 -4.072 11.143 -1.251 1.00 0.00 C ATOM 511 C PHE A 37 -5.365 10.876 -0.485 1.00 0.00 C ATOM 512 O PHE A 37 -6.043 9.877 -0.726 1.00 0.00 O ATOM 513 CB PHE A 37 -2.877 10.593 -0.472 1.00 0.00 C ATOM 514 CG PHE A 37 -2.978 9.126 -0.162 1.00 0.00 C ATOM 515 CD1 PHE A 37 -2.825 8.180 -1.164 1.00 0.00 C ATOM 516 CD2 PHE A 37 -3.226 8.694 1.131 1.00 0.00 C ATOM 517 CE1 PHE A 37 -2.918 6.830 -0.881 1.00 0.00 C ATOM 518 CE2 PHE A 37 -3.320 7.346 1.420 1.00 0.00 C ATOM 519 CZ PHE A 37 -3.165 6.412 0.413 1.00 0.00 C ATOM 0 H PHE A 37 -3.191 13.016 -0.911 1.00 0.00 H new ATOM 0 HA PHE A 37 -4.137 10.636 -2.213 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -1.968 10.772 -1.046 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -2.778 11.146 0.462 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -2.631 8.501 -2.177 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -3.347 9.419 1.922 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -2.798 6.103 -1.670 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -3.514 7.023 2.432 1.00 0.00 H new ATOM 0 HZ PHE A 37 -3.237 5.358 0.637 1.00 0.00 H new ATOM 529 N GLN A 38 -5.699 11.769 0.439 1.00 0.00 N ATOM 530 CA GLN A 38 -6.910 11.626 1.240 1.00 0.00 C ATOM 531 C GLN A 38 -8.161 11.835 0.392 1.00 0.00 C ATOM 532 O GLN A 38 -9.138 11.095 0.519 1.00 0.00 O ATOM 533 CB GLN A 38 -6.897 12.616 2.405 1.00 0.00 C ATOM 534 CG GLN A 38 -5.855 12.294 3.464 1.00 0.00 C ATOM 535 CD GLN A 38 -5.795 13.340 4.560 1.00 0.00 C ATOM 536 OE1 GLN A 38 -6.795 13.988 4.873 1.00 0.00 O ATOM 537 NE2 GLN A 38 -4.618 13.510 5.151 1.00 0.00 N ATOM 0 H GLN A 38 -5.148 12.601 0.653 1.00 0.00 H new ATOM 0 HA GLN A 38 -6.931 10.610 1.635 1.00 0.00 H new ATOM 0 HB2 GLN A 38 -6.712 13.618 2.018 1.00 0.00 H new ATOM 0 HB3 GLN A 38 -7.883 12.631 2.870 1.00 0.00 H new ATOM 0 HG2 GLN A 38 -6.079 11.323 3.906 1.00 0.00 H new ATOM 0 HG3 GLN A 38 -4.876 12.211 2.992 1.00 0.00 H new ATOM 0 HE21 GLN A 38 -3.816 12.951 4.860 1.00 0.00 H new ATOM 0 HE22 GLN A 38 -4.516 14.199 5.896 1.00 0.00 H new ATOM 546 N LEU A 39 -8.127 12.844 -0.475 1.00 0.00 N ATOM 547 CA LEU A 39 -9.263 13.149 -1.339 1.00 0.00 C ATOM 548 C LEU A 39 -9.460 12.057 -2.387 1.00 0.00 C ATOM 549 O LEU A 39 -10.589 11.668 -2.685 1.00 0.00 O ATOM 550 CB LEU A 39 -9.063 14.505 -2.021 1.00 0.00 C ATOM 551 CG LEU A 39 -10.319 15.106 -2.661 1.00 0.00 C ATOM 552 CD1 LEU A 39 -10.239 16.625 -2.667 1.00 0.00 C ATOM 553 CD2 LEU A 39 -10.506 14.581 -4.078 1.00 0.00 C ATOM 0 H LEU A 39 -7.326 13.463 -0.597 1.00 0.00 H new ATOM 0 HA LEU A 39 -10.158 13.193 -0.719 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -8.677 15.210 -1.285 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -8.299 14.397 -2.791 1.00 0.00 H new ATOM 0 HG LEU A 39 -11.181 14.805 -2.066 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -11.139 17.035 -3.125 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -10.155 16.989 -1.643 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -9.366 16.941 -3.237 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -11.403 15.021 -4.513 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -9.640 14.850 -4.683 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -10.609 13.496 -4.053 1.00 0.00 H new ATOM 565 N LEU A 40 -8.356 11.568 -2.940 1.00 0.00 N ATOM 566 CA LEU A 40 -8.406 10.524 -3.959 1.00 0.00 C ATOM 567 C LEU A 40 -8.854 9.190 -3.365 1.00 0.00 C ATOM 568 O LEU A 40 -9.679 8.487 -3.948 1.00 0.00 O ATOM 569 CB LEU A 40 -7.034 10.373 -4.627 1.00 0.00 C ATOM 570 CG LEU A 40 -6.910 9.213 -5.620 1.00 0.00 C ATOM 571 CD1 LEU A 40 -6.017 9.604 -6.789 1.00 0.00 C ATOM 572 CD2 LEU A 40 -6.358 7.975 -4.929 1.00 0.00 C ATOM 0 H LEU A 40 -7.414 11.877 -2.700 1.00 0.00 H new ATOM 0 HA LEU A 40 -9.139 10.820 -4.710 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -6.798 11.301 -5.148 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -6.282 10.244 -3.848 1.00 0.00 H new ATOM 0 HG LEU A 40 -7.904 8.984 -6.003 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -5.941 8.768 -7.484 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -6.446 10.465 -7.302 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -5.024 9.860 -6.419 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -6.277 7.162 -5.650 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -5.373 8.196 -4.519 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -7.029 7.679 -4.122 1.00 0.00 H new ATOM 584 N GLN A 41 -8.308 8.848 -2.201 1.00 0.00 N ATOM 585 CA GLN A 41 -8.647 7.593 -1.536 1.00 0.00 C ATOM 586 C GLN A 41 -10.131 7.533 -1.189 1.00 0.00 C ATOM 587 O GLN A 41 -10.807 6.553 -1.496 1.00 0.00 O ATOM 588 CB GLN A 41 -7.808 7.418 -0.268 1.00 0.00 C ATOM 589 CG GLN A 41 -8.110 6.134 0.490 1.00 0.00 C ATOM 590 CD GLN A 41 -7.229 5.955 1.709 1.00 0.00 C ATOM 591 OE1 GLN A 41 -7.560 6.412 2.804 1.00 0.00 O ATOM 592 NE2 GLN A 41 -6.099 5.282 1.528 1.00 0.00 N ATOM 0 H GLN A 41 -7.630 9.421 -1.699 1.00 0.00 H new ATOM 0 HA GLN A 41 -8.425 6.780 -2.228 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -6.752 7.432 -0.537 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -7.980 8.268 0.392 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -9.155 6.137 0.799 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -7.977 5.283 -0.178 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -5.863 4.920 0.604 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -5.467 5.126 2.313 1.00 0.00 H new ATOM 601 N ARG A 42 -10.631 8.584 -0.548 1.00 0.00 N ATOM 602 CA ARG A 42 -12.035 8.643 -0.156 1.00 0.00 C ATOM 603 C ARG A 42 -12.949 8.709 -1.378 1.00 0.00 C ATOM 604 O ARG A 42 -14.070 8.199 -1.353 1.00 0.00 O ATOM 605 CB ARG A 42 -12.284 9.853 0.749 1.00 0.00 C ATOM 606 CG ARG A 42 -13.709 9.937 1.273 1.00 0.00 C ATOM 607 CD ARG A 42 -13.933 11.205 2.080 1.00 0.00 C ATOM 608 NE ARG A 42 -13.035 11.292 3.229 1.00 0.00 N ATOM 609 CZ ARG A 42 -13.001 12.326 4.064 1.00 0.00 C ATOM 610 NH1 ARG A 42 -13.820 13.355 3.886 1.00 0.00 N ATOM 611 NH2 ARG A 42 -12.148 12.332 5.079 1.00 0.00 N ATOM 0 H ARG A 42 -10.086 9.406 -0.289 1.00 0.00 H new ATOM 0 HA ARG A 42 -12.267 7.731 0.394 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -11.597 9.812 1.594 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -12.055 10.764 0.196 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -14.407 9.909 0.437 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -13.921 9.067 1.894 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -13.785 12.073 1.438 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -14.966 11.237 2.425 1.00 0.00 H new ATOM 0 HE ARG A 42 -12.397 10.515 3.401 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -14.478 13.354 3.107 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -13.791 14.147 4.528 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -11.517 11.543 5.220 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -12.123 13.126 5.719 1.00 0.00 H new ATOM 625 N ASN A 43 -12.466 9.339 -2.444 1.00 0.00 N ATOM 626 CA ASN A 43 -13.247 9.479 -3.669 1.00 0.00 C ATOM 627 C ASN A 43 -13.582 8.121 -4.282 1.00 0.00 C ATOM 628 O ASN A 43 -14.735 7.854 -4.624 1.00 0.00 O ATOM 629 CB ASN A 43 -12.486 10.331 -4.688 1.00 0.00 C ATOM 630 CG ASN A 43 -13.269 10.533 -5.971 1.00 0.00 C ATOM 631 OD1 ASN A 43 -13.154 9.747 -6.912 1.00 0.00 O ATOM 632 ND2 ASN A 43 -14.069 11.592 -6.014 1.00 0.00 N ATOM 0 H ASN A 43 -11.538 9.761 -2.485 1.00 0.00 H new ATOM 0 HA ASN A 43 -14.183 9.972 -3.407 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -12.258 11.302 -4.248 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -11.534 9.853 -4.918 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -14.620 11.781 -6.851 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -14.132 12.216 -5.210 1.00 0.00 H new ATOM 639 N PHE A 44 -12.572 7.266 -4.418 1.00 0.00 N ATOM 640 CA PHE A 44 -12.767 5.941 -5.001 1.00 0.00 C ATOM 641 C PHE A 44 -13.377 4.967 -3.996 1.00 0.00 C ATOM 642 O PHE A 44 -14.297 4.221 -4.328 1.00 0.00 O ATOM 643 CB PHE A 44 -11.440 5.389 -5.531 1.00 0.00 C ATOM 644 CG PHE A 44 -10.989 6.032 -6.813 1.00 0.00 C ATOM 645 CD1 PHE A 44 -11.536 5.643 -8.026 1.00 0.00 C ATOM 646 CD2 PHE A 44 -10.022 7.023 -6.806 1.00 0.00 C ATOM 647 CE1 PHE A 44 -11.126 6.231 -9.208 1.00 0.00 C ATOM 648 CE2 PHE A 44 -9.607 7.615 -7.985 1.00 0.00 C ATOM 649 CZ PHE A 44 -10.160 7.218 -9.187 1.00 0.00 C ATOM 0 H PHE A 44 -11.613 7.466 -4.134 1.00 0.00 H new ATOM 0 HA PHE A 44 -13.467 6.047 -5.830 1.00 0.00 H new ATOM 0 HB2 PHE A 44 -10.669 5.530 -4.773 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -11.540 4.315 -5.689 1.00 0.00 H new ATOM 0 HD1 PHE A 44 -12.291 4.871 -8.048 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -9.587 7.337 -5.869 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -11.560 5.919 -10.146 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -8.852 8.387 -7.966 1.00 0.00 H new ATOM 0 HZ PHE A 44 -9.837 7.679 -10.109 1.00 0.00 H new ATOM 659 N MET A 45 -12.868 4.982 -2.766 1.00 0.00 N ATOM 660 CA MET A 45 -13.366 4.088 -1.722 1.00 0.00 C ATOM 661 C MET A 45 -14.867 4.276 -1.510 1.00 0.00 C ATOM 662 O MET A 45 -15.566 3.347 -1.105 1.00 0.00 O ATOM 663 CB MET A 45 -12.600 4.317 -0.410 1.00 0.00 C ATOM 664 CG MET A 45 -13.240 5.334 0.527 1.00 0.00 C ATOM 665 SD MET A 45 -14.503 4.606 1.593 1.00 0.00 S ATOM 666 CE MET A 45 -13.537 3.392 2.493 1.00 0.00 C ATOM 0 H MET A 45 -12.114 5.601 -2.468 1.00 0.00 H new ATOM 0 HA MET A 45 -13.199 3.061 -2.046 1.00 0.00 H new ATOM 0 HB2 MET A 45 -12.510 3.366 0.114 1.00 0.00 H new ATOM 0 HB3 MET A 45 -11.589 4.647 -0.647 1.00 0.00 H new ATOM 0 HG2 MET A 45 -12.466 5.788 1.146 1.00 0.00 H new ATOM 0 HG3 MET A 45 -13.686 6.134 -0.063 1.00 0.00 H new ATOM 0 HE1 MET A 45 -13.860 2.389 2.212 1.00 0.00 H new ATOM 0 HE2 MET A 45 -12.481 3.515 2.251 1.00 0.00 H new ATOM 0 HE3 MET A 45 -13.682 3.533 3.564 1.00 0.00 H new ATOM 676 N ASP A 46 -15.351 5.483 -1.785 1.00 0.00 N ATOM 677 CA ASP A 46 -16.769 5.795 -1.629 1.00 0.00 C ATOM 678 C ASP A 46 -17.624 4.888 -2.509 1.00 0.00 C ATOM 679 O ASP A 46 -18.759 4.563 -2.164 1.00 0.00 O ATOM 680 CB ASP A 46 -17.029 7.260 -1.984 1.00 0.00 C ATOM 681 CG ASP A 46 -18.489 7.641 -1.839 1.00 0.00 C ATOM 682 OD1 ASP A 46 -19.245 7.482 -2.820 1.00 0.00 O ATOM 683 OD2 ASP A 46 -18.877 8.100 -0.744 1.00 0.00 O ATOM 0 H ASP A 46 -14.783 6.262 -2.117 1.00 0.00 H new ATOM 0 HA ASP A 46 -17.043 5.625 -0.588 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -16.424 7.899 -1.341 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -16.709 7.445 -3.009 1.00 0.00 H new ATOM 688 N LYS A 47 -17.072 4.489 -3.648 1.00 0.00 N ATOM 689 CA LYS A 47 -17.783 3.619 -4.578 1.00 0.00 C ATOM 690 C LYS A 47 -17.475 2.151 -4.293 1.00 0.00 C ATOM 691 O LYS A 47 -18.346 1.289 -4.406 1.00 0.00 O ATOM 692 CB LYS A 47 -17.398 3.957 -6.021 1.00 0.00 C ATOM 693 CG LYS A 47 -18.015 5.248 -6.541 1.00 0.00 C ATOM 694 CD LYS A 47 -17.436 6.473 -5.850 1.00 0.00 C ATOM 695 CE LYS A 47 -18.043 7.756 -6.393 1.00 0.00 C ATOM 696 NZ LYS A 47 -19.518 7.801 -6.197 1.00 0.00 N ATOM 0 H LYS A 47 -16.134 4.754 -3.950 1.00 0.00 H new ATOM 0 HA LYS A 47 -18.852 3.783 -4.444 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -16.313 4.032 -6.088 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -17.701 3.135 -6.669 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -17.846 5.324 -7.615 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -19.094 5.222 -6.389 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -17.619 6.408 -4.777 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -16.355 6.493 -5.988 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -17.585 8.612 -5.897 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -17.815 7.844 -7.455 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -19.862 8.766 -6.374 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -19.976 7.143 -6.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -19.747 7.525 -5.221 1.00 0.00 H new ATOM 710 N TYR A 48 -16.230 1.880 -3.917 1.00 0.00 N ATOM 711 CA TYR A 48 -15.794 0.519 -3.627 1.00 0.00 C ATOM 712 C TYR A 48 -16.597 -0.108 -2.489 1.00 0.00 C ATOM 713 O TYR A 48 -17.181 -1.178 -2.654 1.00 0.00 O ATOM 714 CB TYR A 48 -14.306 0.504 -3.278 1.00 0.00 C ATOM 715 CG TYR A 48 -13.397 0.464 -4.486 1.00 0.00 C ATOM 716 CD1 TYR A 48 -13.407 1.488 -5.424 1.00 0.00 C ATOM 717 CD2 TYR A 48 -12.529 -0.601 -4.687 1.00 0.00 C ATOM 718 CE1 TYR A 48 -12.576 1.453 -6.527 1.00 0.00 C ATOM 719 CE2 TYR A 48 -11.695 -0.644 -5.787 1.00 0.00 C ATOM 720 CZ TYR A 48 -11.722 0.385 -6.704 1.00 0.00 C ATOM 721 OH TYR A 48 -10.893 0.347 -7.799 1.00 0.00 O ATOM 0 H TYR A 48 -15.503 2.587 -3.806 1.00 0.00 H new ATOM 0 HA TYR A 48 -15.966 -0.075 -4.524 1.00 0.00 H new ATOM 0 HB2 TYR A 48 -14.072 1.390 -2.688 1.00 0.00 H new ATOM 0 HB3 TYR A 48 -14.098 -0.362 -2.650 1.00 0.00 H new ATOM 0 HD1 TYR A 48 -14.075 2.325 -5.289 1.00 0.00 H new ATOM 0 HD2 TYR A 48 -12.506 -1.409 -3.971 1.00 0.00 H new ATOM 0 HE1 TYR A 48 -12.595 2.258 -7.247 1.00 0.00 H new ATOM 0 HE2 TYR A 48 -11.025 -1.479 -5.928 1.00 0.00 H new ATOM 0 HH TYR A 48 -9.993 0.635 -7.538 1.00 0.00 H new ATOM 731 N TYR A 49 -16.630 0.561 -1.340 1.00 0.00 N ATOM 732 CA TYR A 49 -17.351 0.043 -0.181 1.00 0.00 C ATOM 733 C TYR A 49 -18.825 -0.197 -0.506 1.00 0.00 C ATOM 734 O TYR A 49 -19.518 -0.913 0.219 1.00 0.00 O ATOM 735 CB TYR A 49 -17.203 0.993 1.017 1.00 0.00 C ATOM 736 CG TYR A 49 -18.354 1.958 1.212 1.00 0.00 C ATOM 737 CD1 TYR A 49 -18.395 3.170 0.535 1.00 0.00 C ATOM 738 CD2 TYR A 49 -19.393 1.660 2.085 1.00 0.00 C ATOM 739 CE1 TYR A 49 -19.440 4.056 0.721 1.00 0.00 C ATOM 740 CE2 TYR A 49 -20.441 2.539 2.275 1.00 0.00 C ATOM 741 CZ TYR A 49 -20.460 3.736 1.592 1.00 0.00 C ATOM 742 OH TYR A 49 -21.502 4.616 1.780 1.00 0.00 O ATOM 0 H TYR A 49 -16.169 1.458 -1.187 1.00 0.00 H new ATOM 0 HA TYR A 49 -16.911 -0.918 0.086 1.00 0.00 H new ATOM 0 HB2 TYR A 49 -17.090 0.397 1.923 1.00 0.00 H new ATOM 0 HB3 TYR A 49 -16.284 1.566 0.896 1.00 0.00 H new ATOM 0 HD1 TYR A 49 -17.598 3.424 -0.148 1.00 0.00 H new ATOM 0 HD2 TYR A 49 -19.381 0.724 2.624 1.00 0.00 H new ATOM 0 HE1 TYR A 49 -19.457 4.994 0.187 1.00 0.00 H new ATOM 0 HE2 TYR A 49 -21.242 2.290 2.955 1.00 0.00 H new ATOM 0 HH TYR A 49 -22.353 4.141 1.680 1.00 0.00 H new ATOM 752 N LEU A 50 -19.298 0.397 -1.597 1.00 0.00 N ATOM 753 CA LEU A 50 -20.686 0.232 -2.011 1.00 0.00 C ATOM 754 C LEU A 50 -20.871 -1.083 -2.761 1.00 0.00 C ATOM 755 O LEU A 50 -21.845 -1.804 -2.542 1.00 0.00 O ATOM 756 CB LEU A 50 -21.130 1.406 -2.887 1.00 0.00 C ATOM 757 CG LEU A 50 -21.270 2.744 -2.157 1.00 0.00 C ATOM 758 CD1 LEU A 50 -21.623 3.852 -3.138 1.00 0.00 C ATOM 759 CD2 LEU A 50 -22.323 2.648 -1.063 1.00 0.00 C ATOM 0 H LEU A 50 -18.742 0.995 -2.208 1.00 0.00 H new ATOM 0 HA LEU A 50 -21.307 0.211 -1.115 1.00 0.00 H new ATOM 0 HB2 LEU A 50 -20.412 1.526 -3.698 1.00 0.00 H new ATOM 0 HB3 LEU A 50 -22.088 1.157 -3.343 1.00 0.00 H new ATOM 0 HG LEU A 50 -20.313 2.984 -1.694 1.00 0.00 H new ATOM 0 HD11 LEU A 50 -21.719 4.796 -2.602 1.00 0.00 H new ATOM 0 HD12 LEU A 50 -20.836 3.939 -3.888 1.00 0.00 H new ATOM 0 HD13 LEU A 50 -22.567 3.616 -3.629 1.00 0.00 H new ATOM 0 HD21 LEU A 50 -22.409 3.609 -0.555 1.00 0.00 H new ATOM 0 HD22 LEU A 50 -23.284 2.384 -1.505 1.00 0.00 H new ATOM 0 HD23 LEU A 50 -22.032 1.882 -0.344 1.00 0.00 H new ATOM 771 N GLU A 51 -19.927 -1.390 -3.645 1.00 0.00 N ATOM 772 CA GLU A 51 -19.982 -2.619 -4.427 1.00 0.00 C ATOM 773 C GLU A 51 -19.736 -3.840 -3.546 1.00 0.00 C ATOM 774 O GLU A 51 -20.307 -4.907 -3.774 1.00 0.00 O ATOM 775 CB GLU A 51 -18.953 -2.574 -5.558 1.00 0.00 C ATOM 776 CG GLU A 51 -19.162 -1.420 -6.524 1.00 0.00 C ATOM 777 CD GLU A 51 -18.120 -1.382 -7.623 1.00 0.00 C ATOM 778 OE1 GLU A 51 -18.344 -2.017 -8.675 1.00 0.00 O ATOM 779 OE2 GLU A 51 -17.080 -0.717 -7.433 1.00 0.00 O ATOM 0 H GLU A 51 -19.115 -0.804 -3.837 1.00 0.00 H new ATOM 0 HA GLU A 51 -20.981 -2.702 -4.856 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -17.955 -2.500 -5.127 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -18.992 -3.512 -6.112 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -20.153 -1.501 -6.971 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -19.137 -0.480 -5.972 1.00 0.00 H new ATOM 786 N PHE A 52 -18.883 -3.679 -2.538 1.00 0.00 N ATOM 787 CA PHE A 52 -18.569 -4.773 -1.627 1.00 0.00 C ATOM 788 C PHE A 52 -19.702 -4.996 -0.632 1.00 0.00 C ATOM 789 O PHE A 52 -19.711 -4.420 0.457 1.00 0.00 O ATOM 790 CB PHE A 52 -17.263 -4.497 -0.878 1.00 0.00 C ATOM 791 CG PHE A 52 -16.031 -4.834 -1.673 1.00 0.00 C ATOM 792 CD1 PHE A 52 -15.514 -3.934 -2.589 1.00 0.00 C ATOM 793 CD2 PHE A 52 -15.394 -6.053 -1.504 1.00 0.00 C ATOM 794 CE1 PHE A 52 -14.382 -4.242 -3.321 1.00 0.00 C ATOM 795 CE2 PHE A 52 -14.263 -6.366 -2.232 1.00 0.00 C ATOM 796 CZ PHE A 52 -13.757 -5.460 -3.142 1.00 0.00 C ATOM 0 H PHE A 52 -18.399 -2.805 -2.333 1.00 0.00 H new ATOM 0 HA PHE A 52 -18.447 -5.677 -2.223 1.00 0.00 H new ATOM 0 HB2 PHE A 52 -17.229 -3.444 -0.600 1.00 0.00 H new ATOM 0 HB3 PHE A 52 -17.256 -5.072 0.048 1.00 0.00 H new ATOM 0 HD1 PHE A 52 -16.000 -2.981 -2.734 1.00 0.00 H new ATOM 0 HD2 PHE A 52 -15.787 -6.767 -0.795 1.00 0.00 H new ATOM 0 HE1 PHE A 52 -13.987 -3.531 -4.032 1.00 0.00 H new ATOM 0 HE2 PHE A 52 -13.775 -7.319 -2.089 1.00 0.00 H new ATOM 0 HZ PHE A 52 -12.873 -5.703 -3.713 1.00 0.00 H new ATOM 806 N GLU A 53 -20.662 -5.829 -1.020 1.00 0.00 N ATOM 807 CA GLU A 53 -21.802 -6.135 -0.164 1.00 0.00 C ATOM 808 C GLU A 53 -21.563 -7.423 0.614 1.00 0.00 C ATOM 809 O GLU A 53 -20.957 -8.366 0.103 1.00 0.00 O ATOM 810 CB GLU A 53 -23.077 -6.260 -1.000 1.00 0.00 C ATOM 811 CG GLU A 53 -23.452 -4.983 -1.735 1.00 0.00 C ATOM 812 CD GLU A 53 -24.707 -5.142 -2.570 1.00 0.00 C ATOM 813 OE1 GLU A 53 -25.810 -4.915 -2.031 1.00 0.00 O ATOM 814 OE2 GLU A 53 -24.585 -5.494 -3.762 1.00 0.00 O ATOM 0 H GLU A 53 -20.673 -6.304 -1.922 1.00 0.00 H new ATOM 0 HA GLU A 53 -21.922 -5.317 0.546 1.00 0.00 H new ATOM 0 HB2 GLU A 53 -22.948 -7.062 -1.726 1.00 0.00 H new ATOM 0 HB3 GLU A 53 -23.901 -6.550 -0.348 1.00 0.00 H new ATOM 0 HG2 GLU A 53 -23.600 -4.181 -1.012 1.00 0.00 H new ATOM 0 HG3 GLU A 53 -22.626 -4.683 -2.380 1.00 0.00 H new ATOM 821 N ASP A 54 -22.046 -7.458 1.852 1.00 0.00 N ATOM 822 CA ASP A 54 -21.882 -8.630 2.702 1.00 0.00 C ATOM 823 C ASP A 54 -22.795 -9.765 2.248 1.00 0.00 C ATOM 824 O ASP A 54 -23.959 -9.835 2.643 1.00 0.00 O ATOM 825 CB ASP A 54 -22.176 -8.271 4.159 1.00 0.00 C ATOM 826 CG ASP A 54 -21.957 -9.439 5.100 1.00 0.00 C ATOM 827 OD1 ASP A 54 -22.913 -10.210 5.323 1.00 0.00 O ATOM 828 OD2 ASP A 54 -20.828 -9.582 5.615 1.00 0.00 O ATOM 0 H ASP A 54 -22.554 -6.688 2.288 1.00 0.00 H new ATOM 0 HA ASP A 54 -20.849 -8.968 2.620 1.00 0.00 H new ATOM 0 HB2 ASP A 54 -21.538 -7.441 4.461 1.00 0.00 H new ATOM 0 HB3 ASP A 54 -23.207 -7.928 4.244 1.00 0.00 H new ATOM 833 N THR A 55 -22.259 -10.647 1.409 1.00 0.00 N ATOM 834 CA THR A 55 -23.021 -11.781 0.897 1.00 0.00 C ATOM 835 C THR A 55 -22.151 -13.030 0.802 1.00 0.00 C ATOM 836 O THR A 55 -20.992 -12.960 0.396 1.00 0.00 O ATOM 837 CB THR A 55 -23.614 -11.483 -0.494 1.00 0.00 C ATOM 838 OG1 THR A 55 -22.572 -11.095 -1.397 1.00 0.00 O ATOM 839 CG2 THR A 55 -24.660 -10.382 -0.415 1.00 0.00 C ATOM 0 H THR A 55 -21.299 -10.598 1.069 1.00 0.00 H new ATOM 0 HA THR A 55 -23.834 -11.955 1.602 1.00 0.00 H new ATOM 0 HB THR A 55 -24.094 -12.390 -0.861 1.00 0.00 H new ATOM 0 HG1 THR A 55 -22.956 -10.909 -2.279 1.00 0.00 H new ATOM 0 HG21 THR A 55 -25.063 -10.191 -1.410 1.00 0.00 H new ATOM 0 HG22 THR A 55 -25.466 -10.693 0.249 1.00 0.00 H new ATOM 0 HG23 THR A 55 -24.202 -9.472 -0.028 1.00 0.00 H new ATOM 847 N GLU A 56 -22.718 -14.169 1.184 1.00 0.00 N ATOM 848 CA GLU A 56 -21.999 -15.433 1.143 1.00 0.00 C ATOM 849 C GLU A 56 -21.611 -15.797 -0.287 1.00 0.00 C ATOM 850 O GLU A 56 -20.478 -16.201 -0.550 1.00 0.00 O ATOM 851 CB GLU A 56 -22.856 -16.542 1.750 1.00 0.00 C ATOM 852 CG GLU A 56 -22.057 -17.762 2.165 1.00 0.00 C ATOM 853 CD GLU A 56 -22.924 -18.858 2.753 1.00 0.00 C ATOM 854 OE1 GLU A 56 -23.228 -18.789 3.963 1.00 0.00 O ATOM 855 OE2 GLU A 56 -23.299 -19.785 2.005 1.00 0.00 O ATOM 0 H GLU A 56 -23.676 -14.241 1.526 1.00 0.00 H new ATOM 0 HA GLU A 56 -21.085 -15.324 1.727 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -23.383 -16.149 2.619 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -23.614 -16.842 1.027 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -21.522 -18.153 1.299 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -21.305 -17.467 2.897 1.00 0.00 H new ATOM 862 N GLU A 57 -22.560 -15.650 -1.208 1.00 0.00 N ATOM 863 CA GLU A 57 -22.321 -15.968 -2.613 1.00 0.00 C ATOM 864 C GLU A 57 -21.260 -15.051 -3.211 1.00 0.00 C ATOM 865 O GLU A 57 -21.360 -13.827 -3.123 1.00 0.00 O ATOM 866 CB GLU A 57 -23.621 -15.850 -3.411 1.00 0.00 C ATOM 867 CG GLU A 57 -24.748 -16.722 -2.879 1.00 0.00 C ATOM 868 CD GLU A 57 -26.029 -16.570 -3.675 1.00 0.00 C ATOM 869 OE1 GLU A 57 -26.842 -15.687 -3.329 1.00 0.00 O ATOM 870 OE2 GLU A 57 -26.221 -17.333 -4.644 1.00 0.00 O ATOM 0 H GLU A 57 -23.501 -15.313 -1.007 1.00 0.00 H new ATOM 0 HA GLU A 57 -21.958 -16.994 -2.668 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -23.946 -14.810 -3.407 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -23.425 -16.119 -4.449 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -24.435 -17.766 -2.898 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -24.940 -16.466 -1.837 1.00 0.00 H new ATOM 877 N ASN A 58 -20.242 -15.652 -3.824 1.00 0.00 N ATOM 878 CA ASN A 58 -19.160 -14.893 -4.441 1.00 0.00 C ATOM 879 C ASN A 58 -19.558 -14.409 -5.832 1.00 0.00 C ATOM 880 O ASN A 58 -20.191 -15.139 -6.596 1.00 0.00 O ATOM 881 CB ASN A 58 -17.895 -15.752 -4.530 1.00 0.00 C ATOM 882 CG ASN A 58 -16.748 -15.024 -5.204 1.00 0.00 C ATOM 883 OD1 ASN A 58 -16.637 -13.802 -5.119 1.00 0.00 O ATOM 884 ND2 ASN A 58 -15.885 -15.776 -5.879 1.00 0.00 N ATOM 0 H ASN A 58 -20.145 -16.664 -3.906 1.00 0.00 H new ATOM 0 HA ASN A 58 -18.958 -14.022 -3.817 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -17.592 -16.052 -3.527 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -18.117 -16.665 -5.083 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -15.092 -15.343 -6.352 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -16.015 -16.787 -5.924 1.00 0.00 H new ATOM 891 N LYS A 59 -19.185 -13.174 -6.153 1.00 0.00 N ATOM 892 CA LYS A 59 -19.504 -12.592 -7.452 1.00 0.00 C ATOM 893 C LYS A 59 -18.243 -12.396 -8.288 1.00 0.00 C ATOM 894 O LYS A 59 -17.141 -12.271 -7.751 1.00 0.00 O ATOM 895 CB LYS A 59 -20.219 -11.251 -7.272 1.00 0.00 C ATOM 896 CG LYS A 59 -21.531 -11.352 -6.509 1.00 0.00 C ATOM 897 CD LYS A 59 -22.162 -9.983 -6.306 1.00 0.00 C ATOM 898 CE LYS A 59 -23.465 -10.075 -5.529 1.00 0.00 C ATOM 899 NZ LYS A 59 -24.084 -8.736 -5.323 1.00 0.00 N ATOM 0 H LYS A 59 -18.662 -12.557 -5.532 1.00 0.00 H new ATOM 0 HA LYS A 59 -20.163 -13.283 -7.977 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -19.556 -10.564 -6.746 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -20.413 -10.819 -8.254 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -22.222 -11.995 -7.054 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -21.355 -11.821 -5.541 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -21.465 -9.336 -5.773 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -22.348 -9.521 -7.275 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -24.162 -10.719 -6.065 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -23.279 -10.542 -4.562 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -24.970 -8.842 -4.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -23.429 -8.129 -4.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -24.285 -8.301 -6.246 1.00 0.00 H new ATOM 913 N LEU A 60 -18.410 -12.378 -9.605 1.00 0.00 N ATOM 914 CA LEU A 60 -17.288 -12.193 -10.518 1.00 0.00 C ATOM 915 C LEU A 60 -16.920 -10.714 -10.623 1.00 0.00 C ATOM 916 O LEU A 60 -15.883 -10.361 -11.184 1.00 0.00 O ATOM 917 CB LEU A 60 -17.635 -12.750 -11.902 1.00 0.00 C ATOM 918 CG LEU A 60 -16.495 -12.730 -12.925 1.00 0.00 C ATOM 919 CD1 LEU A 60 -15.340 -13.602 -12.459 1.00 0.00 C ATOM 920 CD2 LEU A 60 -16.995 -13.191 -14.287 1.00 0.00 C ATOM 0 H LEU A 60 -19.313 -12.489 -10.065 1.00 0.00 H new ATOM 0 HA LEU A 60 -16.429 -12.736 -10.124 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -17.977 -13.778 -11.785 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -18.472 -12.179 -12.305 1.00 0.00 H new ATOM 0 HG LEU A 60 -16.134 -11.705 -13.017 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -14.541 -13.574 -13.200 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -14.964 -13.230 -11.506 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -15.685 -14.629 -12.337 1.00 0.00 H new ATOM 0 HD21 LEU A 60 -16.173 -13.171 -15.002 1.00 0.00 H new ATOM 0 HD22 LEU A 60 -17.382 -14.207 -14.208 1.00 0.00 H new ATOM 0 HD23 LEU A 60 -17.788 -12.526 -14.628 1.00 0.00 H new ATOM 932 N ILE A 61 -17.777 -9.859 -10.072 1.00 0.00 N ATOM 933 CA ILE A 61 -17.554 -8.416 -10.101 1.00 0.00 C ATOM 934 C ILE A 61 -16.371 -8.019 -9.221 1.00 0.00 C ATOM 935 O ILE A 61 -15.790 -6.944 -9.389 1.00 0.00 O ATOM 936 CB ILE A 61 -18.815 -7.652 -9.637 1.00 0.00 C ATOM 937 CG1 ILE A 61 -18.656 -6.149 -9.875 1.00 0.00 C ATOM 938 CG2 ILE A 61 -19.096 -7.930 -8.166 1.00 0.00 C ATOM 939 CD1 ILE A 61 -18.572 -5.771 -11.339 1.00 0.00 C ATOM 0 H ILE A 61 -18.635 -10.141 -9.598 1.00 0.00 H new ATOM 0 HA ILE A 61 -17.331 -8.147 -11.133 1.00 0.00 H new ATOM 0 HB ILE A 61 -19.663 -8.004 -10.225 1.00 0.00 H new ATOM 0 HG12 ILE A 61 -19.499 -5.627 -9.422 1.00 0.00 H new ATOM 0 HG13 ILE A 61 -17.756 -5.803 -9.367 1.00 0.00 H new ATOM 0 HG21 ILE A 61 -19.987 -7.384 -7.856 1.00 0.00 H new ATOM 0 HG22 ILE A 61 -19.257 -8.998 -8.022 1.00 0.00 H new ATOM 0 HG23 ILE A 61 -18.246 -7.607 -7.566 1.00 0.00 H new ATOM 0 HD11 ILE A 61 -18.460 -4.691 -11.430 1.00 0.00 H new ATOM 0 HD12 ILE A 61 -17.713 -6.264 -11.793 1.00 0.00 H new ATOM 0 HD13 ILE A 61 -19.483 -6.086 -11.849 1.00 0.00 H new ATOM 951 N TYR A 62 -16.010 -8.895 -8.291 1.00 0.00 N ATOM 952 CA TYR A 62 -14.900 -8.631 -7.383 1.00 0.00 C ATOM 953 C TYR A 62 -13.558 -8.667 -8.114 1.00 0.00 C ATOM 954 O TYR A 62 -12.569 -8.108 -7.635 1.00 0.00 O ATOM 955 CB TYR A 62 -14.899 -9.645 -6.235 1.00 0.00 C ATOM 956 CG TYR A 62 -16.068 -9.491 -5.285 1.00 0.00 C ATOM 957 CD1 TYR A 62 -16.196 -8.359 -4.488 1.00 0.00 C ATOM 958 CD2 TYR A 62 -17.041 -10.477 -5.184 1.00 0.00 C ATOM 959 CE1 TYR A 62 -17.261 -8.217 -3.617 1.00 0.00 C ATOM 960 CE2 TYR A 62 -18.108 -10.342 -4.315 1.00 0.00 C ATOM 961 CZ TYR A 62 -18.213 -9.210 -3.536 1.00 0.00 C ATOM 962 OH TYR A 62 -19.274 -9.071 -2.669 1.00 0.00 O ATOM 0 H TYR A 62 -16.469 -9.794 -8.146 1.00 0.00 H new ATOM 0 HA TYR A 62 -15.036 -7.629 -6.977 1.00 0.00 H new ATOM 0 HB2 TYR A 62 -14.911 -10.652 -6.652 1.00 0.00 H new ATOM 0 HB3 TYR A 62 -13.970 -9.544 -5.673 1.00 0.00 H new ATOM 0 HD1 TYR A 62 -15.452 -7.578 -4.550 1.00 0.00 H new ATOM 0 HD2 TYR A 62 -16.963 -11.364 -5.795 1.00 0.00 H new ATOM 0 HE1 TYR A 62 -17.346 -7.332 -3.003 1.00 0.00 H new ATOM 0 HE2 TYR A 62 -18.855 -11.119 -4.247 1.00 0.00 H new ATOM 0 HH TYR A 62 -19.855 -9.858 -2.734 1.00 0.00 H new ATOM 972 N THR A 63 -13.525 -9.317 -9.276 1.00 0.00 N ATOM 973 CA THR A 63 -12.292 -9.418 -10.054 1.00 0.00 C ATOM 974 C THR A 63 -11.936 -8.085 -10.725 1.00 0.00 C ATOM 975 O THR A 63 -10.816 -7.597 -10.567 1.00 0.00 O ATOM 976 CB THR A 63 -12.379 -10.529 -11.123 1.00 0.00 C ATOM 977 OG1 THR A 63 -12.721 -11.777 -10.508 1.00 0.00 O ATOM 978 CG2 THR A 63 -11.056 -10.673 -11.863 1.00 0.00 C ATOM 0 H THR A 63 -14.331 -9.778 -9.697 1.00 0.00 H new ATOM 0 HA THR A 63 -11.503 -9.676 -9.348 1.00 0.00 H new ATOM 0 HB THR A 63 -13.153 -10.252 -11.839 1.00 0.00 H new ATOM 0 HG1 THR A 63 -12.776 -12.475 -11.193 1.00 0.00 H new ATOM 0 HG21 THR A 63 -11.141 -11.461 -12.611 1.00 0.00 H new ATOM 0 HG22 THR A 63 -10.810 -9.732 -12.354 1.00 0.00 H new ATOM 0 HG23 THR A 63 -10.269 -10.929 -11.154 1.00 0.00 H new ATOM 986 N PRO A 64 -12.870 -7.471 -11.485 1.00 0.00 N ATOM 987 CA PRO A 64 -12.611 -6.189 -12.153 1.00 0.00 C ATOM 988 C PRO A 64 -12.388 -5.056 -11.158 1.00 0.00 C ATOM 989 O PRO A 64 -11.535 -4.194 -11.370 1.00 0.00 O ATOM 990 CB PRO A 64 -13.881 -5.938 -12.973 1.00 0.00 C ATOM 991 CG PRO A 64 -14.933 -6.757 -12.312 1.00 0.00 C ATOM 992 CD PRO A 64 -14.228 -7.967 -11.769 1.00 0.00 C ATOM 0 HA PRO A 64 -11.705 -6.225 -12.757 1.00 0.00 H new ATOM 0 HB2 PRO A 64 -14.147 -4.881 -12.975 1.00 0.00 H new ATOM 0 HB3 PRO A 64 -13.745 -6.235 -14.013 1.00 0.00 H new ATOM 0 HG2 PRO A 64 -15.420 -6.197 -11.514 1.00 0.00 H new ATOM 0 HG3 PRO A 64 -15.710 -7.042 -13.021 1.00 0.00 H new ATOM 0 HD2 PRO A 64 -14.714 -8.346 -10.870 1.00 0.00 H new ATOM 0 HD3 PRO A 64 -14.215 -8.783 -12.492 1.00 0.00 H new ATOM 1000 N ILE A 65 -13.161 -5.060 -10.073 1.00 0.00 N ATOM 1001 CA ILE A 65 -13.035 -4.029 -9.047 1.00 0.00 C ATOM 1002 C ILE A 65 -11.633 -4.033 -8.444 1.00 0.00 C ATOM 1003 O ILE A 65 -10.990 -2.987 -8.339 1.00 0.00 O ATOM 1004 CB ILE A 65 -14.074 -4.221 -7.921 1.00 0.00 C ATOM 1005 CG1 ILE A 65 -15.492 -4.074 -8.477 1.00 0.00 C ATOM 1006 CG2 ILE A 65 -13.835 -3.222 -6.796 1.00 0.00 C ATOM 1007 CD1 ILE A 65 -16.574 -4.432 -7.480 1.00 0.00 C ATOM 0 H ILE A 65 -13.877 -5.762 -9.883 1.00 0.00 H new ATOM 0 HA ILE A 65 -13.218 -3.070 -9.532 1.00 0.00 H new ATOM 0 HB ILE A 65 -13.963 -5.226 -7.515 1.00 0.00 H new ATOM 0 HG12 ILE A 65 -15.639 -3.046 -8.807 1.00 0.00 H new ATOM 0 HG13 ILE A 65 -15.596 -4.709 -9.357 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -14.577 -3.373 -6.012 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -12.837 -3.370 -6.384 1.00 0.00 H new ATOM 0 HG23 ILE A 65 -13.920 -2.208 -7.186 1.00 0.00 H new ATOM 0 HD11 ILE A 65 -17.552 -4.304 -7.943 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -16.453 -5.469 -7.168 1.00 0.00 H new ATOM 0 HD13 ILE A 65 -16.497 -3.780 -6.610 1.00 0.00 H new ATOM 1019 N PHE A 66 -11.167 -5.215 -8.049 1.00 0.00 N ATOM 1020 CA PHE A 66 -9.840 -5.354 -7.457 1.00 0.00 C ATOM 1021 C PHE A 66 -8.760 -4.894 -8.433 1.00 0.00 C ATOM 1022 O PHE A 66 -7.777 -4.270 -8.034 1.00 0.00 O ATOM 1023 CB PHE A 66 -9.591 -6.807 -7.045 1.00 0.00 C ATOM 1024 CG PHE A 66 -8.303 -7.009 -6.298 1.00 0.00 C ATOM 1025 CD1 PHE A 66 -8.195 -6.645 -4.966 1.00 0.00 C ATOM 1026 CD2 PHE A 66 -7.200 -7.562 -6.929 1.00 0.00 C ATOM 1027 CE1 PHE A 66 -7.012 -6.830 -4.275 1.00 0.00 C ATOM 1028 CE2 PHE A 66 -6.014 -7.750 -6.244 1.00 0.00 C ATOM 1029 CZ PHE A 66 -5.920 -7.383 -4.916 1.00 0.00 C ATOM 0 H PHE A 66 -11.688 -6.089 -8.128 1.00 0.00 H new ATOM 0 HA PHE A 66 -9.795 -4.722 -6.570 1.00 0.00 H new ATOM 0 HB2 PHE A 66 -10.419 -7.146 -6.423 1.00 0.00 H new ATOM 0 HB3 PHE A 66 -9.586 -7.433 -7.937 1.00 0.00 H new ATOM 0 HD1 PHE A 66 -9.045 -6.211 -4.461 1.00 0.00 H new ATOM 0 HD2 PHE A 66 -7.268 -7.849 -7.968 1.00 0.00 H new ATOM 0 HE1 PHE A 66 -6.942 -6.543 -3.236 1.00 0.00 H new ATOM 0 HE2 PHE A 66 -5.162 -8.183 -6.747 1.00 0.00 H new ATOM 0 HZ PHE A 66 -4.994 -7.528 -4.379 1.00 0.00 H new ATOM 1039 N ASN A 67 -8.951 -5.206 -9.712 1.00 0.00 N ATOM 1040 CA ASN A 67 -7.995 -4.821 -10.745 1.00 0.00 C ATOM 1041 C ASN A 67 -7.898 -3.303 -10.856 1.00 0.00 C ATOM 1042 O ASN A 67 -6.845 -2.761 -11.191 1.00 0.00 O ATOM 1043 CB ASN A 67 -8.399 -5.417 -12.095 1.00 0.00 C ATOM 1044 CG ASN A 67 -8.350 -6.931 -12.096 1.00 0.00 C ATOM 1045 OD1 ASN A 67 -7.544 -7.539 -11.392 1.00 0.00 O ATOM 1046 ND2 ASN A 67 -9.215 -7.550 -12.891 1.00 0.00 N ATOM 0 H ASN A 67 -9.759 -5.724 -10.057 1.00 0.00 H new ATOM 0 HA ASN A 67 -7.017 -5.212 -10.463 1.00 0.00 H new ATOM 0 HB2 ASN A 67 -9.407 -5.089 -12.347 1.00 0.00 H new ATOM 0 HB3 ASN A 67 -7.736 -5.034 -12.871 1.00 0.00 H new ATOM 0 HD21 ASN A 67 -9.229 -8.569 -12.935 1.00 0.00 H new ATOM 0 HD22 ASN A 67 -9.866 -7.006 -13.458 1.00 0.00 H new ATOM 1053 N GLU A 68 -9.004 -2.623 -10.571 1.00 0.00 N ATOM 1054 CA GLU A 68 -9.039 -1.168 -10.636 1.00 0.00 C ATOM 1055 C GLU A 68 -8.290 -0.563 -9.454 1.00 0.00 C ATOM 1056 O GLU A 68 -7.675 0.496 -9.575 1.00 0.00 O ATOM 1057 CB GLU A 68 -10.486 -0.671 -10.658 1.00 0.00 C ATOM 1058 CG GLU A 68 -10.611 0.838 -10.795 1.00 0.00 C ATOM 1059 CD GLU A 68 -12.053 1.297 -10.888 1.00 0.00 C ATOM 1060 OE1 GLU A 68 -12.679 1.502 -9.827 1.00 0.00 O ATOM 1061 OE2 GLU A 68 -12.554 1.451 -12.021 1.00 0.00 O ATOM 0 H GLU A 68 -9.885 -3.056 -10.294 1.00 0.00 H new ATOM 0 HA GLU A 68 -8.548 -0.852 -11.556 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -11.012 -1.147 -11.486 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -10.983 -0.986 -9.741 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -10.135 1.318 -9.939 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -10.071 1.164 -11.684 1.00 0.00 H new ATOM 1068 N TYR A 69 -8.343 -1.246 -8.314 1.00 0.00 N ATOM 1069 CA TYR A 69 -7.663 -0.781 -7.109 1.00 0.00 C ATOM 1070 C TYR A 69 -6.150 -0.903 -7.265 1.00 0.00 C ATOM 1071 O TYR A 69 -5.392 -0.046 -6.807 1.00 0.00 O ATOM 1072 CB TYR A 69 -8.130 -1.588 -5.895 1.00 0.00 C ATOM 1073 CG TYR A 69 -7.730 -0.982 -4.570 1.00 0.00 C ATOM 1074 CD1 TYR A 69 -8.535 -0.036 -3.949 1.00 0.00 C ATOM 1075 CD2 TYR A 69 -6.551 -1.357 -3.938 1.00 0.00 C ATOM 1076 CE1 TYR A 69 -8.178 0.521 -2.736 1.00 0.00 C ATOM 1077 CE2 TYR A 69 -6.186 -0.804 -2.723 1.00 0.00 C ATOM 1078 CZ TYR A 69 -7.002 0.134 -2.128 1.00 0.00 C ATOM 1079 OH TYR A 69 -6.641 0.686 -0.920 1.00 0.00 O ATOM 0 H TYR A 69 -8.850 -2.124 -8.199 1.00 0.00 H new ATOM 0 HA TYR A 69 -7.913 0.269 -6.956 1.00 0.00 H new ATOM 0 HB2 TYR A 69 -9.215 -1.682 -5.928 1.00 0.00 H new ATOM 0 HB3 TYR A 69 -7.721 -2.596 -5.961 1.00 0.00 H new ATOM 0 HD1 TYR A 69 -9.456 0.270 -4.423 1.00 0.00 H new ATOM 0 HD2 TYR A 69 -5.909 -2.091 -4.402 1.00 0.00 H new ATOM 0 HE1 TYR A 69 -8.816 1.255 -2.267 1.00 0.00 H new ATOM 0 HE2 TYR A 69 -5.267 -1.106 -2.244 1.00 0.00 H new ATOM 0 HH TYR A 69 -5.787 0.305 -0.628 1.00 0.00 H new ATOM 1089 N ILE A 70 -5.721 -1.977 -7.919 1.00 0.00 N ATOM 1090 CA ILE A 70 -4.305 -2.228 -8.150 1.00 0.00 C ATOM 1091 C ILE A 70 -3.753 -1.290 -9.219 1.00 0.00 C ATOM 1092 O ILE A 70 -2.573 -0.945 -9.213 1.00 0.00 O ATOM 1093 CB ILE A 70 -4.059 -3.691 -8.577 1.00 0.00 C ATOM 1094 CG1 ILE A 70 -4.608 -4.655 -7.521 1.00 0.00 C ATOM 1095 CG2 ILE A 70 -2.576 -3.942 -8.813 1.00 0.00 C ATOM 1096 CD1 ILE A 70 -3.926 -4.541 -6.174 1.00 0.00 C ATOM 0 H ILE A 70 -6.340 -2.692 -8.301 1.00 0.00 H new ATOM 0 HA ILE A 70 -3.787 -2.044 -7.209 1.00 0.00 H new ATOM 0 HB ILE A 70 -4.586 -3.868 -9.514 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -5.675 -4.471 -7.394 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -4.502 -5.677 -7.886 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -2.426 -4.979 -9.113 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -2.216 -3.281 -9.601 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -2.023 -3.746 -7.894 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -4.370 -5.255 -5.480 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -2.863 -4.755 -6.285 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -4.054 -3.530 -5.786 1.00 0.00 H new ATOM 1108 N SER A 71 -4.615 -0.883 -10.142 1.00 0.00 N ATOM 1109 CA SER A 71 -4.211 0.012 -11.218 1.00 0.00 C ATOM 1110 C SER A 71 -4.285 1.474 -10.784 1.00 0.00 C ATOM 1111 O SER A 71 -3.543 2.315 -11.286 1.00 0.00 O ATOM 1112 CB SER A 71 -5.097 -0.213 -12.443 1.00 0.00 C ATOM 1113 OG SER A 71 -6.461 0.017 -12.135 1.00 0.00 O ATOM 0 H SER A 71 -5.597 -1.158 -10.167 1.00 0.00 H new ATOM 0 HA SER A 71 -3.175 -0.212 -11.471 1.00 0.00 H new ATOM 0 HB2 SER A 71 -4.786 0.452 -13.248 1.00 0.00 H new ATOM 0 HB3 SER A 71 -4.970 -1.233 -12.805 1.00 0.00 H new ATOM 0 HG SER A 71 -6.554 0.193 -11.176 1.00 0.00 H new ATOM 1119 N LEU A 72 -5.196 1.774 -9.864 1.00 0.00 N ATOM 1120 CA LEU A 72 -5.368 3.141 -9.379 1.00 0.00 C ATOM 1121 C LEU A 72 -4.495 3.429 -8.155 1.00 0.00 C ATOM 1122 O LEU A 72 -3.610 4.284 -8.199 1.00 0.00 O ATOM 1123 CB LEU A 72 -6.846 3.391 -9.040 1.00 0.00 C ATOM 1124 CG LEU A 72 -7.285 4.863 -8.965 1.00 0.00 C ATOM 1125 CD1 LEU A 72 -6.725 5.541 -7.725 1.00 0.00 C ATOM 1126 CD2 LEU A 72 -6.870 5.618 -10.221 1.00 0.00 C ATOM 0 H LEU A 72 -5.825 1.092 -9.440 1.00 0.00 H new ATOM 0 HA LEU A 72 -5.052 3.817 -10.174 1.00 0.00 H new ATOM 0 HB2 LEU A 72 -7.459 2.888 -9.788 1.00 0.00 H new ATOM 0 HB3 LEU A 72 -7.062 2.920 -8.081 1.00 0.00 H new ATOM 0 HG LEU A 72 -8.373 4.881 -8.897 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -7.052 6.580 -7.699 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -7.085 5.025 -6.835 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -5.636 5.504 -7.751 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -7.192 6.657 -10.144 1.00 0.00 H new ATOM 0 HD22 LEU A 72 -5.786 5.581 -10.326 1.00 0.00 H new ATOM 0 HD23 LEU A 72 -7.335 5.158 -11.093 1.00 0.00 H new ATOM 1138 N VAL A 73 -4.746 2.703 -7.069 1.00 0.00 N ATOM 1139 CA VAL A 73 -4.019 2.905 -5.817 1.00 0.00 C ATOM 1140 C VAL A 73 -2.582 2.384 -5.859 1.00 0.00 C ATOM 1141 O VAL A 73 -1.637 3.156 -5.700 1.00 0.00 O ATOM 1142 CB VAL A 73 -4.757 2.241 -4.638 1.00 0.00 C ATOM 1143 CG1 VAL A 73 -4.042 2.522 -3.325 1.00 0.00 C ATOM 1144 CG2 VAL A 73 -6.198 2.725 -4.579 1.00 0.00 C ATOM 0 H VAL A 73 -5.450 1.966 -7.030 1.00 0.00 H new ATOM 0 HA VAL A 73 -3.976 3.985 -5.676 1.00 0.00 H new ATOM 0 HB VAL A 73 -4.759 1.163 -4.796 1.00 0.00 H new ATOM 0 HG11 VAL A 73 -4.581 2.043 -2.507 1.00 0.00 H new ATOM 0 HG12 VAL A 73 -3.027 2.126 -3.371 1.00 0.00 H new ATOM 0 HG13 VAL A 73 -4.004 3.598 -3.154 1.00 0.00 H new ATOM 0 HG21 VAL A 73 -6.708 2.248 -3.742 1.00 0.00 H new ATOM 0 HG22 VAL A 73 -6.213 3.807 -4.445 1.00 0.00 H new ATOM 0 HG23 VAL A 73 -6.707 2.467 -5.508 1.00 0.00 H new ATOM 1154 N GLU A 74 -2.418 1.080 -6.068 1.00 0.00 N ATOM 1155 CA GLU A 74 -1.084 0.480 -6.096 1.00 0.00 C ATOM 1156 C GLU A 74 -0.161 1.217 -7.064 1.00 0.00 C ATOM 1157 O GLU A 74 1.022 1.412 -6.779 1.00 0.00 O ATOM 1158 CB GLU A 74 -1.162 -1.004 -6.463 1.00 0.00 C ATOM 1159 CG GLU A 74 0.169 -1.731 -6.345 1.00 0.00 C ATOM 1160 CD GLU A 74 0.044 -3.225 -6.571 1.00 0.00 C ATOM 1161 OE1 GLU A 74 -0.291 -3.945 -5.608 1.00 0.00 O ATOM 1162 OE2 GLU A 74 0.283 -3.675 -7.711 1.00 0.00 O ATOM 0 H GLU A 74 -3.183 0.423 -6.219 1.00 0.00 H new ATOM 0 HA GLU A 74 -0.664 0.570 -5.094 1.00 0.00 H new ATOM 0 HB2 GLU A 74 -1.892 -1.492 -5.816 1.00 0.00 H new ATOM 0 HB3 GLU A 74 -1.529 -1.098 -7.485 1.00 0.00 H new ATOM 0 HG2 GLU A 74 0.870 -1.316 -7.069 1.00 0.00 H new ATOM 0 HG3 GLU A 74 0.589 -1.552 -5.355 1.00 0.00 H new ATOM 1169 N LYS A 75 -0.705 1.633 -8.202 1.00 0.00 N ATOM 1170 CA LYS A 75 0.080 2.354 -9.198 1.00 0.00 C ATOM 1171 C LYS A 75 0.374 3.774 -8.730 1.00 0.00 C ATOM 1172 O LYS A 75 1.418 4.339 -9.056 1.00 0.00 O ATOM 1173 CB LYS A 75 -0.655 2.386 -10.537 1.00 0.00 C ATOM 1174 CG LYS A 75 -0.742 1.029 -11.215 1.00 0.00 C ATOM 1175 CD LYS A 75 0.626 0.547 -11.675 1.00 0.00 C ATOM 1176 CE LYS A 75 0.556 -0.853 -12.261 1.00 0.00 C ATOM 1177 NZ LYS A 75 -0.354 -0.919 -13.437 1.00 0.00 N ATOM 0 H LYS A 75 -1.681 1.485 -8.457 1.00 0.00 H new ATOM 0 HA LYS A 75 1.026 1.829 -9.328 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -1.663 2.770 -10.380 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -0.149 3.084 -11.203 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -1.172 0.303 -10.525 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -1.414 1.091 -12.071 1.00 0.00 H new ATOM 0 HD2 LYS A 75 1.023 1.235 -12.421 1.00 0.00 H new ATOM 0 HD3 LYS A 75 1.318 0.556 -10.833 1.00 0.00 H new ATOM 0 HE2 LYS A 75 1.555 -1.173 -12.557 1.00 0.00 H new ATOM 0 HE3 LYS A 75 0.212 -1.550 -11.496 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -0.246 -1.840 -13.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -1.338 -0.805 -13.121 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -0.115 -0.158 -14.104 1.00 0.00 H new ATOM 1191 N TYR A 76 -0.554 4.348 -7.971 1.00 0.00 N ATOM 1192 CA TYR A 76 -0.388 5.702 -7.455 1.00 0.00 C ATOM 1193 C TYR A 76 0.899 5.814 -6.640 1.00 0.00 C ATOM 1194 O TYR A 76 1.730 6.686 -6.891 1.00 0.00 O ATOM 1195 CB TYR A 76 -1.590 6.093 -6.593 1.00 0.00 C ATOM 1196 CG TYR A 76 -1.537 7.514 -6.082 1.00 0.00 C ATOM 1197 CD1 TYR A 76 -1.994 8.568 -6.862 1.00 0.00 C ATOM 1198 CD2 TYR A 76 -1.032 7.801 -4.821 1.00 0.00 C ATOM 1199 CE1 TYR A 76 -1.947 9.869 -6.401 1.00 0.00 C ATOM 1200 CE2 TYR A 76 -0.983 9.100 -4.352 1.00 0.00 C ATOM 1201 CZ TYR A 76 -1.441 10.129 -5.145 1.00 0.00 C ATOM 1202 OH TYR A 76 -1.394 11.424 -4.681 1.00 0.00 O ATOM 0 H TYR A 76 -1.428 3.897 -7.700 1.00 0.00 H new ATOM 0 HA TYR A 76 -0.323 6.385 -8.302 1.00 0.00 H new ATOM 0 HB2 TYR A 76 -2.502 5.960 -7.175 1.00 0.00 H new ATOM 0 HB3 TYR A 76 -1.653 5.413 -5.743 1.00 0.00 H new ATOM 0 HD1 TYR A 76 -2.393 8.367 -7.845 1.00 0.00 H new ATOM 0 HD2 TYR A 76 -0.672 6.997 -4.197 1.00 0.00 H new ATOM 0 HE1 TYR A 76 -2.305 10.678 -7.021 1.00 0.00 H new ATOM 0 HE2 TYR A 76 -0.588 9.307 -3.369 1.00 0.00 H new ATOM 0 HH TYR A 76 -1.011 11.435 -3.779 1.00 0.00 H new ATOM 1212 N ILE A 77 1.057 4.922 -5.664 1.00 0.00 N ATOM 1213 CA ILE A 77 2.244 4.919 -4.817 1.00 0.00 C ATOM 1214 C ILE A 77 3.500 4.632 -5.634 1.00 0.00 C ATOM 1215 O ILE A 77 4.529 5.284 -5.454 1.00 0.00 O ATOM 1216 CB ILE A 77 2.132 3.873 -3.687 1.00 0.00 C ATOM 1217 CG1 ILE A 77 0.940 4.191 -2.778 1.00 0.00 C ATOM 1218 CG2 ILE A 77 3.425 3.825 -2.881 1.00 0.00 C ATOM 1219 CD1 ILE A 77 0.715 3.162 -1.687 1.00 0.00 C ATOM 0 H ILE A 77 0.378 4.194 -5.442 1.00 0.00 H new ATOM 0 HA ILE A 77 2.317 5.913 -4.375 1.00 0.00 H new ATOM 0 HB ILE A 77 1.968 2.893 -4.135 1.00 0.00 H new ATOM 0 HG12 ILE A 77 1.095 5.167 -2.318 1.00 0.00 H new ATOM 0 HG13 ILE A 77 0.039 4.265 -3.387 1.00 0.00 H new ATOM 0 HG21 ILE A 77 3.332 3.083 -2.088 1.00 0.00 H new ATOM 0 HG22 ILE A 77 4.252 3.553 -3.536 1.00 0.00 H new ATOM 0 HG23 ILE A 77 3.616 4.804 -2.442 1.00 0.00 H new ATOM 0 HD11 ILE A 77 -0.145 3.453 -1.084 1.00 0.00 H new ATOM 0 HD12 ILE A 77 0.528 2.188 -2.139 1.00 0.00 H new ATOM 0 HD13 ILE A 77 1.600 3.104 -1.053 1.00 0.00 H new ATOM 1231 N GLU A 78 3.409 3.652 -6.530 1.00 0.00 N ATOM 1232 CA GLU A 78 4.542 3.274 -7.372 1.00 0.00 C ATOM 1233 C GLU A 78 5.097 4.475 -8.134 1.00 0.00 C ATOM 1234 O GLU A 78 6.300 4.733 -8.109 1.00 0.00 O ATOM 1235 CB GLU A 78 4.126 2.185 -8.362 1.00 0.00 C ATOM 1236 CG GLU A 78 5.200 1.847 -9.387 1.00 0.00 C ATOM 1237 CD GLU A 78 6.459 1.289 -8.753 1.00 0.00 C ATOM 1238 OE1 GLU A 78 7.297 2.092 -8.291 1.00 0.00 O ATOM 1239 OE2 GLU A 78 6.608 0.050 -8.721 1.00 0.00 O ATOM 0 H GLU A 78 2.563 3.105 -6.692 1.00 0.00 H new ATOM 0 HA GLU A 78 5.326 2.892 -6.718 1.00 0.00 H new ATOM 0 HB2 GLU A 78 3.868 1.282 -7.808 1.00 0.00 H new ATOM 0 HB3 GLU A 78 3.225 2.507 -8.885 1.00 0.00 H new ATOM 0 HG2 GLU A 78 4.803 1.121 -10.097 1.00 0.00 H new ATOM 0 HG3 GLU A 78 5.450 2.744 -9.954 1.00 0.00 H new ATOM 1246 N GLU A 79 4.214 5.203 -8.807 1.00 0.00 N ATOM 1247 CA GLU A 79 4.616 6.369 -9.587 1.00 0.00 C ATOM 1248 C GLU A 79 5.233 7.448 -8.703 1.00 0.00 C ATOM 1249 O GLU A 79 6.286 7.997 -9.026 1.00 0.00 O ATOM 1250 CB GLU A 79 3.414 6.940 -10.341 1.00 0.00 C ATOM 1251 CG GLU A 79 2.875 6.014 -11.418 1.00 0.00 C ATOM 1252 CD GLU A 79 3.893 5.727 -12.504 1.00 0.00 C ATOM 1253 OE1 GLU A 79 4.086 6.595 -13.382 1.00 0.00 O ATOM 1254 OE2 GLU A 79 4.497 4.634 -12.478 1.00 0.00 O ATOM 0 H GLU A 79 3.213 5.007 -8.829 1.00 0.00 H new ATOM 0 HA GLU A 79 5.372 6.045 -10.302 1.00 0.00 H new ATOM 0 HB2 GLU A 79 2.618 7.156 -9.628 1.00 0.00 H new ATOM 0 HB3 GLU A 79 3.699 7.888 -10.798 1.00 0.00 H new ATOM 0 HG2 GLU A 79 2.562 5.075 -10.961 1.00 0.00 H new ATOM 0 HG3 GLU A 79 1.988 6.462 -11.866 1.00 0.00 H new ATOM 1261 N GLN A 80 4.577 7.739 -7.584 1.00 0.00 N ATOM 1262 CA GLN A 80 5.056 8.761 -6.657 1.00 0.00 C ATOM 1263 C GLN A 80 6.466 8.446 -6.165 1.00 0.00 C ATOM 1264 O GLN A 80 7.282 9.348 -5.976 1.00 0.00 O ATOM 1265 CB GLN A 80 4.104 8.887 -5.467 1.00 0.00 C ATOM 1266 CG GLN A 80 2.743 9.458 -5.834 1.00 0.00 C ATOM 1267 CD GLN A 80 2.828 10.885 -6.341 1.00 0.00 C ATOM 1268 OE1 GLN A 80 2.741 11.837 -5.565 1.00 0.00 O ATOM 1269 NE2 GLN A 80 2.999 11.040 -7.649 1.00 0.00 N ATOM 0 H GLN A 80 3.712 7.282 -7.296 1.00 0.00 H new ATOM 0 HA GLN A 80 5.087 9.709 -7.193 1.00 0.00 H new ATOM 0 HB2 GLN A 80 3.967 7.904 -5.016 1.00 0.00 H new ATOM 0 HB3 GLN A 80 4.564 9.523 -4.710 1.00 0.00 H new ATOM 0 HG2 GLN A 80 2.284 8.831 -6.599 1.00 0.00 H new ATOM 0 HG3 GLN A 80 2.091 9.424 -4.961 1.00 0.00 H new ATOM 0 HE21 GLN A 80 3.066 10.222 -8.255 1.00 0.00 H new ATOM 0 HE22 GLN A 80 3.063 11.977 -8.047 1.00 0.00 H new ATOM 1278 N LEU A 81 6.747 7.163 -5.960 1.00 0.00 N ATOM 1279 CA LEU A 81 8.061 6.739 -5.490 1.00 0.00 C ATOM 1280 C LEU A 81 9.095 6.846 -6.606 1.00 0.00 C ATOM 1281 O LEU A 81 10.250 7.198 -6.365 1.00 0.00 O ATOM 1282 CB LEU A 81 8.001 5.303 -4.965 1.00 0.00 C ATOM 1283 CG LEU A 81 7.172 5.113 -3.693 1.00 0.00 C ATOM 1284 CD1 LEU A 81 7.063 3.639 -3.343 1.00 0.00 C ATOM 1285 CD2 LEU A 81 7.781 5.892 -2.536 1.00 0.00 C ATOM 0 H LEU A 81 6.085 6.402 -6.111 1.00 0.00 H new ATOM 0 HA LEU A 81 8.361 7.400 -4.677 1.00 0.00 H new ATOM 0 HB2 LEU A 81 7.591 4.663 -5.747 1.00 0.00 H new ATOM 0 HB3 LEU A 81 9.018 4.960 -4.773 1.00 0.00 H new ATOM 0 HG LEU A 81 6.169 5.498 -3.877 1.00 0.00 H new ATOM 0 HD11 LEU A 81 6.470 3.523 -2.436 1.00 0.00 H new ATOM 0 HD12 LEU A 81 6.581 3.105 -4.162 1.00 0.00 H new ATOM 0 HD13 LEU A 81 8.060 3.229 -3.180 1.00 0.00 H new ATOM 0 HD21 LEU A 81 7.178 5.744 -1.640 1.00 0.00 H new ATOM 0 HD22 LEU A 81 8.795 5.538 -2.353 1.00 0.00 H new ATOM 0 HD23 LEU A 81 7.807 6.953 -2.785 1.00 0.00 H new ATOM 1297 N LEU A 82 8.669 6.542 -7.828 1.00 0.00 N ATOM 1298 CA LEU A 82 9.555 6.607 -8.984 1.00 0.00 C ATOM 1299 C LEU A 82 9.976 8.047 -9.266 1.00 0.00 C ATOM 1300 O LEU A 82 11.006 8.289 -9.896 1.00 0.00 O ATOM 1301 CB LEU A 82 8.870 6.009 -10.217 1.00 0.00 C ATOM 1302 CG LEU A 82 8.638 4.496 -10.166 1.00 0.00 C ATOM 1303 CD1 LEU A 82 7.824 4.042 -11.368 1.00 0.00 C ATOM 1304 CD2 LEU A 82 9.964 3.752 -10.109 1.00 0.00 C ATOM 0 H LEU A 82 7.716 6.248 -8.043 1.00 0.00 H new ATOM 0 HA LEU A 82 10.448 6.024 -8.759 1.00 0.00 H new ATOM 0 HB2 LEU A 82 7.908 6.503 -10.354 1.00 0.00 H new ATOM 0 HB3 LEU A 82 9.474 6.238 -11.095 1.00 0.00 H new ATOM 0 HG LEU A 82 8.076 4.265 -9.261 1.00 0.00 H new ATOM 0 HD11 LEU A 82 7.668 2.964 -11.316 1.00 0.00 H new ATOM 0 HD12 LEU A 82 6.859 4.549 -11.366 1.00 0.00 H new ATOM 0 HD13 LEU A 82 8.361 4.287 -12.284 1.00 0.00 H new ATOM 0 HD21 LEU A 82 9.778 2.679 -10.073 1.00 0.00 H new ATOM 0 HD22 LEU A 82 10.552 3.989 -10.995 1.00 0.00 H new ATOM 0 HD23 LEU A 82 10.513 4.055 -9.217 1.00 0.00 H new ATOM 1316 N GLN A 83 9.171 8.999 -8.800 1.00 0.00 N ATOM 1317 CA GLN A 83 9.460 10.416 -9.002 1.00 0.00 C ATOM 1318 C GLN A 83 10.845 10.778 -8.476 1.00 0.00 C ATOM 1319 O GLN A 83 11.496 11.686 -8.992 1.00 0.00 O ATOM 1320 CB GLN A 83 8.405 11.281 -8.308 1.00 0.00 C ATOM 1321 CG GLN A 83 6.990 11.046 -8.811 1.00 0.00 C ATOM 1322 CD GLN A 83 6.845 11.319 -10.296 1.00 0.00 C ATOM 1323 OE1 GLN A 83 7.541 12.167 -10.854 1.00 0.00 O ATOM 1324 NE2 GLN A 83 5.937 10.598 -10.943 1.00 0.00 N ATOM 0 H GLN A 83 8.313 8.814 -8.280 1.00 0.00 H new ATOM 0 HA GLN A 83 9.436 10.608 -10.075 1.00 0.00 H new ATOM 0 HB2 GLN A 83 8.437 11.086 -7.236 1.00 0.00 H new ATOM 0 HB3 GLN A 83 8.661 12.331 -8.448 1.00 0.00 H new ATOM 0 HG2 GLN A 83 6.702 10.015 -8.605 1.00 0.00 H new ATOM 0 HG3 GLN A 83 6.301 11.686 -8.259 1.00 0.00 H new ATOM 0 HE21 GLN A 83 5.382 9.906 -10.440 1.00 0.00 H new ATOM 0 HE22 GLN A 83 5.794 10.736 -11.943 1.00 0.00 H new ATOM 1333 N ARG A 84 11.291 10.064 -7.447 1.00 0.00 N ATOM 1334 CA ARG A 84 12.596 10.322 -6.848 1.00 0.00 C ATOM 1335 C ARG A 84 13.496 9.094 -6.925 1.00 0.00 C ATOM 1336 O ARG A 84 14.708 9.189 -6.737 1.00 0.00 O ATOM 1337 CB ARG A 84 12.427 10.760 -5.393 1.00 0.00 C ATOM 1338 CG ARG A 84 11.629 12.044 -5.240 1.00 0.00 C ATOM 1339 CD ARG A 84 11.434 12.414 -3.780 1.00 0.00 C ATOM 1340 NE ARG A 84 10.692 13.663 -3.628 1.00 0.00 N ATOM 1341 CZ ARG A 84 10.160 14.071 -2.479 1.00 0.00 C ATOM 1342 NH1 ARG A 84 10.288 13.331 -1.384 1.00 0.00 N ATOM 1343 NH2 ARG A 84 9.499 15.219 -2.424 1.00 0.00 N ATOM 0 H ARG A 84 10.769 9.304 -7.011 1.00 0.00 H new ATOM 0 HA ARG A 84 13.073 11.123 -7.413 1.00 0.00 H new ATOM 0 HB2 ARG A 84 11.932 9.964 -4.837 1.00 0.00 H new ATOM 0 HB3 ARG A 84 13.411 10.897 -4.945 1.00 0.00 H new ATOM 0 HG2 ARG A 84 12.143 12.855 -5.755 1.00 0.00 H new ATOM 0 HG3 ARG A 84 10.657 11.927 -5.719 1.00 0.00 H new ATOM 0 HD2 ARG A 84 10.901 11.611 -3.270 1.00 0.00 H new ATOM 0 HD3 ARG A 84 12.406 12.508 -3.297 1.00 0.00 H new ATOM 0 HE ARG A 84 10.575 14.256 -4.450 1.00 0.00 H new ATOM 0 HH11 ARG A 84 10.795 12.447 -1.422 1.00 0.00 H new ATOM 0 HH12 ARG A 84 9.879 13.647 -0.505 1.00 0.00 H new ATOM 0 HH21 ARG A 84 9.398 15.790 -3.263 1.00 0.00 H new ATOM 0 HH22 ARG A 84 9.091 15.531 -1.543 1.00 0.00 H new ATOM 1357 N ILE A 85 12.895 7.940 -7.199 1.00 0.00 N ATOM 1358 CA ILE A 85 13.646 6.694 -7.301 1.00 0.00 C ATOM 1359 C ILE A 85 13.201 5.880 -8.519 1.00 0.00 C ATOM 1360 O ILE A 85 12.336 5.013 -8.406 1.00 0.00 O ATOM 1361 CB ILE A 85 13.485 5.835 -6.028 1.00 0.00 C ATOM 1362 CG1 ILE A 85 13.858 6.650 -4.786 1.00 0.00 C ATOM 1363 CG2 ILE A 85 14.343 4.581 -6.122 1.00 0.00 C ATOM 1364 CD1 ILE A 85 13.572 5.936 -3.480 1.00 0.00 C ATOM 0 H ILE A 85 11.892 7.842 -7.354 1.00 0.00 H new ATOM 0 HA ILE A 85 14.696 6.964 -7.415 1.00 0.00 H new ATOM 0 HB ILE A 85 12.442 5.532 -5.942 1.00 0.00 H new ATOM 0 HG12 ILE A 85 14.919 6.897 -4.830 1.00 0.00 H new ATOM 0 HG13 ILE A 85 13.310 7.592 -4.802 1.00 0.00 H new ATOM 0 HG21 ILE A 85 14.218 3.986 -5.217 1.00 0.00 H new ATOM 0 HG22 ILE A 85 14.036 3.994 -6.987 1.00 0.00 H new ATOM 0 HG23 ILE A 85 15.390 4.864 -6.229 1.00 0.00 H new ATOM 0 HD11 ILE A 85 13.862 6.574 -2.645 1.00 0.00 H new ATOM 0 HD12 ILE A 85 12.507 5.712 -3.413 1.00 0.00 H new ATOM 0 HD13 ILE A 85 14.141 5.007 -3.441 1.00 0.00 H new ATOM 1376 N PRO A 86 13.783 6.157 -9.703 1.00 0.00 N ATOM 1377 CA PRO A 86 13.437 5.444 -10.939 1.00 0.00 C ATOM 1378 C PRO A 86 13.935 4.004 -10.938 1.00 0.00 C ATOM 1379 O PRO A 86 13.679 3.245 -11.873 1.00 0.00 O ATOM 1380 CB PRO A 86 14.151 6.252 -12.024 1.00 0.00 C ATOM 1381 CG PRO A 86 15.302 6.882 -11.324 1.00 0.00 C ATOM 1382 CD PRO A 86 14.820 7.184 -9.932 1.00 0.00 C ATOM 0 HA PRO A 86 12.358 5.372 -11.079 1.00 0.00 H new ATOM 0 HB2 PRO A 86 14.485 5.612 -12.840 1.00 0.00 H new ATOM 0 HB3 PRO A 86 13.491 7.003 -12.458 1.00 0.00 H new ATOM 0 HG2 PRO A 86 16.161 6.212 -11.303 1.00 0.00 H new ATOM 0 HG3 PRO A 86 15.619 7.792 -11.834 1.00 0.00 H new ATOM 0 HD2 PRO A 86 15.626 7.112 -9.202 1.00 0.00 H new ATOM 0 HD3 PRO A 86 14.412 8.192 -9.857 1.00 0.00 H new ATOM 1390 N GLU A 87 14.645 3.635 -9.879 1.00 0.00 N ATOM 1391 CA GLU A 87 15.186 2.288 -9.748 1.00 0.00 C ATOM 1392 C GLU A 87 14.517 1.547 -8.597 1.00 0.00 C ATOM 1393 O GLU A 87 15.020 0.527 -8.123 1.00 0.00 O ATOM 1394 CB GLU A 87 16.698 2.349 -9.524 1.00 0.00 C ATOM 1395 CG GLU A 87 17.455 3.017 -10.661 1.00 0.00 C ATOM 1396 CD GLU A 87 17.319 2.266 -11.971 1.00 0.00 C ATOM 1397 OE1 GLU A 87 18.132 1.351 -12.218 1.00 0.00 O ATOM 1398 OE2 GLU A 87 16.400 2.595 -12.750 1.00 0.00 O ATOM 0 H GLU A 87 14.860 4.252 -9.096 1.00 0.00 H new ATOM 0 HA GLU A 87 14.983 1.745 -10.671 1.00 0.00 H new ATOM 0 HB2 GLU A 87 16.898 2.889 -8.599 1.00 0.00 H new ATOM 0 HB3 GLU A 87 17.078 1.336 -9.391 1.00 0.00 H new ATOM 0 HG2 GLU A 87 17.086 4.035 -10.790 1.00 0.00 H new ATOM 0 HG3 GLU A 87 18.510 3.091 -10.396 1.00 0.00 H new ATOM 1405 N PHE A 88 13.374 2.064 -8.156 1.00 0.00 N ATOM 1406 CA PHE A 88 12.632 1.461 -7.055 1.00 0.00 C ATOM 1407 C PHE A 88 12.027 0.120 -7.461 1.00 0.00 C ATOM 1408 O PHE A 88 11.660 -0.081 -8.619 1.00 0.00 O ATOM 1409 CB PHE A 88 11.528 2.406 -6.580 1.00 0.00 C ATOM 1410 CG PHE A 88 10.892 1.980 -5.289 1.00 0.00 C ATOM 1411 CD1 PHE A 88 11.494 2.282 -4.079 1.00 0.00 C ATOM 1412 CD2 PHE A 88 9.699 1.276 -5.284 1.00 0.00 C ATOM 1413 CE1 PHE A 88 10.918 1.890 -2.886 1.00 0.00 C ATOM 1414 CE2 PHE A 88 9.118 0.881 -4.094 1.00 0.00 C ATOM 1415 CZ PHE A 88 9.728 1.189 -2.893 1.00 0.00 C ATOM 0 H PHE A 88 12.941 2.901 -8.546 1.00 0.00 H new ATOM 0 HA PHE A 88 13.333 1.285 -6.239 1.00 0.00 H new ATOM 0 HB2 PHE A 88 11.944 3.406 -6.459 1.00 0.00 H new ATOM 0 HB3 PHE A 88 10.760 2.471 -7.350 1.00 0.00 H new ATOM 0 HD1 PHE A 88 12.424 2.830 -4.068 1.00 0.00 H new ATOM 0 HD2 PHE A 88 9.218 1.033 -6.220 1.00 0.00 H new ATOM 0 HE1 PHE A 88 11.398 2.131 -1.949 1.00 0.00 H new ATOM 0 HE2 PHE A 88 8.188 0.332 -4.103 1.00 0.00 H new ATOM 0 HZ PHE A 88 9.275 0.882 -1.962 1.00 0.00 H new ATOM 1425 N ASN A 89 11.927 -0.789 -6.498 1.00 0.00 N ATOM 1426 CA ASN A 89 11.363 -2.113 -6.742 1.00 0.00 C ATOM 1427 C ASN A 89 10.223 -2.405 -5.769 1.00 0.00 C ATOM 1428 O ASN A 89 10.449 -2.895 -4.664 1.00 0.00 O ATOM 1429 CB ASN A 89 12.452 -3.181 -6.621 1.00 0.00 C ATOM 1430 CG ASN A 89 13.344 -2.965 -5.413 1.00 0.00 C ATOM 1431 OD1 ASN A 89 14.349 -2.256 -5.488 1.00 0.00 O ATOM 1432 ND2 ASN A 89 12.986 -3.578 -4.291 1.00 0.00 N ATOM 0 H ASN A 89 12.230 -0.633 -5.537 1.00 0.00 H new ATOM 0 HA ASN A 89 10.960 -2.133 -7.755 1.00 0.00 H new ATOM 0 HB2 ASN A 89 11.987 -4.164 -6.554 1.00 0.00 H new ATOM 0 HB3 ASN A 89 13.062 -3.178 -7.524 1.00 0.00 H new ATOM 0 HD21 ASN A 89 13.551 -3.471 -3.449 1.00 0.00 H new ATOM 0 HD22 ASN A 89 12.146 -4.156 -4.271 1.00 0.00 H new ATOM 1439 N MET A 90 8.999 -2.098 -6.189 1.00 0.00 N ATOM 1440 CA MET A 90 7.820 -2.321 -5.354 1.00 0.00 C ATOM 1441 C MET A 90 7.581 -3.810 -5.120 1.00 0.00 C ATOM 1442 O MET A 90 6.998 -4.200 -4.108 1.00 0.00 O ATOM 1443 CB MET A 90 6.583 -1.694 -6.005 1.00 0.00 C ATOM 1444 CG MET A 90 5.903 -0.641 -5.143 1.00 0.00 C ATOM 1445 SD MET A 90 5.372 -1.279 -3.543 1.00 0.00 S ATOM 1446 CE MET A 90 4.603 0.175 -2.834 1.00 0.00 C ATOM 0 H MET A 90 8.796 -1.694 -7.103 1.00 0.00 H new ATOM 0 HA MET A 90 8.000 -1.847 -4.389 1.00 0.00 H new ATOM 0 HB2 MET A 90 6.873 -1.242 -6.954 1.00 0.00 H new ATOM 0 HB3 MET A 90 5.865 -2.482 -6.234 1.00 0.00 H new ATOM 0 HG2 MET A 90 6.589 0.192 -4.987 1.00 0.00 H new ATOM 0 HG3 MET A 90 5.038 -0.246 -5.676 1.00 0.00 H new ATOM 0 HE1 MET A 90 4.224 -0.062 -1.840 1.00 0.00 H new ATOM 0 HE2 MET A 90 5.338 0.976 -2.761 1.00 0.00 H new ATOM 0 HE3 MET A 90 3.778 0.497 -3.470 1.00 0.00 H new ATOM 1456 N ALA A 91 8.034 -4.636 -6.056 1.00 0.00 N ATOM 1457 CA ALA A 91 7.859 -6.081 -5.951 1.00 0.00 C ATOM 1458 C ALA A 91 8.687 -6.664 -4.809 1.00 0.00 C ATOM 1459 O ALA A 91 8.149 -7.292 -3.895 1.00 0.00 O ATOM 1460 CB ALA A 91 8.228 -6.751 -7.265 1.00 0.00 C ATOM 0 H ALA A 91 8.525 -4.331 -6.896 1.00 0.00 H new ATOM 0 HA ALA A 91 6.809 -6.275 -5.733 1.00 0.00 H new ATOM 0 HB1 ALA A 91 8.093 -7.829 -7.174 1.00 0.00 H new ATOM 0 HB2 ALA A 91 7.586 -6.371 -8.060 1.00 0.00 H new ATOM 0 HB3 ALA A 91 9.269 -6.534 -7.504 1.00 0.00 H new ATOM 1466 N ALA A 92 9.998 -6.451 -4.864 1.00 0.00 N ATOM 1467 CA ALA A 92 10.902 -6.965 -3.841 1.00 0.00 C ATOM 1468 C ALA A 92 10.710 -6.243 -2.512 1.00 0.00 C ATOM 1469 O ALA A 92 10.930 -6.819 -1.446 1.00 0.00 O ATOM 1470 CB ALA A 92 12.345 -6.843 -4.305 1.00 0.00 C ATOM 0 H ALA A 92 10.458 -5.925 -5.607 1.00 0.00 H new ATOM 0 HA ALA A 92 10.666 -8.018 -3.685 1.00 0.00 H new ATOM 0 HB1 ALA A 92 13.010 -7.230 -3.533 1.00 0.00 H new ATOM 0 HB2 ALA A 92 12.482 -7.416 -5.222 1.00 0.00 H new ATOM 0 HB3 ALA A 92 12.579 -5.795 -4.494 1.00 0.00 H new ATOM 1476 N PHE A 93 10.297 -4.982 -2.580 1.00 0.00 N ATOM 1477 CA PHE A 93 10.082 -4.183 -1.380 1.00 0.00 C ATOM 1478 C PHE A 93 8.930 -4.738 -0.547 1.00 0.00 C ATOM 1479 O PHE A 93 9.063 -4.924 0.662 1.00 0.00 O ATOM 1480 CB PHE A 93 9.800 -2.727 -1.754 1.00 0.00 C ATOM 1481 CG PHE A 93 9.625 -1.827 -0.567 1.00 0.00 C ATOM 1482 CD1 PHE A 93 10.680 -1.590 0.299 1.00 0.00 C ATOM 1483 CD2 PHE A 93 8.404 -1.224 -0.312 1.00 0.00 C ATOM 1484 CE1 PHE A 93 10.522 -0.767 1.397 1.00 0.00 C ATOM 1485 CE2 PHE A 93 8.239 -0.401 0.785 1.00 0.00 C ATOM 1486 CZ PHE A 93 9.301 -0.172 1.640 1.00 0.00 C ATOM 0 H PHE A 93 10.105 -4.492 -3.453 1.00 0.00 H new ATOM 0 HA PHE A 93 10.991 -4.229 -0.781 1.00 0.00 H new ATOM 0 HB2 PHE A 93 10.620 -2.352 -2.366 1.00 0.00 H new ATOM 0 HB3 PHE A 93 8.900 -2.686 -2.367 1.00 0.00 H new ATOM 0 HD1 PHE A 93 11.637 -2.054 0.113 1.00 0.00 H new ATOM 0 HD2 PHE A 93 7.572 -1.399 -0.978 1.00 0.00 H new ATOM 0 HE1 PHE A 93 11.353 -0.590 2.064 1.00 0.00 H new ATOM 0 HE2 PHE A 93 7.282 0.063 0.974 1.00 0.00 H new ATOM 0 HZ PHE A 93 9.175 0.472 2.498 1.00 0.00 H new ATOM 1496 N THR A 94 7.801 -5.001 -1.199 1.00 0.00 N ATOM 1497 CA THR A 94 6.627 -5.530 -0.514 1.00 0.00 C ATOM 1498 C THR A 94 6.901 -6.909 0.078 1.00 0.00 C ATOM 1499 O THR A 94 6.525 -7.187 1.217 1.00 0.00 O ATOM 1500 CB THR A 94 5.417 -5.626 -1.460 1.00 0.00 C ATOM 1501 OG1 THR A 94 5.780 -6.331 -2.653 1.00 0.00 O ATOM 1502 CG2 THR A 94 4.900 -4.241 -1.819 1.00 0.00 C ATOM 0 H THR A 94 7.675 -4.856 -2.201 1.00 0.00 H new ATOM 0 HA THR A 94 6.398 -4.832 0.291 1.00 0.00 H new ATOM 0 HB THR A 94 4.625 -6.170 -0.946 1.00 0.00 H new ATOM 0 HG1 THR A 94 6.208 -5.712 -3.281 1.00 0.00 H new ATOM 0 HG21 THR A 94 4.045 -4.334 -2.488 1.00 0.00 H new ATOM 0 HG22 THR A 94 4.595 -3.720 -0.911 1.00 0.00 H new ATOM 0 HG23 THR A 94 5.689 -3.675 -2.315 1.00 0.00 H new ATOM 1510 N THR A 95 7.552 -7.767 -0.699 1.00 0.00 N ATOM 1511 CA THR A 95 7.871 -9.119 -0.248 1.00 0.00 C ATOM 1512 C THR A 95 8.656 -9.099 1.063 1.00 0.00 C ATOM 1513 O THR A 95 8.355 -9.856 1.987 1.00 0.00 O ATOM 1514 CB THR A 95 8.682 -9.887 -1.309 1.00 0.00 C ATOM 1515 OG1 THR A 95 7.966 -9.912 -2.549 1.00 0.00 O ATOM 1516 CG2 THR A 95 8.964 -11.311 -0.853 1.00 0.00 C ATOM 0 H THR A 95 7.870 -7.552 -1.644 1.00 0.00 H new ATOM 0 HA THR A 95 6.921 -9.628 -0.087 1.00 0.00 H new ATOM 0 HB THR A 95 9.633 -9.373 -1.448 1.00 0.00 H new ATOM 0 HG1 THR A 95 8.034 -9.036 -2.984 1.00 0.00 H new ATOM 0 HG21 THR A 95 9.538 -11.832 -1.620 1.00 0.00 H new ATOM 0 HG22 THR A 95 9.535 -11.289 0.075 1.00 0.00 H new ATOM 0 HG23 THR A 95 8.022 -11.833 -0.688 1.00 0.00 H new ATOM 1524 N THR A 96 9.659 -8.231 1.135 1.00 0.00 N ATOM 1525 CA THR A 96 10.488 -8.118 2.330 1.00 0.00 C ATOM 1526 C THR A 96 9.745 -7.406 3.457 1.00 0.00 C ATOM 1527 O THR A 96 9.973 -7.680 4.635 1.00 0.00 O ATOM 1528 CB THR A 96 11.795 -7.360 2.027 1.00 0.00 C ATOM 1529 OG1 THR A 96 12.485 -7.991 0.941 1.00 0.00 O ATOM 1530 CG2 THR A 96 12.699 -7.320 3.250 1.00 0.00 C ATOM 0 H THR A 96 9.918 -7.595 0.380 1.00 0.00 H new ATOM 0 HA THR A 96 10.726 -9.133 2.649 1.00 0.00 H new ATOM 0 HB THR A 96 11.538 -6.337 1.753 1.00 0.00 H new ATOM 0 HG1 THR A 96 12.872 -7.306 0.357 1.00 0.00 H new ATOM 0 HG21 THR A 96 13.614 -6.779 3.008 1.00 0.00 H new ATOM 0 HG22 THR A 96 12.184 -6.815 4.067 1.00 0.00 H new ATOM 0 HG23 THR A 96 12.948 -8.337 3.552 1.00 0.00 H new ATOM 1538 N LEU A 97 8.854 -6.493 3.088 1.00 0.00 N ATOM 1539 CA LEU A 97 8.076 -5.735 4.063 1.00 0.00 C ATOM 1540 C LEU A 97 7.107 -6.643 4.822 1.00 0.00 C ATOM 1541 O LEU A 97 6.869 -6.451 6.015 1.00 0.00 O ATOM 1542 CB LEU A 97 7.302 -4.612 3.368 1.00 0.00 C ATOM 1543 CG LEU A 97 7.270 -3.275 4.118 1.00 0.00 C ATOM 1544 CD1 LEU A 97 6.509 -2.234 3.313 1.00 0.00 C ATOM 1545 CD2 LEU A 97 6.642 -3.442 5.495 1.00 0.00 C ATOM 0 H LEU A 97 8.651 -6.258 2.116 1.00 0.00 H new ATOM 0 HA LEU A 97 8.771 -5.300 4.781 1.00 0.00 H new ATOM 0 HB2 LEU A 97 7.740 -4.447 2.384 1.00 0.00 H new ATOM 0 HB3 LEU A 97 6.276 -4.945 3.209 1.00 0.00 H new ATOM 0 HG LEU A 97 8.297 -2.933 4.250 1.00 0.00 H new ATOM 0 HD11 LEU A 97 6.495 -1.291 3.859 1.00 0.00 H new ATOM 0 HD12 LEU A 97 6.999 -2.089 2.350 1.00 0.00 H new ATOM 0 HD13 LEU A 97 5.486 -2.575 3.152 1.00 0.00 H new ATOM 0 HD21 LEU A 97 6.630 -2.481 6.008 1.00 0.00 H new ATOM 0 HD22 LEU A 97 5.621 -3.809 5.387 1.00 0.00 H new ATOM 0 HD23 LEU A 97 7.225 -4.157 6.076 1.00 0.00 H new ATOM 1557 N GLN A 98 6.551 -7.629 4.120 1.00 0.00 N ATOM 1558 CA GLN A 98 5.590 -8.559 4.716 1.00 0.00 C ATOM 1559 C GLN A 98 6.112 -9.165 6.015 1.00 0.00 C ATOM 1560 O GLN A 98 5.339 -9.419 6.939 1.00 0.00 O ATOM 1561 CB GLN A 98 5.246 -9.676 3.728 1.00 0.00 C ATOM 1562 CG GLN A 98 4.397 -9.215 2.555 1.00 0.00 C ATOM 1563 CD GLN A 98 4.018 -10.353 1.627 1.00 0.00 C ATOM 1564 OE1 GLN A 98 4.758 -11.326 1.486 1.00 0.00 O ATOM 1565 NE2 GLN A 98 2.859 -10.236 0.992 1.00 0.00 N ATOM 0 H GLN A 98 6.749 -7.806 3.135 1.00 0.00 H new ATOM 0 HA GLN A 98 4.692 -7.988 4.950 1.00 0.00 H new ATOM 0 HB2 GLN A 98 6.171 -10.110 3.347 1.00 0.00 H new ATOM 0 HB3 GLN A 98 4.717 -10.468 4.258 1.00 0.00 H new ATOM 0 HG2 GLN A 98 3.491 -8.741 2.931 1.00 0.00 H new ATOM 0 HG3 GLN A 98 4.943 -8.458 1.992 1.00 0.00 H new ATOM 0 HE21 GLN A 98 2.278 -9.411 1.140 1.00 0.00 H new ATOM 0 HE22 GLN A 98 2.549 -10.971 0.356 1.00 0.00 H new ATOM 1574 N HIS A 99 7.416 -9.407 6.086 1.00 0.00 N ATOM 1575 CA HIS A 99 8.012 -9.982 7.286 1.00 0.00 C ATOM 1576 C HIS A 99 8.715 -8.906 8.106 1.00 0.00 C ATOM 1577 O HIS A 99 8.819 -9.008 9.330 1.00 0.00 O ATOM 1578 CB HIS A 99 8.993 -11.100 6.922 1.00 0.00 C ATOM 1579 CG HIS A 99 10.165 -10.640 6.111 1.00 0.00 C ATOM 1580 ND1 HIS A 99 11.284 -10.058 6.670 1.00 0.00 N ATOM 1581 CD2 HIS A 99 10.396 -10.689 4.777 1.00 0.00 C ATOM 1582 CE1 HIS A 99 12.151 -9.768 5.716 1.00 0.00 C ATOM 1583 NE2 HIS A 99 11.636 -10.141 4.559 1.00 0.00 N ATOM 0 H HIS A 99 8.077 -9.216 5.333 1.00 0.00 H new ATOM 0 HA HIS A 99 7.212 -10.409 7.890 1.00 0.00 H new ATOM 0 HB2 HIS A 99 9.358 -11.563 7.839 1.00 0.00 H new ATOM 0 HB3 HIS A 99 8.460 -11.871 6.366 1.00 0.00 H new ATOM 0 HD1 HIS A 99 11.421 -9.879 7.665 1.00 0.00 H new ATOM 0 HD2 HIS A 99 9.729 -11.085 4.025 1.00 0.00 H new ATOM 0 HE1 HIS A 99 13.116 -9.305 5.858 1.00 0.00 H new ATOM 1592 N HIS A 100 9.181 -7.865 7.425 1.00 0.00 N ATOM 1593 CA HIS A 100 9.872 -6.768 8.091 1.00 0.00 C ATOM 1594 C HIS A 100 8.888 -5.929 8.898 1.00 0.00 C ATOM 1595 O HIS A 100 9.284 -5.028 9.638 1.00 0.00 O ATOM 1596 CB HIS A 100 10.591 -5.889 7.066 1.00 0.00 C ATOM 1597 CG HIS A 100 11.647 -5.014 7.668 1.00 0.00 C ATOM 1598 ND1 HIS A 100 11.373 -3.800 8.263 1.00 0.00 N ATOM 1599 CD2 HIS A 100 12.987 -5.185 7.769 1.00 0.00 C ATOM 1600 CE1 HIS A 100 12.497 -3.264 8.704 1.00 0.00 C ATOM 1601 NE2 HIS A 100 13.489 -4.085 8.417 1.00 0.00 N ATOM 0 H HIS A 100 9.093 -7.758 6.414 1.00 0.00 H new ATOM 0 HA HIS A 100 10.611 -7.192 8.771 1.00 0.00 H new ATOM 0 HB2 HIS A 100 11.047 -6.526 6.308 1.00 0.00 H new ATOM 0 HB3 HIS A 100 9.858 -5.263 6.557 1.00 0.00 H new ATOM 0 HD2 HIS A 100 13.554 -6.030 7.407 1.00 0.00 H new ATOM 0 HE1 HIS A 100 12.588 -2.316 9.213 1.00 0.00 H new ATOM 0 HE2 HIS A 100 14.472 -3.927 8.641 1.00 0.00 H new ATOM 1610 N LYS A 101 7.602 -6.235 8.751 1.00 0.00 N ATOM 1611 CA LYS A 101 6.558 -5.512 9.468 1.00 0.00 C ATOM 1612 C LYS A 101 6.675 -5.744 10.969 1.00 0.00 C ATOM 1613 O LYS A 101 6.113 -4.995 11.768 1.00 0.00 O ATOM 1614 CB LYS A 101 5.176 -5.949 8.979 1.00 0.00 C ATOM 1615 CG LYS A 101 4.877 -7.418 9.236 1.00 0.00 C ATOM 1616 CD LYS A 101 3.469 -7.793 8.798 1.00 0.00 C ATOM 1617 CE LYS A 101 2.416 -7.118 9.664 1.00 0.00 C ATOM 1618 NZ LYS A 101 1.036 -7.475 9.236 1.00 0.00 N ATOM 0 H LYS A 101 7.259 -6.978 8.142 1.00 0.00 H new ATOM 0 HA LYS A 101 6.684 -4.448 9.270 1.00 0.00 H new ATOM 0 HB2 LYS A 101 4.417 -5.341 9.470 1.00 0.00 H new ATOM 0 HB3 LYS A 101 5.099 -5.753 7.910 1.00 0.00 H new ATOM 0 HG2 LYS A 101 5.600 -8.035 8.702 1.00 0.00 H new ATOM 0 HG3 LYS A 101 4.997 -7.633 10.298 1.00 0.00 H new ATOM 0 HD2 LYS A 101 3.323 -7.507 7.756 1.00 0.00 H new ATOM 0 HD3 LYS A 101 3.346 -8.875 8.852 1.00 0.00 H new ATOM 0 HE2 LYS A 101 2.560 -7.409 10.705 1.00 0.00 H new ATOM 0 HE3 LYS A 101 2.544 -6.037 9.615 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 0.347 -6.982 9.839 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 0.895 -7.190 8.246 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 0.900 -8.502 9.323 1.00 0.00 H new ATOM 1632 N ASP A 102 7.409 -6.788 11.346 1.00 0.00 N ATOM 1633 CA ASP A 102 7.599 -7.117 12.754 1.00 0.00 C ATOM 1634 C ASP A 102 8.563 -6.139 13.418 1.00 0.00 C ATOM 1635 O ASP A 102 8.820 -6.226 14.620 1.00 0.00 O ATOM 1636 CB ASP A 102 8.118 -8.549 12.902 1.00 0.00 C ATOM 1637 CG ASP A 102 7.111 -9.578 12.425 1.00 0.00 C ATOM 1638 OD1 ASP A 102 6.272 -10.010 13.241 1.00 0.00 O ATOM 1639 OD2 ASP A 102 7.163 -9.951 11.233 1.00 0.00 O ATOM 0 H ASP A 102 7.880 -7.418 10.697 1.00 0.00 H new ATOM 0 HA ASP A 102 6.633 -7.038 13.252 1.00 0.00 H new ATOM 0 HB2 ASP A 102 9.042 -8.659 12.335 1.00 0.00 H new ATOM 0 HB3 ASP A 102 8.361 -8.739 13.947 1.00 0.00 H new ATOM 1644 N GLU A 103 9.096 -5.211 12.629 1.00 0.00 N ATOM 1645 CA GLU A 103 10.034 -4.217 13.139 1.00 0.00 C ATOM 1646 C GLU A 103 9.453 -2.809 13.031 1.00 0.00 C ATOM 1647 O GLU A 103 9.426 -2.063 14.009 1.00 0.00 O ATOM 1648 CB GLU A 103 11.358 -4.296 12.376 1.00 0.00 C ATOM 1649 CG GLU A 103 12.435 -3.373 12.925 1.00 0.00 C ATOM 1650 CD GLU A 103 13.736 -3.479 12.156 1.00 0.00 C ATOM 1651 OE1 GLU A 103 14.495 -4.440 12.401 1.00 0.00 O ATOM 1652 OE2 GLU A 103 13.996 -2.600 11.308 1.00 0.00 O ATOM 0 H GLU A 103 8.894 -5.127 11.633 1.00 0.00 H new ATOM 0 HA GLU A 103 10.215 -4.434 14.192 1.00 0.00 H new ATOM 0 HB2 GLU A 103 11.723 -5.323 12.404 1.00 0.00 H new ATOM 0 HB3 GLU A 103 11.179 -4.050 11.329 1.00 0.00 H new ATOM 0 HG2 GLU A 103 12.079 -2.343 12.890 1.00 0.00 H new ATOM 0 HG3 GLU A 103 12.615 -3.613 13.973 1.00 0.00 H new ATOM 1659 N VAL A 104 8.989 -2.452 11.836 1.00 0.00 N ATOM 1660 CA VAL A 104 8.411 -1.133 11.603 1.00 0.00 C ATOM 1661 C VAL A 104 7.023 -1.025 12.224 1.00 0.00 C ATOM 1662 O VAL A 104 6.581 -1.922 12.943 1.00 0.00 O ATOM 1663 CB VAL A 104 8.317 -0.819 10.097 1.00 0.00 C ATOM 1664 CG1 VAL A 104 9.660 -1.038 9.419 1.00 0.00 C ATOM 1665 CG2 VAL A 104 7.233 -1.660 9.435 1.00 0.00 C ATOM 0 H VAL A 104 9.002 -3.058 11.015 1.00 0.00 H new ATOM 0 HA VAL A 104 9.074 -0.408 12.075 1.00 0.00 H new ATOM 0 HB VAL A 104 8.045 0.231 9.984 1.00 0.00 H new ATOM 0 HG11 VAL A 104 9.573 -0.811 8.356 1.00 0.00 H new ATOM 0 HG12 VAL A 104 10.406 -0.384 9.870 1.00 0.00 H new ATOM 0 HG13 VAL A 104 9.966 -2.077 9.544 1.00 0.00 H new ATOM 0 HG21 VAL A 104 7.185 -1.421 8.373 1.00 0.00 H new ATOM 0 HG22 VAL A 104 7.466 -2.717 9.559 1.00 0.00 H new ATOM 0 HG23 VAL A 104 6.271 -1.444 9.899 1.00 0.00 H new ATOM 1675 N ALA A 105 6.341 0.080 11.941 1.00 0.00 N ATOM 1676 CA ALA A 105 5.002 0.307 12.469 1.00 0.00 C ATOM 1677 C ALA A 105 3.978 -0.569 11.757 1.00 0.00 C ATOM 1678 O ALA A 105 3.639 -0.329 10.598 1.00 0.00 O ATOM 1679 CB ALA A 105 4.624 1.775 12.339 1.00 0.00 C ATOM 0 H ALA A 105 6.694 0.832 11.349 1.00 0.00 H new ATOM 0 HA ALA A 105 5.004 0.037 13.525 1.00 0.00 H new ATOM 0 HB1 ALA A 105 3.621 1.929 12.738 1.00 0.00 H new ATOM 0 HB2 ALA A 105 5.334 2.384 12.898 1.00 0.00 H new ATOM 0 HB3 ALA A 105 4.645 2.065 11.288 1.00 0.00 H new ATOM 1685 N GLY A 106 3.490 -1.585 12.459 1.00 0.00 N ATOM 1686 CA GLY A 106 2.508 -2.484 11.883 1.00 0.00 C ATOM 1687 C GLY A 106 1.187 -1.795 11.604 1.00 0.00 C ATOM 1688 O GLY A 106 0.472 -2.163 10.673 1.00 0.00 O ATOM 0 H GLY A 106 3.758 -1.802 13.419 1.00 0.00 H new ATOM 0 HA2 GLY A 106 2.901 -2.900 10.955 1.00 0.00 H new ATOM 0 HA3 GLY A 106 2.342 -3.320 12.562 1.00 0.00 H new ATOM 1692 N ASP A 107 0.865 -0.792 12.415 1.00 0.00 N ATOM 1693 CA ASP A 107 -0.383 -0.050 12.261 1.00 0.00 C ATOM 1694 C ASP A 107 -0.421 0.706 10.935 1.00 0.00 C ATOM 1695 O ASP A 107 -1.458 0.759 10.273 1.00 0.00 O ATOM 1696 CB ASP A 107 -0.561 0.930 13.422 1.00 0.00 C ATOM 1697 CG ASP A 107 -0.595 0.232 14.768 1.00 0.00 C ATOM 1698 OD1 ASP A 107 -1.639 -0.369 15.098 1.00 0.00 O ATOM 1699 OD2 ASP A 107 0.423 0.287 15.490 1.00 0.00 O ATOM 0 H ASP A 107 1.451 -0.474 13.187 1.00 0.00 H new ATOM 0 HA ASP A 107 -1.201 -0.770 12.266 1.00 0.00 H new ATOM 0 HB2 ASP A 107 0.254 1.653 13.411 1.00 0.00 H new ATOM 0 HB3 ASP A 107 -1.486 1.490 13.283 1.00 0.00 H new ATOM 1704 N ILE A 108 0.712 1.291 10.553 1.00 0.00 N ATOM 1705 CA ILE A 108 0.796 2.048 9.308 1.00 0.00 C ATOM 1706 C ILE A 108 0.727 1.129 8.094 1.00 0.00 C ATOM 1707 O ILE A 108 -0.053 1.363 7.171 1.00 0.00 O ATOM 1708 CB ILE A 108 2.096 2.874 9.243 1.00 0.00 C ATOM 1709 CG1 ILE A 108 2.147 3.866 10.408 1.00 0.00 C ATOM 1710 CG2 ILE A 108 2.199 3.603 7.908 1.00 0.00 C ATOM 1711 CD1 ILE A 108 3.450 4.632 10.499 1.00 0.00 C ATOM 0 H ILE A 108 1.581 1.255 11.086 1.00 0.00 H new ATOM 0 HA ILE A 108 -0.059 2.724 9.291 1.00 0.00 H new ATOM 0 HB ILE A 108 2.947 2.198 9.326 1.00 0.00 H new ATOM 0 HG12 ILE A 108 1.325 4.575 10.306 1.00 0.00 H new ATOM 0 HG13 ILE A 108 1.988 3.325 11.341 1.00 0.00 H new ATOM 0 HG21 ILE A 108 3.123 4.181 7.879 1.00 0.00 H new ATOM 0 HG22 ILE A 108 2.201 2.876 7.096 1.00 0.00 H new ATOM 0 HG23 ILE A 108 1.348 4.274 7.793 1.00 0.00 H new ATOM 0 HD11 ILE A 108 3.412 5.315 11.348 1.00 0.00 H new ATOM 0 HD12 ILE A 108 4.275 3.932 10.633 1.00 0.00 H new ATOM 0 HD13 ILE A 108 3.602 5.201 9.582 1.00 0.00 H new ATOM 1723 N PHE A 109 1.543 0.080 8.102 1.00 0.00 N ATOM 1724 CA PHE A 109 1.567 -0.870 6.998 1.00 0.00 C ATOM 1725 C PHE A 109 0.232 -1.596 6.877 1.00 0.00 C ATOM 1726 O PHE A 109 -0.159 -2.013 5.786 1.00 0.00 O ATOM 1727 CB PHE A 109 2.702 -1.882 7.169 1.00 0.00 C ATOM 1728 CG PHE A 109 2.857 -2.806 5.991 1.00 0.00 C ATOM 1729 CD1 PHE A 109 2.867 -2.306 4.697 1.00 0.00 C ATOM 1730 CD2 PHE A 109 2.987 -4.173 6.175 1.00 0.00 C ATOM 1731 CE1 PHE A 109 3.002 -3.149 3.611 1.00 0.00 C ATOM 1732 CE2 PHE A 109 3.123 -5.023 5.093 1.00 0.00 C ATOM 1733 CZ PHE A 109 3.131 -4.511 3.809 1.00 0.00 C ATOM 0 H PHE A 109 2.194 -0.132 8.858 1.00 0.00 H new ATOM 0 HA PHE A 109 1.742 -0.307 6.081 1.00 0.00 H new ATOM 0 HB2 PHE A 109 3.638 -1.345 7.327 1.00 0.00 H new ATOM 0 HB3 PHE A 109 2.519 -2.475 8.065 1.00 0.00 H new ATOM 0 HD1 PHE A 109 2.768 -1.243 4.536 1.00 0.00 H new ATOM 0 HD2 PHE A 109 2.982 -4.580 7.176 1.00 0.00 H new ATOM 0 HE1 PHE A 109 3.007 -2.745 2.609 1.00 0.00 H new ATOM 0 HE2 PHE A 109 3.223 -6.087 5.251 1.00 0.00 H new ATOM 0 HZ PHE A 109 3.238 -5.173 2.963 1.00 0.00 H new ATOM 1743 N ASP A 110 -0.465 -1.740 8.003 1.00 0.00 N ATOM 1744 CA ASP A 110 -1.755 -2.422 8.028 1.00 0.00 C ATOM 1745 C ASP A 110 -2.669 -1.904 6.923 1.00 0.00 C ATOM 1746 O ASP A 110 -3.488 -2.649 6.383 1.00 0.00 O ATOM 1747 CB ASP A 110 -2.430 -2.233 9.387 1.00 0.00 C ATOM 1748 CG ASP A 110 -3.762 -2.952 9.477 1.00 0.00 C ATOM 1749 OD1 ASP A 110 -4.787 -2.355 9.088 1.00 0.00 O ATOM 1750 OD2 ASP A 110 -3.779 -4.115 9.933 1.00 0.00 O ATOM 0 H ASP A 110 -0.156 -1.392 8.911 1.00 0.00 H new ATOM 0 HA ASP A 110 -1.576 -3.484 7.860 1.00 0.00 H new ATOM 0 HB2 ASP A 110 -1.769 -2.600 10.172 1.00 0.00 H new ATOM 0 HB3 ASP A 110 -2.582 -1.169 9.569 1.00 0.00 H new ATOM 1755 N MET A 111 -2.526 -0.626 6.592 1.00 0.00 N ATOM 1756 CA MET A 111 -3.330 -0.020 5.538 1.00 0.00 C ATOM 1757 C MET A 111 -2.871 -0.518 4.172 1.00 0.00 C ATOM 1758 O MET A 111 -3.679 -0.929 3.339 1.00 0.00 O ATOM 1759 CB MET A 111 -3.218 1.505 5.596 1.00 0.00 C ATOM 1760 CG MET A 111 -3.944 2.212 4.463 1.00 0.00 C ATOM 1761 SD MET A 111 -3.478 3.947 4.316 1.00 0.00 S ATOM 1762 CE MET A 111 -1.737 3.796 3.920 1.00 0.00 C ATOM 0 H MET A 111 -1.863 0.009 7.037 1.00 0.00 H new ATOM 0 HA MET A 111 -4.371 -0.306 5.690 1.00 0.00 H new ATOM 0 HB2 MET A 111 -3.619 1.854 6.547 1.00 0.00 H new ATOM 0 HB3 MET A 111 -2.165 1.785 5.572 1.00 0.00 H new ATOM 0 HG2 MET A 111 -3.729 1.701 3.524 1.00 0.00 H new ATOM 0 HG3 MET A 111 -5.019 2.141 4.626 1.00 0.00 H new ATOM 0 HE1 MET A 111 -1.140 4.104 4.779 1.00 0.00 H new ATOM 0 HE2 MET A 111 -1.509 2.759 3.672 1.00 0.00 H new ATOM 0 HE3 MET A 111 -1.501 4.433 3.068 1.00 0.00 H new ATOM 1772 N LEU A 112 -1.559 -0.478 3.961 1.00 0.00 N ATOM 1773 CA LEU A 112 -0.956 -0.912 2.706 1.00 0.00 C ATOM 1774 C LEU A 112 -1.190 -2.399 2.460 1.00 0.00 C ATOM 1775 O LEU A 112 -1.126 -2.862 1.322 1.00 0.00 O ATOM 1776 CB LEU A 112 0.541 -0.602 2.706 1.00 0.00 C ATOM 1777 CG LEU A 112 0.893 0.885 2.801 1.00 0.00 C ATOM 1778 CD1 LEU A 112 2.398 1.071 2.920 1.00 0.00 C ATOM 1779 CD2 LEU A 112 0.357 1.643 1.595 1.00 0.00 C ATOM 0 H LEU A 112 -0.887 -0.145 4.652 1.00 0.00 H new ATOM 0 HA LEU A 112 -1.434 -0.362 1.895 1.00 0.00 H new ATOM 0 HB2 LEU A 112 1.005 -1.124 3.543 1.00 0.00 H new ATOM 0 HB3 LEU A 112 0.981 -1.007 1.794 1.00 0.00 H new ATOM 0 HG LEU A 112 0.423 1.290 3.697 1.00 0.00 H new ATOM 0 HD11 LEU A 112 2.629 2.134 2.986 1.00 0.00 H new ATOM 0 HD12 LEU A 112 2.757 0.565 3.816 1.00 0.00 H new ATOM 0 HD13 LEU A 112 2.887 0.647 2.043 1.00 0.00 H new ATOM 0 HD21 LEU A 112 0.618 2.698 1.683 1.00 0.00 H new ATOM 0 HD22 LEU A 112 0.796 1.235 0.684 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -0.727 1.540 1.553 1.00 0.00 H new ATOM 1791 N LEU A 113 -1.460 -3.145 3.529 1.00 0.00 N ATOM 1792 CA LEU A 113 -1.696 -4.584 3.424 1.00 0.00 C ATOM 1793 C LEU A 113 -2.710 -4.897 2.330 1.00 0.00 C ATOM 1794 O LEU A 113 -2.697 -5.986 1.754 1.00 0.00 O ATOM 1795 CB LEU A 113 -2.181 -5.152 4.761 1.00 0.00 C ATOM 1796 CG LEU A 113 -1.092 -5.361 5.817 1.00 0.00 C ATOM 1797 CD1 LEU A 113 -1.697 -5.898 7.105 1.00 0.00 C ATOM 1798 CD2 LEU A 113 -0.019 -6.308 5.300 1.00 0.00 C ATOM 0 H LEU A 113 -1.521 -2.777 4.478 1.00 0.00 H new ATOM 0 HA LEU A 113 -0.749 -5.055 3.162 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -2.936 -4.481 5.170 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -2.671 -6.107 4.575 1.00 0.00 H new ATOM 0 HG LEU A 113 -0.628 -4.397 6.027 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -0.910 -6.041 7.845 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -2.429 -5.187 7.487 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -2.186 -6.852 6.907 1.00 0.00 H new ATOM 0 HD21 LEU A 113 0.746 -6.444 6.065 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -0.469 -7.272 5.061 1.00 0.00 H new ATOM 0 HD23 LEU A 113 0.436 -5.888 4.403 1.00 0.00 H new ATOM 1810 N THR A 114 -3.594 -3.942 2.053 1.00 0.00 N ATOM 1811 CA THR A 114 -4.618 -4.112 1.023 1.00 0.00 C ATOM 1812 C THR A 114 -4.012 -4.441 -0.344 1.00 0.00 C ATOM 1813 O THR A 114 -4.741 -4.654 -1.313 1.00 0.00 O ATOM 1814 CB THR A 114 -5.487 -2.848 0.885 1.00 0.00 C ATOM 1815 OG1 THR A 114 -4.668 -1.719 0.559 1.00 0.00 O ATOM 1816 CG2 THR A 114 -6.249 -2.571 2.173 1.00 0.00 C ATOM 0 H THR A 114 -3.623 -3.040 2.528 1.00 0.00 H new ATOM 0 HA THR A 114 -5.235 -4.950 1.346 1.00 0.00 H new ATOM 0 HB THR A 114 -6.206 -3.017 0.083 1.00 0.00 H new ATOM 0 HG1 THR A 114 -4.263 -1.362 1.377 1.00 0.00 H new ATOM 0 HG21 THR A 114 -6.856 -1.674 2.051 1.00 0.00 H new ATOM 0 HG22 THR A 114 -6.896 -3.418 2.402 1.00 0.00 H new ATOM 0 HG23 THR A 114 -5.542 -2.423 2.989 1.00 0.00 H new ATOM 1824 N PHE A 115 -2.682 -4.478 -0.426 1.00 0.00 N ATOM 1825 CA PHE A 115 -2.004 -4.790 -1.682 1.00 0.00 C ATOM 1826 C PHE A 115 -2.311 -6.217 -2.127 1.00 0.00 C ATOM 1827 O PHE A 115 -2.264 -6.527 -3.319 1.00 0.00 O ATOM 1828 CB PHE A 115 -0.487 -4.612 -1.546 1.00 0.00 C ATOM 1829 CG PHE A 115 -0.022 -3.181 -1.621 1.00 0.00 C ATOM 1830 CD1 PHE A 115 -0.529 -2.320 -2.582 1.00 0.00 C ATOM 1831 CD2 PHE A 115 0.928 -2.702 -0.732 1.00 0.00 C ATOM 1832 CE1 PHE A 115 -0.097 -1.009 -2.655 1.00 0.00 C ATOM 1833 CE2 PHE A 115 1.363 -1.392 -0.801 1.00 0.00 C ATOM 1834 CZ PHE A 115 0.848 -0.544 -1.763 1.00 0.00 C ATOM 0 H PHE A 115 -2.056 -4.297 0.359 1.00 0.00 H new ATOM 0 HA PHE A 115 -2.376 -4.095 -2.435 1.00 0.00 H new ATOM 0 HB2 PHE A 115 -0.167 -5.036 -0.594 1.00 0.00 H new ATOM 0 HB3 PHE A 115 0.006 -5.184 -2.332 1.00 0.00 H new ATOM 0 HD1 PHE A 115 -1.270 -2.678 -3.282 1.00 0.00 H new ATOM 0 HD2 PHE A 115 1.333 -3.360 0.023 1.00 0.00 H new ATOM 0 HE1 PHE A 115 -0.499 -0.349 -3.410 1.00 0.00 H new ATOM 0 HE2 PHE A 115 2.105 -1.031 -0.104 1.00 0.00 H new ATOM 0 HZ PHE A 115 1.184 0.481 -1.817 1.00 0.00 H new ATOM 1844 N THR A 116 -2.622 -7.084 -1.167 1.00 0.00 N ATOM 1845 CA THR A 116 -2.931 -8.476 -1.472 1.00 0.00 C ATOM 1846 C THR A 116 -3.824 -9.100 -0.402 1.00 0.00 C ATOM 1847 O THR A 116 -4.581 -10.030 -0.680 1.00 0.00 O ATOM 1848 CB THR A 116 -1.649 -9.318 -1.604 1.00 0.00 C ATOM 1849 OG1 THR A 116 -1.986 -10.681 -1.894 1.00 0.00 O ATOM 1850 CG2 THR A 116 -0.824 -9.256 -0.327 1.00 0.00 C ATOM 0 H THR A 116 -2.666 -6.848 -0.176 1.00 0.00 H new ATOM 0 HA THR A 116 -3.462 -8.475 -2.424 1.00 0.00 H new ATOM 0 HB THR A 116 -1.055 -8.908 -2.421 1.00 0.00 H new ATOM 0 HG1 THR A 116 -1.165 -11.210 -1.978 1.00 0.00 H new ATOM 0 HG21 THR A 116 0.076 -9.859 -0.446 1.00 0.00 H new ATOM 0 HG22 THR A 116 -0.544 -8.222 -0.124 1.00 0.00 H new ATOM 0 HG23 THR A 116 -1.412 -9.642 0.505 1.00 0.00 H new ATOM 1858 N ASP A 117 -3.729 -8.585 0.820 1.00 0.00 N ATOM 1859 CA ASP A 117 -4.529 -9.097 1.927 1.00 0.00 C ATOM 1860 C ASP A 117 -6.009 -8.797 1.714 1.00 0.00 C ATOM 1861 O ASP A 117 -6.526 -7.790 2.200 1.00 0.00 O ATOM 1862 CB ASP A 117 -4.054 -8.497 3.251 1.00 0.00 C ATOM 1863 CG ASP A 117 -2.617 -8.863 3.566 1.00 0.00 C ATOM 1864 OD1 ASP A 117 -1.704 -8.168 3.071 1.00 0.00 O ATOM 1865 OD2 ASP A 117 -2.404 -9.846 4.306 1.00 0.00 O ATOM 0 H ASP A 117 -3.107 -7.815 1.068 1.00 0.00 H new ATOM 0 HA ASP A 117 -4.401 -10.179 1.965 1.00 0.00 H new ATOM 0 HB2 ASP A 117 -4.150 -7.412 3.211 1.00 0.00 H new ATOM 0 HB3 ASP A 117 -4.700 -8.844 4.057 1.00 0.00 H new ATOM 1870 N PHE A 118 -6.683 -9.677 0.979 1.00 0.00 N ATOM 1871 CA PHE A 118 -8.102 -9.510 0.690 1.00 0.00 C ATOM 1872 C PHE A 118 -8.916 -9.433 1.976 1.00 0.00 C ATOM 1873 O PHE A 118 -9.947 -8.762 2.029 1.00 0.00 O ATOM 1874 CB PHE A 118 -8.604 -10.661 -0.183 1.00 0.00 C ATOM 1875 CG PHE A 118 -10.016 -10.481 -0.664 1.00 0.00 C ATOM 1876 CD1 PHE A 118 -10.292 -9.648 -1.737 1.00 0.00 C ATOM 1877 CD2 PHE A 118 -11.065 -11.140 -0.045 1.00 0.00 C ATOM 1878 CE1 PHE A 118 -11.587 -9.478 -2.184 1.00 0.00 C ATOM 1879 CE2 PHE A 118 -12.364 -10.973 -0.488 1.00 0.00 C ATOM 1880 CZ PHE A 118 -12.625 -10.141 -1.558 1.00 0.00 C ATOM 0 H PHE A 118 -6.267 -10.515 0.572 1.00 0.00 H new ATOM 0 HA PHE A 118 -8.229 -8.572 0.149 1.00 0.00 H new ATOM 0 HB2 PHE A 118 -7.946 -10.765 -1.046 1.00 0.00 H new ATOM 0 HB3 PHE A 118 -8.538 -11.590 0.383 1.00 0.00 H new ATOM 0 HD1 PHE A 118 -9.485 -9.126 -2.229 1.00 0.00 H new ATOM 0 HD2 PHE A 118 -10.866 -11.792 0.793 1.00 0.00 H new ATOM 0 HE1 PHE A 118 -11.789 -8.827 -3.022 1.00 0.00 H new ATOM 0 HE2 PHE A 118 -13.174 -11.493 0.003 1.00 0.00 H new ATOM 0 HZ PHE A 118 -13.639 -10.008 -1.905 1.00 0.00 H new ATOM 1890 N LEU A 119 -8.448 -10.122 3.013 1.00 0.00 N ATOM 1891 CA LEU A 119 -9.136 -10.125 4.299 1.00 0.00 C ATOM 1892 C LEU A 119 -9.228 -8.712 4.863 1.00 0.00 C ATOM 1893 O LEU A 119 -10.267 -8.306 5.385 1.00 0.00 O ATOM 1894 CB LEU A 119 -8.410 -11.038 5.292 1.00 0.00 C ATOM 1895 CG LEU A 119 -8.232 -12.488 4.834 1.00 0.00 C ATOM 1896 CD1 LEU A 119 -7.423 -13.275 5.855 1.00 0.00 C ATOM 1897 CD2 LEU A 119 -9.584 -13.147 4.605 1.00 0.00 C ATOM 0 H LEU A 119 -7.597 -10.684 2.988 1.00 0.00 H new ATOM 0 HA LEU A 119 -10.146 -10.505 4.143 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -7.427 -10.615 5.498 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -8.961 -11.036 6.233 1.00 0.00 H new ATOM 0 HG LEU A 119 -7.687 -12.484 3.890 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -7.307 -14.303 5.513 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -6.440 -12.818 5.971 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -7.942 -13.268 6.814 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -9.436 -14.177 4.280 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -10.155 -13.138 5.533 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -10.130 -12.599 3.837 1.00 0.00 H new ATOM 1909 N ALA A 120 -8.135 -7.965 4.746 1.00 0.00 N ATOM 1910 CA ALA A 120 -8.084 -6.595 5.242 1.00 0.00 C ATOM 1911 C ALA A 120 -8.845 -5.651 4.316 1.00 0.00 C ATOM 1912 O ALA A 120 -9.337 -4.607 4.743 1.00 0.00 O ATOM 1913 CB ALA A 120 -6.638 -6.141 5.392 1.00 0.00 C ATOM 0 H ALA A 120 -7.271 -8.287 4.311 1.00 0.00 H new ATOM 0 HA ALA A 120 -8.563 -6.569 6.221 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -6.615 -5.116 5.763 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -6.123 -6.794 6.097 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -6.140 -6.187 4.424 1.00 0.00 H new ATOM 1919 N PHE A 121 -8.935 -6.030 3.045 1.00 0.00 N ATOM 1920 CA PHE A 121 -9.630 -5.227 2.045 1.00 0.00 C ATOM 1921 C PHE A 121 -11.133 -5.183 2.329 1.00 0.00 C ATOM 1922 O PHE A 121 -11.724 -4.106 2.453 1.00 0.00 O ATOM 1923 CB PHE A 121 -9.370 -5.812 0.653 1.00 0.00 C ATOM 1924 CG PHE A 121 -9.575 -4.844 -0.480 1.00 0.00 C ATOM 1925 CD1 PHE A 121 -9.004 -3.581 -0.448 1.00 0.00 C ATOM 1926 CD2 PHE A 121 -10.331 -5.205 -1.584 1.00 0.00 C ATOM 1927 CE1 PHE A 121 -9.186 -2.698 -1.496 1.00 0.00 C ATOM 1928 CE2 PHE A 121 -10.514 -4.327 -2.635 1.00 0.00 C ATOM 1929 CZ PHE A 121 -9.941 -3.071 -2.591 1.00 0.00 C ATOM 0 H PHE A 121 -8.532 -6.894 2.682 1.00 0.00 H new ATOM 0 HA PHE A 121 -9.250 -4.206 2.087 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -8.346 -6.184 0.615 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -10.027 -6.669 0.505 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -8.411 -3.284 0.404 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -10.783 -6.185 -1.623 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -8.738 -1.716 -1.459 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -11.104 -4.622 -3.490 1.00 0.00 H new ATOM 0 HZ PHE A 121 -10.083 -2.382 -3.411 1.00 0.00 H new ATOM 1939 N LYS A 122 -11.740 -6.361 2.446 1.00 0.00 N ATOM 1940 CA LYS A 122 -13.170 -6.461 2.716 1.00 0.00 C ATOM 1941 C LYS A 122 -13.512 -5.857 4.073 1.00 0.00 C ATOM 1942 O LYS A 122 -14.463 -5.085 4.199 1.00 0.00 O ATOM 1943 CB LYS A 122 -13.622 -7.923 2.666 1.00 0.00 C ATOM 1944 CG LYS A 122 -15.127 -8.101 2.806 1.00 0.00 C ATOM 1945 CD LYS A 122 -15.520 -9.569 2.782 1.00 0.00 C ATOM 1946 CE LYS A 122 -17.028 -9.744 2.849 1.00 0.00 C ATOM 1947 NZ LYS A 122 -17.606 -9.129 4.075 1.00 0.00 N ATOM 0 H LYS A 122 -11.264 -7.259 2.358 1.00 0.00 H new ATOM 0 HA LYS A 122 -13.698 -5.899 1.945 1.00 0.00 H new ATOM 0 HB2 LYS A 122 -13.299 -8.362 1.722 1.00 0.00 H new ATOM 0 HB3 LYS A 122 -13.124 -8.476 3.462 1.00 0.00 H new ATOM 0 HG2 LYS A 122 -15.462 -7.649 3.739 1.00 0.00 H new ATOM 0 HG3 LYS A 122 -15.633 -7.575 1.997 1.00 0.00 H new ATOM 0 HD2 LYS A 122 -15.139 -10.034 1.873 1.00 0.00 H new ATOM 0 HD3 LYS A 122 -15.055 -10.085 3.622 1.00 0.00 H new ATOM 0 HE2 LYS A 122 -17.485 -9.294 1.968 1.00 0.00 H new ATOM 0 HE3 LYS A 122 -17.271 -10.806 2.827 1.00 0.00 H new ATOM 0 HZ1 LYS A 122 -18.456 -9.656 4.360 1.00 0.00 H new ATOM 0 HZ2 LYS A 122 -16.905 -9.161 4.843 1.00 0.00 H new ATOM 0 HZ3 LYS A 122 -17.860 -8.140 3.880 1.00 0.00 H new ATOM 1961 N GLU A 123 -12.731 -6.213 5.089 1.00 0.00 N ATOM 1962 CA GLU A 123 -12.950 -5.707 6.436 1.00 0.00 C ATOM 1963 C GLU A 123 -12.822 -4.188 6.479 1.00 0.00 C ATOM 1964 O GLU A 123 -13.442 -3.529 7.313 1.00 0.00 O ATOM 1965 CB GLU A 123 -11.956 -6.347 7.404 1.00 0.00 C ATOM 1966 CG GLU A 123 -12.236 -7.816 7.680 1.00 0.00 C ATOM 1967 CD GLU A 123 -13.605 -8.045 8.289 1.00 0.00 C ATOM 1968 OE1 GLU A 123 -13.737 -7.908 9.523 1.00 0.00 O ATOM 1969 OE2 GLU A 123 -14.547 -8.359 7.531 1.00 0.00 O ATOM 0 H GLU A 123 -11.940 -6.851 5.002 1.00 0.00 H new ATOM 0 HA GLU A 123 -13.964 -5.970 6.738 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -10.950 -6.248 6.997 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -11.974 -5.799 8.346 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -12.158 -8.378 6.749 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -11.473 -8.207 8.353 1.00 0.00 H new ATOM 1976 N MET A 124 -12.012 -3.638 5.580 1.00 0.00 N ATOM 1977 CA MET A 124 -11.808 -2.196 5.516 1.00 0.00 C ATOM 1978 C MET A 124 -13.090 -1.488 5.092 1.00 0.00 C ATOM 1979 O MET A 124 -13.492 -0.495 5.700 1.00 0.00 O ATOM 1980 CB MET A 124 -10.681 -1.858 4.538 1.00 0.00 C ATOM 1981 CG MET A 124 -10.412 -0.366 4.408 1.00 0.00 C ATOM 1982 SD MET A 124 -9.081 0.000 3.246 1.00 0.00 S ATOM 1983 CE MET A 124 -9.759 -0.672 1.730 1.00 0.00 C ATOM 0 H MET A 124 -11.486 -4.169 4.886 1.00 0.00 H new ATOM 0 HA MET A 124 -11.530 -1.850 6.511 1.00 0.00 H new ATOM 0 HB2 MET A 124 -9.768 -2.356 4.864 1.00 0.00 H new ATOM 0 HB3 MET A 124 -10.931 -2.260 3.556 1.00 0.00 H new ATOM 0 HG2 MET A 124 -11.323 0.137 4.082 1.00 0.00 H new ATOM 0 HG3 MET A 124 -10.157 0.040 5.387 1.00 0.00 H new ATOM 0 HE1 MET A 124 -9.261 -0.215 0.875 1.00 0.00 H new ATOM 0 HE2 MET A 124 -9.602 -1.750 1.708 1.00 0.00 H new ATOM 0 HE3 MET A 124 -10.827 -0.460 1.684 1.00 0.00 H new ATOM 1993 N PHE A 125 -13.726 -2.003 4.044 1.00 0.00 N ATOM 1994 CA PHE A 125 -14.964 -1.414 3.541 1.00 0.00 C ATOM 1995 C PHE A 125 -16.103 -1.563 4.547 1.00 0.00 C ATOM 1996 O PHE A 125 -16.848 -0.615 4.793 1.00 0.00 O ATOM 1997 CB PHE A 125 -15.354 -2.055 2.209 1.00 0.00 C ATOM 1998 CG PHE A 125 -14.333 -1.843 1.131 1.00 0.00 C ATOM 1999 CD1 PHE A 125 -13.945 -0.562 0.769 1.00 0.00 C ATOM 2000 CD2 PHE A 125 -13.757 -2.922 0.482 1.00 0.00 C ATOM 2001 CE1 PHE A 125 -13.002 -0.362 -0.220 1.00 0.00 C ATOM 2002 CE2 PHE A 125 -12.815 -2.729 -0.509 1.00 0.00 C ATOM 2003 CZ PHE A 125 -12.437 -1.448 -0.860 1.00 0.00 C ATOM 0 H PHE A 125 -13.407 -2.823 3.528 1.00 0.00 H new ATOM 0 HA PHE A 125 -14.787 -0.349 3.388 1.00 0.00 H new ATOM 0 HB2 PHE A 125 -15.500 -3.125 2.357 1.00 0.00 H new ATOM 0 HB3 PHE A 125 -16.309 -1.645 1.882 1.00 0.00 H new ATOM 0 HD1 PHE A 125 -14.385 0.290 1.266 1.00 0.00 H new ATOM 0 HD2 PHE A 125 -14.048 -3.926 0.754 1.00 0.00 H new ATOM 0 HE1 PHE A 125 -12.707 0.641 -0.492 1.00 0.00 H new ATOM 0 HE2 PHE A 125 -12.374 -3.579 -1.009 1.00 0.00 H new ATOM 0 HZ PHE A 125 -11.700 -1.295 -1.635 1.00 0.00 H new ATOM 2013 N LEU A 126 -16.234 -2.753 5.124 1.00 0.00 N ATOM 2014 CA LEU A 126 -17.286 -3.013 6.102 1.00 0.00 C ATOM 2015 C LEU A 126 -17.094 -2.158 7.350 1.00 0.00 C ATOM 2016 O LEU A 126 -18.066 -1.746 7.986 1.00 0.00 O ATOM 2017 CB LEU A 126 -17.314 -4.495 6.480 1.00 0.00 C ATOM 2018 CG LEU A 126 -18.152 -5.386 5.558 1.00 0.00 C ATOM 2019 CD1 LEU A 126 -17.589 -5.380 4.144 1.00 0.00 C ATOM 2020 CD2 LEU A 126 -18.215 -6.803 6.105 1.00 0.00 C ATOM 0 H LEU A 126 -15.628 -3.550 4.933 1.00 0.00 H new ATOM 0 HA LEU A 126 -18.240 -2.748 5.646 1.00 0.00 H new ATOM 0 HB2 LEU A 126 -16.291 -4.871 6.490 1.00 0.00 H new ATOM 0 HB3 LEU A 126 -17.698 -4.587 7.496 1.00 0.00 H new ATOM 0 HG LEU A 126 -19.165 -4.985 5.520 1.00 0.00 H new ATOM 0 HD11 LEU A 126 -18.200 -6.019 3.507 1.00 0.00 H new ATOM 0 HD12 LEU A 126 -17.598 -4.363 3.753 1.00 0.00 H new ATOM 0 HD13 LEU A 126 -16.565 -5.754 4.158 1.00 0.00 H new ATOM 0 HD21 LEU A 126 -18.814 -7.424 5.439 1.00 0.00 H new ATOM 0 HD22 LEU A 126 -17.207 -7.212 6.173 1.00 0.00 H new ATOM 0 HD23 LEU A 126 -18.669 -6.791 7.096 1.00 0.00 H new ATOM 2032 N ASP A 127 -15.838 -1.894 7.697 1.00 0.00 N ATOM 2033 CA ASP A 127 -15.525 -1.081 8.867 1.00 0.00 C ATOM 2034 C ASP A 127 -15.936 0.369 8.639 1.00 0.00 C ATOM 2035 O ASP A 127 -16.530 1.002 9.512 1.00 0.00 O ATOM 2036 CB ASP A 127 -14.030 -1.159 9.186 1.00 0.00 C ATOM 2037 CG ASP A 127 -13.642 -0.289 10.367 1.00 0.00 C ATOM 2038 OD1 ASP A 127 -13.706 -0.780 11.513 1.00 0.00 O ATOM 2039 OD2 ASP A 127 -13.273 0.884 10.145 1.00 0.00 O ATOM 0 H ASP A 127 -15.022 -2.231 7.186 1.00 0.00 H new ATOM 0 HA ASP A 127 -16.087 -1.472 9.715 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -13.760 -2.194 9.397 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -13.458 -0.853 8.310 1.00 0.00 H new ATOM 2044 N TYR A 128 -15.618 0.888 7.455 1.00 0.00 N ATOM 2045 CA TYR A 128 -15.956 2.264 7.105 1.00 0.00 C ATOM 2046 C TYR A 128 -17.463 2.483 7.167 1.00 0.00 C ATOM 2047 O TYR A 128 -17.931 3.475 7.724 1.00 0.00 O ATOM 2048 CB TYR A 128 -15.433 2.598 5.705 1.00 0.00 C ATOM 2049 CG TYR A 128 -15.876 3.952 5.193 1.00 0.00 C ATOM 2050 CD1 TYR A 128 -15.242 5.116 5.611 1.00 0.00 C ATOM 2051 CD2 TYR A 128 -16.930 4.066 4.295 1.00 0.00 C ATOM 2052 CE1 TYR A 128 -15.646 6.354 5.148 1.00 0.00 C ATOM 2053 CE2 TYR A 128 -17.338 5.300 3.826 1.00 0.00 C ATOM 2054 CZ TYR A 128 -16.694 6.441 4.256 1.00 0.00 C ATOM 2055 OH TYR A 128 -17.099 7.672 3.794 1.00 0.00 O ATOM 0 H TYR A 128 -15.127 0.376 6.722 1.00 0.00 H new ATOM 0 HA TYR A 128 -15.482 2.927 7.828 1.00 0.00 H new ATOM 0 HB2 TYR A 128 -14.344 2.563 5.717 1.00 0.00 H new ATOM 0 HB3 TYR A 128 -15.769 1.829 5.009 1.00 0.00 H new ATOM 0 HD1 TYR A 128 -14.420 5.052 6.309 1.00 0.00 H new ATOM 0 HD2 TYR A 128 -17.439 3.175 3.958 1.00 0.00 H new ATOM 0 HE1 TYR A 128 -15.143 7.249 5.483 1.00 0.00 H new ATOM 0 HE2 TYR A 128 -18.157 5.371 3.126 1.00 0.00 H new ATOM 0 HH TYR A 128 -17.848 7.558 3.172 1.00 0.00 H new ATOM 2065 N ARG A 129 -18.216 1.550 6.592 1.00 0.00 N ATOM 2066 CA ARG A 129 -19.672 1.640 6.578 1.00 0.00 C ATOM 2067 C ARG A 129 -20.234 1.670 7.997 1.00 0.00 C ATOM 2068 O ARG A 129 -21.105 2.482 8.310 1.00 0.00 O ATOM 2069 CB ARG A 129 -20.267 0.461 5.805 1.00 0.00 C ATOM 2070 CG ARG A 129 -21.783 0.508 5.695 1.00 0.00 C ATOM 2071 CD ARG A 129 -22.323 -0.701 4.948 1.00 0.00 C ATOM 2072 NE ARG A 129 -23.777 -0.662 4.819 1.00 0.00 N ATOM 2073 CZ ARG A 129 -24.508 -1.695 4.412 1.00 0.00 C ATOM 2074 NH1 ARG A 129 -23.923 -2.842 4.093 1.00 0.00 N ATOM 2075 NH2 ARG A 129 -25.825 -1.583 4.321 1.00 0.00 N ATOM 0 H ARG A 129 -17.841 0.722 6.129 1.00 0.00 H new ATOM 0 HA ARG A 129 -19.948 2.570 6.081 1.00 0.00 H new ATOM 0 HB2 ARG A 129 -19.839 0.441 4.803 1.00 0.00 H new ATOM 0 HB3 ARG A 129 -19.975 -0.468 6.295 1.00 0.00 H new ATOM 0 HG2 ARG A 129 -22.221 0.546 6.693 1.00 0.00 H new ATOM 0 HG3 ARG A 129 -22.084 1.420 5.180 1.00 0.00 H new ATOM 0 HD2 ARG A 129 -21.872 -0.745 3.956 1.00 0.00 H new ATOM 0 HD3 ARG A 129 -22.030 -1.611 5.472 1.00 0.00 H new ATOM 0 HE ARG A 129 -24.258 0.206 5.054 1.00 0.00 H new ATOM 0 HH11 ARG A 129 -22.909 -2.933 4.160 1.00 0.00 H new ATOM 0 HH12 ARG A 129 -24.487 -3.633 3.781 1.00 0.00 H new ATOM 0 HH21 ARG A 129 -26.280 -0.703 4.563 1.00 0.00 H new ATOM 0 HH22 ARG A 129 -26.384 -2.377 4.008 1.00 0.00 H new ATOM 2089 N ALA A 130 -19.732 0.781 8.848 1.00 0.00 N ATOM 2090 CA ALA A 130 -20.184 0.702 10.233 1.00 0.00 C ATOM 2091 C ALA A 130 -20.123 2.065 10.917 1.00 0.00 C ATOM 2092 O ALA A 130 -21.086 2.497 11.548 1.00 0.00 O ATOM 2093 CB ALA A 130 -19.349 -0.310 11.003 1.00 0.00 C ATOM 0 H ALA A 130 -19.010 0.104 8.602 1.00 0.00 H new ATOM 0 HA ALA A 130 -21.224 0.376 10.227 1.00 0.00 H new ATOM 0 HB1 ALA A 130 -19.697 -0.359 12.035 1.00 0.00 H new ATOM 0 HB2 ALA A 130 -19.448 -1.292 10.540 1.00 0.00 H new ATOM 0 HB3 ALA A 130 -18.302 -0.006 10.987 1.00 0.00 H new ATOM 2099 N GLU A 131 -18.983 2.737 10.787 1.00 0.00 N ATOM 2100 CA GLU A 131 -18.795 4.050 11.395 1.00 0.00 C ATOM 2101 C GLU A 131 -19.514 5.141 10.603 1.00 0.00 C ATOM 2102 O GLU A 131 -19.838 6.197 11.145 1.00 0.00 O ATOM 2103 CB GLU A 131 -17.306 4.382 11.503 1.00 0.00 C ATOM 2104 CG GLU A 131 -16.598 3.666 12.644 1.00 0.00 C ATOM 2105 CD GLU A 131 -16.627 2.157 12.501 1.00 0.00 C ATOM 2106 OE1 GLU A 131 -17.618 1.537 12.943 1.00 0.00 O ATOM 2107 OE2 GLU A 131 -15.658 1.594 11.950 1.00 0.00 O ATOM 0 H GLU A 131 -18.176 2.394 10.266 1.00 0.00 H new ATOM 0 HA GLU A 131 -19.228 4.014 12.395 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -16.816 4.123 10.564 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -17.192 5.458 11.635 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -15.562 4.002 12.690 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -17.066 3.946 13.588 1.00 0.00 H new ATOM 2114 N LYS A 132 -19.763 4.881 9.322 1.00 0.00 N ATOM 2115 CA LYS A 132 -20.441 5.853 8.470 1.00 0.00 C ATOM 2116 C LYS A 132 -21.902 6.000 8.886 1.00 0.00 C ATOM 2117 O LYS A 132 -22.556 6.990 8.554 1.00 0.00 O ATOM 2118 CB LYS A 132 -20.321 5.442 6.992 1.00 0.00 C ATOM 2119 CG LYS A 132 -21.563 4.785 6.406 1.00 0.00 C ATOM 2120 CD LYS A 132 -22.506 5.815 5.805 1.00 0.00 C ATOM 2121 CE LYS A 132 -23.179 5.289 4.549 1.00 0.00 C ATOM 2122 NZ LYS A 132 -24.115 6.286 3.960 1.00 0.00 N ATOM 0 H LYS A 132 -19.507 4.012 8.854 1.00 0.00 H new ATOM 0 HA LYS A 132 -19.960 6.824 8.591 1.00 0.00 H new ATOM 0 HB2 LYS A 132 -20.084 6.327 6.402 1.00 0.00 H new ATOM 0 HB3 LYS A 132 -19.481 4.755 6.888 1.00 0.00 H new ATOM 0 HG2 LYS A 132 -21.269 4.068 5.640 1.00 0.00 H new ATOM 0 HG3 LYS A 132 -22.082 4.225 7.184 1.00 0.00 H new ATOM 0 HD2 LYS A 132 -23.265 6.087 6.539 1.00 0.00 H new ATOM 0 HD3 LYS A 132 -21.951 6.723 5.569 1.00 0.00 H new ATOM 0 HE2 LYS A 132 -22.419 5.026 3.813 1.00 0.00 H new ATOM 0 HE3 LYS A 132 -23.724 4.375 4.785 1.00 0.00 H new ATOM 0 HZ1 LYS A 132 -24.553 5.888 3.105 1.00 0.00 H new ATOM 0 HZ2 LYS A 132 -24.855 6.518 4.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 132 -23.591 7.149 3.711 1.00 0.00 H new ATOM 2136 N GLU A 133 -22.403 5.013 9.623 1.00 0.00 N ATOM 2137 CA GLU A 133 -23.783 5.028 10.092 1.00 0.00 C ATOM 2138 C GLU A 133 -24.059 6.277 10.926 1.00 0.00 C ATOM 2139 O GLU A 133 -25.201 6.726 11.029 1.00 0.00 O ATOM 2140 CB GLU A 133 -24.081 3.766 10.904 1.00 0.00 C ATOM 2141 CG GLU A 133 -23.747 3.905 12.373 1.00 0.00 C ATOM 2142 CD GLU A 133 -24.212 2.721 13.197 1.00 0.00 C ATOM 2143 OE1 GLU A 133 -25.390 2.711 13.611 1.00 0.00 O ATOM 2144 OE2 GLU A 133 -23.397 1.804 13.431 1.00 0.00 O ATOM 0 H GLU A 133 -21.871 4.191 9.909 1.00 0.00 H new ATOM 0 HA GLU A 133 -24.440 5.048 9.223 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -25.137 3.517 10.801 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -23.515 2.933 10.487 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -22.669 4.019 12.486 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -24.206 4.814 12.761 1.00 0.00 H new ATOM 2151 N GLY A 134 -23.004 6.834 11.514 1.00 0.00 N ATOM 2152 CA GLY A 134 -23.149 8.026 12.330 1.00 0.00 C ATOM 2153 C GLY A 134 -24.059 7.807 13.523 1.00 0.00 C ATOM 2154 O GLY A 134 -25.267 8.036 13.441 1.00 0.00 O ATOM 0 H GLY A 134 -22.050 6.480 11.440 1.00 0.00 H new ATOM 0 HA2 GLY A 134 -22.167 8.344 12.680 1.00 0.00 H new ATOM 0 HA3 GLY A 134 -23.547 8.835 11.718 1.00 0.00 H new ATOM 2158 N ARG A 135 -23.480 7.366 14.635 1.00 0.00 N ATOM 2159 CA ARG A 135 -24.248 7.116 15.850 1.00 0.00 C ATOM 2160 C ARG A 135 -24.787 8.420 16.428 1.00 0.00 C ATOM 2161 O ARG A 135 -24.404 9.508 15.995 1.00 0.00 O ATOM 2162 CB ARG A 135 -23.381 6.399 16.888 1.00 0.00 C ATOM 2163 CG ARG A 135 -22.189 7.218 17.358 1.00 0.00 C ATOM 2164 CD ARG A 135 -21.327 6.436 18.336 1.00 0.00 C ATOM 2165 NE ARG A 135 -20.686 5.286 17.703 1.00 0.00 N ATOM 2166 CZ ARG A 135 -19.843 4.471 18.333 1.00 0.00 C ATOM 2167 NH1 ARG A 135 -19.537 4.683 19.605 1.00 0.00 N ATOM 2168 NH2 ARG A 135 -19.305 3.445 17.688 1.00 0.00 N ATOM 0 H ARG A 135 -22.482 7.174 14.720 1.00 0.00 H new ATOM 0 HA ARG A 135 -25.093 6.478 15.593 1.00 0.00 H new ATOM 0 HB2 ARG A 135 -23.998 6.143 17.750 1.00 0.00 H new ATOM 0 HB3 ARG A 135 -23.022 5.461 16.464 1.00 0.00 H new ATOM 0 HG2 ARG A 135 -21.588 7.515 16.498 1.00 0.00 H new ATOM 0 HG3 ARG A 135 -22.540 8.134 17.833 1.00 0.00 H new ATOM 0 HD2 ARG A 135 -20.563 7.093 18.752 1.00 0.00 H new ATOM 0 HD3 ARG A 135 -21.942 6.095 19.169 1.00 0.00 H new ATOM 0 HE ARG A 135 -20.896 5.097 16.723 1.00 0.00 H new ATOM 0 HH11 ARG A 135 -19.948 5.472 20.104 1.00 0.00 H new ATOM 0 HH12 ARG A 135 -18.891 4.057 20.085 1.00 0.00 H new ATOM 0 HH21 ARG A 135 -19.537 3.280 16.709 1.00 0.00 H new ATOM 0 HH22 ARG A 135 -18.659 2.821 18.171 1.00 0.00 H new ATOM 2182 N GLY A 136 -25.677 8.303 17.409 1.00 0.00 N ATOM 2183 CA GLY A 136 -26.255 9.480 18.032 1.00 0.00 C ATOM 2184 C GLY A 136 -26.467 9.303 19.523 1.00 0.00 C ATOM 2185 O GLY A 136 -26.709 8.158 19.958 1.00 0.00 O ATOM 2186 OXT GLY A 136 -26.392 10.312 20.256 1.00 0.00 O ATOM 0 H GLY A 136 -26.008 7.414 17.784 1.00 0.00 H new ATOM 0 HA2 GLY A 136 -25.602 10.336 17.860 1.00 0.00 H new ATOM 0 HA3 GLY A 136 -27.209 9.707 17.557 1.00 0.00 H new TER 2190 GLY A 136