USER MOD reduce.3.24.130724 H: found=0, std=0, add=432, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 424 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 179 CYS SG : rot -138:sc= -0.224 USER MOD Set 1.2: A 182 CYS SG : rot -170:sc= 0.0312 USER MOD Set 1.3: A 186 HIS : no HD1:sc= -0.693 K(o=-0.89,f=-0.3) USER MOD Set 2.1: A 138 CYS SG : rot -92:sc= -3.58! USER MOD Set 2.2: A 143 CYS SG : rot 180:sc= 0 USER MOD Set 2.3: A 160 CYS SG : rot 150:sc= -0.435 USER MOD Set 2.4: A 163 CYS SG : rot 145:sc= -1.54! USER MOD Single : A 139 GLN : amide:sc= -1.6 K(o=-1.6,f=-2.1) USER MOD Single : A 148 SER OG : rot 108:sc= 0.41 USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 153 TYR OH : rot 180:sc= 0 USER MOD Single : A 154 HIS : no HD1:sc= -5.13! C(o=-5.1!,f=-3.4!) USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 157 HIS : no HD1:sc= -1.57 K(o=-1.6,f=-0.97) USER MOD Single : A 165 THR OG1 : rot -71:sc= 0.295 USER MOD Single : A 167 SER OG : rot 94:sc= 0.519 USER MOD Single : A 175 ASN : amide:sc= -1.19 K(o=-1.2,f=-4!) USER MOD Single : A 176 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 178 TYR OH : rot 153:sc= 1.35 USER MOD Single : A 180 GLN : amide:sc= -0.289 K(o=-0.29,f=-2.8!) USER MOD Single : A 181 GLN : amide:sc= 0 K(o=0,f=-0.7) USER MOD Single : A 184 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 17 N ALA A 136 -8.131 19.836 -12.169 1.00 0.00 N ATOM 18 CA ALA A 136 -8.158 19.439 -10.766 1.00 0.00 C ATOM 19 C ALA A 136 -9.545 19.643 -10.163 1.00 0.00 C ATOM 20 O ALA A 136 -9.853 20.713 -9.639 1.00 0.00 O ATOM 21 CB ALA A 136 -7.120 20.220 -9.977 1.00 0.00 C ATOM 0 HA ALA A 136 -7.919 18.377 -10.711 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -7.151 19.913 -8.931 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -6.128 20.021 -10.384 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -7.335 21.286 -10.049 1.00 0.00 H new ATOM 27 N ARG A 137 -10.378 18.611 -10.247 1.00 0.00 N ATOM 28 CA ARG A 137 -11.733 18.679 -9.713 1.00 0.00 C ATOM 29 C ARG A 137 -12.301 17.281 -9.486 1.00 0.00 C ATOM 30 O ARG A 137 -12.554 16.543 -10.438 1.00 0.00 O ATOM 31 CB ARG A 137 -12.634 19.463 -10.671 1.00 0.00 C ATOM 32 CG ARG A 137 -14.089 19.526 -10.233 1.00 0.00 C ATOM 33 CD ARG A 137 -14.580 20.962 -10.125 1.00 0.00 C ATOM 34 NE ARG A 137 -15.921 21.041 -9.551 1.00 0.00 N ATOM 35 CZ ARG A 137 -17.037 20.803 -10.237 1.00 0.00 C ATOM 36 NH1 ARG A 137 -16.977 20.474 -11.521 1.00 0.00 N ATOM 37 NH2 ARG A 137 -18.216 20.897 -9.638 1.00 0.00 N ATOM 0 H ARG A 137 -10.139 17.719 -10.679 1.00 0.00 H new ATOM 0 HA ARG A 137 -11.697 19.193 -8.752 1.00 0.00 H new ATOM 0 HB2 ARG A 137 -12.249 20.478 -10.768 1.00 0.00 H new ATOM 0 HB3 ARG A 137 -12.581 19.007 -11.660 1.00 0.00 H new ATOM 0 HG2 ARG A 137 -14.708 18.982 -10.946 1.00 0.00 H new ATOM 0 HG3 ARG A 137 -14.201 19.029 -9.269 1.00 0.00 H new ATOM 0 HD2 ARG A 137 -13.888 21.536 -9.509 1.00 0.00 H new ATOM 0 HD3 ARG A 137 -14.582 21.420 -11.114 1.00 0.00 H new ATOM 0 HE ARG A 137 -16.007 21.293 -8.567 1.00 0.00 H new ATOM 0 HH11 ARG A 137 -16.073 20.402 -11.987 1.00 0.00 H new ATOM 0 HH12 ARG A 137 -17.835 20.293 -12.042 1.00 0.00 H new ATOM 0 HH21 ARG A 137 -18.268 21.152 -8.652 1.00 0.00 H new ATOM 0 HH22 ARG A 137 -19.071 20.715 -10.163 1.00 0.00 H new ATOM 51 N CYS A 138 -12.509 16.922 -8.220 1.00 0.00 N ATOM 52 CA CYS A 138 -13.054 15.614 -7.880 1.00 0.00 C ATOM 53 C CYS A 138 -14.386 15.390 -8.591 1.00 0.00 C ATOM 54 O CYS A 138 -15.428 15.878 -8.149 1.00 0.00 O ATOM 55 CB CYS A 138 -13.237 15.482 -6.367 1.00 0.00 C ATOM 56 SG CYS A 138 -13.523 13.787 -5.810 1.00 0.00 S ATOM 0 H CYS A 138 -12.308 17.518 -7.417 1.00 0.00 H new ATOM 0 HA CYS A 138 -12.347 14.854 -8.212 1.00 0.00 H new ATOM 0 HB2 CYS A 138 -12.350 15.873 -5.868 1.00 0.00 H new ATOM 0 HB3 CYS A 138 -14.078 16.103 -6.057 1.00 0.00 H new ATOM 0 HG CYS A 138 -14.801 13.556 -5.762 1.00 0.00 H new ATOM 61 N GLN A 139 -14.334 14.667 -9.706 1.00 0.00 N ATOM 62 CA GLN A 139 -15.528 14.392 -10.503 1.00 0.00 C ATOM 63 C GLN A 139 -16.232 13.111 -10.059 1.00 0.00 C ATOM 64 O GLN A 139 -16.688 12.327 -10.893 1.00 0.00 O ATOM 65 CB GLN A 139 -15.162 14.295 -11.987 1.00 0.00 C ATOM 66 CG GLN A 139 -14.095 13.253 -12.291 1.00 0.00 C ATOM 67 CD GLN A 139 -14.682 11.912 -12.684 1.00 0.00 C ATOM 68 OE1 GLN A 139 -15.635 11.841 -13.461 1.00 0.00 O ATOM 69 NE2 GLN A 139 -14.114 10.839 -12.148 1.00 0.00 N ATOM 0 H GLN A 139 -13.477 14.260 -10.080 1.00 0.00 H new ATOM 0 HA GLN A 139 -16.219 15.221 -10.349 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -16.060 14.059 -12.558 1.00 0.00 H new ATOM 0 HB3 GLN A 139 -14.813 15.269 -12.330 1.00 0.00 H new ATOM 0 HG2 GLN A 139 -13.458 13.616 -13.097 1.00 0.00 H new ATOM 0 HG3 GLN A 139 -13.459 13.124 -11.415 1.00 0.00 H new ATOM 0 HE21 GLN A 139 -13.326 10.945 -11.509 1.00 0.00 H new ATOM 0 HE22 GLN A 139 -14.465 9.909 -12.375 1.00 0.00 H new ATOM 78 N VAL A 140 -16.339 12.904 -8.751 1.00 0.00 N ATOM 79 CA VAL A 140 -17.010 11.721 -8.227 1.00 0.00 C ATOM 80 C VAL A 140 -18.499 12.001 -8.021 1.00 0.00 C ATOM 81 O VAL A 140 -18.867 12.948 -7.328 1.00 0.00 O ATOM 82 CB VAL A 140 -16.388 11.258 -6.895 1.00 0.00 C ATOM 83 CG1 VAL A 140 -16.958 9.910 -6.477 1.00 0.00 C ATOM 84 CG2 VAL A 140 -14.872 11.190 -7.009 1.00 0.00 C ATOM 0 H VAL A 140 -15.972 13.535 -8.039 1.00 0.00 H new ATOM 0 HA VAL A 140 -16.884 10.925 -8.960 1.00 0.00 H new ATOM 0 HB VAL A 140 -16.641 11.987 -6.125 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -16.506 9.600 -5.535 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -18.037 9.994 -6.352 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -16.739 9.168 -7.245 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -14.450 10.861 -6.059 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -14.597 10.483 -7.792 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -14.481 12.177 -7.258 1.00 0.00 H new ATOM 94 N PRO A 141 -19.383 11.184 -8.626 1.00 0.00 N ATOM 95 CA PRO A 141 -20.832 11.361 -8.504 1.00 0.00 C ATOM 96 C PRO A 141 -21.273 11.664 -7.075 1.00 0.00 C ATOM 97 O PRO A 141 -21.947 12.663 -6.822 1.00 0.00 O ATOM 98 CB PRO A 141 -21.382 10.012 -8.960 1.00 0.00 C ATOM 99 CG PRO A 141 -20.380 9.516 -9.945 1.00 0.00 C ATOM 100 CD PRO A 141 -19.041 10.029 -9.481 1.00 0.00 C ATOM 0 HA PRO A 141 -21.190 12.209 -9.088 1.00 0.00 H new ATOM 0 HB2 PRO A 141 -21.490 9.323 -8.122 1.00 0.00 H new ATOM 0 HB3 PRO A 141 -22.367 10.118 -9.414 1.00 0.00 H new ATOM 0 HG2 PRO A 141 -20.385 8.427 -9.990 1.00 0.00 H new ATOM 0 HG3 PRO A 141 -20.609 9.877 -10.948 1.00 0.00 H new ATOM 0 HD2 PRO A 141 -18.492 9.269 -8.925 1.00 0.00 H new ATOM 0 HD3 PRO A 141 -18.413 10.325 -10.321 1.00 0.00 H new ATOM 108 N ASP A 142 -20.891 10.797 -6.145 1.00 0.00 N ATOM 109 CA ASP A 142 -21.250 10.973 -4.742 1.00 0.00 C ATOM 110 C ASP A 142 -20.445 12.103 -4.103 1.00 0.00 C ATOM 111 O ASP A 142 -20.890 12.720 -3.135 1.00 0.00 O ATOM 112 CB ASP A 142 -21.025 9.673 -3.969 1.00 0.00 C ATOM 113 CG ASP A 142 -19.613 9.144 -4.124 1.00 0.00 C ATOM 114 OD1 ASP A 142 -19.195 8.893 -5.274 1.00 0.00 O ATOM 115 OD2 ASP A 142 -18.924 8.978 -3.095 1.00 0.00 O ATOM 0 H ASP A 142 -20.333 9.965 -6.336 1.00 0.00 H new ATOM 0 HA ASP A 142 -22.306 11.238 -4.699 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -21.233 9.842 -2.912 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -21.732 8.920 -4.317 1.00 0.00 H new ATOM 120 N CYS A 143 -19.259 12.366 -4.645 1.00 0.00 N ATOM 121 CA CYS A 143 -18.398 13.420 -4.117 1.00 0.00 C ATOM 122 C CYS A 143 -17.962 14.382 -5.218 1.00 0.00 C ATOM 123 O CYS A 143 -16.954 14.159 -5.890 1.00 0.00 O ATOM 124 CB CYS A 143 -17.169 12.811 -3.439 1.00 0.00 C ATOM 125 SG CYS A 143 -16.049 14.026 -2.705 1.00 0.00 S ATOM 0 H CYS A 143 -18.873 11.866 -5.446 1.00 0.00 H new ATOM 0 HA CYS A 143 -18.972 13.983 -3.381 1.00 0.00 H new ATOM 0 HB2 CYS A 143 -17.501 12.123 -2.661 1.00 0.00 H new ATOM 0 HB3 CYS A 143 -16.618 12.222 -4.172 1.00 0.00 H new ATOM 0 HG CYS A 143 -15.043 13.413 -2.155 1.00 0.00 H new ATOM 130 N GLU A 144 -18.722 15.459 -5.392 1.00 0.00 N ATOM 131 CA GLU A 144 -18.410 16.459 -6.406 1.00 0.00 C ATOM 132 C GLU A 144 -17.613 17.608 -5.793 1.00 0.00 C ATOM 133 O GLU A 144 -18.150 18.689 -5.548 1.00 0.00 O ATOM 134 CB GLU A 144 -19.694 16.993 -7.043 1.00 0.00 C ATOM 135 CG GLU A 144 -19.518 17.436 -8.486 1.00 0.00 C ATOM 136 CD GLU A 144 -20.821 17.878 -9.124 1.00 0.00 C ATOM 137 OE1 GLU A 144 -21.620 18.550 -8.439 1.00 0.00 O ATOM 138 OE2 GLU A 144 -21.043 17.552 -10.310 1.00 0.00 O ATOM 0 H GLU A 144 -19.558 15.661 -4.844 1.00 0.00 H new ATOM 0 HA GLU A 144 -17.806 15.986 -7.180 1.00 0.00 H new ATOM 0 HB2 GLU A 144 -20.460 16.219 -7.000 1.00 0.00 H new ATOM 0 HB3 GLU A 144 -20.059 17.835 -6.455 1.00 0.00 H new ATOM 0 HG2 GLU A 144 -18.802 18.257 -8.525 1.00 0.00 H new ATOM 0 HG3 GLU A 144 -19.094 16.615 -9.065 1.00 0.00 H new ATOM 145 N ALA A 145 -16.332 17.362 -5.542 1.00 0.00 N ATOM 146 CA ALA A 145 -15.461 18.371 -4.949 1.00 0.00 C ATOM 147 C ALA A 145 -14.783 19.216 -6.021 1.00 0.00 C ATOM 148 O ALA A 145 -14.466 18.727 -7.105 1.00 0.00 O ATOM 149 CB ALA A 145 -14.419 17.709 -4.060 1.00 0.00 C ATOM 0 H ALA A 145 -15.873 16.473 -5.740 1.00 0.00 H new ATOM 0 HA ALA A 145 -16.077 19.033 -4.341 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -13.775 18.473 -3.623 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -14.918 17.157 -3.264 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -13.816 17.023 -4.655 1.00 0.00 H new ATOM 155 N ASP A 146 -14.556 20.488 -5.706 1.00 0.00 N ATOM 156 CA ASP A 146 -13.911 21.404 -6.639 1.00 0.00 C ATOM 157 C ASP A 146 -12.486 21.719 -6.191 1.00 0.00 C ATOM 158 O ASP A 146 -12.181 22.843 -5.794 1.00 0.00 O ATOM 159 CB ASP A 146 -14.719 22.697 -6.760 1.00 0.00 C ATOM 160 CG ASP A 146 -14.190 23.610 -7.849 1.00 0.00 C ATOM 161 OD1 ASP A 146 -13.255 24.390 -7.568 1.00 0.00 O ATOM 162 OD2 ASP A 146 -14.710 23.547 -8.982 1.00 0.00 O ATOM 0 H ASP A 146 -14.810 20.907 -4.811 1.00 0.00 H new ATOM 0 HA ASP A 146 -13.868 20.920 -7.615 1.00 0.00 H new ATOM 0 HB2 ASP A 146 -15.761 22.453 -6.969 1.00 0.00 H new ATOM 0 HB3 ASP A 146 -14.700 23.225 -5.806 1.00 0.00 H new ATOM 167 N ILE A 147 -11.617 20.715 -6.258 1.00 0.00 N ATOM 168 CA ILE A 147 -10.225 20.879 -5.858 1.00 0.00 C ATOM 169 C ILE A 147 -9.433 21.639 -6.920 1.00 0.00 C ATOM 170 O ILE A 147 -8.539 21.083 -7.560 1.00 0.00 O ATOM 171 CB ILE A 147 -9.550 19.518 -5.605 1.00 0.00 C ATOM 172 CG1 ILE A 147 -9.664 18.627 -6.846 1.00 0.00 C ATOM 173 CG2 ILE A 147 -10.172 18.834 -4.395 1.00 0.00 C ATOM 174 CD1 ILE A 147 -8.376 17.917 -7.200 1.00 0.00 C ATOM 0 H ILE A 147 -11.853 19.779 -6.586 1.00 0.00 H new ATOM 0 HA ILE A 147 -10.227 21.453 -4.931 1.00 0.00 H new ATOM 0 HB ILE A 147 -8.493 19.687 -5.399 1.00 0.00 H new ATOM 0 HG12 ILE A 147 -10.445 17.885 -6.680 1.00 0.00 H new ATOM 0 HG13 ILE A 147 -9.978 19.236 -7.693 1.00 0.00 H new ATOM 0 HG21 ILE A 147 -9.684 17.873 -4.229 1.00 0.00 H new ATOM 0 HG22 ILE A 147 -10.042 19.463 -3.515 1.00 0.00 H new ATOM 0 HG23 ILE A 147 -11.235 18.675 -4.574 1.00 0.00 H new ATOM 0 HD11 ILE A 147 -8.530 17.304 -8.088 1.00 0.00 H new ATOM 0 HD12 ILE A 147 -7.597 18.653 -7.398 1.00 0.00 H new ATOM 0 HD13 ILE A 147 -8.071 17.281 -6.369 1.00 0.00 H new ATOM 186 N SER A 148 -9.765 22.913 -7.104 1.00 0.00 N ATOM 187 CA SER A 148 -9.082 23.745 -8.088 1.00 0.00 C ATOM 188 C SER A 148 -7.985 24.579 -7.435 1.00 0.00 C ATOM 189 O SER A 148 -7.635 25.653 -7.923 1.00 0.00 O ATOM 190 CB SER A 148 -10.084 24.660 -8.793 1.00 0.00 C ATOM 191 OG SER A 148 -11.053 23.909 -9.503 1.00 0.00 O ATOM 0 H SER A 148 -10.502 23.391 -6.585 1.00 0.00 H new ATOM 0 HA SER A 148 -8.619 23.087 -8.823 1.00 0.00 H new ATOM 0 HB2 SER A 148 -10.579 25.295 -8.059 1.00 0.00 H new ATOM 0 HB3 SER A 148 -9.556 25.320 -9.481 1.00 0.00 H new ATOM 0 HG SER A 148 -11.912 23.957 -9.034 1.00 0.00 H new ATOM 197 N GLU A 149 -7.445 24.078 -6.326 1.00 0.00 N ATOM 198 CA GLU A 149 -6.388 24.780 -5.608 1.00 0.00 C ATOM 199 C GLU A 149 -5.615 23.825 -4.704 1.00 0.00 C ATOM 200 O GLU A 149 -5.090 24.228 -3.666 1.00 0.00 O ATOM 201 CB GLU A 149 -6.978 25.922 -4.778 1.00 0.00 C ATOM 202 CG GLU A 149 -7.255 27.179 -5.586 1.00 0.00 C ATOM 203 CD GLU A 149 -7.505 28.391 -4.709 1.00 0.00 C ATOM 204 OE1 GLU A 149 -8.061 28.219 -3.603 1.00 0.00 O ATOM 205 OE2 GLU A 149 -7.144 29.511 -5.127 1.00 0.00 O ATOM 0 H GLU A 149 -7.722 23.190 -5.907 1.00 0.00 H new ATOM 0 HA GLU A 149 -5.697 25.193 -6.343 1.00 0.00 H new ATOM 0 HB2 GLU A 149 -7.906 25.584 -4.318 1.00 0.00 H new ATOM 0 HB3 GLU A 149 -6.290 26.165 -3.968 1.00 0.00 H new ATOM 0 HG2 GLU A 149 -6.408 27.379 -6.243 1.00 0.00 H new ATOM 0 HG3 GLU A 149 -8.122 27.012 -6.225 1.00 0.00 H new ATOM 212 N LEU A 150 -5.551 22.560 -5.102 1.00 0.00 N ATOM 213 CA LEU A 150 -4.842 21.548 -4.326 1.00 0.00 C ATOM 214 C LEU A 150 -3.420 21.364 -4.847 1.00 0.00 C ATOM 215 O LEU A 150 -3.117 21.711 -5.988 1.00 0.00 O ATOM 216 CB LEU A 150 -5.598 20.217 -4.369 1.00 0.00 C ATOM 217 CG LEU A 150 -6.302 19.829 -3.068 1.00 0.00 C ATOM 218 CD1 LEU A 150 -7.362 20.858 -2.708 1.00 0.00 C ATOM 219 CD2 LEU A 150 -6.918 18.443 -3.188 1.00 0.00 C ATOM 0 H LEU A 150 -5.981 22.210 -5.958 1.00 0.00 H new ATOM 0 HA LEU A 150 -4.788 21.888 -3.292 1.00 0.00 H new ATOM 0 HB2 LEU A 150 -6.340 20.264 -5.166 1.00 0.00 H new ATOM 0 HB3 LEU A 150 -4.896 19.426 -4.634 1.00 0.00 H new ATOM 0 HG LEU A 150 -5.562 19.807 -2.268 1.00 0.00 H new ATOM 0 HD11 LEU A 150 -7.853 20.566 -1.780 1.00 0.00 H new ATOM 0 HD12 LEU A 150 -6.893 21.834 -2.579 1.00 0.00 H new ATOM 0 HD13 LEU A 150 -8.101 20.914 -3.507 1.00 0.00 H new ATOM 0 HD21 LEU A 150 -7.415 18.183 -2.253 1.00 0.00 H new ATOM 0 HD22 LEU A 150 -7.646 18.437 -3.999 1.00 0.00 H new ATOM 0 HD23 LEU A 150 -6.135 17.714 -3.398 1.00 0.00 H new ATOM 231 N LYS A 151 -2.553 20.815 -4.004 1.00 0.00 N ATOM 232 CA LYS A 151 -1.162 20.583 -4.379 1.00 0.00 C ATOM 233 C LYS A 151 -0.721 19.174 -3.997 1.00 0.00 C ATOM 234 O LYS A 151 -0.468 18.890 -2.826 1.00 0.00 O ATOM 235 CB LYS A 151 -0.252 21.615 -3.710 1.00 0.00 C ATOM 236 CG LYS A 151 -0.584 21.862 -2.248 1.00 0.00 C ATOM 237 CD LYS A 151 0.563 22.551 -1.524 1.00 0.00 C ATOM 238 CE LYS A 151 0.061 23.658 -0.611 1.00 0.00 C ATOM 239 NZ LYS A 151 1.086 24.720 -0.410 1.00 0.00 N ATOM 0 H LYS A 151 -2.788 20.522 -3.056 1.00 0.00 H new ATOM 0 HA LYS A 151 -1.083 20.687 -5.461 1.00 0.00 H new ATOM 0 HB2 LYS A 151 0.782 21.279 -3.787 1.00 0.00 H new ATOM 0 HB3 LYS A 151 -0.323 22.557 -4.254 1.00 0.00 H new ATOM 0 HG2 LYS A 151 -1.482 22.476 -2.176 1.00 0.00 H new ATOM 0 HG3 LYS A 151 -0.807 20.914 -1.759 1.00 0.00 H new ATOM 0 HD2 LYS A 151 1.117 21.818 -0.938 1.00 0.00 H new ATOM 0 HD3 LYS A 151 1.258 22.967 -2.254 1.00 0.00 H new ATOM 0 HE2 LYS A 151 -0.840 24.099 -1.037 1.00 0.00 H new ATOM 0 HE3 LYS A 151 -0.217 23.234 0.354 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 0.705 25.456 0.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 1.937 24.304 0.020 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 1.333 25.142 -1.328 1.00 0.00 H new ATOM 253 N GLY A 152 -0.633 18.297 -4.991 1.00 0.00 N ATOM 254 CA GLY A 152 -0.224 16.929 -4.736 1.00 0.00 C ATOM 255 C GLY A 152 -0.481 16.016 -5.920 1.00 0.00 C ATOM 256 O GLY A 152 -0.484 16.463 -7.067 1.00 0.00 O ATOM 0 H GLY A 152 -0.837 18.509 -5.968 1.00 0.00 H new ATOM 0 HA2 GLY A 152 0.838 16.910 -4.491 1.00 0.00 H new ATOM 0 HA3 GLY A 152 -0.759 16.549 -3.866 1.00 0.00 H new ATOM 260 N TYR A 153 -0.699 14.735 -5.642 1.00 0.00 N ATOM 261 CA TYR A 153 -0.958 13.758 -6.693 1.00 0.00 C ATOM 262 C TYR A 153 -2.447 13.696 -7.021 1.00 0.00 C ATOM 263 O TYR A 153 -2.830 13.429 -8.160 1.00 0.00 O ATOM 264 CB TYR A 153 -0.458 12.376 -6.270 1.00 0.00 C ATOM 265 CG TYR A 153 -0.907 11.966 -4.885 1.00 0.00 C ATOM 266 CD1 TYR A 153 -2.219 11.576 -4.646 1.00 0.00 C ATOM 267 CD2 TYR A 153 -0.018 11.968 -3.817 1.00 0.00 C ATOM 268 CE1 TYR A 153 -2.632 11.201 -3.382 1.00 0.00 C ATOM 269 CE2 TYR A 153 -0.424 11.592 -2.550 1.00 0.00 C ATOM 270 CZ TYR A 153 -1.732 11.211 -2.339 1.00 0.00 C ATOM 271 OH TYR A 153 -2.139 10.838 -1.078 1.00 0.00 O ATOM 0 H TYR A 153 -0.701 14.349 -4.698 1.00 0.00 H new ATOM 0 HA TYR A 153 -0.419 14.071 -7.587 1.00 0.00 H new ATOM 0 HB2 TYR A 153 -0.808 11.636 -6.990 1.00 0.00 H new ATOM 0 HB3 TYR A 153 0.631 12.366 -6.307 1.00 0.00 H new ATOM 0 HD1 TYR A 153 -2.927 11.566 -5.461 1.00 0.00 H new ATOM 0 HD2 TYR A 153 1.007 12.268 -3.979 1.00 0.00 H new ATOM 0 HE1 TYR A 153 -3.656 10.901 -3.212 1.00 0.00 H new ATOM 0 HE2 TYR A 153 0.279 11.597 -1.730 1.00 0.00 H new ATOM 0 HH TYR A 153 -1.382 10.900 -0.458 1.00 0.00 H new ATOM 281 N HIS A 154 -3.281 13.946 -6.017 1.00 0.00 N ATOM 282 CA HIS A 154 -4.729 13.920 -6.201 1.00 0.00 C ATOM 283 C HIS A 154 -5.200 15.095 -7.058 1.00 0.00 C ATOM 284 O HIS A 154 -6.349 15.127 -7.501 1.00 0.00 O ATOM 285 CB HIS A 154 -5.444 13.946 -4.848 1.00 0.00 C ATOM 286 CG HIS A 154 -4.878 14.943 -3.885 1.00 0.00 C ATOM 287 ND1 HIS A 154 -4.571 14.631 -2.578 1.00 0.00 N ATOM 288 CD2 HIS A 154 -4.569 16.252 -4.040 1.00 0.00 C ATOM 289 CE1 HIS A 154 -4.097 15.705 -1.970 1.00 0.00 C ATOM 290 NE2 HIS A 154 -4.086 16.701 -2.836 1.00 0.00 N ATOM 0 H HIS A 154 -2.980 14.169 -5.068 1.00 0.00 H new ATOM 0 HA HIS A 154 -4.979 12.994 -6.719 1.00 0.00 H new ATOM 0 HB2 HIS A 154 -6.499 14.169 -5.009 1.00 0.00 H new ATOM 0 HB3 HIS A 154 -5.392 12.953 -4.401 1.00 0.00 H new ATOM 0 HD2 HIS A 154 -4.682 16.834 -4.943 1.00 0.00 H new ATOM 0 HE1 HIS A 154 -3.774 15.758 -0.941 1.00 0.00 H new ATOM 0 HE2 HIS A 154 -3.770 17.651 -2.642 1.00 0.00 H new ATOM 298 N LYS A 155 -4.311 16.058 -7.290 1.00 0.00 N ATOM 299 CA LYS A 155 -4.645 17.227 -8.094 1.00 0.00 C ATOM 300 C LYS A 155 -4.718 16.868 -9.573 1.00 0.00 C ATOM 301 O LYS A 155 -5.637 17.280 -10.280 1.00 0.00 O ATOM 302 CB LYS A 155 -3.611 18.334 -7.876 1.00 0.00 C ATOM 303 CG LYS A 155 -4.154 19.732 -8.121 1.00 0.00 C ATOM 304 CD LYS A 155 -3.199 20.564 -8.963 1.00 0.00 C ATOM 305 CE LYS A 155 -3.922 21.695 -9.675 1.00 0.00 C ATOM 306 NZ LYS A 155 -3.496 21.820 -11.096 1.00 0.00 N ATOM 0 H LYS A 155 -3.356 16.050 -6.932 1.00 0.00 H new ATOM 0 HA LYS A 155 -5.624 17.586 -7.778 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -3.236 18.273 -6.854 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -2.762 18.162 -8.538 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -5.119 19.665 -8.623 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -4.325 20.229 -7.166 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -2.416 20.976 -8.326 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -2.709 19.925 -9.698 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -4.997 21.522 -9.632 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -3.729 22.633 -9.155 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -4.013 22.603 -11.546 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -2.474 22.011 -11.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -3.703 20.934 -11.600 1.00 0.00 H new ATOM 320 N ARG A 156 -3.738 16.097 -10.038 1.00 0.00 N ATOM 321 CA ARG A 156 -3.686 15.681 -11.436 1.00 0.00 C ATOM 322 C ARG A 156 -4.420 14.358 -11.653 1.00 0.00 C ATOM 323 O ARG A 156 -4.051 13.573 -12.525 1.00 0.00 O ATOM 324 CB ARG A 156 -2.232 15.550 -11.892 1.00 0.00 C ATOM 325 CG ARG A 156 -2.006 15.985 -13.331 1.00 0.00 C ATOM 326 CD ARG A 156 -1.753 14.794 -14.243 1.00 0.00 C ATOM 327 NE ARG A 156 -0.333 14.462 -14.328 1.00 0.00 N ATOM 328 CZ ARG A 156 0.574 15.232 -14.923 1.00 0.00 C ATOM 329 NH1 ARG A 156 0.216 16.379 -15.486 1.00 0.00 N ATOM 330 NH2 ARG A 156 1.846 14.855 -14.954 1.00 0.00 N ATOM 0 H ARG A 156 -2.969 15.748 -9.466 1.00 0.00 H new ATOM 0 HA ARG A 156 -4.185 16.446 -12.031 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -1.599 16.148 -11.236 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -1.917 14.513 -11.781 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -2.876 16.537 -13.686 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -1.156 16.666 -13.377 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -2.306 13.930 -13.873 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -2.134 15.013 -15.240 1.00 0.00 H new ATOM 0 HE ARG A 156 -0.018 13.588 -13.906 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -0.760 16.675 -15.464 1.00 0.00 H new ATOM 0 HH12 ARG A 156 0.917 16.965 -15.941 1.00 0.00 H new ATOM 0 HH21 ARG A 156 2.128 13.975 -14.522 1.00 0.00 H new ATOM 0 HH22 ARG A 156 2.542 15.445 -15.410 1.00 0.00 H new ATOM 344 N HIS A 157 -5.459 14.114 -10.858 1.00 0.00 N ATOM 345 CA HIS A 157 -6.234 12.882 -10.976 1.00 0.00 C ATOM 346 C HIS A 157 -7.725 13.140 -10.762 1.00 0.00 C ATOM 347 O HIS A 157 -8.498 12.208 -10.544 1.00 0.00 O ATOM 348 CB HIS A 157 -5.736 11.847 -9.967 1.00 0.00 C ATOM 349 CG HIS A 157 -4.628 10.987 -10.488 1.00 0.00 C ATOM 350 ND1 HIS A 157 -4.824 9.987 -11.418 1.00 0.00 N ATOM 351 CD2 HIS A 157 -3.303 10.981 -10.206 1.00 0.00 C ATOM 352 CE1 HIS A 157 -3.669 9.403 -11.684 1.00 0.00 C ATOM 353 NE2 HIS A 157 -2.731 9.988 -10.963 1.00 0.00 N ATOM 0 H HIS A 157 -5.782 14.750 -10.129 1.00 0.00 H new ATOM 0 HA HIS A 157 -6.097 12.497 -11.987 1.00 0.00 H new ATOM 0 HB2 HIS A 157 -5.393 12.362 -9.070 1.00 0.00 H new ATOM 0 HB3 HIS A 157 -6.570 11.211 -9.670 1.00 0.00 H new ATOM 0 HD2 HIS A 157 -2.792 11.635 -9.515 1.00 0.00 H new ATOM 0 HE1 HIS A 157 -3.518 8.586 -12.374 1.00 0.00 H new ATOM 0 HE2 HIS A 157 -1.741 9.742 -10.967 1.00 0.00 H new ATOM 361 N ARG A 158 -8.128 14.410 -10.830 1.00 0.00 N ATOM 362 CA ARG A 158 -9.528 14.783 -10.647 1.00 0.00 C ATOM 363 C ARG A 158 -10.115 14.137 -9.394 1.00 0.00 C ATOM 364 O ARG A 158 -11.161 13.486 -9.448 1.00 0.00 O ATOM 365 CB ARG A 158 -10.346 14.384 -11.877 1.00 0.00 C ATOM 366 CG ARG A 158 -10.050 15.233 -13.101 1.00 0.00 C ATOM 367 CD ARG A 158 -11.306 15.494 -13.918 1.00 0.00 C ATOM 368 NE ARG A 158 -11.785 14.286 -14.587 1.00 0.00 N ATOM 369 CZ ARG A 158 -12.818 14.265 -15.427 1.00 0.00 C ATOM 370 NH1 ARG A 158 -13.481 15.382 -15.704 1.00 0.00 N ATOM 371 NH2 ARG A 158 -13.188 13.126 -15.995 1.00 0.00 N ATOM 0 H ARG A 158 -7.503 15.196 -11.010 1.00 0.00 H new ATOM 0 HA ARG A 158 -9.574 15.865 -10.522 1.00 0.00 H new ATOM 0 HB2 ARG A 158 -10.147 13.339 -12.113 1.00 0.00 H new ATOM 0 HB3 ARG A 158 -11.407 14.461 -11.639 1.00 0.00 H new ATOM 0 HG2 ARG A 158 -9.614 16.182 -12.789 1.00 0.00 H new ATOM 0 HG3 ARG A 158 -9.309 14.731 -13.722 1.00 0.00 H new ATOM 0 HD2 ARG A 158 -12.089 15.882 -13.266 1.00 0.00 H new ATOM 0 HD3 ARG A 158 -11.101 16.264 -14.662 1.00 0.00 H new ATOM 0 HE ARG A 158 -11.300 13.408 -14.400 1.00 0.00 H new ATOM 0 HH11 ARG A 158 -13.200 16.262 -15.272 1.00 0.00 H new ATOM 0 HH12 ARG A 158 -14.271 15.359 -16.348 1.00 0.00 H new ATOM 0 HH21 ARG A 158 -12.681 12.265 -15.789 1.00 0.00 H new ATOM 0 HH22 ARG A 158 -13.979 13.110 -16.638 1.00 0.00 H new ATOM 385 N VAL A 159 -9.434 14.322 -8.267 1.00 0.00 N ATOM 386 CA VAL A 159 -9.882 13.763 -6.998 1.00 0.00 C ATOM 387 C VAL A 159 -9.410 14.623 -5.828 1.00 0.00 C ATOM 388 O VAL A 159 -8.317 15.187 -5.862 1.00 0.00 O ATOM 389 CB VAL A 159 -9.370 12.321 -6.809 1.00 0.00 C ATOM 390 CG1 VAL A 159 -7.849 12.282 -6.845 1.00 0.00 C ATOM 391 CG2 VAL A 159 -9.897 11.727 -5.509 1.00 0.00 C ATOM 0 H VAL A 159 -8.567 14.857 -8.208 1.00 0.00 H new ATOM 0 HA VAL A 159 -10.972 13.750 -7.019 1.00 0.00 H new ATOM 0 HB VAL A 159 -9.745 11.715 -7.634 1.00 0.00 H new ATOM 0 HG11 VAL A 159 -7.508 11.256 -6.710 1.00 0.00 H new ATOM 0 HG12 VAL A 159 -7.498 12.657 -7.806 1.00 0.00 H new ATOM 0 HG13 VAL A 159 -7.450 12.905 -6.045 1.00 0.00 H new ATOM 0 HG21 VAL A 159 -9.523 10.709 -5.396 1.00 0.00 H new ATOM 0 HG22 VAL A 159 -9.559 12.333 -4.669 1.00 0.00 H new ATOM 0 HG23 VAL A 159 -10.987 11.713 -5.531 1.00 0.00 H new ATOM 401 N CYS A 160 -10.244 14.726 -4.798 1.00 0.00 N ATOM 402 CA CYS A 160 -9.910 15.522 -3.623 1.00 0.00 C ATOM 403 C CYS A 160 -9.083 14.715 -2.625 1.00 0.00 C ATOM 404 O CYS A 160 -8.969 13.494 -2.740 1.00 0.00 O ATOM 405 CB CYS A 160 -11.187 16.051 -2.957 1.00 0.00 C ATOM 406 SG CYS A 160 -12.127 14.808 -2.038 1.00 0.00 S ATOM 0 H CYS A 160 -11.155 14.269 -4.753 1.00 0.00 H new ATOM 0 HA CYS A 160 -9.307 16.369 -3.950 1.00 0.00 H new ATOM 0 HB2 CYS A 160 -10.918 16.860 -2.278 1.00 0.00 H new ATOM 0 HB3 CYS A 160 -11.831 16.480 -3.725 1.00 0.00 H new ATOM 0 HG CYS A 160 -12.751 15.378 -1.050 1.00 0.00 H new ATOM 411 N LEU A 161 -8.505 15.407 -1.647 1.00 0.00 N ATOM 412 CA LEU A 161 -7.685 14.759 -0.630 1.00 0.00 C ATOM 413 C LEU A 161 -8.517 13.806 0.223 1.00 0.00 C ATOM 414 O LEU A 161 -8.038 12.750 0.638 1.00 0.00 O ATOM 415 CB LEU A 161 -7.023 15.810 0.264 1.00 0.00 C ATOM 416 CG LEU A 161 -6.056 15.253 1.311 1.00 0.00 C ATOM 417 CD1 LEU A 161 -4.911 16.226 1.550 1.00 0.00 C ATOM 418 CD2 LEU A 161 -6.790 14.960 2.611 1.00 0.00 C ATOM 0 H LEU A 161 -8.590 16.418 -1.538 1.00 0.00 H new ATOM 0 HA LEU A 161 -6.914 14.181 -1.139 1.00 0.00 H new ATOM 0 HB2 LEU A 161 -6.483 16.515 -0.368 1.00 0.00 H new ATOM 0 HB3 LEU A 161 -7.803 16.373 0.776 1.00 0.00 H new ATOM 0 HG LEU A 161 -5.639 14.319 0.934 1.00 0.00 H new ATOM 0 HD11 LEU A 161 -4.233 15.814 2.297 1.00 0.00 H new ATOM 0 HD12 LEU A 161 -4.369 16.386 0.618 1.00 0.00 H new ATOM 0 HD13 LEU A 161 -5.309 17.176 1.906 1.00 0.00 H new ATOM 0 HD21 LEU A 161 -6.087 14.565 3.344 1.00 0.00 H new ATOM 0 HD22 LEU A 161 -7.234 15.879 2.993 1.00 0.00 H new ATOM 0 HD23 LEU A 161 -7.575 14.226 2.428 1.00 0.00 H new ATOM 430 N ARG A 162 -9.763 14.186 0.484 1.00 0.00 N ATOM 431 CA ARG A 162 -10.662 13.367 1.292 1.00 0.00 C ATOM 432 C ARG A 162 -10.837 11.978 0.686 1.00 0.00 C ATOM 433 O ARG A 162 -10.985 10.991 1.407 1.00 0.00 O ATOM 434 CB ARG A 162 -12.022 14.051 1.429 1.00 0.00 C ATOM 435 CG ARG A 162 -12.846 13.536 2.598 1.00 0.00 C ATOM 436 CD ARG A 162 -14.265 14.077 2.562 1.00 0.00 C ATOM 437 NE ARG A 162 -14.295 15.536 2.629 1.00 0.00 N ATOM 438 CZ ARG A 162 -15.396 16.244 2.874 1.00 0.00 C ATOM 439 NH1 ARG A 162 -16.556 15.631 3.077 1.00 0.00 N ATOM 440 NH2 ARG A 162 -15.336 17.568 2.917 1.00 0.00 N ATOM 0 H ARG A 162 -10.175 15.057 0.148 1.00 0.00 H new ATOM 0 HA ARG A 162 -10.216 13.255 2.280 1.00 0.00 H new ATOM 0 HB2 ARG A 162 -11.870 15.124 1.547 1.00 0.00 H new ATOM 0 HB3 ARG A 162 -12.586 13.909 0.507 1.00 0.00 H new ATOM 0 HG2 ARG A 162 -12.870 12.447 2.575 1.00 0.00 H new ATOM 0 HG3 ARG A 162 -12.370 13.824 3.535 1.00 0.00 H new ATOM 0 HD2 ARG A 162 -14.756 13.746 1.647 1.00 0.00 H new ATOM 0 HD3 ARG A 162 -14.832 13.664 3.396 1.00 0.00 H new ATOM 0 HE ARG A 162 -13.422 16.042 2.479 1.00 0.00 H new ATOM 0 HH11 ARG A 162 -16.607 14.613 3.046 1.00 0.00 H new ATOM 0 HH12 ARG A 162 -17.396 16.178 3.264 1.00 0.00 H new ATOM 0 HH21 ARG A 162 -14.447 18.044 2.762 1.00 0.00 H new ATOM 0 HH22 ARG A 162 -16.179 18.111 3.105 1.00 0.00 H new ATOM 454 N CYS A 163 -10.824 11.908 -0.640 1.00 0.00 N ATOM 455 CA CYS A 163 -10.985 10.638 -1.340 1.00 0.00 C ATOM 456 C CYS A 163 -9.670 9.867 -1.380 1.00 0.00 C ATOM 457 O CYS A 163 -9.660 8.636 -1.413 1.00 0.00 O ATOM 458 CB CYS A 163 -11.496 10.874 -2.762 1.00 0.00 C ATOM 459 SG CYS A 163 -13.283 11.120 -2.873 1.00 0.00 S ATOM 0 H CYS A 163 -10.704 12.715 -1.252 1.00 0.00 H new ATOM 0 HA CYS A 163 -11.717 10.043 -0.794 1.00 0.00 H new ATOM 0 HB2 CYS A 163 -10.993 11.748 -3.177 1.00 0.00 H new ATOM 0 HB3 CYS A 163 -11.218 10.022 -3.382 1.00 0.00 H new ATOM 0 HG CYS A 163 -13.545 11.986 -3.807 1.00 0.00 H new ATOM 464 N ALA A 164 -8.559 10.597 -1.379 1.00 0.00 N ATOM 465 CA ALA A 164 -7.238 9.980 -1.417 1.00 0.00 C ATOM 466 C ALA A 164 -6.931 9.257 -0.111 1.00 0.00 C ATOM 467 O ALA A 164 -6.208 8.260 -0.096 1.00 0.00 O ATOM 468 CB ALA A 164 -6.175 11.031 -1.705 1.00 0.00 C ATOM 0 H ALA A 164 -8.547 11.617 -1.352 1.00 0.00 H new ATOM 0 HA ALA A 164 -7.231 9.242 -2.219 1.00 0.00 H new ATOM 0 HB1 ALA A 164 -5.193 10.558 -1.731 1.00 0.00 H new ATOM 0 HB2 ALA A 164 -6.378 11.499 -2.668 1.00 0.00 H new ATOM 0 HB3 ALA A 164 -6.192 11.789 -0.922 1.00 0.00 H new ATOM 474 N THR A 165 -7.483 9.765 0.987 1.00 0.00 N ATOM 475 CA THR A 165 -7.265 9.166 2.299 1.00 0.00 C ATOM 476 C THR A 165 -8.411 8.233 2.675 1.00 0.00 C ATOM 477 O THR A 165 -8.220 7.260 3.405 1.00 0.00 O ATOM 478 CB THR A 165 -7.115 10.241 3.390 1.00 0.00 C ATOM 479 OG1 THR A 165 -8.139 11.233 3.246 1.00 0.00 O ATOM 480 CG2 THR A 165 -5.747 10.901 3.316 1.00 0.00 C ATOM 0 H THR A 165 -8.084 10.589 0.994 1.00 0.00 H new ATOM 0 HA THR A 165 -6.340 8.593 2.234 1.00 0.00 H new ATOM 0 HB THR A 165 -7.214 9.757 4.361 1.00 0.00 H new ATOM 0 HG1 THR A 165 -7.958 11.777 2.451 1.00 0.00 H new ATOM 0 HG21 THR A 165 -5.665 11.657 4.097 1.00 0.00 H new ATOM 0 HG22 THR A 165 -4.972 10.148 3.457 1.00 0.00 H new ATOM 0 HG23 THR A 165 -5.622 11.372 2.341 1.00 0.00 H new ATOM 488 N ALA A 166 -9.605 8.536 2.172 1.00 0.00 N ATOM 489 CA ALA A 166 -10.783 7.726 2.457 1.00 0.00 C ATOM 490 C ALA A 166 -10.576 6.281 2.014 1.00 0.00 C ATOM 491 O ALA A 166 -9.910 6.018 1.013 1.00 0.00 O ATOM 492 CB ALA A 166 -12.007 8.319 1.778 1.00 0.00 C ATOM 0 H ALA A 166 -9.781 9.337 1.565 1.00 0.00 H new ATOM 0 HA ALA A 166 -10.943 7.728 3.535 1.00 0.00 H new ATOM 0 HB1 ALA A 166 -12.879 7.704 1.999 1.00 0.00 H new ATOM 0 HB2 ALA A 166 -12.173 9.331 2.147 1.00 0.00 H new ATOM 0 HB3 ALA A 166 -11.847 8.348 0.700 1.00 0.00 H new ATOM 498 N SER A 167 -11.152 5.349 2.766 1.00 0.00 N ATOM 499 CA SER A 167 -11.031 3.930 2.451 1.00 0.00 C ATOM 500 C SER A 167 -11.649 3.621 1.092 1.00 0.00 C ATOM 501 O SER A 167 -11.046 2.933 0.266 1.00 0.00 O ATOM 502 CB SER A 167 -11.705 3.087 3.534 1.00 0.00 C ATOM 503 OG SER A 167 -12.983 3.604 3.861 1.00 0.00 O ATOM 0 H SER A 167 -11.707 5.551 3.598 1.00 0.00 H new ATOM 0 HA SER A 167 -9.971 3.680 2.413 1.00 0.00 H new ATOM 0 HB2 SER A 167 -11.803 2.058 3.189 1.00 0.00 H new ATOM 0 HB3 SER A 167 -11.079 3.066 4.426 1.00 0.00 H new ATOM 0 HG SER A 167 -13.668 3.141 3.334 1.00 0.00 H new ATOM 509 N PHE A 168 -12.853 4.134 0.864 1.00 0.00 N ATOM 510 CA PHE A 168 -13.553 3.913 -0.397 1.00 0.00 C ATOM 511 C PHE A 168 -14.630 4.970 -0.614 1.00 0.00 C ATOM 512 O PHE A 168 -14.944 5.747 0.289 1.00 0.00 O ATOM 513 CB PHE A 168 -14.178 2.518 -0.419 1.00 0.00 C ATOM 514 CG PHE A 168 -15.225 2.312 0.638 1.00 0.00 C ATOM 515 CD1 PHE A 168 -16.539 2.689 0.412 1.00 0.00 C ATOM 516 CD2 PHE A 168 -14.896 1.741 1.856 1.00 0.00 C ATOM 517 CE1 PHE A 168 -17.505 2.502 1.383 1.00 0.00 C ATOM 518 CE2 PHE A 168 -15.856 1.550 2.831 1.00 0.00 C ATOM 519 CZ PHE A 168 -17.164 1.930 2.593 1.00 0.00 C ATOM 0 H PHE A 168 -13.365 4.706 1.536 1.00 0.00 H new ATOM 0 HA PHE A 168 -12.826 3.990 -1.206 1.00 0.00 H new ATOM 0 HB2 PHE A 168 -14.623 2.344 -1.399 1.00 0.00 H new ATOM 0 HB3 PHE A 168 -13.392 1.774 -0.290 1.00 0.00 H new ATOM 0 HD1 PHE A 168 -16.812 3.134 -0.534 1.00 0.00 H new ATOM 0 HD2 PHE A 168 -13.876 1.441 2.046 1.00 0.00 H new ATOM 0 HE1 PHE A 168 -18.525 2.803 1.196 1.00 0.00 H new ATOM 0 HE2 PHE A 168 -15.585 1.105 3.777 1.00 0.00 H new ATOM 0 HZ PHE A 168 -17.918 1.780 3.352 1.00 0.00 H new ATOM 529 N VAL A 169 -15.195 4.995 -1.818 1.00 0.00 N ATOM 530 CA VAL A 169 -16.238 5.957 -2.152 1.00 0.00 C ATOM 531 C VAL A 169 -17.351 5.301 -2.961 1.00 0.00 C ATOM 532 O VAL A 169 -17.123 4.321 -3.670 1.00 0.00 O ATOM 533 CB VAL A 169 -15.671 7.145 -2.951 1.00 0.00 C ATOM 534 CG1 VAL A 169 -14.696 7.944 -2.101 1.00 0.00 C ATOM 535 CG2 VAL A 169 -15.004 6.661 -4.229 1.00 0.00 C ATOM 0 H VAL A 169 -14.948 4.360 -2.577 1.00 0.00 H new ATOM 0 HA VAL A 169 -16.644 6.323 -1.209 1.00 0.00 H new ATOM 0 HB VAL A 169 -16.497 7.800 -3.227 1.00 0.00 H new ATOM 0 HG11 VAL A 169 -14.306 8.779 -2.683 1.00 0.00 H new ATOM 0 HG12 VAL A 169 -15.210 8.325 -1.219 1.00 0.00 H new ATOM 0 HG13 VAL A 169 -13.872 7.301 -1.791 1.00 0.00 H new ATOM 0 HG21 VAL A 169 -14.610 7.515 -4.780 1.00 0.00 H new ATOM 0 HG22 VAL A 169 -14.188 5.982 -3.979 1.00 0.00 H new ATOM 0 HG23 VAL A 169 -15.735 6.138 -4.845 1.00 0.00 H new ATOM 545 N VAL A 170 -18.556 5.848 -2.850 1.00 0.00 N ATOM 546 CA VAL A 170 -19.707 5.317 -3.573 1.00 0.00 C ATOM 547 C VAL A 170 -19.855 5.986 -4.935 1.00 0.00 C ATOM 548 O VAL A 170 -20.719 6.841 -5.128 1.00 0.00 O ATOM 549 CB VAL A 170 -21.010 5.507 -2.773 1.00 0.00 C ATOM 550 CG1 VAL A 170 -22.162 4.779 -3.447 1.00 0.00 C ATOM 551 CG2 VAL A 170 -20.831 5.027 -1.340 1.00 0.00 C ATOM 0 H VAL A 170 -18.762 6.659 -2.267 1.00 0.00 H new ATOM 0 HA VAL A 170 -19.530 4.251 -3.713 1.00 0.00 H new ATOM 0 HB VAL A 170 -21.248 6.570 -2.749 1.00 0.00 H new ATOM 0 HG11 VAL A 170 -23.073 4.925 -2.867 1.00 0.00 H new ATOM 0 HG12 VAL A 170 -22.304 5.175 -4.453 1.00 0.00 H new ATOM 0 HG13 VAL A 170 -21.935 3.714 -3.505 1.00 0.00 H new ATOM 0 HG21 VAL A 170 -21.761 5.169 -0.790 1.00 0.00 H new ATOM 0 HG22 VAL A 170 -20.568 3.969 -1.341 1.00 0.00 H new ATOM 0 HG23 VAL A 170 -20.036 5.599 -0.861 1.00 0.00 H new ATOM 561 N LEU A 171 -19.005 5.592 -5.877 1.00 0.00 N ATOM 562 CA LEU A 171 -19.042 6.153 -7.223 1.00 0.00 C ATOM 563 C LEU A 171 -20.398 5.907 -7.877 1.00 0.00 C ATOM 564 O LEU A 171 -21.336 5.447 -7.227 1.00 0.00 O ATOM 565 CB LEU A 171 -17.927 5.548 -8.080 1.00 0.00 C ATOM 566 CG LEU A 171 -17.284 6.515 -9.080 1.00 0.00 C ATOM 567 CD1 LEU A 171 -15.936 6.998 -8.566 1.00 0.00 C ATOM 568 CD2 LEU A 171 -17.130 5.854 -10.442 1.00 0.00 C ATOM 0 H LEU A 171 -18.282 4.887 -5.734 1.00 0.00 H new ATOM 0 HA LEU A 171 -18.887 7.229 -7.148 1.00 0.00 H new ATOM 0 HB2 LEU A 171 -17.150 5.162 -7.420 1.00 0.00 H new ATOM 0 HB3 LEU A 171 -18.331 4.697 -8.628 1.00 0.00 H new ATOM 0 HG LEU A 171 -17.940 7.379 -9.190 1.00 0.00 H new ATOM 0 HD11 LEU A 171 -15.495 7.684 -9.290 1.00 0.00 H new ATOM 0 HD12 LEU A 171 -16.072 7.513 -7.615 1.00 0.00 H new ATOM 0 HD13 LEU A 171 -15.273 6.144 -8.425 1.00 0.00 H new ATOM 0 HD21 LEU A 171 -16.672 6.557 -11.138 1.00 0.00 H new ATOM 0 HD22 LEU A 171 -16.497 4.971 -10.349 1.00 0.00 H new ATOM 0 HD23 LEU A 171 -18.110 5.560 -10.817 1.00 0.00 H new ATOM 580 N ASP A 172 -20.497 6.223 -9.166 1.00 0.00 N ATOM 581 CA ASP A 172 -21.741 6.042 -9.907 1.00 0.00 C ATOM 582 C ASP A 172 -22.232 4.598 -9.816 1.00 0.00 C ATOM 583 O ASP A 172 -21.889 3.762 -10.651 1.00 0.00 O ATOM 584 CB ASP A 172 -21.547 6.434 -11.372 1.00 0.00 C ATOM 585 CG ASP A 172 -22.771 7.110 -11.957 1.00 0.00 C ATOM 586 OD1 ASP A 172 -23.043 8.271 -11.582 1.00 0.00 O ATOM 587 OD2 ASP A 172 -23.457 6.482 -12.790 1.00 0.00 O ATOM 0 H ASP A 172 -19.730 6.606 -9.719 1.00 0.00 H new ATOM 0 HA ASP A 172 -22.495 6.689 -9.459 1.00 0.00 H new ATOM 0 HB2 ASP A 172 -20.691 7.103 -11.456 1.00 0.00 H new ATOM 0 HB3 ASP A 172 -21.314 5.543 -11.956 1.00 0.00 H new ATOM 592 N GLY A 173 -23.042 4.317 -8.801 1.00 0.00 N ATOM 593 CA GLY A 173 -23.574 2.979 -8.618 1.00 0.00 C ATOM 594 C GLY A 173 -22.491 1.917 -8.580 1.00 0.00 C ATOM 595 O GLY A 173 -22.727 0.767 -8.954 1.00 0.00 O ATOM 0 H GLY A 173 -23.341 4.995 -8.099 1.00 0.00 H new ATOM 0 HA2 GLY A 173 -24.144 2.943 -7.690 1.00 0.00 H new ATOM 0 HA3 GLY A 173 -24.268 2.755 -9.428 1.00 0.00 H new ATOM 599 N GLU A 174 -21.301 2.300 -8.129 1.00 0.00 N ATOM 600 CA GLU A 174 -20.181 1.370 -8.047 1.00 0.00 C ATOM 601 C GLU A 174 -19.120 1.879 -7.078 1.00 0.00 C ATOM 602 O GLU A 174 -18.609 2.989 -7.225 1.00 0.00 O ATOM 603 CB GLU A 174 -19.566 1.157 -9.431 1.00 0.00 C ATOM 604 CG GLU A 174 -20.407 0.281 -10.343 1.00 0.00 C ATOM 605 CD GLU A 174 -19.573 -0.480 -11.354 1.00 0.00 C ATOM 606 OE1 GLU A 174 -18.507 0.035 -11.753 1.00 0.00 O ATOM 607 OE2 GLU A 174 -19.984 -1.592 -11.747 1.00 0.00 O ATOM 0 H GLU A 174 -21.088 3.247 -7.815 1.00 0.00 H new ATOM 0 HA GLU A 174 -20.559 0.418 -7.675 1.00 0.00 H new ATOM 0 HB2 GLU A 174 -19.419 2.127 -9.907 1.00 0.00 H new ATOM 0 HB3 GLU A 174 -18.580 0.706 -9.316 1.00 0.00 H new ATOM 0 HG2 GLU A 174 -20.974 -0.427 -9.739 1.00 0.00 H new ATOM 0 HG3 GLU A 174 -21.132 0.902 -10.870 1.00 0.00 H new ATOM 614 N ASN A 175 -18.788 1.056 -6.087 1.00 0.00 N ATOM 615 CA ASN A 175 -17.782 1.421 -5.095 1.00 0.00 C ATOM 616 C ASN A 175 -16.378 1.277 -5.671 1.00 0.00 C ATOM 617 O ASN A 175 -15.965 0.183 -6.058 1.00 0.00 O ATOM 618 CB ASN A 175 -17.929 0.549 -3.846 1.00 0.00 C ATOM 619 CG ASN A 175 -18.800 1.195 -2.788 1.00 0.00 C ATOM 620 OD1 ASN A 175 -18.831 2.418 -2.654 1.00 0.00 O ATOM 621 ND2 ASN A 175 -19.515 0.373 -2.027 1.00 0.00 N ATOM 0 H ASN A 175 -19.200 0.133 -5.950 1.00 0.00 H new ATOM 0 HA ASN A 175 -17.937 2.464 -4.819 1.00 0.00 H new ATOM 0 HB2 ASN A 175 -18.357 -0.413 -4.127 1.00 0.00 H new ATOM 0 HB3 ASN A 175 -16.942 0.349 -3.428 1.00 0.00 H new ATOM 0 HD21 ASN A 175 -20.120 0.750 -1.297 1.00 0.00 H new ATOM 0 HD22 ASN A 175 -19.459 -0.635 -2.173 1.00 0.00 H new ATOM 628 N LYS A 176 -15.647 2.386 -5.727 1.00 0.00 N ATOM 629 CA LYS A 176 -14.289 2.380 -6.259 1.00 0.00 C ATOM 630 C LYS A 176 -13.276 2.739 -5.178 1.00 0.00 C ATOM 631 O LYS A 176 -13.599 3.432 -4.214 1.00 0.00 O ATOM 632 CB LYS A 176 -14.174 3.359 -7.428 1.00 0.00 C ATOM 633 CG LYS A 176 -15.324 3.267 -8.417 1.00 0.00 C ATOM 634 CD LYS A 176 -15.246 1.994 -9.244 1.00 0.00 C ATOM 635 CE LYS A 176 -14.400 2.190 -10.493 1.00 0.00 C ATOM 636 NZ LYS A 176 -15.236 2.415 -11.703 1.00 0.00 N ATOM 0 H LYS A 176 -15.972 3.300 -5.411 1.00 0.00 H new ATOM 0 HA LYS A 176 -14.070 1.373 -6.613 1.00 0.00 H new ATOM 0 HB2 LYS A 176 -14.124 4.375 -7.036 1.00 0.00 H new ATOM 0 HB3 LYS A 176 -13.238 3.174 -7.955 1.00 0.00 H new ATOM 0 HG2 LYS A 176 -16.271 3.295 -7.879 1.00 0.00 H new ATOM 0 HG3 LYS A 176 -15.307 4.133 -9.078 1.00 0.00 H new ATOM 0 HD2 LYS A 176 -14.823 1.192 -8.639 1.00 0.00 H new ATOM 0 HD3 LYS A 176 -16.251 1.682 -9.529 1.00 0.00 H new ATOM 0 HE2 LYS A 176 -13.734 3.041 -10.350 1.00 0.00 H new ATOM 0 HE3 LYS A 176 -13.770 1.314 -10.645 1.00 0.00 H new ATOM 0 HZ1 LYS A 176 -14.620 2.544 -12.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 176 -15.854 1.593 -11.856 1.00 0.00 H new ATOM 0 HZ3 LYS A 176 -15.819 3.266 -11.569 1.00 0.00 H new ATOM 650 N ARG A 177 -12.046 2.261 -5.346 1.00 0.00 N ATOM 651 CA ARG A 177 -10.981 2.531 -4.387 1.00 0.00 C ATOM 652 C ARG A 177 -9.810 3.239 -5.062 1.00 0.00 C ATOM 653 O ARG A 177 -9.381 2.851 -6.148 1.00 0.00 O ATOM 654 CB ARG A 177 -10.502 1.229 -3.744 1.00 0.00 C ATOM 655 CG ARG A 177 -10.114 1.379 -2.281 1.00 0.00 C ATOM 656 CD ARG A 177 -8.696 1.905 -2.133 1.00 0.00 C ATOM 657 NE ARG A 177 -8.423 2.368 -0.773 1.00 0.00 N ATOM 658 CZ ARG A 177 -7.277 2.930 -0.397 1.00 0.00 C ATOM 659 NH1 ARG A 177 -6.294 3.100 -1.272 1.00 0.00 N ATOM 660 NH2 ARG A 177 -7.112 3.322 0.859 1.00 0.00 N ATOM 0 H ARG A 177 -11.763 1.684 -6.138 1.00 0.00 H new ATOM 0 HA ARG A 177 -11.381 3.184 -3.612 1.00 0.00 H new ATOM 0 HB2 ARG A 177 -11.290 0.481 -3.827 1.00 0.00 H new ATOM 0 HB3 ARG A 177 -9.645 0.852 -4.302 1.00 0.00 H new ATOM 0 HG2 ARG A 177 -10.809 2.058 -1.787 1.00 0.00 H new ATOM 0 HG3 ARG A 177 -10.200 0.415 -1.780 1.00 0.00 H new ATOM 0 HD2 ARG A 177 -7.988 1.119 -2.397 1.00 0.00 H new ATOM 0 HD3 ARG A 177 -8.538 2.725 -2.834 1.00 0.00 H new ATOM 0 HE ARG A 177 -9.154 2.253 -0.071 1.00 0.00 H new ATOM 0 HH11 ARG A 177 -6.414 2.799 -2.239 1.00 0.00 H new ATOM 0 HH12 ARG A 177 -5.418 3.531 -0.977 1.00 0.00 H new ATOM 0 HH21 ARG A 177 -7.863 3.193 1.537 1.00 0.00 H new ATOM 0 HH22 ARG A 177 -6.234 3.753 1.148 1.00 0.00 H new ATOM 674 N TYR A 178 -9.301 4.280 -4.411 1.00 0.00 N ATOM 675 CA TYR A 178 -8.181 5.045 -4.949 1.00 0.00 C ATOM 676 C TYR A 178 -6.913 4.197 -4.998 1.00 0.00 C ATOM 677 O TYR A 178 -6.362 3.828 -3.963 1.00 0.00 O ATOM 678 CB TYR A 178 -7.938 6.297 -4.104 1.00 0.00 C ATOM 679 CG TYR A 178 -6.807 7.162 -4.611 1.00 0.00 C ATOM 680 CD1 TYR A 178 -6.955 7.928 -5.761 1.00 0.00 C ATOM 681 CD2 TYR A 178 -5.590 7.211 -3.943 1.00 0.00 C ATOM 682 CE1 TYR A 178 -5.924 8.720 -6.228 1.00 0.00 C ATOM 683 CE2 TYR A 178 -4.554 8.001 -4.404 1.00 0.00 C ATOM 684 CZ TYR A 178 -4.725 8.752 -5.547 1.00 0.00 C ATOM 685 OH TYR A 178 -3.696 9.539 -6.009 1.00 0.00 O ATOM 0 H TYR A 178 -9.646 4.613 -3.511 1.00 0.00 H new ATOM 0 HA TYR A 178 -8.435 5.344 -5.966 1.00 0.00 H new ATOM 0 HB2 TYR A 178 -8.853 6.889 -4.077 1.00 0.00 H new ATOM 0 HB3 TYR A 178 -7.722 5.996 -3.079 1.00 0.00 H new ATOM 0 HD1 TYR A 178 -7.891 7.904 -6.298 1.00 0.00 H new ATOM 0 HD2 TYR A 178 -5.451 6.622 -3.049 1.00 0.00 H new ATOM 0 HE1 TYR A 178 -6.056 9.311 -7.122 1.00 0.00 H new ATOM 0 HE2 TYR A 178 -3.615 8.030 -3.871 1.00 0.00 H new ATOM 0 HH TYR A 178 -3.121 9.799 -5.259 1.00 0.00 H new ATOM 695 N CYS A 179 -6.456 3.898 -6.210 1.00 0.00 N ATOM 696 CA CYS A 179 -5.250 3.099 -6.396 1.00 0.00 C ATOM 697 C CYS A 179 -4.004 3.972 -6.290 1.00 0.00 C ATOM 698 O CYS A 179 -3.784 4.859 -7.111 1.00 0.00 O ATOM 699 CB CYS A 179 -5.283 2.399 -7.756 1.00 0.00 C ATOM 700 SG CYS A 179 -4.105 1.036 -7.916 1.00 0.00 S ATOM 0 H CYS A 179 -6.902 4.197 -7.077 1.00 0.00 H new ATOM 0 HA CYS A 179 -5.214 2.345 -5.609 1.00 0.00 H new ATOM 0 HB2 CYS A 179 -6.289 2.018 -7.932 1.00 0.00 H new ATOM 0 HB3 CYS A 179 -5.080 3.134 -8.535 1.00 0.00 H new ATOM 0 HG CYS A 179 -3.541 1.085 -9.086 1.00 0.00 H new ATOM 705 N GLN A 180 -3.192 3.716 -5.270 1.00 0.00 N ATOM 706 CA GLN A 180 -1.970 4.483 -5.054 1.00 0.00 C ATOM 707 C GLN A 180 -0.895 4.136 -6.085 1.00 0.00 C ATOM 708 O GLN A 180 0.162 4.766 -6.122 1.00 0.00 O ATOM 709 CB GLN A 180 -1.434 4.236 -3.643 1.00 0.00 C ATOM 710 CG GLN A 180 -2.428 4.581 -2.546 1.00 0.00 C ATOM 711 CD GLN A 180 -2.353 3.628 -1.371 1.00 0.00 C ATOM 712 OE1 GLN A 180 -1.721 2.575 -1.449 1.00 0.00 O ATOM 713 NE2 GLN A 180 -3.001 3.994 -0.270 1.00 0.00 N ATOM 0 H GLN A 180 -3.358 2.983 -4.580 1.00 0.00 H new ATOM 0 HA GLN A 180 -2.219 5.538 -5.170 1.00 0.00 H new ATOM 0 HB2 GLN A 180 -1.151 3.188 -3.549 1.00 0.00 H new ATOM 0 HB3 GLN A 180 -0.528 4.825 -3.499 1.00 0.00 H new ATOM 0 HG2 GLN A 180 -2.241 5.597 -2.198 1.00 0.00 H new ATOM 0 HG3 GLN A 180 -3.437 4.566 -2.957 1.00 0.00 H new ATOM 0 HE21 GLN A 180 -3.513 4.876 -0.249 1.00 0.00 H new ATOM 0 HE22 GLN A 180 -2.987 3.393 0.554 1.00 0.00 H new ATOM 722 N GLN A 181 -1.162 3.132 -6.917 1.00 0.00 N ATOM 723 CA GLN A 181 -0.203 2.714 -7.935 1.00 0.00 C ATOM 724 C GLN A 181 -0.533 3.324 -9.297 1.00 0.00 C ATOM 725 O GLN A 181 0.345 3.466 -10.147 1.00 0.00 O ATOM 726 CB GLN A 181 -0.179 1.188 -8.041 1.00 0.00 C ATOM 727 CG GLN A 181 0.804 0.528 -7.089 1.00 0.00 C ATOM 728 CD GLN A 181 0.770 -0.987 -7.173 1.00 0.00 C ATOM 729 OE1 GLN A 181 0.290 -1.555 -8.155 1.00 0.00 O ATOM 730 NE2 GLN A 181 1.280 -1.648 -6.141 1.00 0.00 N ATOM 0 H GLN A 181 -2.030 2.596 -6.906 1.00 0.00 H new ATOM 0 HA GLN A 181 0.781 3.072 -7.633 1.00 0.00 H new ATOM 0 HB2 GLN A 181 -1.179 0.803 -7.842 1.00 0.00 H new ATOM 0 HB3 GLN A 181 0.074 0.907 -9.063 1.00 0.00 H new ATOM 0 HG2 GLN A 181 1.812 0.878 -7.313 1.00 0.00 H new ATOM 0 HG3 GLN A 181 0.579 0.837 -6.068 1.00 0.00 H new ATOM 0 HE21 GLN A 181 1.667 -1.136 -5.348 1.00 0.00 H new ATOM 0 HE22 GLN A 181 1.285 -2.668 -6.141 1.00 0.00 H new ATOM 739 N CYS A 182 -1.799 3.677 -9.503 1.00 0.00 N ATOM 740 CA CYS A 182 -2.227 4.262 -10.771 1.00 0.00 C ATOM 741 C CYS A 182 -2.855 5.639 -10.568 1.00 0.00 C ATOM 742 O CYS A 182 -2.778 6.500 -11.444 1.00 0.00 O ATOM 743 CB CYS A 182 -3.223 3.336 -11.471 1.00 0.00 C ATOM 744 SG CYS A 182 -2.670 1.620 -11.598 1.00 0.00 S ATOM 0 H CYS A 182 -2.543 3.569 -8.813 1.00 0.00 H new ATOM 0 HA CYS A 182 -1.342 4.382 -11.396 1.00 0.00 H new ATOM 0 HB2 CYS A 182 -4.169 3.363 -10.931 1.00 0.00 H new ATOM 0 HB3 CYS A 182 -3.417 3.719 -12.473 1.00 0.00 H new ATOM 0 HG CYS A 182 -3.473 0.962 -12.381 1.00 0.00 H new ATOM 749 N GLY A 183 -3.479 5.841 -9.414 1.00 0.00 N ATOM 750 CA GLY A 183 -4.112 7.114 -9.126 1.00 0.00 C ATOM 751 C GLY A 183 -5.589 7.113 -9.463 1.00 0.00 C ATOM 752 O GLY A 183 -6.405 7.648 -8.711 1.00 0.00 O ATOM 0 H GLY A 183 -3.558 5.146 -8.672 1.00 0.00 H new ATOM 0 HA2 GLY A 183 -3.983 7.350 -8.070 1.00 0.00 H new ATOM 0 HA3 GLY A 183 -3.613 7.901 -9.692 1.00 0.00 H new ATOM 756 N LYS A 184 -5.935 6.508 -10.594 1.00 0.00 N ATOM 757 CA LYS A 184 -7.326 6.436 -11.028 1.00 0.00 C ATOM 758 C LYS A 184 -8.178 5.690 -10.007 1.00 0.00 C ATOM 759 O LYS A 184 -7.710 5.361 -8.916 1.00 0.00 O ATOM 760 CB LYS A 184 -7.424 5.747 -12.391 1.00 0.00 C ATOM 761 CG LYS A 184 -6.406 6.249 -13.401 1.00 0.00 C ATOM 762 CD LYS A 184 -7.048 6.532 -14.750 1.00 0.00 C ATOM 763 CE LYS A 184 -6.373 7.698 -15.456 1.00 0.00 C ATOM 764 NZ LYS A 184 -5.440 7.237 -16.522 1.00 0.00 N ATOM 0 H LYS A 184 -5.272 6.060 -11.227 1.00 0.00 H new ATOM 0 HA LYS A 184 -7.704 7.454 -11.116 1.00 0.00 H new ATOM 0 HB2 LYS A 184 -7.291 4.674 -12.256 1.00 0.00 H new ATOM 0 HB3 LYS A 184 -8.426 5.896 -12.793 1.00 0.00 H new ATOM 0 HG2 LYS A 184 -5.936 7.157 -13.024 1.00 0.00 H new ATOM 0 HG3 LYS A 184 -5.616 5.507 -13.522 1.00 0.00 H new ATOM 0 HD2 LYS A 184 -6.988 5.642 -15.376 1.00 0.00 H new ATOM 0 HD3 LYS A 184 -8.106 6.753 -14.611 1.00 0.00 H new ATOM 0 HE2 LYS A 184 -7.132 8.346 -15.894 1.00 0.00 H new ATOM 0 HE3 LYS A 184 -5.825 8.296 -14.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 184 -5.000 8.061 -16.979 1.00 0.00 H new ATOM 0 HZ2 LYS A 184 -4.700 6.639 -16.101 1.00 0.00 H new ATOM 0 HZ3 LYS A 184 -5.967 6.688 -17.231 1.00 0.00 H new ATOM 778 N PHE A 185 -9.428 5.423 -10.368 1.00 0.00 N ATOM 779 CA PHE A 185 -10.345 4.713 -9.482 1.00 0.00 C ATOM 780 C PHE A 185 -10.596 3.294 -9.982 1.00 0.00 C ATOM 781 O PHE A 185 -11.019 3.092 -11.120 1.00 0.00 O ATOM 782 CB PHE A 185 -11.670 5.470 -9.374 1.00 0.00 C ATOM 783 CG PHE A 185 -11.584 6.717 -8.541 1.00 0.00 C ATOM 784 CD1 PHE A 185 -11.129 6.664 -7.234 1.00 0.00 C ATOM 785 CD2 PHE A 185 -11.962 7.943 -9.067 1.00 0.00 C ATOM 786 CE1 PHE A 185 -11.052 7.811 -6.466 1.00 0.00 C ATOM 787 CE2 PHE A 185 -11.886 9.092 -8.304 1.00 0.00 C ATOM 788 CZ PHE A 185 -11.431 9.026 -7.002 1.00 0.00 C ATOM 0 H PHE A 185 -9.830 5.687 -11.267 1.00 0.00 H new ATOM 0 HA PHE A 185 -9.886 4.655 -8.495 1.00 0.00 H new ATOM 0 HB2 PHE A 185 -12.010 5.735 -10.375 1.00 0.00 H new ATOM 0 HB3 PHE A 185 -12.423 4.808 -8.946 1.00 0.00 H new ATOM 0 HD1 PHE A 185 -10.831 5.716 -6.810 1.00 0.00 H new ATOM 0 HD2 PHE A 185 -12.320 8.000 -10.084 1.00 0.00 H new ATOM 0 HE1 PHE A 185 -10.696 7.757 -5.448 1.00 0.00 H new ATOM 0 HE2 PHE A 185 -12.182 10.041 -8.725 1.00 0.00 H new ATOM 0 HZ PHE A 185 -11.372 9.923 -6.404 1.00 0.00 H new ATOM 798 N HIS A 186 -10.335 2.314 -9.123 1.00 0.00 N ATOM 799 CA HIS A 186 -10.535 0.913 -9.478 1.00 0.00 C ATOM 800 C HIS A 186 -11.762 0.344 -8.772 1.00 0.00 C ATOM 801 O HIS A 186 -12.247 0.914 -7.795 1.00 0.00 O ATOM 802 CB HIS A 186 -9.298 0.092 -9.112 1.00 0.00 C ATOM 803 CG HIS A 186 -8.139 0.310 -10.033 1.00 0.00 C ATOM 804 ND1 HIS A 186 -8.284 0.689 -11.351 1.00 0.00 N ATOM 805 CD2 HIS A 186 -6.806 0.203 -9.820 1.00 0.00 C ATOM 806 CE1 HIS A 186 -7.092 0.804 -11.909 1.00 0.00 C ATOM 807 NE2 HIS A 186 -6.179 0.515 -11.000 1.00 0.00 N ATOM 0 H HIS A 186 -9.985 2.464 -8.177 1.00 0.00 H new ATOM 0 HA HIS A 186 -10.696 0.856 -10.554 1.00 0.00 H new ATOM 0 HB2 HIS A 186 -8.995 0.341 -8.095 1.00 0.00 H new ATOM 0 HB3 HIS A 186 -9.560 -0.966 -9.116 1.00 0.00 H new ATOM 0 HD2 HIS A 186 -6.326 -0.076 -8.894 1.00 0.00 H new ATOM 0 HE1 HIS A 186 -6.898 1.086 -12.933 1.00 0.00 H new ATOM 0 HE2 HIS A 186 -5.170 0.522 -11.151 1.00 0.00 H new ATOM 815 N LEU A 187 -12.256 -0.783 -9.272 1.00 0.00 N ATOM 816 CA LEU A 187 -13.426 -1.430 -8.689 1.00 0.00 C ATOM 817 C LEU A 187 -13.074 -2.089 -7.358 1.00 0.00 C ATOM 818 O LEU A 187 -11.974 -2.614 -7.185 1.00 0.00 O ATOM 819 CB LEU A 187 -13.995 -2.470 -9.658 1.00 0.00 C ATOM 820 CG LEU A 187 -15.503 -2.375 -9.896 1.00 0.00 C ATOM 821 CD1 LEU A 187 -15.845 -1.095 -10.645 1.00 0.00 C ATOM 822 CD2 LEU A 187 -15.999 -3.592 -10.663 1.00 0.00 C ATOM 0 H LEU A 187 -11.865 -1.268 -10.080 1.00 0.00 H new ATOM 0 HA LEU A 187 -14.182 -0.667 -8.505 1.00 0.00 H new ATOM 0 HB2 LEU A 187 -13.484 -2.370 -10.616 1.00 0.00 H new ATOM 0 HB3 LEU A 187 -13.765 -3.465 -9.276 1.00 0.00 H new ATOM 0 HG LEU A 187 -16.004 -2.351 -8.928 1.00 0.00 H new ATOM 0 HD11 LEU A 187 -16.922 -1.044 -10.806 1.00 0.00 H new ATOM 0 HD12 LEU A 187 -15.524 -0.234 -10.059 1.00 0.00 H new ATOM 0 HD13 LEU A 187 -15.334 -1.089 -11.608 1.00 0.00 H new ATOM 0 HD21 LEU A 187 -17.074 -3.508 -10.823 1.00 0.00 H new ATOM 0 HD22 LEU A 187 -15.492 -3.647 -11.626 1.00 0.00 H new ATOM 0 HD23 LEU A 187 -15.787 -4.495 -10.090 1.00 0.00 H new ATOM 834 N LEU A 188 -14.014 -2.055 -6.419 1.00 0.00 N ATOM 835 CA LEU A 188 -13.800 -2.648 -5.104 1.00 0.00 C ATOM 836 C LEU A 188 -13.774 -4.179 -5.162 1.00 0.00 C ATOM 837 O LEU A 188 -13.009 -4.810 -4.434 1.00 0.00 O ATOM 838 CB LEU A 188 -14.876 -2.173 -4.119 1.00 0.00 C ATOM 839 CG LEU A 188 -14.341 -1.476 -2.867 1.00 0.00 C ATOM 840 CD1 LEU A 188 -13.871 -0.068 -3.199 1.00 0.00 C ATOM 841 CD2 LEU A 188 -15.406 -1.441 -1.781 1.00 0.00 C ATOM 0 H LEU A 188 -14.930 -1.624 -6.544 1.00 0.00 H new ATOM 0 HA LEU A 188 -12.823 -2.315 -4.754 1.00 0.00 H new ATOM 0 HB2 LEU A 188 -15.547 -1.489 -4.639 1.00 0.00 H new ATOM 0 HB3 LEU A 188 -15.472 -3.033 -3.812 1.00 0.00 H new ATOM 0 HG LEU A 188 -13.488 -2.044 -2.495 1.00 0.00 H new ATOM 0 HD11 LEU A 188 -13.494 0.412 -2.296 1.00 0.00 H new ATOM 0 HD12 LEU A 188 -13.076 -0.116 -3.944 1.00 0.00 H new ATOM 0 HD13 LEU A 188 -14.706 0.510 -3.596 1.00 0.00 H new ATOM 0 HD21 LEU A 188 -15.008 -0.942 -0.897 1.00 0.00 H new ATOM 0 HD22 LEU A 188 -16.278 -0.897 -2.144 1.00 0.00 H new ATOM 0 HD23 LEU A 188 -15.696 -2.460 -1.523 1.00 0.00 H new ATOM 853 N PRO A 189 -14.603 -4.813 -6.022 1.00 0.00 N ATOM 854 CA PRO A 189 -14.637 -6.270 -6.135 1.00 0.00 C ATOM 855 C PRO A 189 -13.530 -6.809 -7.036 1.00 0.00 C ATOM 856 O PRO A 189 -13.794 -7.515 -8.009 1.00 0.00 O ATOM 857 CB PRO A 189 -16.007 -6.530 -6.751 1.00 0.00 C ATOM 858 CG PRO A 189 -16.263 -5.339 -7.608 1.00 0.00 C ATOM 859 CD PRO A 189 -15.567 -4.174 -6.947 1.00 0.00 C ATOM 0 HA PRO A 189 -14.480 -6.764 -5.176 1.00 0.00 H new ATOM 0 HB2 PRO A 189 -16.011 -7.449 -7.337 1.00 0.00 H new ATOM 0 HB3 PRO A 189 -16.773 -6.639 -5.983 1.00 0.00 H new ATOM 0 HG2 PRO A 189 -15.880 -5.498 -8.616 1.00 0.00 H new ATOM 0 HG3 PRO A 189 -17.333 -5.150 -7.699 1.00 0.00 H new ATOM 0 HD2 PRO A 189 -15.061 -3.544 -7.678 1.00 0.00 H new ATOM 0 HD3 PRO A 189 -16.273 -3.538 -6.412 1.00 0.00 H new ATOM 867 N ASP A 190 -12.288 -6.471 -6.704 1.00 0.00 N ATOM 868 CA ASP A 190 -11.139 -6.920 -7.480 1.00 0.00 C ATOM 869 C ASP A 190 -9.838 -6.662 -6.728 1.00 0.00 C ATOM 870 O ASP A 190 -8.805 -6.376 -7.335 1.00 0.00 O ATOM 871 CB ASP A 190 -11.107 -6.215 -8.838 1.00 0.00 C ATOM 872 CG ASP A 190 -10.645 -7.129 -9.955 1.00 0.00 C ATOM 873 OD1 ASP A 190 -9.779 -7.991 -9.697 1.00 0.00 O ATOM 874 OD2 ASP A 190 -11.149 -6.983 -11.088 1.00 0.00 O ATOM 0 H ASP A 190 -12.052 -5.887 -5.902 1.00 0.00 H new ATOM 0 HA ASP A 190 -11.237 -7.994 -7.638 1.00 0.00 H new ATOM 0 HB2 ASP A 190 -12.102 -5.836 -9.071 1.00 0.00 H new ATOM 0 HB3 ASP A 190 -10.443 -5.352 -8.781 1.00 0.00 H new