USER MOD reduce.3.24.130724 H: found=0, std=0, add=432, rem=0, adj=14 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 -137:sc= -0.293 USER MOD Set 1.2: A 182 CYS SG : rot -170:sc= 0.0477 USER MOD Set 1.3: A 186 HIS : no HD1:sc= -2.19 K(o=-2.4,f=-0.75) USER MOD Set 2.1: A 138 CYS SG : rot 173:sc= -3.98! USER MOD Set 2.2: A 143 CYS SG : rot 180:sc= 0 USER MOD Set 2.3: A 160 CYS SG : rot 180:sc= -0.371 USER MOD Set 2.4: A 163 CYS SG : rot 161:sc= -0.281 USER MOD Single : A 139 GLN : amide:sc= -1.36 K(o=-1.4,f=-2.6) USER MOD Single : A 148 SER OG : rot 105:sc= 0.112 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= -3.83! K(o=-3.8!,f=-1.7) USER MOD Single : A 155 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00347) USER MOD Single : A 157 HIS : no HD1:sc= -4.67 X(o=-4.7,f=-4.9!) USER MOD Single : A 165 THR OG1 : rot -72:sc= 0.287 USER MOD Single : A 167 SER OG : rot 180:sc= 0.0883 USER MOD Single : A 175 ASN : amide:sc= -2.08! C(o=-2.1!,f=-7.9!) USER MOD Single : A 176 LYS NZ :NH3+ -146:sc= 0.469 (180deg=0.05) USER MOD Single : A 178 TYR OH : rot 180:sc= -0.215 USER MOD Single : A 180 GLN : amide:sc= -1.04 K(o=-1,f=-4.2!) USER MOD Single : A 181 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 184 LYS NZ :NH3+ 146:sc= -0.336 (180deg=-1.71!) USER MOD ----------------------------------------------------------------- ATOM 17 N ALA A 136 -8.169 20.046 -11.933 1.00 0.00 N ATOM 18 CA ALA A 136 -8.351 19.291 -10.698 1.00 0.00 C ATOM 19 C ALA A 136 -9.748 19.505 -10.124 1.00 0.00 C ATOM 20 O ALA A 136 -10.084 20.600 -9.674 1.00 0.00 O ATOM 21 CB ALA A 136 -7.293 19.685 -9.679 1.00 0.00 C ATOM 0 HA ALA A 136 -8.241 18.231 -10.929 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -7.440 19.114 -8.762 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -6.303 19.474 -10.083 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -7.377 20.750 -9.461 1.00 0.00 H new ATOM 27 N ARG A 137 -10.559 18.453 -10.149 1.00 0.00 N ATOM 28 CA ARG A 137 -11.921 18.528 -9.633 1.00 0.00 C ATOM 29 C ARG A 137 -12.463 17.136 -9.323 1.00 0.00 C ATOM 30 O ARG A 137 -12.652 16.320 -10.224 1.00 0.00 O ATOM 31 CB ARG A 137 -12.827 19.230 -10.648 1.00 0.00 C ATOM 32 CG ARG A 137 -14.302 19.214 -10.273 1.00 0.00 C ATOM 33 CD ARG A 137 -15.127 18.433 -11.282 1.00 0.00 C ATOM 34 NE ARG A 137 -16.546 18.779 -11.215 1.00 0.00 N ATOM 35 CZ ARG A 137 -17.042 19.950 -11.608 1.00 0.00 C ATOM 36 NH1 ARG A 137 -16.239 20.889 -12.094 1.00 0.00 N ATOM 37 NH2 ARG A 137 -18.343 20.183 -11.516 1.00 0.00 N ATOM 0 H ARG A 137 -10.298 17.540 -10.520 1.00 0.00 H new ATOM 0 HA ARG A 137 -11.906 19.103 -8.707 1.00 0.00 H new ATOM 0 HB2 ARG A 137 -12.501 20.264 -10.757 1.00 0.00 H new ATOM 0 HB3 ARG A 137 -12.704 18.753 -11.621 1.00 0.00 H new ATOM 0 HG2 ARG A 137 -14.422 18.772 -9.284 1.00 0.00 H new ATOM 0 HG3 ARG A 137 -14.674 20.237 -10.212 1.00 0.00 H new ATOM 0 HD2 ARG A 137 -14.753 18.630 -12.287 1.00 0.00 H new ATOM 0 HD3 ARG A 137 -15.005 17.365 -11.101 1.00 0.00 H new ATOM 0 HE ARG A 137 -17.193 18.083 -10.846 1.00 0.00 H new ATOM 0 HH11 ARG A 137 -15.237 20.715 -12.168 1.00 0.00 H new ATOM 0 HH12 ARG A 137 -16.624 21.785 -12.394 1.00 0.00 H new ATOM 0 HH21 ARG A 137 -18.965 19.465 -11.144 1.00 0.00 H new ATOM 0 HH22 ARG A 137 -18.723 21.080 -11.817 1.00 0.00 H new ATOM 51 N CYS A 138 -12.719 16.871 -8.044 1.00 0.00 N ATOM 52 CA CYS A 138 -13.249 15.578 -7.631 1.00 0.00 C ATOM 53 C CYS A 138 -14.596 15.325 -8.298 1.00 0.00 C ATOM 54 O CYS A 138 -15.620 15.866 -7.879 1.00 0.00 O ATOM 55 CB CYS A 138 -13.393 15.516 -6.108 1.00 0.00 C ATOM 56 SG CYS A 138 -13.432 13.836 -5.444 1.00 0.00 S ATOM 0 H CYS A 138 -12.568 17.531 -7.281 1.00 0.00 H new ATOM 0 HA CYS A 138 -12.549 14.802 -7.943 1.00 0.00 H new ATOM 0 HB2 CYS A 138 -12.564 16.057 -5.652 1.00 0.00 H new ATOM 0 HB3 CYS A 138 -14.308 16.032 -5.818 1.00 0.00 H new ATOM 0 HG CYS A 138 -13.403 13.882 -4.145 1.00 0.00 H new ATOM 61 N GLN A 139 -14.581 14.515 -9.354 1.00 0.00 N ATOM 62 CA GLN A 139 -15.796 14.205 -10.102 1.00 0.00 C ATOM 63 C GLN A 139 -16.518 12.981 -9.544 1.00 0.00 C ATOM 64 O GLN A 139 -17.043 12.165 -10.302 1.00 0.00 O ATOM 65 CB GLN A 139 -15.458 13.978 -11.577 1.00 0.00 C ATOM 66 CG GLN A 139 -14.631 12.728 -11.827 1.00 0.00 C ATOM 67 CD GLN A 139 -13.819 12.809 -13.106 1.00 0.00 C ATOM 68 OE1 GLN A 139 -14.269 13.373 -14.105 1.00 0.00 O ATOM 69 NE2 GLN A 139 -12.617 12.246 -13.080 1.00 0.00 N ATOM 0 H GLN A 139 -13.740 14.061 -9.711 1.00 0.00 H new ATOM 0 HA GLN A 139 -16.467 15.058 -10.002 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -16.385 13.910 -12.147 1.00 0.00 H new ATOM 0 HB3 GLN A 139 -14.914 14.844 -11.954 1.00 0.00 H new ATOM 0 HG2 GLN A 139 -13.959 12.568 -10.984 1.00 0.00 H new ATOM 0 HG3 GLN A 139 -15.293 11.863 -11.876 1.00 0.00 H new ATOM 0 HE21 GLN A 139 -12.286 11.790 -12.230 1.00 0.00 H new ATOM 0 HE22 GLN A 139 -12.025 12.270 -13.910 1.00 0.00 H new ATOM 78 N VAL A 140 -16.563 12.861 -8.222 1.00 0.00 N ATOM 79 CA VAL A 140 -17.242 11.739 -7.588 1.00 0.00 C ATOM 80 C VAL A 140 -18.705 12.089 -7.321 1.00 0.00 C ATOM 81 O VAL A 140 -19.000 13.131 -6.740 1.00 0.00 O ATOM 82 CB VAL A 140 -16.560 11.335 -6.265 1.00 0.00 C ATOM 83 CG1 VAL A 140 -17.082 9.993 -5.777 1.00 0.00 C ATOM 84 CG2 VAL A 140 -15.047 11.291 -6.431 1.00 0.00 C ATOM 0 H VAL A 140 -16.140 13.523 -7.572 1.00 0.00 H new ATOM 0 HA VAL A 140 -17.185 10.893 -8.273 1.00 0.00 H new ATOM 0 HB VAL A 140 -16.801 12.089 -5.516 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -16.587 9.728 -4.843 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -18.157 10.059 -5.612 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -16.876 9.228 -6.526 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -14.586 11.004 -5.486 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -14.786 10.562 -7.198 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -14.685 12.275 -6.727 1.00 0.00 H new ATOM 94 N PRO A 141 -19.653 11.231 -7.745 1.00 0.00 N ATOM 95 CA PRO A 141 -21.082 11.477 -7.543 1.00 0.00 C ATOM 96 C PRO A 141 -21.401 11.856 -6.100 1.00 0.00 C ATOM 97 O PRO A 141 -21.953 12.924 -5.835 1.00 0.00 O ATOM 98 CB PRO A 141 -21.749 10.141 -7.913 1.00 0.00 C ATOM 99 CG PRO A 141 -20.630 9.162 -8.075 1.00 0.00 C ATOM 100 CD PRO A 141 -19.420 9.966 -8.450 1.00 0.00 C ATOM 0 HA PRO A 141 -21.436 12.314 -8.145 1.00 0.00 H new ATOM 0 HB2 PRO A 141 -22.441 9.820 -7.134 1.00 0.00 H new ATOM 0 HB3 PRO A 141 -22.325 10.233 -8.834 1.00 0.00 H new ATOM 0 HG2 PRO A 141 -20.459 8.610 -7.151 1.00 0.00 H new ATOM 0 HG3 PRO A 141 -20.864 8.428 -8.846 1.00 0.00 H new ATOM 0 HD2 PRO A 141 -18.497 9.485 -8.128 1.00 0.00 H new ATOM 0 HD3 PRO A 141 -19.345 10.109 -9.528 1.00 0.00 H new ATOM 108 N ASP A 142 -21.044 10.976 -5.171 1.00 0.00 N ATOM 109 CA ASP A 142 -21.287 11.219 -3.754 1.00 0.00 C ATOM 110 C ASP A 142 -20.457 12.399 -3.252 1.00 0.00 C ATOM 111 O ASP A 142 -20.837 13.071 -2.294 1.00 0.00 O ATOM 112 CB ASP A 142 -20.955 9.969 -2.935 1.00 0.00 C ATOM 113 CG ASP A 142 -21.458 8.695 -3.582 1.00 0.00 C ATOM 114 OD1 ASP A 142 -22.497 8.749 -4.273 1.00 0.00 O ATOM 115 OD2 ASP A 142 -20.811 7.641 -3.399 1.00 0.00 O ATOM 0 H ASP A 142 -20.585 10.088 -5.374 1.00 0.00 H new ATOM 0 HA ASP A 142 -22.343 11.459 -3.631 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -19.875 9.903 -2.803 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -21.392 10.064 -1.941 1.00 0.00 H new ATOM 120 N CYS A 143 -19.319 12.642 -3.899 1.00 0.00 N ATOM 121 CA CYS A 143 -18.439 13.740 -3.507 1.00 0.00 C ATOM 122 C CYS A 143 -18.090 14.627 -4.699 1.00 0.00 C ATOM 123 O CYS A 143 -17.208 14.299 -5.497 1.00 0.00 O ATOM 124 CB CYS A 143 -17.158 13.187 -2.876 1.00 0.00 C ATOM 125 SG CYS A 143 -15.974 14.457 -2.366 1.00 0.00 S ATOM 0 H CYS A 143 -18.986 12.096 -4.694 1.00 0.00 H new ATOM 0 HA CYS A 143 -18.970 14.350 -2.776 1.00 0.00 H new ATOM 0 HB2 CYS A 143 -17.425 12.585 -2.007 1.00 0.00 H new ATOM 0 HB3 CYS A 143 -16.674 12.520 -3.589 1.00 0.00 H new ATOM 0 HG CYS A 143 -14.927 13.890 -1.843 1.00 0.00 H new ATOM 130 N GLU A 144 -18.783 15.757 -4.807 1.00 0.00 N ATOM 131 CA GLU A 144 -18.544 16.702 -5.892 1.00 0.00 C ATOM 132 C GLU A 144 -17.677 17.859 -5.407 1.00 0.00 C ATOM 133 O GLU A 144 -18.176 18.947 -5.120 1.00 0.00 O ATOM 134 CB GLU A 144 -19.871 17.235 -6.439 1.00 0.00 C ATOM 135 CG GLU A 144 -19.739 17.927 -7.785 1.00 0.00 C ATOM 136 CD GLU A 144 -21.083 18.270 -8.398 1.00 0.00 C ATOM 137 OE1 GLU A 144 -21.799 19.116 -7.822 1.00 0.00 O ATOM 138 OE2 GLU A 144 -21.421 17.690 -9.452 1.00 0.00 O ATOM 0 H GLU A 144 -19.515 16.040 -4.156 1.00 0.00 H new ATOM 0 HA GLU A 144 -18.019 16.181 -6.693 1.00 0.00 H new ATOM 0 HB2 GLU A 144 -20.575 16.408 -6.532 1.00 0.00 H new ATOM 0 HB3 GLU A 144 -20.296 17.935 -5.720 1.00 0.00 H new ATOM 0 HG2 GLU A 144 -19.155 18.840 -7.665 1.00 0.00 H new ATOM 0 HG3 GLU A 144 -19.186 17.282 -8.468 1.00 0.00 H new ATOM 145 N ALA A 145 -16.376 17.610 -5.306 1.00 0.00 N ATOM 146 CA ALA A 145 -15.435 18.622 -4.841 1.00 0.00 C ATOM 147 C ALA A 145 -14.882 19.449 -5.997 1.00 0.00 C ATOM 148 O ALA A 145 -14.640 18.929 -7.086 1.00 0.00 O ATOM 149 CB ALA A 145 -14.299 17.967 -4.071 1.00 0.00 C ATOM 0 H ALA A 145 -15.948 16.714 -5.540 1.00 0.00 H new ATOM 0 HA ALA A 145 -15.974 19.299 -4.178 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -13.603 18.732 -3.729 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -14.703 17.433 -3.211 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -13.776 17.265 -4.721 1.00 0.00 H new ATOM 155 N ASP A 146 -14.679 20.739 -5.746 1.00 0.00 N ATOM 156 CA ASP A 146 -14.147 21.644 -6.758 1.00 0.00 C ATOM 157 C ASP A 146 -12.692 21.995 -6.457 1.00 0.00 C ATOM 158 O ASP A 146 -12.296 23.158 -6.527 1.00 0.00 O ATOM 159 CB ASP A 146 -14.991 22.918 -6.827 1.00 0.00 C ATOM 160 CG ASP A 146 -14.569 23.831 -7.962 1.00 0.00 C ATOM 161 OD1 ASP A 146 -14.261 23.315 -9.056 1.00 0.00 O ATOM 162 OD2 ASP A 146 -14.547 25.063 -7.756 1.00 0.00 O ATOM 0 H ASP A 146 -14.876 21.181 -4.848 1.00 0.00 H new ATOM 0 HA ASP A 146 -14.189 21.140 -7.723 1.00 0.00 H new ATOM 0 HB2 ASP A 146 -16.040 22.649 -6.952 1.00 0.00 H new ATOM 0 HB3 ASP A 146 -14.910 23.456 -5.882 1.00 0.00 H new ATOM 167 N ILE A 147 -11.904 20.979 -6.120 1.00 0.00 N ATOM 168 CA ILE A 147 -10.493 21.173 -5.805 1.00 0.00 C ATOM 169 C ILE A 147 -9.699 21.583 -7.043 1.00 0.00 C ATOM 170 O ILE A 147 -8.870 20.822 -7.540 1.00 0.00 O ATOM 171 CB ILE A 147 -9.872 19.893 -5.213 1.00 0.00 C ATOM 172 CG1 ILE A 147 -10.182 18.685 -6.102 1.00 0.00 C ATOM 173 CG2 ILE A 147 -10.380 19.663 -3.796 1.00 0.00 C ATOM 174 CD1 ILE A 147 -8.946 17.981 -6.619 1.00 0.00 C ATOM 0 H ILE A 147 -12.219 20.011 -6.058 1.00 0.00 H new ATOM 0 HA ILE A 147 -10.442 21.973 -5.066 1.00 0.00 H new ATOM 0 HB ILE A 147 -8.790 20.019 -5.174 1.00 0.00 H new ATOM 0 HG12 ILE A 147 -10.786 17.974 -5.538 1.00 0.00 H new ATOM 0 HG13 ILE A 147 -10.785 19.013 -6.949 1.00 0.00 H new ATOM 0 HG21 ILE A 147 -9.932 18.755 -3.392 1.00 0.00 H new ATOM 0 HG22 ILE A 147 -10.107 20.512 -3.169 1.00 0.00 H new ATOM 0 HG23 ILE A 147 -11.465 19.557 -3.811 1.00 0.00 H new ATOM 0 HD11 ILE A 147 -9.242 17.136 -7.241 1.00 0.00 H new ATOM 0 HD12 ILE A 147 -8.352 18.677 -7.211 1.00 0.00 H new ATOM 0 HD13 ILE A 147 -8.353 17.622 -5.778 1.00 0.00 H new ATOM 186 N SER A 148 -9.954 22.793 -7.538 1.00 0.00 N ATOM 187 CA SER A 148 -9.257 23.297 -8.715 1.00 0.00 C ATOM 188 C SER A 148 -8.065 24.162 -8.317 1.00 0.00 C ATOM 189 O SER A 148 -7.727 25.125 -9.005 1.00 0.00 O ATOM 190 CB SER A 148 -10.215 24.105 -9.593 1.00 0.00 C ATOM 191 OG SER A 148 -11.474 23.464 -9.699 1.00 0.00 O ATOM 0 H SER A 148 -10.637 23.439 -7.142 1.00 0.00 H new ATOM 0 HA SER A 148 -8.888 22.441 -9.280 1.00 0.00 H new ATOM 0 HB2 SER A 148 -10.345 25.102 -9.172 1.00 0.00 H new ATOM 0 HB3 SER A 148 -9.784 24.232 -10.586 1.00 0.00 H new ATOM 0 HG SER A 148 -12.128 23.932 -9.139 1.00 0.00 H new ATOM 197 N GLU A 149 -7.430 23.811 -7.203 1.00 0.00 N ATOM 198 CA GLU A 149 -6.275 24.556 -6.715 1.00 0.00 C ATOM 199 C GLU A 149 -5.451 23.710 -5.748 1.00 0.00 C ATOM 200 O GLU A 149 -4.795 24.238 -4.851 1.00 0.00 O ATOM 201 CB GLU A 149 -6.728 25.844 -6.026 1.00 0.00 C ATOM 202 CG GLU A 149 -7.776 25.622 -4.948 1.00 0.00 C ATOM 203 CD GLU A 149 -9.125 26.211 -5.313 1.00 0.00 C ATOM 204 OE1 GLU A 149 -9.496 26.152 -6.504 1.00 0.00 O ATOM 205 OE2 GLU A 149 -9.812 26.730 -4.408 1.00 0.00 O ATOM 0 H GLU A 149 -7.696 23.016 -6.622 1.00 0.00 H new ATOM 0 HA GLU A 149 -5.649 24.810 -7.570 1.00 0.00 H new ATOM 0 HB2 GLU A 149 -5.861 26.333 -5.582 1.00 0.00 H new ATOM 0 HB3 GLU A 149 -7.129 26.525 -6.776 1.00 0.00 H new ATOM 0 HG2 GLU A 149 -7.887 24.552 -4.770 1.00 0.00 H new ATOM 0 HG3 GLU A 149 -7.431 26.066 -4.014 1.00 0.00 H new ATOM 212 N LEU A 150 -5.485 22.395 -5.940 1.00 0.00 N ATOM 213 CA LEU A 150 -4.739 21.477 -5.086 1.00 0.00 C ATOM 214 C LEU A 150 -3.349 21.214 -5.659 1.00 0.00 C ATOM 215 O LEU A 150 -2.978 21.766 -6.693 1.00 0.00 O ATOM 216 CB LEU A 150 -5.501 20.158 -4.926 1.00 0.00 C ATOM 217 CG LEU A 150 -6.065 19.902 -3.527 1.00 0.00 C ATOM 218 CD1 LEU A 150 -6.988 21.036 -3.108 1.00 0.00 C ATOM 219 CD2 LEU A 150 -6.796 18.567 -3.483 1.00 0.00 C ATOM 0 H LEU A 150 -6.021 21.941 -6.679 1.00 0.00 H new ATOM 0 HA LEU A 150 -4.627 21.940 -4.106 1.00 0.00 H new ATOM 0 HB2 LEU A 150 -6.323 20.142 -5.641 1.00 0.00 H new ATOM 0 HB3 LEU A 150 -4.834 19.337 -5.188 1.00 0.00 H new ATOM 0 HG LEU A 150 -5.235 19.860 -2.822 1.00 0.00 H new ATOM 0 HD11 LEU A 150 -7.380 20.837 -2.111 1.00 0.00 H new ATOM 0 HD12 LEU A 150 -6.432 21.973 -3.099 1.00 0.00 H new ATOM 0 HD13 LEU A 150 -7.815 21.112 -3.814 1.00 0.00 H new ATOM 0 HD21 LEU A 150 -7.191 18.401 -2.481 1.00 0.00 H new ATOM 0 HD22 LEU A 150 -7.618 18.578 -4.199 1.00 0.00 H new ATOM 0 HD23 LEU A 150 -6.104 17.765 -3.738 1.00 0.00 H new ATOM 231 N LYS A 151 -2.585 20.365 -4.978 1.00 0.00 N ATOM 232 CA LYS A 151 -1.237 20.028 -5.421 1.00 0.00 C ATOM 233 C LYS A 151 -0.790 18.693 -4.835 1.00 0.00 C ATOM 234 O LYS A 151 -0.972 18.431 -3.646 1.00 0.00 O ATOM 235 CB LYS A 151 -0.255 21.130 -5.018 1.00 0.00 C ATOM 236 CG LYS A 151 -0.221 21.399 -3.522 1.00 0.00 C ATOM 237 CD LYS A 151 0.629 22.616 -3.194 1.00 0.00 C ATOM 238 CE LYS A 151 -0.187 23.898 -3.240 1.00 0.00 C ATOM 239 NZ LYS A 151 -0.272 24.552 -1.906 1.00 0.00 N ATOM 0 H LYS A 151 -2.876 19.899 -4.119 1.00 0.00 H new ATOM 0 HA LYS A 151 -1.249 19.941 -6.507 1.00 0.00 H new ATOM 0 HB2 LYS A 151 0.745 20.853 -5.352 1.00 0.00 H new ATOM 0 HB3 LYS A 151 -0.521 22.050 -5.538 1.00 0.00 H new ATOM 0 HG2 LYS A 151 -1.236 21.553 -3.156 1.00 0.00 H new ATOM 0 HG3 LYS A 151 0.176 20.526 -3.003 1.00 0.00 H new ATOM 0 HD2 LYS A 151 1.067 22.498 -2.203 1.00 0.00 H new ATOM 0 HD3 LYS A 151 1.455 22.685 -3.901 1.00 0.00 H new ATOM 0 HE2 LYS A 151 0.262 24.588 -3.954 1.00 0.00 H new ATOM 0 HE3 LYS A 151 -1.192 23.676 -3.600 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 -0.837 25.422 -1.981 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 -0.724 23.904 -1.230 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 0.685 24.788 -1.573 1.00 0.00 H new ATOM 253 N GLY A 152 -0.204 17.850 -5.679 1.00 0.00 N ATOM 254 CA GLY A 152 0.260 16.550 -5.230 1.00 0.00 C ATOM 255 C GLY A 152 -0.057 15.447 -6.222 1.00 0.00 C ATOM 256 O GLY A 152 0.297 15.540 -7.396 1.00 0.00 O ATOM 0 H GLY A 152 -0.042 18.044 -6.667 1.00 0.00 H new ATOM 0 HA2 GLY A 152 1.337 16.589 -5.066 1.00 0.00 H new ATOM 0 HA3 GLY A 152 -0.200 16.315 -4.270 1.00 0.00 H new ATOM 260 N TYR A 153 -0.725 14.400 -5.746 1.00 0.00 N ATOM 261 CA TYR A 153 -1.090 13.276 -6.599 1.00 0.00 C ATOM 262 C TYR A 153 -2.566 13.334 -6.976 1.00 0.00 C ATOM 263 O TYR A 153 -2.927 13.163 -8.140 1.00 0.00 O ATOM 264 CB TYR A 153 -0.783 11.953 -5.895 1.00 0.00 C ATOM 265 CG TYR A 153 -1.247 11.910 -4.457 1.00 0.00 C ATOM 266 CD1 TYR A 153 -2.521 11.461 -4.132 1.00 0.00 C ATOM 267 CD2 TYR A 153 -0.413 12.319 -3.425 1.00 0.00 C ATOM 268 CE1 TYR A 153 -2.950 11.421 -2.819 1.00 0.00 C ATOM 269 CE2 TYR A 153 -0.834 12.280 -2.109 1.00 0.00 C ATOM 270 CZ TYR A 153 -2.103 11.831 -1.812 1.00 0.00 C ATOM 271 OH TYR A 153 -2.527 11.792 -0.503 1.00 0.00 O ATOM 0 H TYR A 153 -1.024 14.308 -4.775 1.00 0.00 H new ATOM 0 HA TYR A 153 -0.498 13.340 -7.512 1.00 0.00 H new ATOM 0 HB2 TYR A 153 -1.257 11.140 -6.445 1.00 0.00 H new ATOM 0 HB3 TYR A 153 0.292 11.775 -5.927 1.00 0.00 H new ATOM 0 HD1 TYR A 153 -3.187 11.138 -4.918 1.00 0.00 H new ATOM 0 HD2 TYR A 153 0.581 12.673 -3.654 1.00 0.00 H new ATOM 0 HE1 TYR A 153 -3.944 11.070 -2.583 1.00 0.00 H new ATOM 0 HE2 TYR A 153 -0.172 12.600 -1.318 1.00 0.00 H new ATOM 0 HH TYR A 153 -1.810 12.113 0.083 1.00 0.00 H new ATOM 281 N HIS A 154 -3.418 13.578 -5.985 1.00 0.00 N ATOM 282 CA HIS A 154 -4.857 13.660 -6.216 1.00 0.00 C ATOM 283 C HIS A 154 -5.200 14.772 -7.205 1.00 0.00 C ATOM 284 O HIS A 154 -6.289 14.789 -7.778 1.00 0.00 O ATOM 285 CB HIS A 154 -5.608 13.885 -4.898 1.00 0.00 C ATOM 286 CG HIS A 154 -4.915 14.812 -3.950 1.00 0.00 C ATOM 287 ND1 HIS A 154 -4.576 14.453 -2.662 1.00 0.00 N ATOM 288 CD2 HIS A 154 -4.501 16.093 -4.101 1.00 0.00 C ATOM 289 CE1 HIS A 154 -3.989 15.470 -2.062 1.00 0.00 C ATOM 290 NE2 HIS A 154 -3.929 16.478 -2.913 1.00 0.00 N ATOM 0 H HIS A 154 -3.138 13.722 -5.015 1.00 0.00 H new ATOM 0 HA HIS A 154 -5.172 12.709 -6.646 1.00 0.00 H new ATOM 0 HB2 HIS A 154 -6.598 14.283 -5.120 1.00 0.00 H new ATOM 0 HB3 HIS A 154 -5.754 12.923 -4.407 1.00 0.00 H new ATOM 0 HD2 HIS A 154 -4.602 16.699 -4.990 1.00 0.00 H new ATOM 0 HE1 HIS A 154 -3.620 15.477 -1.047 1.00 0.00 H new ATOM 0 HE2 HIS A 154 -3.524 17.394 -2.720 1.00 0.00 H new ATOM 298 N LYS A 155 -4.268 15.702 -7.401 1.00 0.00 N ATOM 299 CA LYS A 155 -4.485 16.814 -8.320 1.00 0.00 C ATOM 300 C LYS A 155 -4.567 16.324 -9.763 1.00 0.00 C ATOM 301 O LYS A 155 -5.405 16.787 -10.537 1.00 0.00 O ATOM 302 CB LYS A 155 -3.358 17.840 -8.183 1.00 0.00 C ATOM 303 CG LYS A 155 -3.788 19.262 -8.505 1.00 0.00 C ATOM 304 CD LYS A 155 -2.701 20.019 -9.253 1.00 0.00 C ATOM 305 CE LYS A 155 -3.053 20.192 -10.724 1.00 0.00 C ATOM 306 NZ LYS A 155 -4.035 21.290 -10.934 1.00 0.00 N ATOM 0 H LYS A 155 -3.359 15.707 -6.937 1.00 0.00 H new ATOM 0 HA LYS A 155 -5.434 17.285 -8.062 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -2.971 17.808 -7.165 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -2.539 17.558 -8.845 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -4.697 19.241 -9.106 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -4.029 19.788 -7.581 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -2.557 20.997 -8.795 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -1.756 19.483 -9.165 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -2.147 20.402 -11.292 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -3.463 19.259 -11.111 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -4.274 21.353 -11.944 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -4.897 21.095 -10.386 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -3.621 22.191 -10.619 1.00 0.00 H new ATOM 320 N ARG A 156 -3.690 15.390 -10.118 1.00 0.00 N ATOM 321 CA ARG A 156 -3.660 14.842 -11.471 1.00 0.00 C ATOM 322 C ARG A 156 -4.558 13.613 -11.603 1.00 0.00 C ATOM 323 O ARG A 156 -4.266 12.708 -12.384 1.00 0.00 O ATOM 324 CB ARG A 156 -2.225 14.479 -11.862 1.00 0.00 C ATOM 325 CG ARG A 156 -2.004 14.415 -13.364 1.00 0.00 C ATOM 326 CD ARG A 156 -1.143 13.222 -13.750 1.00 0.00 C ATOM 327 NE ARG A 156 -0.413 13.453 -14.995 1.00 0.00 N ATOM 328 CZ ARG A 156 -0.966 13.382 -16.203 1.00 0.00 C ATOM 329 NH1 ARG A 156 -2.254 13.089 -16.335 1.00 0.00 N ATOM 330 NH2 ARG A 156 -0.230 13.608 -17.283 1.00 0.00 N ATOM 0 H ARG A 156 -2.991 14.997 -9.488 1.00 0.00 H new ATOM 0 HA ARG A 156 -4.039 15.610 -12.145 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -1.543 15.214 -11.433 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -1.970 13.514 -11.424 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -2.966 14.350 -13.872 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -1.526 15.335 -13.702 1.00 0.00 H new ATOM 0 HD2 ARG A 156 -0.435 13.012 -12.948 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -1.774 12.340 -13.858 1.00 0.00 H new ATOM 0 HE ARG A 156 0.579 13.682 -14.934 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -2.825 12.917 -15.508 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -2.672 13.036 -17.264 1.00 0.00 H new ATOM 0 HH21 ARG A 156 0.760 13.836 -17.187 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -0.654 13.554 -18.209 1.00 0.00 H new ATOM 344 N HIS A 157 -5.647 13.580 -10.838 1.00 0.00 N ATOM 345 CA HIS A 157 -6.572 12.452 -10.887 1.00 0.00 C ATOM 346 C HIS A 157 -8.005 12.889 -10.589 1.00 0.00 C ATOM 347 O HIS A 157 -8.851 12.065 -10.242 1.00 0.00 O ATOM 348 CB HIS A 157 -6.138 11.370 -9.897 1.00 0.00 C ATOM 349 CG HIS A 157 -4.976 10.555 -10.375 1.00 0.00 C ATOM 350 ND1 HIS A 157 -5.112 9.484 -11.235 1.00 0.00 N ATOM 351 CD2 HIS A 157 -3.652 10.662 -10.115 1.00 0.00 C ATOM 352 CE1 HIS A 157 -3.922 8.968 -11.481 1.00 0.00 C ATOM 353 NE2 HIS A 157 -3.019 9.664 -10.815 1.00 0.00 N ATOM 0 H HIS A 157 -5.909 14.316 -10.182 1.00 0.00 H new ATOM 0 HA HIS A 157 -6.548 12.046 -11.898 1.00 0.00 H new ATOM 0 HB2 HIS A 157 -5.877 11.840 -8.949 1.00 0.00 H new ATOM 0 HB3 HIS A 157 -6.981 10.707 -9.703 1.00 0.00 H new ATOM 0 HD2 HIS A 157 -3.181 11.395 -9.477 1.00 0.00 H new ATOM 0 HE1 HIS A 157 -3.721 8.120 -12.119 1.00 0.00 H new ATOM 0 HE2 HIS A 157 -2.014 9.489 -10.820 1.00 0.00 H new ATOM 361 N ARG A 158 -8.272 14.186 -10.730 1.00 0.00 N ATOM 362 CA ARG A 158 -9.606 14.734 -10.480 1.00 0.00 C ATOM 363 C ARG A 158 -10.219 14.159 -9.203 1.00 0.00 C ATOM 364 O ARG A 158 -11.301 13.570 -9.230 1.00 0.00 O ATOM 365 CB ARG A 158 -10.521 14.462 -11.676 1.00 0.00 C ATOM 366 CG ARG A 158 -10.600 15.622 -12.654 1.00 0.00 C ATOM 367 CD ARG A 158 -11.512 15.305 -13.826 1.00 0.00 C ATOM 368 NE ARG A 158 -10.879 14.401 -14.784 1.00 0.00 N ATOM 369 CZ ARG A 158 -11.381 14.125 -15.987 1.00 0.00 C ATOM 370 NH1 ARG A 158 -12.521 14.679 -16.380 1.00 0.00 N ATOM 371 NH2 ARG A 158 -10.741 13.293 -16.797 1.00 0.00 N ATOM 0 H ARG A 158 -7.581 14.879 -11.017 1.00 0.00 H new ATOM 0 HA ARG A 158 -9.504 15.811 -10.344 1.00 0.00 H new ATOM 0 HB2 ARG A 158 -10.164 13.577 -12.202 1.00 0.00 H new ATOM 0 HB3 ARG A 158 -11.523 14.235 -11.313 1.00 0.00 H new ATOM 0 HG2 ARG A 158 -10.966 16.510 -12.138 1.00 0.00 H new ATOM 0 HG3 ARG A 158 -9.601 15.856 -13.023 1.00 0.00 H new ATOM 0 HD2 ARG A 158 -12.433 14.855 -13.457 1.00 0.00 H new ATOM 0 HD3 ARG A 158 -11.790 16.231 -14.330 1.00 0.00 H new ATOM 0 HE ARG A 158 -10.002 13.955 -14.516 1.00 0.00 H new ATOM 0 HH11 ARG A 158 -13.017 15.319 -15.760 1.00 0.00 H new ATOM 0 HH12 ARG A 158 -12.901 14.464 -17.302 1.00 0.00 H new ATOM 0 HH21 ARG A 158 -9.865 12.864 -16.499 1.00 0.00 H new ATOM 0 HH22 ARG A 158 -11.125 13.081 -17.718 1.00 0.00 H new ATOM 385 N VAL A 159 -9.518 14.338 -8.087 1.00 0.00 N ATOM 386 CA VAL A 159 -9.987 13.845 -6.799 1.00 0.00 C ATOM 387 C VAL A 159 -9.458 14.715 -5.662 1.00 0.00 C ATOM 388 O VAL A 159 -8.427 15.371 -5.799 1.00 0.00 O ATOM 389 CB VAL A 159 -9.557 12.383 -6.565 1.00 0.00 C ATOM 390 CG1 VAL A 159 -8.041 12.259 -6.562 1.00 0.00 C ATOM 391 CG2 VAL A 159 -10.147 11.850 -5.268 1.00 0.00 C ATOM 0 H VAL A 159 -8.621 14.822 -8.051 1.00 0.00 H new ATOM 0 HA VAL A 159 -11.076 13.891 -6.813 1.00 0.00 H new ATOM 0 HB VAL A 159 -9.943 11.779 -7.387 1.00 0.00 H new ATOM 0 HG11 VAL A 159 -7.761 11.219 -6.395 1.00 0.00 H new ATOM 0 HG12 VAL A 159 -7.647 12.591 -7.522 1.00 0.00 H new ATOM 0 HG13 VAL A 159 -7.627 12.878 -5.766 1.00 0.00 H new ATOM 0 HG21 VAL A 159 -9.831 10.817 -5.122 1.00 0.00 H new ATOM 0 HG22 VAL A 159 -9.798 12.457 -4.433 1.00 0.00 H new ATOM 0 HG23 VAL A 159 -11.235 11.893 -5.318 1.00 0.00 H new ATOM 401 N CYS A 160 -10.174 14.722 -4.541 1.00 0.00 N ATOM 402 CA CYS A 160 -9.773 15.520 -3.387 1.00 0.00 C ATOM 403 C CYS A 160 -8.988 14.681 -2.382 1.00 0.00 C ATOM 404 O CYS A 160 -8.992 13.451 -2.445 1.00 0.00 O ATOM 405 CB CYS A 160 -11.004 16.142 -2.718 1.00 0.00 C ATOM 406 SG CYS A 160 -11.998 14.985 -1.741 1.00 0.00 S ATOM 0 H CYS A 160 -11.032 14.186 -4.408 1.00 0.00 H new ATOM 0 HA CYS A 160 -9.121 16.319 -3.739 1.00 0.00 H new ATOM 0 HB2 CYS A 160 -10.677 16.956 -2.071 1.00 0.00 H new ATOM 0 HB3 CYS A 160 -11.636 16.582 -3.489 1.00 0.00 H new ATOM 0 HG CYS A 160 -13.009 15.614 -1.220 1.00 0.00 H new ATOM 411 N LEU A 161 -8.312 15.356 -1.456 1.00 0.00 N ATOM 412 CA LEU A 161 -7.521 14.677 -0.437 1.00 0.00 C ATOM 413 C LEU A 161 -8.408 13.839 0.476 1.00 0.00 C ATOM 414 O LEU A 161 -7.984 12.804 0.993 1.00 0.00 O ATOM 415 CB LEU A 161 -6.740 15.700 0.392 1.00 0.00 C ATOM 416 CG LEU A 161 -5.761 15.101 1.404 1.00 0.00 C ATOM 417 CD1 LEU A 161 -4.532 15.987 1.546 1.00 0.00 C ATOM 418 CD2 LEU A 161 -6.440 14.909 2.752 1.00 0.00 C ATOM 0 H LEU A 161 -8.297 16.374 -1.391 1.00 0.00 H new ATOM 0 HA LEU A 161 -6.820 14.011 -0.941 1.00 0.00 H new ATOM 0 HB2 LEU A 161 -6.186 16.348 -0.287 1.00 0.00 H new ATOM 0 HB3 LEU A 161 -7.451 16.331 0.926 1.00 0.00 H new ATOM 0 HG LEU A 161 -5.441 14.126 1.038 1.00 0.00 H new ATOM 0 HD11 LEU A 161 -3.847 15.545 2.270 1.00 0.00 H new ATOM 0 HD12 LEU A 161 -4.033 16.075 0.581 1.00 0.00 H new ATOM 0 HD13 LEU A 161 -4.834 16.976 1.889 1.00 0.00 H new ATOM 0 HD21 LEU A 161 -5.729 14.482 3.460 1.00 0.00 H new ATOM 0 HD22 LEU A 161 -6.789 15.872 3.124 1.00 0.00 H new ATOM 0 HD23 LEU A 161 -7.289 14.235 2.639 1.00 0.00 H new ATOM 430 N ARG A 162 -9.642 14.291 0.675 1.00 0.00 N ATOM 431 CA ARG A 162 -10.589 13.584 1.528 1.00 0.00 C ATOM 432 C ARG A 162 -10.854 12.175 1.003 1.00 0.00 C ATOM 433 O ARG A 162 -11.049 11.240 1.778 1.00 0.00 O ATOM 434 CB ARG A 162 -11.904 14.360 1.621 1.00 0.00 C ATOM 435 CG ARG A 162 -12.632 14.169 2.941 1.00 0.00 C ATOM 436 CD ARG A 162 -14.053 14.707 2.876 1.00 0.00 C ATOM 437 NE ARG A 162 -14.995 13.706 2.378 1.00 0.00 N ATOM 438 CZ ARG A 162 -15.488 12.719 3.121 1.00 0.00 C ATOM 439 NH1 ARG A 162 -15.135 12.594 4.394 1.00 0.00 N ATOM 440 NH2 ARG A 162 -16.341 11.852 2.590 1.00 0.00 N ATOM 0 H ARG A 162 -10.009 15.145 0.256 1.00 0.00 H new ATOM 0 HA ARG A 162 -10.150 13.504 2.522 1.00 0.00 H new ATOM 0 HB2 ARG A 162 -11.701 15.421 1.478 1.00 0.00 H new ATOM 0 HB3 ARG A 162 -12.558 14.049 0.807 1.00 0.00 H new ATOM 0 HG2 ARG A 162 -12.654 13.109 3.196 1.00 0.00 H new ATOM 0 HG3 ARG A 162 -12.086 14.676 3.736 1.00 0.00 H new ATOM 0 HD2 ARG A 162 -14.363 15.034 3.869 1.00 0.00 H new ATOM 0 HD3 ARG A 162 -14.080 15.584 2.229 1.00 0.00 H new ATOM 0 HE ARG A 162 -15.291 13.768 1.404 1.00 0.00 H new ATOM 0 HH11 ARG A 162 -14.481 13.258 4.809 1.00 0.00 H new ATOM 0 HH12 ARG A 162 -15.518 11.834 4.957 1.00 0.00 H new ATOM 0 HH21 ARG A 162 -16.618 11.943 1.613 1.00 0.00 H new ATOM 0 HH22 ARG A 162 -16.719 11.095 3.159 1.00 0.00 H new ATOM 454 N CYS A 163 -10.857 12.033 -0.318 1.00 0.00 N ATOM 455 CA CYS A 163 -11.098 10.738 -0.946 1.00 0.00 C ATOM 456 C CYS A 163 -9.809 9.927 -1.033 1.00 0.00 C ATOM 457 O CYS A 163 -9.833 8.697 -0.990 1.00 0.00 O ATOM 458 CB CYS A 163 -11.691 10.927 -2.344 1.00 0.00 C ATOM 459 SG CYS A 163 -13.449 11.351 -2.348 1.00 0.00 S ATOM 0 H CYS A 163 -10.696 12.797 -0.974 1.00 0.00 H new ATOM 0 HA CYS A 163 -11.810 10.190 -0.328 1.00 0.00 H new ATOM 0 HB2 CYS A 163 -11.137 11.712 -2.859 1.00 0.00 H new ATOM 0 HB3 CYS A 163 -11.548 10.010 -2.915 1.00 0.00 H new ATOM 0 HG CYS A 163 -13.766 11.878 -3.493 1.00 0.00 H new ATOM 464 N ALA A 164 -8.685 10.625 -1.157 1.00 0.00 N ATOM 465 CA ALA A 164 -7.385 9.971 -1.253 1.00 0.00 C ATOM 466 C ALA A 164 -7.050 9.219 0.033 1.00 0.00 C ATOM 467 O ALA A 164 -6.331 8.221 0.007 1.00 0.00 O ATOM 468 CB ALA A 164 -6.305 10.995 -1.567 1.00 0.00 C ATOM 0 H ALA A 164 -8.648 11.644 -1.193 1.00 0.00 H new ATOM 0 HA ALA A 164 -7.429 9.244 -2.064 1.00 0.00 H new ATOM 0 HB1 ALA A 164 -5.339 10.495 -1.636 1.00 0.00 H new ATOM 0 HB2 ALA A 164 -6.530 11.482 -2.516 1.00 0.00 H new ATOM 0 HB3 ALA A 164 -6.271 11.742 -0.774 1.00 0.00 H new ATOM 474 N THR A 165 -7.573 9.706 1.155 1.00 0.00 N ATOM 475 CA THR A 165 -7.325 9.080 2.448 1.00 0.00 C ATOM 476 C THR A 165 -8.516 8.240 2.894 1.00 0.00 C ATOM 477 O THR A 165 -8.356 7.243 3.600 1.00 0.00 O ATOM 478 CB THR A 165 -7.018 10.130 3.531 1.00 0.00 C ATOM 479 OG1 THR A 165 -8.059 11.115 3.569 1.00 0.00 O ATOM 480 CG2 THR A 165 -5.682 10.809 3.265 1.00 0.00 C ATOM 0 H THR A 165 -8.171 10.532 1.194 1.00 0.00 H new ATOM 0 HA THR A 165 -6.457 8.433 2.322 1.00 0.00 H new ATOM 0 HB THR A 165 -6.964 9.621 4.493 1.00 0.00 H new ATOM 0 HG1 THR A 165 -7.992 11.692 2.780 1.00 0.00 H new ATOM 0 HG21 THR A 165 -5.487 11.547 4.044 1.00 0.00 H new ATOM 0 HG22 THR A 165 -4.888 10.062 3.266 1.00 0.00 H new ATOM 0 HG23 THR A 165 -5.713 11.305 2.295 1.00 0.00 H new ATOM 488 N ALA A 166 -9.714 8.647 2.482 1.00 0.00 N ATOM 489 CA ALA A 166 -10.932 7.931 2.843 1.00 0.00 C ATOM 490 C ALA A 166 -10.872 6.476 2.387 1.00 0.00 C ATOM 491 O ALA A 166 -10.095 6.123 1.499 1.00 0.00 O ATOM 492 CB ALA A 166 -12.147 8.623 2.243 1.00 0.00 C ATOM 0 H ALA A 166 -9.866 9.469 1.898 1.00 0.00 H new ATOM 0 HA ALA A 166 -11.020 7.940 3.929 1.00 0.00 H new ATOM 0 HB1 ALA A 166 -13.050 8.078 2.520 1.00 0.00 H new ATOM 0 HB2 ALA A 166 -12.208 9.643 2.621 1.00 0.00 H new ATOM 0 HB3 ALA A 166 -12.055 8.644 1.157 1.00 0.00 H new ATOM 498 N SER A 167 -11.696 5.634 3.003 1.00 0.00 N ATOM 499 CA SER A 167 -11.738 4.217 2.663 1.00 0.00 C ATOM 500 C SER A 167 -12.110 4.020 1.196 1.00 0.00 C ATOM 501 O SER A 167 -11.320 3.496 0.410 1.00 0.00 O ATOM 502 CB SER A 167 -12.741 3.485 3.557 1.00 0.00 C ATOM 503 OG SER A 167 -12.954 4.188 4.769 1.00 0.00 O ATOM 0 H SER A 167 -12.344 5.909 3.741 1.00 0.00 H new ATOM 0 HA SER A 167 -10.744 3.801 2.827 1.00 0.00 H new ATOM 0 HB2 SER A 167 -13.687 3.370 3.029 1.00 0.00 H new ATOM 0 HB3 SER A 167 -12.374 2.482 3.775 1.00 0.00 H new ATOM 0 HG SER A 167 -13.600 3.700 5.321 1.00 0.00 H new ATOM 509 N PHE A 168 -13.317 4.444 0.835 1.00 0.00 N ATOM 510 CA PHE A 168 -13.792 4.315 -0.537 1.00 0.00 C ATOM 511 C PHE A 168 -14.989 5.225 -0.786 1.00 0.00 C ATOM 512 O PHE A 168 -15.436 5.939 0.112 1.00 0.00 O ATOM 513 CB PHE A 168 -14.171 2.862 -0.834 1.00 0.00 C ATOM 514 CG PHE A 168 -15.296 2.350 0.019 1.00 0.00 C ATOM 515 CD1 PHE A 168 -15.042 1.798 1.265 1.00 0.00 C ATOM 516 CD2 PHE A 168 -16.606 2.418 -0.426 1.00 0.00 C ATOM 517 CE1 PHE A 168 -16.075 1.326 2.052 1.00 0.00 C ATOM 518 CE2 PHE A 168 -17.643 1.948 0.357 1.00 0.00 C ATOM 519 CZ PHE A 168 -17.379 1.401 1.597 1.00 0.00 C ATOM 0 H PHE A 168 -13.983 4.879 1.473 1.00 0.00 H new ATOM 0 HA PHE A 168 -12.984 4.616 -1.204 1.00 0.00 H new ATOM 0 HB2 PHE A 168 -14.453 2.776 -1.883 1.00 0.00 H new ATOM 0 HB3 PHE A 168 -13.296 2.229 -0.686 1.00 0.00 H new ATOM 0 HD1 PHE A 168 -14.025 1.736 1.625 1.00 0.00 H new ATOM 0 HD2 PHE A 168 -16.819 2.843 -1.396 1.00 0.00 H new ATOM 0 HE1 PHE A 168 -15.864 0.899 3.021 1.00 0.00 H new ATOM 0 HE2 PHE A 168 -18.660 2.009 -0.001 1.00 0.00 H new ATOM 0 HZ PHE A 168 -18.188 1.033 2.210 1.00 0.00 H new ATOM 529 N VAL A 169 -15.506 5.194 -2.010 1.00 0.00 N ATOM 530 CA VAL A 169 -16.651 6.015 -2.377 1.00 0.00 C ATOM 531 C VAL A 169 -17.573 5.272 -3.337 1.00 0.00 C ATOM 532 O VAL A 169 -17.109 4.566 -4.235 1.00 0.00 O ATOM 533 CB VAL A 169 -16.209 7.338 -3.030 1.00 0.00 C ATOM 534 CG1 VAL A 169 -15.456 8.202 -2.029 1.00 0.00 C ATOM 535 CG2 VAL A 169 -15.355 7.067 -4.259 1.00 0.00 C ATOM 0 H VAL A 169 -15.149 4.608 -2.764 1.00 0.00 H new ATOM 0 HA VAL A 169 -17.190 6.236 -1.456 1.00 0.00 H new ATOM 0 HB VAL A 169 -17.099 7.881 -3.347 1.00 0.00 H new ATOM 0 HG11 VAL A 169 -15.152 9.133 -2.508 1.00 0.00 H new ATOM 0 HG12 VAL A 169 -16.104 8.425 -1.181 1.00 0.00 H new ATOM 0 HG13 VAL A 169 -14.572 7.668 -1.680 1.00 0.00 H new ATOM 0 HG21 VAL A 169 -15.052 8.013 -4.707 1.00 0.00 H new ATOM 0 HG22 VAL A 169 -14.469 6.502 -3.969 1.00 0.00 H new ATOM 0 HG23 VAL A 169 -15.931 6.491 -4.983 1.00 0.00 H new ATOM 545 N VAL A 170 -18.877 5.432 -3.145 1.00 0.00 N ATOM 546 CA VAL A 170 -19.859 4.774 -3.998 1.00 0.00 C ATOM 547 C VAL A 170 -20.071 5.552 -5.292 1.00 0.00 C ATOM 548 O VAL A 170 -21.069 6.254 -5.452 1.00 0.00 O ATOM 549 CB VAL A 170 -21.212 4.612 -3.280 1.00 0.00 C ATOM 550 CG1 VAL A 170 -22.159 3.758 -4.109 1.00 0.00 C ATOM 551 CG2 VAL A 170 -21.014 4.011 -1.897 1.00 0.00 C ATOM 0 H VAL A 170 -19.278 6.011 -2.407 1.00 0.00 H new ATOM 0 HA VAL A 170 -19.462 3.786 -4.232 1.00 0.00 H new ATOM 0 HB VAL A 170 -21.659 5.599 -3.162 1.00 0.00 H new ATOM 0 HG11 VAL A 170 -23.109 3.655 -3.585 1.00 0.00 H new ATOM 0 HG12 VAL A 170 -22.327 4.234 -5.075 1.00 0.00 H new ATOM 0 HG13 VAL A 170 -21.720 2.772 -4.262 1.00 0.00 H new ATOM 0 HG21 VAL A 170 -21.981 3.904 -1.405 1.00 0.00 H new ATOM 0 HG22 VAL A 170 -20.544 3.032 -1.990 1.00 0.00 H new ATOM 0 HG23 VAL A 170 -20.375 4.666 -1.304 1.00 0.00 H new ATOM 561 N LEU A 171 -19.120 5.424 -6.212 1.00 0.00 N ATOM 562 CA LEU A 171 -19.198 6.115 -7.494 1.00 0.00 C ATOM 563 C LEU A 171 -20.485 5.753 -8.231 1.00 0.00 C ATOM 564 O LEU A 171 -21.373 5.111 -7.667 1.00 0.00 O ATOM 565 CB LEU A 171 -17.980 5.769 -8.355 1.00 0.00 C ATOM 566 CG LEU A 171 -17.471 6.906 -9.248 1.00 0.00 C ATOM 567 CD1 LEU A 171 -16.206 7.518 -8.667 1.00 0.00 C ATOM 568 CD2 LEU A 171 -17.220 6.402 -10.661 1.00 0.00 C ATOM 0 H LEU A 171 -18.286 4.848 -6.093 1.00 0.00 H new ATOM 0 HA LEU A 171 -19.205 7.188 -7.304 1.00 0.00 H new ATOM 0 HB2 LEU A 171 -17.169 5.452 -7.699 1.00 0.00 H new ATOM 0 HB3 LEU A 171 -18.231 4.917 -8.986 1.00 0.00 H new ATOM 0 HG LEU A 171 -18.238 7.680 -9.289 1.00 0.00 H new ATOM 0 HD11 LEU A 171 -15.860 8.323 -9.315 1.00 0.00 H new ATOM 0 HD12 LEU A 171 -16.417 7.916 -7.675 1.00 0.00 H new ATOM 0 HD13 LEU A 171 -15.432 6.754 -8.594 1.00 0.00 H new ATOM 0 HD21 LEU A 171 -16.859 7.222 -11.281 1.00 0.00 H new ATOM 0 HD22 LEU A 171 -16.472 5.609 -10.637 1.00 0.00 H new ATOM 0 HD23 LEU A 171 -18.148 6.013 -11.079 1.00 0.00 H new ATOM 580 N ASP A 172 -20.585 6.170 -9.489 1.00 0.00 N ATOM 581 CA ASP A 172 -21.767 5.894 -10.300 1.00 0.00 C ATOM 582 C ASP A 172 -22.100 4.405 -10.305 1.00 0.00 C ATOM 583 O ASP A 172 -21.596 3.647 -11.134 1.00 0.00 O ATOM 584 CB ASP A 172 -21.552 6.383 -11.734 1.00 0.00 C ATOM 585 CG ASP A 172 -22.835 6.393 -12.541 1.00 0.00 C ATOM 586 OD1 ASP A 172 -23.559 7.410 -12.492 1.00 0.00 O ATOM 587 OD2 ASP A 172 -23.119 5.385 -13.220 1.00 0.00 O ATOM 0 H ASP A 172 -19.860 6.702 -9.971 1.00 0.00 H new ATOM 0 HA ASP A 172 -22.607 6.430 -9.858 1.00 0.00 H new ATOM 0 HB2 ASP A 172 -21.132 7.389 -11.713 1.00 0.00 H new ATOM 0 HB3 ASP A 172 -20.821 5.743 -12.227 1.00 0.00 H new ATOM 592 N GLY A 173 -22.956 3.993 -9.375 1.00 0.00 N ATOM 593 CA GLY A 173 -23.351 2.597 -9.288 1.00 0.00 C ATOM 594 C GLY A 173 -22.166 1.653 -9.250 1.00 0.00 C ATOM 595 O GLY A 173 -22.266 0.503 -9.679 1.00 0.00 O ATOM 0 H GLY A 173 -23.385 4.602 -8.678 1.00 0.00 H new ATOM 0 HA2 GLY A 173 -23.956 2.450 -8.393 1.00 0.00 H new ATOM 0 HA3 GLY A 173 -23.981 2.348 -10.142 1.00 0.00 H new ATOM 599 N GLU A 174 -21.040 2.136 -8.734 1.00 0.00 N ATOM 600 CA GLU A 174 -19.832 1.323 -8.644 1.00 0.00 C ATOM 601 C GLU A 174 -18.898 1.850 -7.560 1.00 0.00 C ATOM 602 O GLU A 174 -18.503 3.016 -7.579 1.00 0.00 O ATOM 603 CB GLU A 174 -19.107 1.300 -9.991 1.00 0.00 C ATOM 604 CG GLU A 174 -19.712 0.328 -10.990 1.00 0.00 C ATOM 605 CD GLU A 174 -18.660 -0.464 -11.742 1.00 0.00 C ATOM 606 OE1 GLU A 174 -17.570 0.090 -11.999 1.00 0.00 O ATOM 607 OE2 GLU A 174 -18.926 -1.637 -12.077 1.00 0.00 O ATOM 0 H GLU A 174 -20.939 3.084 -8.372 1.00 0.00 H new ATOM 0 HA GLU A 174 -20.127 0.308 -8.380 1.00 0.00 H new ATOM 0 HB2 GLU A 174 -19.120 2.303 -10.418 1.00 0.00 H new ATOM 0 HB3 GLU A 174 -18.062 1.037 -9.827 1.00 0.00 H new ATOM 0 HG2 GLU A 174 -20.375 -0.361 -10.466 1.00 0.00 H new ATOM 0 HG3 GLU A 174 -20.325 0.880 -11.703 1.00 0.00 H new ATOM 614 N ASN A 175 -18.548 0.982 -6.617 1.00 0.00 N ATOM 615 CA ASN A 175 -17.658 1.357 -5.525 1.00 0.00 C ATOM 616 C ASN A 175 -16.200 1.294 -5.968 1.00 0.00 C ATOM 617 O ASN A 175 -15.662 0.216 -6.214 1.00 0.00 O ATOM 618 CB ASN A 175 -17.879 0.439 -4.321 1.00 0.00 C ATOM 619 CG ASN A 175 -19.284 0.547 -3.762 1.00 0.00 C ATOM 620 OD1 ASN A 175 -19.971 1.548 -3.970 1.00 0.00 O ATOM 621 ND2 ASN A 175 -19.717 -0.485 -3.049 1.00 0.00 N ATOM 0 H ASN A 175 -18.867 0.014 -6.587 1.00 0.00 H new ATOM 0 HA ASN A 175 -17.888 2.383 -5.237 1.00 0.00 H new ATOM 0 HB2 ASN A 175 -17.686 -0.593 -4.614 1.00 0.00 H new ATOM 0 HB3 ASN A 175 -17.160 0.689 -3.541 1.00 0.00 H new ATOM 0 HD21 ASN A 175 -20.654 -0.470 -2.647 1.00 0.00 H new ATOM 0 HD22 ASN A 175 -19.112 -1.293 -2.903 1.00 0.00 H new ATOM 628 N LYS A 176 -15.566 2.459 -6.069 1.00 0.00 N ATOM 629 CA LYS A 176 -14.169 2.535 -6.485 1.00 0.00 C ATOM 630 C LYS A 176 -13.289 3.052 -5.353 1.00 0.00 C ATOM 631 O LYS A 176 -13.750 3.790 -4.482 1.00 0.00 O ATOM 632 CB LYS A 176 -14.030 3.441 -7.710 1.00 0.00 C ATOM 633 CG LYS A 176 -15.092 3.200 -8.771 1.00 0.00 C ATOM 634 CD LYS A 176 -14.477 3.027 -10.151 1.00 0.00 C ATOM 635 CE LYS A 176 -15.486 3.309 -11.253 1.00 0.00 C ATOM 636 NZ LYS A 176 -15.450 2.270 -12.320 1.00 0.00 N ATOM 0 H LYS A 176 -15.997 3.362 -5.869 1.00 0.00 H new ATOM 0 HA LYS A 176 -13.839 1.529 -6.745 1.00 0.00 H new ATOM 0 HB2 LYS A 176 -14.079 4.482 -7.389 1.00 0.00 H new ATOM 0 HB3 LYS A 176 -13.046 3.290 -8.153 1.00 0.00 H new ATOM 0 HG2 LYS A 176 -15.668 2.311 -8.515 1.00 0.00 H new ATOM 0 HG3 LYS A 176 -15.789 4.038 -8.785 1.00 0.00 H new ATOM 0 HD2 LYS A 176 -13.625 3.698 -10.257 1.00 0.00 H new ATOM 0 HD3 LYS A 176 -14.097 2.011 -10.256 1.00 0.00 H new ATOM 0 HE2 LYS A 176 -16.487 3.355 -10.825 1.00 0.00 H new ATOM 0 HE3 LYS A 176 -15.281 4.286 -11.691 1.00 0.00 H new ATOM 0 HZ1 LYS A 176 -15.654 2.710 -13.240 1.00 0.00 H new ATOM 0 HZ2 LYS A 176 -14.507 1.832 -12.347 1.00 0.00 H new ATOM 0 HZ3 LYS A 176 -16.164 1.541 -12.119 1.00 0.00 H new ATOM 650 N ARG A 177 -12.020 2.659 -5.372 1.00 0.00 N ATOM 651 CA ARG A 177 -11.073 3.083 -4.346 1.00 0.00 C ATOM 652 C ARG A 177 -9.775 3.577 -4.977 1.00 0.00 C ATOM 653 O ARG A 177 -9.298 3.014 -5.962 1.00 0.00 O ATOM 654 CB ARG A 177 -10.781 1.929 -3.385 1.00 0.00 C ATOM 655 CG ARG A 177 -10.177 2.377 -2.064 1.00 0.00 C ATOM 656 CD ARG A 177 -8.660 2.283 -2.084 1.00 0.00 C ATOM 657 NE ARG A 177 -8.055 2.895 -0.902 1.00 0.00 N ATOM 658 CZ ARG A 177 -6.758 2.825 -0.613 1.00 0.00 C ATOM 659 NH1 ARG A 177 -5.926 2.174 -1.415 1.00 0.00 N ATOM 660 NH2 ARG A 177 -6.291 3.411 0.482 1.00 0.00 N ATOM 0 H ARG A 177 -11.623 2.048 -6.086 1.00 0.00 H new ATOM 0 HA ARG A 177 -11.521 3.906 -3.789 1.00 0.00 H new ATOM 0 HB2 ARG A 177 -11.707 1.388 -3.187 1.00 0.00 H new ATOM 0 HB3 ARG A 177 -10.100 1.228 -3.868 1.00 0.00 H new ATOM 0 HG2 ARG A 177 -10.476 3.404 -1.856 1.00 0.00 H new ATOM 0 HG3 ARG A 177 -10.570 1.761 -1.256 1.00 0.00 H new ATOM 0 HD2 ARG A 177 -8.363 1.236 -2.142 1.00 0.00 H new ATOM 0 HD3 ARG A 177 -8.279 2.772 -2.980 1.00 0.00 H new ATOM 0 HE ARG A 177 -8.663 3.406 -0.261 1.00 0.00 H new ATOM 0 HH11 ARG A 177 -6.279 1.723 -2.259 1.00 0.00 H new ATOM 0 HH12 ARG A 177 -4.933 2.124 -1.188 1.00 0.00 H new ATOM 0 HH21 ARG A 177 -6.926 3.915 1.101 1.00 0.00 H new ATOM 0 HH22 ARG A 177 -5.297 3.358 0.704 1.00 0.00 H new ATOM 674 N TYR A 178 -9.207 4.633 -4.403 1.00 0.00 N ATOM 675 CA TYR A 178 -7.965 5.207 -4.909 1.00 0.00 C ATOM 676 C TYR A 178 -6.840 4.174 -4.889 1.00 0.00 C ATOM 677 O TYR A 178 -6.439 3.700 -3.827 1.00 0.00 O ATOM 678 CB TYR A 178 -7.568 6.427 -4.078 1.00 0.00 C ATOM 679 CG TYR A 178 -6.516 7.292 -4.737 1.00 0.00 C ATOM 680 CD1 TYR A 178 -5.168 6.971 -4.639 1.00 0.00 C ATOM 681 CD2 TYR A 178 -6.872 8.427 -5.454 1.00 0.00 C ATOM 682 CE1 TYR A 178 -4.203 7.760 -5.240 1.00 0.00 C ATOM 683 CE2 TYR A 178 -5.913 9.219 -6.056 1.00 0.00 C ATOM 684 CZ TYR A 178 -4.581 8.882 -5.946 1.00 0.00 C ATOM 685 OH TYR A 178 -3.624 9.668 -6.545 1.00 0.00 O ATOM 0 H TYR A 178 -9.588 5.109 -3.586 1.00 0.00 H new ATOM 0 HA TYR A 178 -8.130 5.517 -5.941 1.00 0.00 H new ATOM 0 HB2 TYR A 178 -8.455 7.031 -3.887 1.00 0.00 H new ATOM 0 HB3 TYR A 178 -7.196 6.091 -3.110 1.00 0.00 H new ATOM 0 HD1 TYR A 178 -4.869 6.093 -4.086 1.00 0.00 H new ATOM 0 HD2 TYR A 178 -7.915 8.695 -5.542 1.00 0.00 H new ATOM 0 HE1 TYR A 178 -3.159 7.498 -5.156 1.00 0.00 H new ATOM 0 HE2 TYR A 178 -6.206 10.098 -6.610 1.00 0.00 H new ATOM 0 HH TYR A 178 -4.057 10.419 -7.003 1.00 0.00 H new ATOM 695 N CYS A 179 -6.335 3.835 -6.071 1.00 0.00 N ATOM 696 CA CYS A 179 -5.256 2.862 -6.190 1.00 0.00 C ATOM 697 C CYS A 179 -3.910 3.499 -5.860 1.00 0.00 C ATOM 698 O CYS A 179 -3.423 4.362 -6.593 1.00 0.00 O ATOM 699 CB CYS A 179 -5.223 2.278 -7.604 1.00 0.00 C ATOM 700 SG CYS A 179 -3.919 1.051 -7.871 1.00 0.00 S ATOM 0 H CYS A 179 -6.656 4.220 -6.959 1.00 0.00 H new ATOM 0 HA CYS A 179 -5.443 2.060 -5.476 1.00 0.00 H new ATOM 0 HB2 CYS A 179 -6.188 1.818 -7.818 1.00 0.00 H new ATOM 0 HB3 CYS A 179 -5.092 3.091 -8.318 1.00 0.00 H new ATOM 0 HG CYS A 179 -3.350 1.266 -9.020 1.00 0.00 H new ATOM 705 N GLN A 180 -3.309 3.064 -4.757 1.00 0.00 N ATOM 706 CA GLN A 180 -2.016 3.585 -4.328 1.00 0.00 C ATOM 707 C GLN A 180 -0.900 3.063 -5.225 1.00 0.00 C ATOM 708 O GLN A 180 0.049 2.430 -4.758 1.00 0.00 O ATOM 709 CB GLN A 180 -1.743 3.202 -2.872 1.00 0.00 C ATOM 710 CG GLN A 180 -2.447 4.095 -1.864 1.00 0.00 C ATOM 711 CD GLN A 180 -1.859 5.490 -1.812 1.00 0.00 C ATOM 712 OE1 GLN A 180 -1.834 6.206 -2.813 1.00 0.00 O ATOM 713 NE2 GLN A 180 -1.379 5.887 -0.638 1.00 0.00 N ATOM 0 H GLN A 180 -3.699 2.349 -4.142 1.00 0.00 H new ATOM 0 HA GLN A 180 -2.044 4.672 -4.407 1.00 0.00 H new ATOM 0 HB2 GLN A 180 -2.057 2.170 -2.712 1.00 0.00 H new ATOM 0 HB3 GLN A 180 -0.669 3.240 -2.691 1.00 0.00 H new ATOM 0 HG2 GLN A 180 -3.505 4.160 -2.118 1.00 0.00 H new ATOM 0 HG3 GLN A 180 -2.384 3.641 -0.875 1.00 0.00 H new ATOM 0 HE21 GLN A 180 -1.419 5.262 0.167 1.00 0.00 H new ATOM 0 HE22 GLN A 180 -0.970 6.817 -0.542 1.00 0.00 H new ATOM 722 N GLN A 181 -1.025 3.332 -6.517 1.00 0.00 N ATOM 723 CA GLN A 181 -0.038 2.895 -7.495 1.00 0.00 C ATOM 724 C GLN A 181 -0.267 3.581 -8.839 1.00 0.00 C ATOM 725 O GLN A 181 0.684 3.959 -9.525 1.00 0.00 O ATOM 726 CB GLN A 181 -0.096 1.376 -7.666 1.00 0.00 C ATOM 727 CG GLN A 181 1.056 0.643 -6.998 1.00 0.00 C ATOM 728 CD GLN A 181 1.502 -0.576 -7.779 1.00 0.00 C ATOM 729 OE1 GLN A 181 2.168 -0.459 -8.807 1.00 0.00 O ATOM 730 NE2 GLN A 181 1.134 -1.757 -7.296 1.00 0.00 N ATOM 0 H GLN A 181 -1.806 3.854 -6.914 1.00 0.00 H new ATOM 0 HA GLN A 181 0.950 3.173 -7.129 1.00 0.00 H new ATOM 0 HB2 GLN A 181 -1.036 1.008 -7.255 1.00 0.00 H new ATOM 0 HB3 GLN A 181 -0.098 1.139 -8.730 1.00 0.00 H new ATOM 0 HG2 GLN A 181 1.898 1.325 -6.884 1.00 0.00 H new ATOM 0 HG3 GLN A 181 0.755 0.338 -5.996 1.00 0.00 H new ATOM 0 HE21 GLN A 181 0.582 -1.808 -6.440 1.00 0.00 H new ATOM 0 HE22 GLN A 181 1.404 -2.613 -7.781 1.00 0.00 H new ATOM 739 N CYS A 182 -1.535 3.742 -9.207 1.00 0.00 N ATOM 740 CA CYS A 182 -1.889 4.385 -10.469 1.00 0.00 C ATOM 741 C CYS A 182 -2.522 5.751 -10.222 1.00 0.00 C ATOM 742 O CYS A 182 -2.403 6.659 -11.044 1.00 0.00 O ATOM 743 CB CYS A 182 -2.852 3.501 -11.262 1.00 0.00 C ATOM 744 SG CYS A 182 -2.303 1.789 -11.447 1.00 0.00 S ATOM 0 H CYS A 182 -2.333 3.437 -8.650 1.00 0.00 H new ATOM 0 HA CYS A 182 -0.976 4.525 -11.047 1.00 0.00 H new ATOM 0 HB2 CYS A 182 -3.824 3.508 -10.769 1.00 0.00 H new ATOM 0 HB3 CYS A 182 -2.994 3.934 -12.252 1.00 0.00 H new ATOM 0 HG CYS A 182 -3.069 1.177 -12.300 1.00 0.00 H new ATOM 749 N GLY A 183 -3.196 5.889 -9.085 1.00 0.00 N ATOM 750 CA GLY A 183 -3.837 7.147 -8.752 1.00 0.00 C ATOM 751 C GLY A 183 -5.308 7.162 -9.117 1.00 0.00 C ATOM 752 O GLY A 183 -6.153 7.532 -8.301 1.00 0.00 O ATOM 0 H GLY A 183 -3.310 5.152 -8.389 1.00 0.00 H new ATOM 0 HA2 GLY A 183 -3.729 7.335 -7.684 1.00 0.00 H new ATOM 0 HA3 GLY A 183 -3.329 7.959 -9.272 1.00 0.00 H new ATOM 756 N LYS A 184 -5.616 6.758 -10.345 1.00 0.00 N ATOM 757 CA LYS A 184 -6.997 6.728 -10.815 1.00 0.00 C ATOM 758 C LYS A 184 -7.842 5.802 -9.945 1.00 0.00 C ATOM 759 O LYS A 184 -7.316 5.077 -9.099 1.00 0.00 O ATOM 760 CB LYS A 184 -7.057 6.273 -12.274 1.00 0.00 C ATOM 761 CG LYS A 184 -6.594 4.840 -12.488 1.00 0.00 C ATOM 762 CD LYS A 184 -7.156 4.258 -13.775 1.00 0.00 C ATOM 763 CE LYS A 184 -6.103 4.203 -14.870 1.00 0.00 C ATOM 764 NZ LYS A 184 -4.853 3.540 -14.407 1.00 0.00 N ATOM 0 H LYS A 184 -4.929 6.447 -11.032 1.00 0.00 H new ATOM 0 HA LYS A 184 -7.401 7.738 -10.745 1.00 0.00 H new ATOM 0 HB2 LYS A 184 -8.081 6.372 -12.634 1.00 0.00 H new ATOM 0 HB3 LYS A 184 -6.441 6.939 -12.878 1.00 0.00 H new ATOM 0 HG2 LYS A 184 -5.505 4.809 -12.519 1.00 0.00 H new ATOM 0 HG3 LYS A 184 -6.906 4.226 -11.643 1.00 0.00 H new ATOM 0 HD2 LYS A 184 -7.537 3.255 -13.585 1.00 0.00 H new ATOM 0 HD3 LYS A 184 -7.999 4.862 -14.110 1.00 0.00 H new ATOM 0 HE2 LYS A 184 -6.502 3.665 -15.730 1.00 0.00 H new ATOM 0 HE3 LYS A 184 -5.874 5.215 -15.205 1.00 0.00 H new ATOM 0 HZ1 LYS A 184 -4.426 3.015 -15.196 1.00 0.00 H new ATOM 0 HZ2 LYS A 184 -4.184 4.260 -14.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 184 -5.075 2.882 -13.633 1.00 0.00 H new ATOM 778 N PHE A 185 -9.154 5.831 -10.155 1.00 0.00 N ATOM 779 CA PHE A 185 -10.070 4.994 -9.388 1.00 0.00 C ATOM 780 C PHE A 185 -10.198 3.609 -10.015 1.00 0.00 C ATOM 781 O PHE A 185 -10.298 3.475 -11.235 1.00 0.00 O ATOM 782 CB PHE A 185 -11.446 5.657 -9.299 1.00 0.00 C ATOM 783 CG PHE A 185 -11.515 6.763 -8.285 1.00 0.00 C ATOM 784 CD1 PHE A 185 -11.088 6.555 -6.982 1.00 0.00 C ATOM 785 CD2 PHE A 185 -12.007 8.012 -8.633 1.00 0.00 C ATOM 786 CE1 PHE A 185 -11.151 7.571 -6.047 1.00 0.00 C ATOM 787 CE2 PHE A 185 -12.071 9.031 -7.702 1.00 0.00 C ATOM 788 CZ PHE A 185 -11.643 8.811 -6.407 1.00 0.00 C ATOM 0 H PHE A 185 -9.607 6.425 -10.850 1.00 0.00 H new ATOM 0 HA PHE A 185 -9.664 4.880 -8.383 1.00 0.00 H new ATOM 0 HB2 PHE A 185 -11.712 6.056 -10.278 1.00 0.00 H new ATOM 0 HB3 PHE A 185 -12.190 4.900 -9.050 1.00 0.00 H new ATOM 0 HD1 PHE A 185 -10.702 5.588 -6.695 1.00 0.00 H new ATOM 0 HD2 PHE A 185 -12.344 8.190 -9.643 1.00 0.00 H new ATOM 0 HE1 PHE A 185 -10.816 7.396 -5.035 1.00 0.00 H new ATOM 0 HE2 PHE A 185 -12.456 9.999 -7.987 1.00 0.00 H new ATOM 0 HZ PHE A 185 -11.693 9.606 -5.678 1.00 0.00 H new ATOM 798 N HIS A 186 -10.192 2.583 -9.171 1.00 0.00 N ATOM 799 CA HIS A 186 -10.308 1.206 -9.638 1.00 0.00 C ATOM 800 C HIS A 186 -11.549 0.537 -9.057 1.00 0.00 C ATOM 801 O HIS A 186 -12.317 1.162 -8.326 1.00 0.00 O ATOM 802 CB HIS A 186 -9.062 0.409 -9.249 1.00 0.00 C ATOM 803 CG HIS A 186 -7.883 0.659 -10.138 1.00 0.00 C ATOM 804 ND1 HIS A 186 -7.992 1.158 -11.418 1.00 0.00 N ATOM 805 CD2 HIS A 186 -6.559 0.475 -9.921 1.00 0.00 C ATOM 806 CE1 HIS A 186 -6.787 1.269 -11.951 1.00 0.00 C ATOM 807 NE2 HIS A 186 -5.901 0.862 -11.061 1.00 0.00 N ATOM 0 H HIS A 186 -10.108 2.679 -8.159 1.00 0.00 H new ATOM 0 HA HIS A 186 -10.399 1.224 -10.724 1.00 0.00 H new ATOM 0 HB2 HIS A 186 -8.790 0.656 -8.223 1.00 0.00 H new ATOM 0 HB3 HIS A 186 -9.301 -0.654 -9.269 1.00 0.00 H new ATOM 0 HD2 HIS A 186 -6.105 0.094 -9.018 1.00 0.00 H new ATOM 0 HE1 HIS A 186 -6.566 1.631 -12.944 1.00 0.00 H new ATOM 0 HE2 HIS A 186 -4.891 0.839 -11.199 1.00 0.00 H new ATOM 815 N LEU A 187 -11.737 -0.738 -9.385 1.00 0.00 N ATOM 816 CA LEU A 187 -12.884 -1.491 -8.891 1.00 0.00 C ATOM 817 C LEU A 187 -12.558 -2.160 -7.559 1.00 0.00 C ATOM 818 O LEU A 187 -11.534 -2.832 -7.423 1.00 0.00 O ATOM 819 CB LEU A 187 -13.309 -2.544 -9.917 1.00 0.00 C ATOM 820 CG LEU A 187 -14.418 -2.103 -10.876 1.00 0.00 C ATOM 821 CD1 LEU A 187 -15.710 -1.846 -10.116 1.00 0.00 C ATOM 822 CD2 LEU A 187 -13.992 -0.862 -11.646 1.00 0.00 C ATOM 0 H LEU A 187 -11.111 -1.270 -9.990 1.00 0.00 H new ATOM 0 HA LEU A 187 -13.708 -0.795 -8.736 1.00 0.00 H new ATOM 0 HB2 LEU A 187 -12.436 -2.832 -10.503 1.00 0.00 H new ATOM 0 HB3 LEU A 187 -13.643 -3.434 -9.384 1.00 0.00 H new ATOM 0 HG LEU A 187 -14.597 -2.906 -11.591 1.00 0.00 H new ATOM 0 HD11 LEU A 187 -16.487 -1.534 -10.814 1.00 0.00 H new ATOM 0 HD12 LEU A 187 -16.023 -2.760 -9.610 1.00 0.00 H new ATOM 0 HD13 LEU A 187 -15.548 -1.060 -9.378 1.00 0.00 H new ATOM 0 HD21 LEU A 187 -14.792 -0.562 -12.323 1.00 0.00 H new ATOM 0 HD22 LEU A 187 -13.786 -0.052 -10.946 1.00 0.00 H new ATOM 0 HD23 LEU A 187 -13.093 -1.082 -12.221 1.00 0.00 H new ATOM 834 N LEU A 188 -13.433 -1.969 -6.579 1.00 0.00 N ATOM 835 CA LEU A 188 -13.239 -2.551 -5.255 1.00 0.00 C ATOM 836 C LEU A 188 -13.250 -4.085 -5.294 1.00 0.00 C ATOM 837 O LEU A 188 -12.435 -4.721 -4.626 1.00 0.00 O ATOM 838 CB LEU A 188 -14.306 -2.037 -4.282 1.00 0.00 C ATOM 839 CG LEU A 188 -13.766 -1.218 -3.109 1.00 0.00 C ATOM 840 CD1 LEU A 188 -14.807 -0.215 -2.634 1.00 0.00 C ATOM 841 CD2 LEU A 188 -13.347 -2.134 -1.969 1.00 0.00 C ATOM 0 H LEU A 188 -14.284 -1.416 -6.675 1.00 0.00 H new ATOM 0 HA LEU A 188 -12.255 -2.239 -4.904 1.00 0.00 H new ATOM 0 HB2 LEU A 188 -15.018 -1.425 -4.836 1.00 0.00 H new ATOM 0 HB3 LEU A 188 -14.858 -2.890 -3.887 1.00 0.00 H new ATOM 0 HG LEU A 188 -12.889 -0.667 -3.448 1.00 0.00 H new ATOM 0 HD11 LEU A 188 -14.405 0.359 -1.799 1.00 0.00 H new ATOM 0 HD12 LEU A 188 -15.060 0.461 -3.451 1.00 0.00 H new ATOM 0 HD13 LEU A 188 -15.703 -0.746 -2.312 1.00 0.00 H new ATOM 0 HD21 LEU A 188 -12.965 -1.535 -1.142 1.00 0.00 H new ATOM 0 HD22 LEU A 188 -14.208 -2.712 -1.631 1.00 0.00 H new ATOM 0 HD23 LEU A 188 -12.568 -2.813 -2.315 1.00 0.00 H new ATOM 853 N PRO A 189 -14.165 -4.714 -6.064 1.00 0.00 N ATOM 854 CA PRO A 189 -14.232 -6.178 -6.145 1.00 0.00 C ATOM 855 C PRO A 189 -12.940 -6.792 -6.673 1.00 0.00 C ATOM 856 O PRO A 189 -12.640 -7.956 -6.410 1.00 0.00 O ATOM 857 CB PRO A 189 -15.391 -6.447 -7.113 1.00 0.00 C ATOM 858 CG PRO A 189 -15.579 -5.173 -7.858 1.00 0.00 C ATOM 859 CD PRO A 189 -15.195 -4.075 -6.908 1.00 0.00 C ATOM 0 HA PRO A 189 -14.378 -6.625 -5.162 1.00 0.00 H new ATOM 0 HB2 PRO A 189 -15.156 -7.268 -7.790 1.00 0.00 H new ATOM 0 HB3 PRO A 189 -16.297 -6.726 -6.575 1.00 0.00 H new ATOM 0 HG2 PRO A 189 -14.957 -5.149 -8.753 1.00 0.00 H new ATOM 0 HG3 PRO A 189 -16.613 -5.062 -8.185 1.00 0.00 H new ATOM 0 HD2 PRO A 189 -14.803 -3.204 -7.434 1.00 0.00 H new ATOM 0 HD3 PRO A 189 -16.046 -3.735 -6.318 1.00 0.00 H new ATOM 867 N ASP A 190 -12.174 -5.999 -7.419 1.00 0.00 N ATOM 868 CA ASP A 190 -10.913 -6.467 -7.980 1.00 0.00 C ATOM 869 C ASP A 190 -9.730 -5.870 -7.220 1.00 0.00 C ATOM 870 O ASP A 190 -8.810 -5.313 -7.819 1.00 0.00 O ATOM 871 CB ASP A 190 -10.824 -6.100 -9.462 1.00 0.00 C ATOM 872 CG ASP A 190 -12.036 -6.560 -10.246 1.00 0.00 C ATOM 873 OD1 ASP A 190 -12.146 -7.776 -10.512 1.00 0.00 O ATOM 874 OD2 ASP A 190 -12.878 -5.706 -10.595 1.00 0.00 O ATOM 0 H ASP A 190 -12.405 -5.032 -7.647 1.00 0.00 H new ATOM 0 HA ASP A 190 -10.876 -7.552 -7.881 1.00 0.00 H new ATOM 0 HB2 ASP A 190 -10.720 -5.019 -9.560 1.00 0.00 H new ATOM 0 HB3 ASP A 190 -9.927 -6.547 -9.891 1.00 0.00 H new