USER MOD reduce.3.24.130724 H: found=0, std=0, add=432, rem=0, adj=13 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 -136:sc= -0.324 USER MOD Set 1.2: A 182 CYS SG : rot -170:sc= 0.0553 USER MOD Set 1.3: A 186 HIS : no HD1:sc= -1 K(o=-1.3,f=-0.56) USER MOD Set 2.1: A 138 CYS SG : rot -87:sc= -3.93! 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= -0.239 USER MOD Set 2.4: A 163 CYS SG : rot 145:sc= -3.48! USER MOD Single : A 139 GLN : amide:sc= -1.58 K(o=-1.6,f=-2.3) USER MOD Single : A 148 SER OG : rot 180:sc= 0 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 HE2:sc= -2.88! K(o=-2.9!,f=-1.5) USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 157 HIS : no HD1:sc= -2 K(o=-2,f=-2.7!) USER MOD Single : A 165 THR OG1 : rot -75:sc= 0.534 USER MOD Single : A 167 SER OG : rot 106:sc= 1.58 USER MOD Single : A 175 ASN : amide:sc= -0.509 K(o=-0.51,f=-2.5) USER MOD Single : A 176 LYS NZ :NH3+ -142:sc= 0.0979 (180deg=0) USER MOD Single : A 178 TYR OH : rot -39:sc= 0.247 USER MOD Single : A 180 GLN : amide:sc= -0.323 K(o=-0.32,f=-1) USER MOD Single : A 181 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 184 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 17 N ALA A 136 -7.928 20.515 -11.913 1.00 0.00 N ATOM 18 CA ALA A 136 -8.142 19.610 -10.789 1.00 0.00 C ATOM 19 C ALA A 136 -9.543 19.775 -10.212 1.00 0.00 C ATOM 20 O ALA A 136 -9.896 20.843 -9.710 1.00 0.00 O ATOM 21 CB ALA A 136 -7.094 19.851 -9.714 1.00 0.00 C ATOM 0 HA ALA A 136 -8.046 18.587 -11.152 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -7.264 19.170 -8.880 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -6.101 19.676 -10.128 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -7.164 20.880 -9.362 1.00 0.00 H new ATOM 27 N ARG A 137 -10.339 18.714 -10.290 1.00 0.00 N ATOM 28 CA ARG A 137 -11.704 18.744 -9.778 1.00 0.00 C ATOM 29 C ARG A 137 -12.227 17.332 -9.535 1.00 0.00 C ATOM 30 O ARG A 137 -12.378 16.547 -10.472 1.00 0.00 O ATOM 31 CB ARG A 137 -12.616 19.479 -10.766 1.00 0.00 C ATOM 32 CG ARG A 137 -14.090 19.443 -10.386 1.00 0.00 C ATOM 33 CD ARG A 137 -14.802 18.252 -11.010 1.00 0.00 C ATOM 34 NE ARG A 137 -15.938 18.663 -11.833 1.00 0.00 N ATOM 35 CZ ARG A 137 -15.836 19.056 -13.101 1.00 0.00 C ATOM 36 NH1 ARG A 137 -14.652 19.088 -13.702 1.00 0.00 N ATOM 37 NH2 ARG A 137 -16.922 19.415 -13.772 1.00 0.00 N ATOM 0 H ARG A 137 -10.063 17.823 -10.703 1.00 0.00 H new ATOM 0 HA ARG A 137 -11.702 19.275 -8.826 1.00 0.00 H new ATOM 0 HB2 ARG A 137 -12.295 20.518 -10.839 1.00 0.00 H new ATOM 0 HB3 ARG A 137 -12.495 19.038 -11.755 1.00 0.00 H new ATOM 0 HG2 ARG A 137 -14.185 19.397 -9.301 1.00 0.00 H new ATOM 0 HG3 ARG A 137 -14.572 20.366 -10.709 1.00 0.00 H new ATOM 0 HD2 ARG A 137 -14.097 17.688 -11.621 1.00 0.00 H new ATOM 0 HD3 ARG A 137 -15.148 17.583 -10.222 1.00 0.00 H new ATOM 0 HE ARG A 137 -16.866 18.648 -11.410 1.00 0.00 H new ATOM 0 HH11 ARG A 137 -13.813 18.810 -13.192 1.00 0.00 H new ATOM 0 HH12 ARG A 137 -14.581 19.390 -14.674 1.00 0.00 H new ATOM 0 HH21 ARG A 137 -17.834 19.390 -13.317 1.00 0.00 H new ATOM 0 HH22 ARG A 137 -16.845 19.716 -14.743 1.00 0.00 H new ATOM 51 N CYS A 138 -12.511 17.013 -8.275 1.00 0.00 N ATOM 52 CA CYS A 138 -13.027 15.694 -7.925 1.00 0.00 C ATOM 53 C CYS A 138 -14.348 15.437 -8.644 1.00 0.00 C ATOM 54 O CYS A 138 -15.404 15.900 -8.208 1.00 0.00 O ATOM 55 CB CYS A 138 -13.217 15.570 -6.412 1.00 0.00 C ATOM 56 SG CYS A 138 -13.513 13.878 -5.849 1.00 0.00 S ATOM 0 H CYS A 138 -12.393 17.646 -7.484 1.00 0.00 H new ATOM 0 HA CYS A 138 -12.300 14.946 -8.242 1.00 0.00 H new ATOM 0 HB2 CYS A 138 -12.331 15.960 -5.911 1.00 0.00 H new ATOM 0 HB3 CYS A 138 -14.056 16.196 -6.108 1.00 0.00 H new ATOM 0 HG CYS A 138 -14.786 13.618 -5.905 1.00 0.00 H new ATOM 61 N GLN A 139 -14.274 14.714 -9.758 1.00 0.00 N ATOM 62 CA GLN A 139 -15.457 14.412 -10.559 1.00 0.00 C ATOM 63 C GLN A 139 -16.149 13.128 -10.101 1.00 0.00 C ATOM 64 O GLN A 139 -16.582 12.323 -10.926 1.00 0.00 O ATOM 65 CB GLN A 139 -15.076 14.297 -12.037 1.00 0.00 C ATOM 66 CG GLN A 139 -14.020 13.239 -12.319 1.00 0.00 C ATOM 67 CD GLN A 139 -14.617 11.921 -12.772 1.00 0.00 C ATOM 68 OE1 GLN A 139 -15.582 11.893 -13.536 1.00 0.00 O ATOM 69 NE2 GLN A 139 -14.043 10.819 -12.302 1.00 0.00 N ATOM 0 H GLN A 139 -13.406 14.326 -10.127 1.00 0.00 H new ATOM 0 HA GLN A 139 -16.160 15.233 -10.423 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -15.970 14.067 -12.616 1.00 0.00 H new ATOM 0 HB3 GLN A 139 -14.710 15.263 -12.384 1.00 0.00 H new ATOM 0 HG2 GLN A 139 -13.339 13.607 -13.086 1.00 0.00 H new ATOM 0 HG3 GLN A 139 -13.427 13.074 -11.419 1.00 0.00 H new ATOM 0 HE21 GLN A 139 -13.245 10.889 -11.671 1.00 0.00 H new ATOM 0 HE22 GLN A 139 -14.400 9.903 -12.572 1.00 0.00 H new ATOM 78 N VAL A 140 -16.273 12.947 -8.792 1.00 0.00 N ATOM 79 CA VAL A 140 -16.937 11.765 -8.254 1.00 0.00 C ATOM 80 C VAL A 140 -18.430 12.033 -8.075 1.00 0.00 C ATOM 81 O VAL A 140 -18.816 13.028 -7.463 1.00 0.00 O ATOM 82 CB VAL A 140 -16.327 11.335 -6.904 1.00 0.00 C ATOM 83 CG1 VAL A 140 -16.923 10.013 -6.443 1.00 0.00 C ATOM 84 CG2 VAL A 140 -14.813 11.235 -7.011 1.00 0.00 C ATOM 0 H VAL A 140 -15.926 13.598 -8.087 1.00 0.00 H new ATOM 0 HA VAL A 140 -16.792 10.955 -8.968 1.00 0.00 H new ATOM 0 HB VAL A 140 -16.568 12.094 -6.160 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -16.480 9.727 -5.489 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -18.001 10.122 -6.324 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -16.716 9.242 -7.185 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -14.400 10.931 -6.049 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -14.550 10.497 -7.769 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -14.403 12.205 -7.291 1.00 0.00 H new ATOM 94 N PRO A 141 -19.299 11.156 -8.612 1.00 0.00 N ATOM 95 CA PRO A 141 -20.752 11.321 -8.508 1.00 0.00 C ATOM 96 C PRO A 141 -21.203 11.636 -7.085 1.00 0.00 C ATOM 97 O PRO A 141 -21.840 12.660 -6.838 1.00 0.00 O ATOM 98 CB PRO A 141 -21.316 9.965 -8.968 1.00 0.00 C ATOM 99 CG PRO A 141 -20.136 9.057 -9.119 1.00 0.00 C ATOM 100 CD PRO A 141 -18.950 9.944 -9.362 1.00 0.00 C ATOM 0 HA PRO A 141 -21.103 12.160 -9.108 1.00 0.00 H new ATOM 0 HB2 PRO A 141 -22.022 9.569 -8.239 1.00 0.00 H new ATOM 0 HB3 PRO A 141 -21.854 10.066 -9.911 1.00 0.00 H new ATOM 0 HG2 PRO A 141 -19.993 8.453 -8.223 1.00 0.00 H new ATOM 0 HG3 PRO A 141 -20.281 8.366 -9.949 1.00 0.00 H new ATOM 0 HD2 PRO A 141 -18.026 9.494 -8.999 1.00 0.00 H new ATOM 0 HD3 PRO A 141 -18.808 10.150 -10.423 1.00 0.00 H new ATOM 108 N ASP A 142 -20.872 10.749 -6.153 1.00 0.00 N ATOM 109 CA ASP A 142 -21.248 10.934 -4.756 1.00 0.00 C ATOM 110 C ASP A 142 -20.455 12.068 -4.109 1.00 0.00 C ATOM 111 O ASP A 142 -20.854 12.598 -3.072 1.00 0.00 O ATOM 112 CB ASP A 142 -21.030 9.638 -3.974 1.00 0.00 C ATOM 113 CG ASP A 142 -19.605 9.131 -4.083 1.00 0.00 C ATOM 114 OD1 ASP A 142 -19.131 8.929 -5.220 1.00 0.00 O ATOM 115 OD2 ASP A 142 -18.962 8.936 -3.030 1.00 0.00 O ATOM 0 H ASP A 142 -20.345 9.896 -6.339 1.00 0.00 H new ATOM 0 HA ASP A 142 -22.305 11.201 -4.730 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -21.275 9.804 -2.925 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -21.714 8.874 -4.344 1.00 0.00 H new ATOM 120 N CYS A 143 -19.330 12.437 -4.719 1.00 0.00 N ATOM 121 CA CYS A 143 -18.493 13.507 -4.185 1.00 0.00 C ATOM 122 C CYS A 143 -18.065 14.480 -5.280 1.00 0.00 C ATOM 123 O CYS A 143 -17.147 14.201 -6.052 1.00 0.00 O ATOM 124 CB CYS A 143 -17.259 12.919 -3.497 1.00 0.00 C ATOM 125 SG CYS A 143 -16.134 14.155 -2.805 1.00 0.00 S ATOM 0 H CYS A 143 -18.980 12.013 -5.578 1.00 0.00 H new ATOM 0 HA CYS A 143 -19.084 14.060 -3.455 1.00 0.00 H new ATOM 0 HB2 CYS A 143 -17.585 12.254 -2.698 1.00 0.00 H new ATOM 0 HB3 CYS A 143 -16.712 12.309 -4.216 1.00 0.00 H new ATOM 0 HG CYS A 143 -15.125 13.558 -2.244 1.00 0.00 H new ATOM 130 N GLU A 144 -18.730 15.630 -5.334 1.00 0.00 N ATOM 131 CA GLU A 144 -18.414 16.652 -6.325 1.00 0.00 C ATOM 132 C GLU A 144 -17.569 17.757 -5.695 1.00 0.00 C ATOM 133 O GLU A 144 -18.080 18.818 -5.340 1.00 0.00 O ATOM 134 CB GLU A 144 -19.700 17.237 -6.916 1.00 0.00 C ATOM 135 CG GLU A 144 -19.834 17.019 -8.415 1.00 0.00 C ATOM 136 CD GLU A 144 -20.395 18.230 -9.132 1.00 0.00 C ATOM 137 OE1 GLU A 144 -19.895 19.348 -8.888 1.00 0.00 O ATOM 138 OE2 GLU A 144 -21.334 18.062 -9.937 1.00 0.00 O ATOM 0 H GLU A 144 -19.492 15.877 -4.702 1.00 0.00 H new ATOM 0 HA GLU A 144 -17.841 16.191 -7.129 1.00 0.00 H new ATOM 0 HB2 GLU A 144 -20.558 16.789 -6.414 1.00 0.00 H new ATOM 0 HB3 GLU A 144 -19.732 18.307 -6.708 1.00 0.00 H new ATOM 0 HG2 GLU A 144 -18.857 16.775 -8.832 1.00 0.00 H new ATOM 0 HG3 GLU A 144 -20.481 16.161 -8.597 1.00 0.00 H new ATOM 145 N ALA A 145 -16.274 17.491 -5.551 1.00 0.00 N ATOM 146 CA ALA A 145 -15.359 18.456 -4.953 1.00 0.00 C ATOM 147 C ALA A 145 -14.748 19.376 -6.006 1.00 0.00 C ATOM 148 O ALA A 145 -14.488 18.960 -7.133 1.00 0.00 O ATOM 149 CB ALA A 145 -14.263 17.735 -4.183 1.00 0.00 C ATOM 0 H ALA A 145 -15.836 16.616 -5.840 1.00 0.00 H new ATOM 0 HA ALA A 145 -15.932 19.075 -4.263 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -13.587 18.467 -3.742 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -14.710 17.131 -3.393 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -13.706 17.089 -4.862 1.00 0.00 H new ATOM 155 N ASP A 146 -14.521 20.629 -5.623 1.00 0.00 N ATOM 156 CA ASP A 146 -13.937 21.613 -6.528 1.00 0.00 C ATOM 157 C ASP A 146 -12.473 21.863 -6.181 1.00 0.00 C ATOM 158 O ASP A 146 -12.040 23.009 -6.050 1.00 0.00 O ATOM 159 CB ASP A 146 -14.723 22.924 -6.461 1.00 0.00 C ATOM 160 CG ASP A 146 -14.506 23.790 -7.687 1.00 0.00 C ATOM 161 OD1 ASP A 146 -15.010 23.424 -8.769 1.00 0.00 O ATOM 162 OD2 ASP A 146 -13.832 24.835 -7.564 1.00 0.00 O ATOM 0 H ASP A 146 -14.733 20.987 -4.692 1.00 0.00 H new ATOM 0 HA ASP A 146 -13.989 21.219 -7.543 1.00 0.00 H new ATOM 0 HB2 ASP A 146 -15.785 22.703 -6.359 1.00 0.00 H new ATOM 0 HB3 ASP A 146 -14.426 23.478 -5.571 1.00 0.00 H new ATOM 167 N ILE A 147 -11.714 20.782 -6.032 1.00 0.00 N ATOM 168 CA ILE A 147 -10.297 20.879 -5.699 1.00 0.00 C ATOM 169 C ILE A 147 -9.495 21.463 -6.860 1.00 0.00 C ATOM 170 O ILE A 147 -8.681 20.774 -7.475 1.00 0.00 O ATOM 171 CB ILE A 147 -9.713 19.502 -5.327 1.00 0.00 C ATOM 172 CG1 ILE A 147 -10.101 18.453 -6.373 1.00 0.00 C ATOM 173 CG2 ILE A 147 -10.188 19.083 -3.944 1.00 0.00 C ATOM 174 CD1 ILE A 147 -8.919 17.686 -6.924 1.00 0.00 C ATOM 0 H ILE A 147 -12.057 19.827 -6.137 1.00 0.00 H new ATOM 0 HA ILE A 147 -10.220 21.544 -4.839 1.00 0.00 H new ATOM 0 HB ILE A 147 -8.626 19.579 -5.309 1.00 0.00 H new ATOM 0 HG12 ILE A 147 -10.805 17.750 -5.928 1.00 0.00 H new ATOM 0 HG13 ILE A 147 -10.620 18.946 -7.195 1.00 0.00 H new ATOM 0 HG21 ILE A 147 -9.768 18.109 -3.695 1.00 0.00 H new ATOM 0 HG22 ILE A 147 -9.861 19.818 -3.209 1.00 0.00 H new ATOM 0 HG23 ILE A 147 -11.276 19.021 -3.936 1.00 0.00 H new ATOM 0 HD11 ILE A 147 -9.267 16.960 -7.659 1.00 0.00 H new ATOM 0 HD12 ILE A 147 -8.225 18.379 -7.399 1.00 0.00 H new ATOM 0 HD13 ILE A 147 -8.413 17.165 -6.111 1.00 0.00 H new ATOM 186 N SER A 148 -9.726 22.739 -7.155 1.00 0.00 N ATOM 187 CA SER A 148 -9.022 23.411 -8.240 1.00 0.00 C ATOM 188 C SER A 148 -7.698 23.993 -7.754 1.00 0.00 C ATOM 189 O SER A 148 -6.741 24.107 -8.520 1.00 0.00 O ATOM 190 CB SER A 148 -9.894 24.523 -8.828 1.00 0.00 C ATOM 191 OG SER A 148 -10.650 24.049 -9.930 1.00 0.00 O ATOM 0 H SER A 148 -10.395 23.327 -6.658 1.00 0.00 H new ATOM 0 HA SER A 148 -8.811 22.673 -9.014 1.00 0.00 H new ATOM 0 HB2 SER A 148 -10.566 24.907 -8.060 1.00 0.00 H new ATOM 0 HB3 SER A 148 -9.264 25.354 -9.145 1.00 0.00 H new ATOM 0 HG SER A 148 -11.200 24.777 -10.287 1.00 0.00 H new ATOM 197 N GLU A 149 -7.649 24.358 -6.477 1.00 0.00 N ATOM 198 CA GLU A 149 -6.441 24.927 -5.890 1.00 0.00 C ATOM 199 C GLU A 149 -5.766 23.927 -4.955 1.00 0.00 C ATOM 200 O GLU A 149 -5.274 24.294 -3.888 1.00 0.00 O ATOM 201 CB GLU A 149 -6.776 26.210 -5.127 1.00 0.00 C ATOM 202 CG GLU A 149 -6.958 27.422 -6.026 1.00 0.00 C ATOM 203 CD GLU A 149 -5.879 28.468 -5.824 1.00 0.00 C ATOM 204 OE1 GLU A 149 -5.444 28.657 -4.667 1.00 0.00 O ATOM 205 OE2 GLU A 149 -5.467 29.098 -6.820 1.00 0.00 O ATOM 0 H GLU A 149 -8.432 24.270 -5.829 1.00 0.00 H new ATOM 0 HA GLU A 149 -5.750 25.163 -6.699 1.00 0.00 H new ATOM 0 HB2 GLU A 149 -7.689 26.053 -4.553 1.00 0.00 H new ATOM 0 HB3 GLU A 149 -5.980 26.415 -4.411 1.00 0.00 H new ATOM 0 HG2 GLU A 149 -6.956 27.100 -7.067 1.00 0.00 H new ATOM 0 HG3 GLU A 149 -7.933 27.870 -5.833 1.00 0.00 H new ATOM 212 N LEU A 150 -5.746 22.662 -5.365 1.00 0.00 N ATOM 213 CA LEU A 150 -5.131 21.610 -4.564 1.00 0.00 C ATOM 214 C LEU A 150 -3.746 21.261 -5.098 1.00 0.00 C ATOM 215 O LEU A 150 -3.382 21.649 -6.209 1.00 0.00 O ATOM 216 CB LEU A 150 -6.019 20.362 -4.559 1.00 0.00 C ATOM 217 CG LEU A 150 -5.924 19.503 -3.297 1.00 0.00 C ATOM 218 CD1 LEU A 150 -6.173 20.346 -2.055 1.00 0.00 C ATOM 219 CD2 LEU A 150 -6.914 18.348 -3.363 1.00 0.00 C ATOM 0 H LEU A 150 -6.148 22.342 -6.246 1.00 0.00 H new ATOM 0 HA LEU A 150 -5.025 21.977 -3.543 1.00 0.00 H new ATOM 0 HB2 LEU A 150 -7.056 20.672 -4.691 1.00 0.00 H new ATOM 0 HB3 LEU A 150 -5.758 19.746 -5.420 1.00 0.00 H new ATOM 0 HG LEU A 150 -4.916 19.092 -3.237 1.00 0.00 H new ATOM 0 HD11 LEU A 150 -6.101 19.717 -1.168 1.00 0.00 H new ATOM 0 HD12 LEU A 150 -5.428 21.140 -1.998 1.00 0.00 H new ATOM 0 HD13 LEU A 150 -7.169 20.786 -2.108 1.00 0.00 H new ATOM 0 HD21 LEU A 150 -6.833 17.747 -2.457 1.00 0.00 H new ATOM 0 HD22 LEU A 150 -7.927 18.741 -3.448 1.00 0.00 H new ATOM 0 HD23 LEU A 150 -6.692 17.727 -4.231 1.00 0.00 H new ATOM 231 N LYS A 151 -2.976 20.529 -4.299 1.00 0.00 N ATOM 232 CA LYS A 151 -1.630 20.128 -4.693 1.00 0.00 C ATOM 233 C LYS A 151 -1.340 18.696 -4.253 1.00 0.00 C ATOM 234 O LYS A 151 -1.848 18.234 -3.231 1.00 0.00 O ATOM 235 CB LYS A 151 -0.596 21.080 -4.088 1.00 0.00 C ATOM 236 CG LYS A 151 -0.713 22.507 -4.597 1.00 0.00 C ATOM 237 CD LYS A 151 0.436 22.867 -5.526 1.00 0.00 C ATOM 238 CE LYS A 151 1.584 23.518 -4.770 1.00 0.00 C ATOM 239 NZ LYS A 151 2.875 22.812 -5.005 1.00 0.00 N ATOM 0 H LYS A 151 -3.261 20.202 -3.376 1.00 0.00 H new ATOM 0 HA LYS A 151 -1.565 20.175 -5.780 1.00 0.00 H new ATOM 0 HB2 LYS A 151 -0.705 21.080 -3.003 1.00 0.00 H new ATOM 0 HB3 LYS A 151 0.404 20.705 -4.308 1.00 0.00 H new ATOM 0 HG2 LYS A 151 -1.659 22.629 -5.124 1.00 0.00 H new ATOM 0 HG3 LYS A 151 -0.727 23.195 -3.752 1.00 0.00 H new ATOM 0 HD2 LYS A 151 0.794 21.968 -6.028 1.00 0.00 H new ATOM 0 HD3 LYS A 151 0.079 23.545 -6.301 1.00 0.00 H new ATOM 0 HE2 LYS A 151 1.678 24.559 -5.079 1.00 0.00 H new ATOM 0 HE3 LYS A 151 1.361 23.521 -3.703 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 3.632 23.286 -4.472 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 2.794 21.825 -4.687 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 3.101 22.831 -6.020 1.00 0.00 H new ATOM 253 N GLY A 152 -0.519 18.000 -5.032 1.00 0.00 N ATOM 254 CA GLY A 152 -0.174 16.627 -4.707 1.00 0.00 C ATOM 255 C GLY A 152 -0.417 15.679 -5.863 1.00 0.00 C ATOM 256 O GLY A 152 -0.322 16.070 -7.027 1.00 0.00 O ATOM 0 H GLY A 152 -0.086 18.361 -5.882 1.00 0.00 H new ATOM 0 HA2 GLY A 152 0.875 16.579 -4.416 1.00 0.00 H new ATOM 0 HA3 GLY A 152 -0.759 16.303 -3.846 1.00 0.00 H new ATOM 260 N TYR A 153 -0.732 14.428 -5.544 1.00 0.00 N ATOM 261 CA TYR A 153 -0.990 13.419 -6.566 1.00 0.00 C ATOM 262 C TYR A 153 -2.465 13.401 -6.955 1.00 0.00 C ATOM 263 O TYR A 153 -2.808 13.166 -8.113 1.00 0.00 O ATOM 264 CB TYR A 153 -0.563 12.037 -6.070 1.00 0.00 C ATOM 265 CG TYR A 153 -1.048 11.715 -4.675 1.00 0.00 C ATOM 266 CD1 TYR A 153 -2.352 11.290 -4.453 1.00 0.00 C ATOM 267 CD2 TYR A 153 -0.202 11.837 -3.580 1.00 0.00 C ATOM 268 CE1 TYR A 153 -2.799 10.995 -3.179 1.00 0.00 C ATOM 269 CE2 TYR A 153 -0.642 11.543 -2.302 1.00 0.00 C ATOM 270 CZ TYR A 153 -1.940 11.124 -2.108 1.00 0.00 C ATOM 271 OH TYR A 153 -2.382 10.831 -0.837 1.00 0.00 O ATOM 0 H TYR A 153 -0.815 14.088 -4.586 1.00 0.00 H new ATOM 0 HA TYR A 153 -0.404 13.676 -7.449 1.00 0.00 H new ATOM 0 HB2 TYR A 153 -0.939 11.281 -6.759 1.00 0.00 H new ATOM 0 HB3 TYR A 153 0.525 11.974 -6.090 1.00 0.00 H new ATOM 0 HD1 TYR A 153 -3.027 11.189 -5.290 1.00 0.00 H new ATOM 0 HD2 TYR A 153 0.816 12.167 -3.729 1.00 0.00 H new ATOM 0 HE1 TYR A 153 -3.816 10.665 -3.023 1.00 0.00 H new ATOM 0 HE2 TYR A 153 0.028 11.641 -1.461 1.00 0.00 H new ATOM 0 HH TYR A 153 -1.654 10.972 -0.197 1.00 0.00 H new ATOM 281 N HIS A 154 -3.332 13.652 -5.979 1.00 0.00 N ATOM 282 CA HIS A 154 -4.772 13.667 -6.224 1.00 0.00 C ATOM 283 C HIS A 154 -5.170 14.838 -7.120 1.00 0.00 C ATOM 284 O HIS A 154 -6.282 14.879 -7.644 1.00 0.00 O ATOM 285 CB HIS A 154 -5.539 13.742 -4.901 1.00 0.00 C ATOM 286 CG HIS A 154 -4.986 14.745 -3.938 1.00 0.00 C ATOM 287 ND1 HIS A 154 -4.688 14.442 -2.627 1.00 0.00 N ATOM 288 CD2 HIS A 154 -4.681 16.055 -4.098 1.00 0.00 C ATOM 289 CE1 HIS A 154 -4.225 15.522 -2.021 1.00 0.00 C ATOM 290 NE2 HIS A 154 -4.210 16.514 -2.892 1.00 0.00 N ATOM 0 H HIS A 154 -3.065 13.847 -5.014 1.00 0.00 H new ATOM 0 HA HIS A 154 -5.030 12.740 -6.736 1.00 0.00 H new ATOM 0 HB2 HIS A 154 -6.580 13.988 -5.109 1.00 0.00 H new ATOM 0 HB3 HIS A 154 -5.531 12.759 -4.431 1.00 0.00 H new ATOM 0 HD1 HIS A 154 -4.806 13.527 -2.192 1.00 0.00 H new ATOM 0 HD2 HIS A 154 -4.788 16.631 -5.005 1.00 0.00 H new ATOM 0 HE1 HIS A 154 -3.912 15.582 -0.989 1.00 0.00 H new ATOM 298 N LYS A 155 -4.257 15.789 -7.295 1.00 0.00 N ATOM 299 CA LYS A 155 -4.520 16.956 -8.128 1.00 0.00 C ATOM 300 C LYS A 155 -4.543 16.576 -9.605 1.00 0.00 C ATOM 301 O LYS A 155 -5.371 17.070 -10.371 1.00 0.00 O ATOM 302 CB LYS A 155 -3.461 18.031 -7.880 1.00 0.00 C ATOM 303 CG LYS A 155 -3.777 19.362 -8.544 1.00 0.00 C ATOM 304 CD LYS A 155 -3.023 19.525 -9.855 1.00 0.00 C ATOM 305 CE LYS A 155 -1.582 19.949 -9.620 1.00 0.00 C ATOM 306 NZ LYS A 155 -0.865 20.214 -10.896 1.00 0.00 N ATOM 0 H LYS A 155 -3.329 15.774 -6.871 1.00 0.00 H new ATOM 0 HA LYS A 155 -5.500 17.352 -7.860 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -3.357 18.186 -6.806 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -2.499 17.672 -8.245 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -4.849 19.432 -8.729 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -3.516 20.177 -7.869 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -3.041 18.585 -10.406 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -3.525 20.268 -10.475 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -1.564 20.846 -9.001 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -1.060 19.169 -9.066 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 0.114 20.500 -10.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -0.859 19.351 -11.477 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -1.348 20.976 -11.414 1.00 0.00 H new ATOM 320 N ARG A 156 -3.626 15.699 -9.999 1.00 0.00 N ATOM 321 CA ARG A 156 -3.534 15.254 -11.386 1.00 0.00 C ATOM 322 C ARG A 156 -4.387 14.011 -11.638 1.00 0.00 C ATOM 323 O ARG A 156 -4.071 13.206 -12.514 1.00 0.00 O ATOM 324 CB ARG A 156 -2.077 14.965 -11.750 1.00 0.00 C ATOM 325 CG ARG A 156 -1.818 14.940 -13.247 1.00 0.00 C ATOM 326 CD ARG A 156 -0.345 14.720 -13.552 1.00 0.00 C ATOM 327 NE ARG A 156 -0.093 14.608 -14.986 1.00 0.00 N ATOM 328 CZ ARG A 156 -0.309 13.501 -15.694 1.00 0.00 C ATOM 329 NH1 ARG A 156 -0.787 12.412 -15.105 1.00 0.00 N ATOM 330 NH2 ARG A 156 -0.050 13.484 -16.994 1.00 0.00 N ATOM 0 H ARG A 156 -2.934 15.281 -9.377 1.00 0.00 H new ATOM 0 HA ARG A 156 -3.916 16.057 -12.016 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -1.440 15.721 -11.292 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -1.788 14.004 -11.324 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -2.409 14.147 -13.707 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -2.146 15.880 -13.690 1.00 0.00 H new ATOM 0 HD2 ARG A 156 0.237 15.547 -13.145 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -0.003 13.814 -13.052 1.00 0.00 H new ATOM 0 HE ARG A 156 0.270 15.426 -15.474 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -0.991 12.420 -14.106 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -0.951 11.567 -15.652 1.00 0.00 H new ATOM 0 HH21 ARG A 156 0.315 14.319 -17.452 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -0.216 12.636 -17.536 1.00 0.00 H new ATOM 344 N HIS A 157 -5.461 13.851 -10.870 1.00 0.00 N ATOM 345 CA HIS A 157 -6.341 12.698 -11.030 1.00 0.00 C ATOM 346 C HIS A 157 -7.798 13.063 -10.754 1.00 0.00 C ATOM 347 O HIS A 157 -8.626 12.188 -10.501 1.00 0.00 O ATOM 348 CB HIS A 157 -5.900 11.566 -10.101 1.00 0.00 C ATOM 349 CG HIS A 157 -4.765 10.756 -10.646 1.00 0.00 C ATOM 350 ND1 HIS A 157 -4.902 9.885 -11.706 1.00 0.00 N ATOM 351 CD2 HIS A 157 -3.464 10.688 -10.274 1.00 0.00 C ATOM 352 CE1 HIS A 157 -3.739 9.318 -11.962 1.00 0.00 C ATOM 353 NE2 HIS A 157 -2.849 9.789 -11.108 1.00 0.00 N ATOM 0 H HIS A 157 -5.742 14.501 -10.135 1.00 0.00 H new ATOM 0 HA HIS A 157 -6.269 12.365 -12.065 1.00 0.00 H new ATOM 0 HB2 HIS A 157 -5.606 11.988 -9.140 1.00 0.00 H new ATOM 0 HB3 HIS A 157 -6.749 10.908 -9.914 1.00 0.00 H new ATOM 0 HD2 HIS A 157 -2.998 11.239 -9.471 1.00 0.00 H new ATOM 0 HE1 HIS A 157 -3.547 8.592 -12.738 1.00 0.00 H new ATOM 0 HE2 HIS A 157 -1.864 9.527 -11.074 1.00 0.00 H new ATOM 361 N ARG A 158 -8.108 14.356 -10.811 1.00 0.00 N ATOM 362 CA ARG A 158 -9.469 14.838 -10.575 1.00 0.00 C ATOM 363 C ARG A 158 -10.090 14.179 -9.344 1.00 0.00 C ATOM 364 O ARG A 158 -11.127 13.517 -9.437 1.00 0.00 O ATOM 365 CB ARG A 158 -10.342 14.578 -11.805 1.00 0.00 C ATOM 366 CG ARG A 158 -9.975 15.442 -13.000 1.00 0.00 C ATOM 367 CD ARG A 158 -10.752 15.033 -14.241 1.00 0.00 C ATOM 368 NE ARG A 158 -12.141 15.485 -14.191 1.00 0.00 N ATOM 369 CZ ARG A 158 -13.034 15.245 -15.148 1.00 0.00 C ATOM 370 NH1 ARG A 158 -12.688 14.557 -16.231 1.00 0.00 N ATOM 371 NH2 ARG A 158 -14.275 15.692 -15.024 1.00 0.00 N ATOM 0 H ARG A 158 -7.433 15.092 -11.019 1.00 0.00 H new ATOM 0 HA ARG A 158 -9.415 15.911 -10.391 1.00 0.00 H new ATOM 0 HB2 ARG A 158 -10.258 13.528 -12.086 1.00 0.00 H new ATOM 0 HB3 ARG A 158 -11.385 14.755 -11.545 1.00 0.00 H new ATOM 0 HG2 ARG A 158 -10.178 16.488 -12.770 1.00 0.00 H new ATOM 0 HG3 ARG A 158 -8.906 15.360 -13.195 1.00 0.00 H new ATOM 0 HD2 ARG A 158 -10.267 15.447 -15.125 1.00 0.00 H new ATOM 0 HD3 ARG A 158 -10.727 13.948 -14.343 1.00 0.00 H new ATOM 0 HE ARG A 158 -12.444 16.016 -13.374 1.00 0.00 H new ATOM 0 HH11 ARG A 158 -11.734 14.210 -16.332 1.00 0.00 H new ATOM 0 HH12 ARG A 158 -13.376 14.376 -16.962 1.00 0.00 H new ATOM 0 HH21 ARG A 158 -14.546 16.220 -14.195 1.00 0.00 H new ATOM 0 HH22 ARG A 158 -14.959 15.508 -15.758 1.00 0.00 H new ATOM 385 N VAL A 159 -9.452 14.366 -8.194 1.00 0.00 N ATOM 386 CA VAL A 159 -9.940 13.795 -6.944 1.00 0.00 C ATOM 387 C VAL A 159 -9.452 14.609 -5.750 1.00 0.00 C ATOM 388 O VAL A 159 -8.360 15.178 -5.779 1.00 0.00 O ATOM 389 CB VAL A 159 -9.495 12.328 -6.782 1.00 0.00 C ATOM 390 CG1 VAL A 159 -7.977 12.223 -6.781 1.00 0.00 C ATOM 391 CG2 VAL A 159 -10.081 11.724 -5.515 1.00 0.00 C ATOM 0 H VAL A 159 -8.594 14.910 -8.101 1.00 0.00 H new ATOM 0 HA VAL A 159 -11.029 13.825 -6.980 1.00 0.00 H new ATOM 0 HB VAL A 159 -9.873 11.761 -7.633 1.00 0.00 H new ATOM 0 HG11 VAL A 159 -7.685 11.179 -6.666 1.00 0.00 H new ATOM 0 HG12 VAL A 159 -7.585 12.608 -7.723 1.00 0.00 H new ATOM 0 HG13 VAL A 159 -7.572 12.807 -5.954 1.00 0.00 H new ATOM 0 HG21 VAL A 159 -9.754 10.688 -5.421 1.00 0.00 H new ATOM 0 HG22 VAL A 159 -9.740 12.292 -4.650 1.00 0.00 H new ATOM 0 HG23 VAL A 159 -11.169 11.758 -5.565 1.00 0.00 H new ATOM 401 N CYS A 160 -10.269 14.667 -4.702 1.00 0.00 N ATOM 402 CA CYS A 160 -9.918 15.419 -3.503 1.00 0.00 C ATOM 403 C CYS A 160 -9.154 14.547 -2.509 1.00 0.00 C ATOM 404 O CYS A 160 -9.157 13.322 -2.611 1.00 0.00 O ATOM 405 CB CYS A 160 -11.180 15.995 -2.850 1.00 0.00 C ATOM 406 SG CYS A 160 -12.210 14.776 -1.996 1.00 0.00 S ATOM 0 H CYS A 160 -11.176 14.203 -4.659 1.00 0.00 H new ATOM 0 HA CYS A 160 -9.266 16.241 -3.797 1.00 0.00 H new ATOM 0 HB2 CYS A 160 -10.885 16.765 -2.137 1.00 0.00 H new ATOM 0 HB3 CYS A 160 -11.780 16.484 -3.618 1.00 0.00 H new ATOM 0 HG CYS A 160 -13.246 15.368 -1.480 1.00 0.00 H new ATOM 411 N LEU A 161 -8.500 15.193 -1.549 1.00 0.00 N ATOM 412 CA LEU A 161 -7.731 14.482 -0.534 1.00 0.00 C ATOM 413 C LEU A 161 -8.624 13.556 0.284 1.00 0.00 C ATOM 414 O LEU A 161 -8.204 12.477 0.699 1.00 0.00 O ATOM 415 CB LEU A 161 -7.027 15.478 0.390 1.00 0.00 C ATOM 416 CG LEU A 161 -5.962 14.871 1.304 1.00 0.00 C ATOM 417 CD1 LEU A 161 -4.813 15.846 1.507 1.00 0.00 C ATOM 418 CD2 LEU A 161 -6.570 14.477 2.642 1.00 0.00 C ATOM 0 H LEU A 161 -8.487 16.208 -1.453 1.00 0.00 H new ATOM 0 HA LEU A 161 -6.983 13.874 -1.043 1.00 0.00 H new ATOM 0 HB2 LEU A 161 -6.562 16.251 -0.221 1.00 0.00 H new ATOM 0 HB3 LEU A 161 -7.778 15.970 1.009 1.00 0.00 H new ATOM 0 HG LEU A 161 -5.570 13.973 0.826 1.00 0.00 H new ATOM 0 HD11 LEU A 161 -4.065 15.396 2.160 1.00 0.00 H new ATOM 0 HD12 LEU A 161 -4.360 16.080 0.544 1.00 0.00 H new ATOM 0 HD13 LEU A 161 -5.189 16.762 1.963 1.00 0.00 H new ATOM 0 HD21 LEU A 161 -5.798 14.047 3.280 1.00 0.00 H new ATOM 0 HD22 LEU A 161 -6.990 15.359 3.125 1.00 0.00 H new ATOM 0 HD23 LEU A 161 -7.359 13.742 2.481 1.00 0.00 H new ATOM 430 N ARG A 162 -9.862 13.986 0.511 1.00 0.00 N ATOM 431 CA ARG A 162 -10.816 13.196 1.282 1.00 0.00 C ATOM 432 C ARG A 162 -11.036 11.827 0.644 1.00 0.00 C ATOM 433 O ARG A 162 -11.217 10.829 1.339 1.00 0.00 O ATOM 434 CB ARG A 162 -12.149 13.938 1.394 1.00 0.00 C ATOM 435 CG ARG A 162 -12.932 13.594 2.651 1.00 0.00 C ATOM 436 CD ARG A 162 -13.498 12.184 2.586 1.00 0.00 C ATOM 437 NE ARG A 162 -14.641 12.011 3.478 1.00 0.00 N ATOM 438 CZ ARG A 162 -15.527 11.025 3.365 1.00 0.00 C ATOM 439 NH1 ARG A 162 -15.404 10.120 2.402 1.00 0.00 N ATOM 440 NH2 ARG A 162 -16.539 10.940 4.218 1.00 0.00 N ATOM 0 H ARG A 162 -10.227 14.876 0.172 1.00 0.00 H new ATOM 0 HA ARG A 162 -10.403 13.048 2.280 1.00 0.00 H new ATOM 0 HB2 ARG A 162 -11.961 15.011 1.375 1.00 0.00 H new ATOM 0 HB3 ARG A 162 -12.759 13.706 0.521 1.00 0.00 H new ATOM 0 HG2 ARG A 162 -12.283 13.687 3.522 1.00 0.00 H new ATOM 0 HG3 ARG A 162 -13.745 14.308 2.781 1.00 0.00 H new ATOM 0 HD2 ARG A 162 -13.800 11.962 1.563 1.00 0.00 H new ATOM 0 HD3 ARG A 162 -12.720 11.468 2.851 1.00 0.00 H new ATOM 0 HE ARG A 162 -14.768 12.686 4.232 1.00 0.00 H new ATOM 0 HH11 ARG A 162 -14.627 10.178 1.744 1.00 0.00 H new ATOM 0 HH12 ARG A 162 -16.086 9.366 2.320 1.00 0.00 H new ATOM 0 HH21 ARG A 162 -16.639 11.631 4.962 1.00 0.00 H new ATOM 0 HH22 ARG A 162 -17.218 10.184 4.130 1.00 0.00 H new ATOM 454 N CYS A 163 -11.017 11.789 -0.685 1.00 0.00 N ATOM 455 CA CYS A 163 -11.214 10.542 -1.416 1.00 0.00 C ATOM 456 C CYS A 163 -9.922 9.733 -1.466 1.00 0.00 C ATOM 457 O CYS A 163 -9.950 8.502 -1.507 1.00 0.00 O ATOM 458 CB CYS A 163 -11.704 10.831 -2.836 1.00 0.00 C ATOM 459 SG CYS A 163 -13.478 11.166 -2.950 1.00 0.00 S ATOM 0 H CYS A 163 -10.867 12.606 -1.277 1.00 0.00 H new ATOM 0 HA CYS A 163 -11.969 9.956 -0.891 1.00 0.00 H new ATOM 0 HB2 CYS A 163 -11.157 11.687 -3.230 1.00 0.00 H new ATOM 0 HB3 CYS A 163 -11.464 9.979 -3.472 1.00 0.00 H new ATOM 0 HG CYS A 163 -13.693 12.057 -3.871 1.00 0.00 H new ATOM 464 N ALA A 164 -8.790 10.431 -1.462 1.00 0.00 N ATOM 465 CA ALA A 164 -7.489 9.778 -1.506 1.00 0.00 C ATOM 466 C ALA A 164 -7.200 9.039 -0.204 1.00 0.00 C ATOM 467 O ALA A 164 -6.519 8.014 -0.198 1.00 0.00 O ATOM 468 CB ALA A 164 -6.398 10.799 -1.791 1.00 0.00 C ATOM 0 H ALA A 164 -8.749 11.450 -1.429 1.00 0.00 H new ATOM 0 HA ALA A 164 -7.505 9.044 -2.312 1.00 0.00 H new ATOM 0 HB1 ALA A 164 -5.430 10.298 -1.821 1.00 0.00 H new ATOM 0 HB2 ALA A 164 -6.589 11.277 -2.751 1.00 0.00 H new ATOM 0 HB3 ALA A 164 -6.392 11.554 -1.005 1.00 0.00 H new ATOM 474 N THR A 165 -7.722 9.567 0.898 1.00 0.00 N ATOM 475 CA THR A 165 -7.520 8.958 2.208 1.00 0.00 C ATOM 476 C THR A 165 -8.677 8.030 2.569 1.00 0.00 C ATOM 477 O THR A 165 -8.502 7.064 3.312 1.00 0.00 O ATOM 478 CB THR A 165 -7.374 10.026 3.308 1.00 0.00 C ATOM 479 OG1 THR A 165 -8.447 10.969 3.222 1.00 0.00 O ATOM 480 CG2 THR A 165 -6.042 10.751 3.183 1.00 0.00 C ATOM 0 H THR A 165 -8.288 10.415 0.910 1.00 0.00 H new ATOM 0 HA THR A 165 -6.598 8.380 2.147 1.00 0.00 H new ATOM 0 HB THR A 165 -7.409 9.526 4.276 1.00 0.00 H new ATOM 0 HG1 THR A 165 -8.294 11.570 2.463 1.00 0.00 H new ATOM 0 HG21 THR A 165 -5.961 11.501 3.970 1.00 0.00 H new ATOM 0 HG22 THR A 165 -5.227 10.034 3.279 1.00 0.00 H new ATOM 0 HG23 THR A 165 -5.983 11.239 2.210 1.00 0.00 H new ATOM 488 N ALA A 166 -9.858 8.331 2.039 1.00 0.00 N ATOM 489 CA ALA A 166 -11.043 7.523 2.306 1.00 0.00 C ATOM 490 C ALA A 166 -10.818 6.067 1.912 1.00 0.00 C ATOM 491 O ALA A 166 -10.099 5.777 0.957 1.00 0.00 O ATOM 492 CB ALA A 166 -12.246 8.092 1.566 1.00 0.00 C ATOM 0 H ALA A 166 -10.020 9.127 1.423 1.00 0.00 H new ATOM 0 HA ALA A 166 -11.239 7.554 3.378 1.00 0.00 H new ATOM 0 HB1 ALA A 166 -13.124 7.480 1.774 1.00 0.00 H new ATOM 0 HB2 ALA A 166 -12.429 9.113 1.900 1.00 0.00 H new ATOM 0 HB3 ALA A 166 -12.048 8.090 0.494 1.00 0.00 H new ATOM 498 N SER A 167 -11.438 5.157 2.655 1.00 0.00 N ATOM 499 CA SER A 167 -11.304 3.729 2.385 1.00 0.00 C ATOM 500 C SER A 167 -11.996 3.356 1.078 1.00 0.00 C ATOM 501 O SER A 167 -11.568 2.439 0.377 1.00 0.00 O ATOM 502 CB SER A 167 -11.890 2.913 3.537 1.00 0.00 C ATOM 503 OG SER A 167 -13.261 3.217 3.732 1.00 0.00 O ATOM 0 H SER A 167 -12.038 5.382 3.449 1.00 0.00 H new ATOM 0 HA SER A 167 -10.242 3.500 2.292 1.00 0.00 H new ATOM 0 HB2 SER A 167 -11.776 1.849 3.328 1.00 0.00 H new ATOM 0 HB3 SER A 167 -11.335 3.119 4.452 1.00 0.00 H new ATOM 0 HG SER A 167 -13.811 2.479 3.395 1.00 0.00 H new ATOM 509 N PHE A 168 -13.069 4.072 0.755 1.00 0.00 N ATOM 510 CA PHE A 168 -13.820 3.815 -0.467 1.00 0.00 C ATOM 511 C PHE A 168 -14.946 4.828 -0.640 1.00 0.00 C ATOM 512 O PHE A 168 -15.559 5.260 0.336 1.00 0.00 O ATOM 513 CB PHE A 168 -14.392 2.396 -0.450 1.00 0.00 C ATOM 514 CG PHE A 168 -15.370 2.157 0.666 1.00 0.00 C ATOM 515 CD1 PHE A 168 -16.709 2.474 0.510 1.00 0.00 C ATOM 516 CD2 PHE A 168 -14.947 1.615 1.869 1.00 0.00 C ATOM 517 CE1 PHE A 168 -17.610 2.257 1.536 1.00 0.00 C ATOM 518 CE2 PHE A 168 -15.844 1.394 2.898 1.00 0.00 C ATOM 519 CZ PHE A 168 -17.177 1.716 2.731 1.00 0.00 C ATOM 0 H PHE A 168 -13.437 4.835 1.323 1.00 0.00 H new ATOM 0 HA PHE A 168 -13.136 3.914 -1.310 1.00 0.00 H new ATOM 0 HB2 PHE A 168 -14.885 2.200 -1.402 1.00 0.00 H new ATOM 0 HB3 PHE A 168 -13.572 1.683 -0.363 1.00 0.00 H new ATOM 0 HD1 PHE A 168 -17.053 2.895 -0.423 1.00 0.00 H new ATOM 0 HD2 PHE A 168 -13.906 1.362 2.004 1.00 0.00 H new ATOM 0 HE1 PHE A 168 -18.651 2.510 1.403 1.00 0.00 H new ATOM 0 HE2 PHE A 168 -15.503 0.970 3.831 1.00 0.00 H new ATOM 0 HZ PHE A 168 -17.879 1.545 3.533 1.00 0.00 H new ATOM 529 N VAL A 169 -15.213 5.202 -1.887 1.00 0.00 N ATOM 530 CA VAL A 169 -16.268 6.164 -2.187 1.00 0.00 C ATOM 531 C VAL A 169 -17.411 5.506 -2.950 1.00 0.00 C ATOM 532 O VAL A 169 -17.190 4.613 -3.770 1.00 0.00 O ATOM 533 CB VAL A 169 -15.729 7.349 -3.013 1.00 0.00 C ATOM 534 CG1 VAL A 169 -14.805 8.216 -2.171 1.00 0.00 C ATOM 535 CG2 VAL A 169 -15.017 6.847 -4.260 1.00 0.00 C ATOM 0 H VAL A 169 -14.714 4.854 -2.706 1.00 0.00 H new ATOM 0 HA VAL A 169 -16.639 6.535 -1.232 1.00 0.00 H new ATOM 0 HB VAL A 169 -16.573 7.964 -3.326 1.00 0.00 H new ATOM 0 HG11 VAL A 169 -14.436 9.046 -2.773 1.00 0.00 H new ATOM 0 HG12 VAL A 169 -15.353 8.606 -1.313 1.00 0.00 H new ATOM 0 HG13 VAL A 169 -13.963 7.618 -1.822 1.00 0.00 H new ATOM 0 HG21 VAL A 169 -14.643 7.696 -4.832 1.00 0.00 H new ATOM 0 HG22 VAL A 169 -14.183 6.208 -3.970 1.00 0.00 H new ATOM 0 HG23 VAL A 169 -15.715 6.276 -4.873 1.00 0.00 H new ATOM 545 N VAL A 170 -18.633 5.951 -2.677 1.00 0.00 N ATOM 546 CA VAL A 170 -19.811 5.404 -3.339 1.00 0.00 C ATOM 547 C VAL A 170 -20.007 6.032 -4.716 1.00 0.00 C ATOM 548 O VAL A 170 -20.899 6.856 -4.914 1.00 0.00 O ATOM 549 CB VAL A 170 -21.082 5.627 -2.498 1.00 0.00 C ATOM 550 CG1 VAL A 170 -22.269 4.909 -3.121 1.00 0.00 C ATOM 551 CG2 VAL A 170 -20.863 5.165 -1.066 1.00 0.00 C ATOM 0 H VAL A 170 -18.833 6.689 -2.002 1.00 0.00 H new ATOM 0 HA VAL A 170 -19.644 4.333 -3.451 1.00 0.00 H new ATOM 0 HB VAL A 170 -21.301 6.695 -2.482 1.00 0.00 H new ATOM 0 HG11 VAL A 170 -23.157 5.079 -2.512 1.00 0.00 H new ATOM 0 HG12 VAL A 170 -22.440 5.293 -4.127 1.00 0.00 H new ATOM 0 HG13 VAL A 170 -22.062 3.840 -3.171 1.00 0.00 H new ATOM 0 HG21 VAL A 170 -21.772 5.331 -0.487 1.00 0.00 H new ATOM 0 HG22 VAL A 170 -20.617 4.103 -1.060 1.00 0.00 H new ATOM 0 HG23 VAL A 170 -20.043 5.730 -0.623 1.00 0.00 H new ATOM 561 N LEU A 171 -19.166 5.635 -5.666 1.00 0.00 N ATOM 562 CA LEU A 171 -19.247 6.160 -7.023 1.00 0.00 C ATOM 563 C LEU A 171 -20.599 5.834 -7.650 1.00 0.00 C ATOM 564 O LEU A 171 -21.505 5.348 -6.973 1.00 0.00 O ATOM 565 CB LEU A 171 -18.116 5.589 -7.882 1.00 0.00 C ATOM 566 CG LEU A 171 -17.542 6.553 -8.925 1.00 0.00 C ATOM 567 CD1 LEU A 171 -16.202 7.103 -8.464 1.00 0.00 C ATOM 568 CD2 LEU A 171 -17.402 5.861 -10.272 1.00 0.00 C ATOM 0 H LEU A 171 -18.422 4.953 -5.521 1.00 0.00 H new ATOM 0 HA LEU A 171 -19.142 7.244 -6.976 1.00 0.00 H new ATOM 0 HB2 LEU A 171 -17.309 5.267 -7.225 1.00 0.00 H new ATOM 0 HB3 LEU A 171 -18.483 4.700 -8.395 1.00 0.00 H new ATOM 0 HG LEU A 171 -18.234 7.388 -9.039 1.00 0.00 H new ATOM 0 HD11 LEU A 171 -15.810 7.786 -9.218 1.00 0.00 H new ATOM 0 HD12 LEU A 171 -16.332 7.638 -7.523 1.00 0.00 H new ATOM 0 HD13 LEU A 171 -15.501 6.281 -8.320 1.00 0.00 H new ATOM 0 HD21 LEU A 171 -16.993 6.561 -11.000 1.00 0.00 H new ATOM 0 HD22 LEU A 171 -16.732 5.007 -10.174 1.00 0.00 H new ATOM 0 HD23 LEU A 171 -18.381 5.518 -10.608 1.00 0.00 H new ATOM 580 N ASP A 172 -20.729 6.109 -8.944 1.00 0.00 N ATOM 581 CA ASP A 172 -21.974 5.847 -9.661 1.00 0.00 C ATOM 582 C ASP A 172 -22.385 4.383 -9.537 1.00 0.00 C ATOM 583 O ASP A 172 -22.006 3.550 -10.360 1.00 0.00 O ATOM 584 CB ASP A 172 -21.824 6.223 -11.137 1.00 0.00 C ATOM 585 CG ASP A 172 -23.138 6.150 -11.889 1.00 0.00 C ATOM 586 OD1 ASP A 172 -24.033 6.974 -11.602 1.00 0.00 O ATOM 587 OD2 ASP A 172 -23.275 5.270 -12.764 1.00 0.00 O ATOM 0 H ASP A 172 -19.989 6.513 -9.518 1.00 0.00 H new ATOM 0 HA ASP A 172 -22.755 6.460 -9.211 1.00 0.00 H new ATOM 0 HB2 ASP A 172 -21.421 7.233 -11.213 1.00 0.00 H new ATOM 0 HB3 ASP A 172 -21.102 5.556 -11.607 1.00 0.00 H new ATOM 592 N GLY A 173 -23.165 4.078 -8.505 1.00 0.00 N ATOM 593 CA GLY A 173 -23.618 2.714 -8.293 1.00 0.00 C ATOM 594 C GLY A 173 -22.474 1.723 -8.212 1.00 0.00 C ATOM 595 O GLY A 173 -22.646 0.542 -8.516 1.00 0.00 O ATOM 0 H GLY A 173 -23.492 4.750 -7.811 1.00 0.00 H new ATOM 0 HA2 GLY A 173 -24.199 2.668 -7.372 1.00 0.00 H new ATOM 0 HA3 GLY A 173 -24.285 2.427 -9.106 1.00 0.00 H new ATOM 599 N GLU A 174 -21.304 2.201 -7.802 1.00 0.00 N ATOM 600 CA GLU A 174 -20.129 1.345 -7.684 1.00 0.00 C ATOM 601 C GLU A 174 -19.108 1.953 -6.727 1.00 0.00 C ATOM 602 O GLU A 174 -18.768 3.131 -6.832 1.00 0.00 O ATOM 603 CB GLU A 174 -19.491 1.127 -9.057 1.00 0.00 C ATOM 604 CG GLU A 174 -20.356 0.315 -10.007 1.00 0.00 C ATOM 605 CD GLU A 174 -19.582 -0.197 -11.207 1.00 0.00 C ATOM 606 OE1 GLU A 174 -18.965 0.630 -11.912 1.00 0.00 O ATOM 607 OE2 GLU A 174 -19.593 -1.423 -11.441 1.00 0.00 O ATOM 0 H GLU A 174 -21.144 3.175 -7.546 1.00 0.00 H new ATOM 0 HA GLU A 174 -20.449 0.383 -7.283 1.00 0.00 H new ATOM 0 HB2 GLU A 174 -19.281 2.096 -9.509 1.00 0.00 H new ATOM 0 HB3 GLU A 174 -18.534 0.621 -8.928 1.00 0.00 H new ATOM 0 HG2 GLU A 174 -20.786 -0.530 -9.469 1.00 0.00 H new ATOM 0 HG3 GLU A 174 -21.188 0.930 -10.351 1.00 0.00 H new ATOM 614 N ASN A 175 -18.621 1.140 -5.796 1.00 0.00 N ATOM 615 CA ASN A 175 -17.637 1.596 -4.822 1.00 0.00 C ATOM 616 C ASN A 175 -16.221 1.438 -5.365 1.00 0.00 C ATOM 617 O ASN A 175 -15.695 0.328 -5.441 1.00 0.00 O ATOM 618 CB ASN A 175 -17.784 0.816 -3.514 1.00 0.00 C ATOM 619 CG ASN A 175 -19.041 1.191 -2.755 1.00 0.00 C ATOM 620 OD1 ASN A 175 -19.205 2.335 -2.329 1.00 0.00 O ATOM 621 ND2 ASN A 175 -19.936 0.227 -2.579 1.00 0.00 N ATOM 0 H ASN A 175 -18.892 0.162 -5.696 1.00 0.00 H new ATOM 0 HA ASN A 175 -17.817 2.654 -4.629 1.00 0.00 H new ATOM 0 HB2 ASN A 175 -17.799 -0.252 -3.731 1.00 0.00 H new ATOM 0 HB3 ASN A 175 -16.914 1.001 -2.884 1.00 0.00 H new ATOM 0 HD21 ASN A 175 -20.801 0.420 -2.074 1.00 0.00 H new ATOM 0 HD22 ASN A 175 -19.759 -0.707 -2.949 1.00 0.00 H new ATOM 628 N LYS A 176 -15.609 2.555 -5.744 1.00 0.00 N ATOM 629 CA LYS A 176 -14.254 2.539 -6.282 1.00 0.00 C ATOM 630 C LYS A 176 -13.251 3.040 -5.247 1.00 0.00 C ATOM 631 O LYS A 176 -13.567 3.906 -4.431 1.00 0.00 O ATOM 632 CB LYS A 176 -14.173 3.396 -7.545 1.00 0.00 C ATOM 633 CG LYS A 176 -15.243 3.067 -8.573 1.00 0.00 C ATOM 634 CD LYS A 176 -14.732 2.083 -9.615 1.00 0.00 C ATOM 635 CE LYS A 176 -13.734 2.737 -10.557 1.00 0.00 C ATOM 636 NZ LYS A 176 -13.278 1.799 -11.620 1.00 0.00 N ATOM 0 H LYS A 176 -16.030 3.482 -5.688 1.00 0.00 H new ATOM 0 HA LYS A 176 -14.003 1.509 -6.535 1.00 0.00 H new ATOM 0 HB2 LYS A 176 -14.259 4.447 -7.267 1.00 0.00 H new ATOM 0 HB3 LYS A 176 -13.191 3.266 -8.000 1.00 0.00 H new ATOM 0 HG2 LYS A 176 -16.114 2.647 -8.071 1.00 0.00 H new ATOM 0 HG3 LYS A 176 -15.570 3.983 -9.065 1.00 0.00 H new ATOM 0 HD2 LYS A 176 -14.262 1.235 -9.117 1.00 0.00 H new ATOM 0 HD3 LYS A 176 -15.572 1.690 -10.188 1.00 0.00 H new ATOM 0 HE2 LYS A 176 -14.190 3.614 -11.017 1.00 0.00 H new ATOM 0 HE3 LYS A 176 -12.873 3.087 -9.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 176 -12.267 1.952 -11.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 176 -13.427 0.819 -11.306 1.00 0.00 H new ATOM 0 HZ3 LYS A 176 -13.821 1.970 -12.490 1.00 0.00 H new ATOM 650 N ARG A 177 -12.043 2.490 -5.286 1.00 0.00 N ATOM 651 CA ARG A 177 -10.992 2.880 -4.353 1.00 0.00 C ATOM 652 C ARG A 177 -9.787 3.444 -5.098 1.00 0.00 C ATOM 653 O ARG A 177 -9.340 2.878 -6.096 1.00 0.00 O ATOM 654 CB ARG A 177 -10.566 1.682 -3.503 1.00 0.00 C ATOM 655 CG ARG A 177 -10.198 2.051 -2.074 1.00 0.00 C ATOM 656 CD ARG A 177 -8.774 2.576 -1.984 1.00 0.00 C ATOM 657 NE ARG A 177 -8.576 3.422 -0.808 1.00 0.00 N ATOM 658 CZ ARG A 177 -7.521 4.214 -0.633 1.00 0.00 C ATOM 659 NH1 ARG A 177 -6.567 4.275 -1.555 1.00 0.00 N ATOM 660 NH2 ARG A 177 -7.419 4.948 0.465 1.00 0.00 N ATOM 0 H ARG A 177 -11.766 1.771 -5.955 1.00 0.00 H new ATOM 0 HA ARG A 177 -11.389 3.657 -3.700 1.00 0.00 H new ATOM 0 HB2 ARG A 177 -11.377 0.954 -3.484 1.00 0.00 H new ATOM 0 HB3 ARG A 177 -9.712 1.197 -3.976 1.00 0.00 H new ATOM 0 HG2 ARG A 177 -10.890 2.807 -1.702 1.00 0.00 H new ATOM 0 HG3 ARG A 177 -10.306 1.177 -1.432 1.00 0.00 H new ATOM 0 HD2 ARG A 177 -8.080 1.737 -1.948 1.00 0.00 H new ATOM 0 HD3 ARG A 177 -8.540 3.145 -2.884 1.00 0.00 H new ATOM 0 HE ARG A 177 -9.289 3.404 -0.079 1.00 0.00 H new ATOM 0 HH11 ARG A 177 -6.641 3.713 -2.403 1.00 0.00 H new ATOM 0 HH12 ARG A 177 -5.761 4.884 -1.415 1.00 0.00 H new ATOM 0 HH21 ARG A 177 -8.149 4.906 1.176 1.00 0.00 H new ATOM 0 HH22 ARG A 177 -6.610 5.555 0.599 1.00 0.00 H new ATOM 674 N TYR A 178 -9.264 4.563 -4.609 1.00 0.00 N ATOM 675 CA TYR A 178 -8.110 5.203 -5.229 1.00 0.00 C ATOM 676 C TYR A 178 -6.899 4.276 -5.218 1.00 0.00 C ATOM 677 O TYR A 178 -6.503 3.770 -4.168 1.00 0.00 O ATOM 678 CB TYR A 178 -7.774 6.509 -4.507 1.00 0.00 C ATOM 679 CG TYR A 178 -6.608 7.256 -5.116 1.00 0.00 C ATOM 680 CD1 TYR A 178 -5.301 6.964 -4.743 1.00 0.00 C ATOM 681 CD2 TYR A 178 -6.814 8.249 -6.064 1.00 0.00 C ATOM 682 CE1 TYR A 178 -4.233 7.644 -5.296 1.00 0.00 C ATOM 683 CE2 TYR A 178 -5.751 8.932 -6.624 1.00 0.00 C ATOM 684 CZ TYR A 178 -4.464 8.627 -6.236 1.00 0.00 C ATOM 685 OH TYR A 178 -3.402 9.305 -6.791 1.00 0.00 O ATOM 0 H TYR A 178 -9.621 5.046 -3.785 1.00 0.00 H new ATOM 0 HA TYR A 178 -8.365 5.424 -6.266 1.00 0.00 H new ATOM 0 HB2 TYR A 178 -8.652 7.155 -4.515 1.00 0.00 H new ATOM 0 HB3 TYR A 178 -7.549 6.290 -3.463 1.00 0.00 H new ATOM 0 HD1 TYR A 178 -5.118 6.193 -4.009 1.00 0.00 H new ATOM 0 HD2 TYR A 178 -7.821 8.492 -6.369 1.00 0.00 H new ATOM 0 HE1 TYR A 178 -3.223 7.407 -4.994 1.00 0.00 H new ATOM 0 HE2 TYR A 178 -5.928 9.701 -7.362 1.00 0.00 H new ATOM 0 HH TYR A 178 -2.727 9.477 -6.101 1.00 0.00 H new ATOM 695 N CYS A 179 -6.315 4.063 -6.392 1.00 0.00 N ATOM 696 CA CYS A 179 -5.146 3.201 -6.519 1.00 0.00 C ATOM 697 C CYS A 179 -3.862 4.021 -6.467 1.00 0.00 C ATOM 698 O CYS A 179 -3.604 4.843 -7.345 1.00 0.00 O ATOM 699 CB CYS A 179 -5.209 2.412 -7.828 1.00 0.00 C ATOM 700 SG CYS A 179 -3.983 1.089 -7.955 1.00 0.00 S ATOM 0 H CYS A 179 -6.632 4.476 -7.269 1.00 0.00 H new ATOM 0 HA CYS A 179 -5.145 2.502 -5.682 1.00 0.00 H new ATOM 0 HB2 CYS A 179 -6.205 1.981 -7.932 1.00 0.00 H new ATOM 0 HB3 CYS A 179 -5.072 3.101 -8.661 1.00 0.00 H new ATOM 0 HG CYS A 179 -3.441 1.111 -9.137 1.00 0.00 H new ATOM 705 N GLN A 180 -3.061 3.796 -5.432 1.00 0.00 N ATOM 706 CA GLN A 180 -1.804 4.521 -5.265 1.00 0.00 C ATOM 707 C GLN A 180 -0.750 4.065 -6.274 1.00 0.00 C ATOM 708 O GLN A 180 0.332 4.647 -6.351 1.00 0.00 O ATOM 709 CB GLN A 180 -1.274 4.335 -3.842 1.00 0.00 C ATOM 710 CG GLN A 180 -1.858 5.320 -2.841 1.00 0.00 C ATOM 711 CD GLN A 180 -2.444 4.635 -1.622 1.00 0.00 C ATOM 712 OE1 GLN A 180 -2.022 3.542 -1.246 1.00 0.00 O ATOM 713 NE2 GLN A 180 -3.426 5.277 -0.998 1.00 0.00 N ATOM 0 H GLN A 180 -3.258 3.118 -4.696 1.00 0.00 H new ATOM 0 HA GLN A 180 -2.006 5.577 -5.445 1.00 0.00 H new ATOM 0 HB2 GLN A 180 -1.494 3.320 -3.511 1.00 0.00 H new ATOM 0 HB3 GLN A 180 -0.189 4.439 -3.851 1.00 0.00 H new ATOM 0 HG2 GLN A 180 -1.080 6.014 -2.524 1.00 0.00 H new ATOM 0 HG3 GLN A 180 -2.633 5.911 -3.329 1.00 0.00 H new ATOM 0 HE21 GLN A 180 -3.745 6.182 -1.344 1.00 0.00 H new ATOM 0 HE22 GLN A 180 -3.861 4.865 -0.173 1.00 0.00 H new ATOM 722 N GLN A 181 -1.061 3.023 -7.040 1.00 0.00 N ATOM 723 CA GLN A 181 -0.125 2.501 -8.030 1.00 0.00 C ATOM 724 C GLN A 181 -0.419 3.055 -9.423 1.00 0.00 C ATOM 725 O GLN A 181 0.472 3.116 -10.272 1.00 0.00 O ATOM 726 CB GLN A 181 -0.181 0.972 -8.056 1.00 0.00 C ATOM 727 CG GLN A 181 0.767 0.312 -7.068 1.00 0.00 C ATOM 728 CD GLN A 181 1.668 -0.719 -7.721 1.00 0.00 C ATOM 729 OE1 GLN A 181 2.665 -0.376 -8.357 1.00 0.00 O ATOM 730 NE2 GLN A 181 1.318 -1.991 -7.568 1.00 0.00 N ATOM 0 H GLN A 181 -1.950 2.525 -6.994 1.00 0.00 H new ATOM 0 HA GLN A 181 0.876 2.822 -7.742 1.00 0.00 H new ATOM 0 HB2 GLN A 181 -1.200 0.650 -7.840 1.00 0.00 H new ATOM 0 HB3 GLN A 181 0.056 0.625 -9.062 1.00 0.00 H new ATOM 0 HG2 GLN A 181 1.381 1.077 -6.594 1.00 0.00 H new ATOM 0 HG3 GLN A 181 0.187 -0.166 -6.278 1.00 0.00 H new ATOM 0 HE21 GLN A 181 0.483 -2.229 -7.032 1.00 0.00 H new ATOM 0 HE22 GLN A 181 1.884 -2.729 -7.986 1.00 0.00 H new ATOM 739 N CYS A 182 -1.666 3.448 -9.660 1.00 0.00 N ATOM 740 CA CYS A 182 -2.059 3.987 -10.960 1.00 0.00 C ATOM 741 C CYS A 182 -2.626 5.398 -10.833 1.00 0.00 C ATOM 742 O CYS A 182 -2.531 6.199 -11.762 1.00 0.00 O ATOM 743 CB CYS A 182 -3.091 3.071 -11.621 1.00 0.00 C ATOM 744 SG CYS A 182 -2.608 1.330 -11.675 1.00 0.00 S ATOM 0 H CYS A 182 -2.419 3.404 -8.974 1.00 0.00 H new ATOM 0 HA CYS A 182 -1.165 4.036 -11.582 1.00 0.00 H new ATOM 0 HB2 CYS A 182 -4.035 3.158 -11.083 1.00 0.00 H new ATOM 0 HB3 CYS A 182 -3.270 3.419 -12.638 1.00 0.00 H new ATOM 0 HG CYS A 182 -3.437 0.673 -12.430 1.00 0.00 H new ATOM 749 N GLY A 183 -3.218 5.696 -9.683 1.00 0.00 N ATOM 750 CA GLY A 183 -3.793 7.010 -9.464 1.00 0.00 C ATOM 751 C GLY A 183 -5.277 7.047 -9.771 1.00 0.00 C ATOM 752 O GLY A 183 -6.055 7.653 -9.035 1.00 0.00 O ATOM 0 H GLY A 183 -3.310 5.051 -8.898 1.00 0.00 H new ATOM 0 HA2 GLY A 183 -3.631 7.307 -8.428 1.00 0.00 H new ATOM 0 HA3 GLY A 183 -3.277 7.739 -10.089 1.00 0.00 H new ATOM 756 N LYS A 184 -5.668 6.395 -10.861 1.00 0.00 N ATOM 757 CA LYS A 184 -7.068 6.351 -11.265 1.00 0.00 C ATOM 758 C LYS A 184 -7.898 5.558 -10.259 1.00 0.00 C ATOM 759 O LYS A 184 -7.363 5.004 -9.299 1.00 0.00 O ATOM 760 CB LYS A 184 -7.200 5.728 -12.657 1.00 0.00 C ATOM 761 CG LYS A 184 -6.775 4.269 -12.715 1.00 0.00 C ATOM 762 CD LYS A 184 -5.602 4.064 -13.661 1.00 0.00 C ATOM 763 CE LYS A 184 -6.063 3.960 -15.105 1.00 0.00 C ATOM 764 NZ LYS A 184 -4.943 3.610 -16.022 1.00 0.00 N ATOM 0 H LYS A 184 -5.034 5.890 -11.480 1.00 0.00 H new ATOM 0 HA LYS A 184 -7.445 7.373 -11.296 1.00 0.00 H new ATOM 0 HB2 LYS A 184 -8.236 5.809 -12.985 1.00 0.00 H new ATOM 0 HB3 LYS A 184 -6.597 6.301 -13.361 1.00 0.00 H new ATOM 0 HG2 LYS A 184 -6.501 3.929 -11.716 1.00 0.00 H new ATOM 0 HG3 LYS A 184 -7.616 3.657 -13.040 1.00 0.00 H new ATOM 0 HD2 LYS A 184 -4.903 4.894 -13.560 1.00 0.00 H new ATOM 0 HD3 LYS A 184 -5.064 3.158 -13.384 1.00 0.00 H new ATOM 0 HE2 LYS A 184 -6.845 3.205 -15.183 1.00 0.00 H new ATOM 0 HE3 LYS A 184 -6.503 4.908 -15.415 1.00 0.00 H new ATOM 0 HZ1 LYS A 184 -5.299 3.549 -16.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 184 -4.208 4.343 -15.967 1.00 0.00 H new ATOM 0 HZ3 LYS A 184 -4.539 2.693 -15.743 1.00 0.00 H new ATOM 778 N PHE A 185 -9.206 5.509 -10.486 1.00 0.00 N ATOM 779 CA PHE A 185 -10.108 4.783 -9.600 1.00 0.00 C ATOM 780 C PHE A 185 -10.291 3.342 -10.067 1.00 0.00 C ATOM 781 O PHE A 185 -10.419 3.080 -11.263 1.00 0.00 O ATOM 782 CB PHE A 185 -11.465 5.484 -9.532 1.00 0.00 C ATOM 783 CG PHE A 185 -11.472 6.695 -8.642 1.00 0.00 C ATOM 784 CD1 PHE A 185 -10.924 6.639 -7.370 1.00 0.00 C ATOM 785 CD2 PHE A 185 -12.026 7.888 -9.077 1.00 0.00 C ATOM 786 CE1 PHE A 185 -10.929 7.749 -6.549 1.00 0.00 C ATOM 787 CE2 PHE A 185 -12.034 9.002 -8.260 1.00 0.00 C ATOM 788 CZ PHE A 185 -11.485 8.933 -6.995 1.00 0.00 C ATOM 0 H PHE A 185 -9.665 5.963 -11.276 1.00 0.00 H new ATOM 0 HA PHE A 185 -9.663 4.769 -8.605 1.00 0.00 H new ATOM 0 HB2 PHE A 185 -11.762 5.781 -10.538 1.00 0.00 H new ATOM 0 HB3 PHE A 185 -12.213 4.776 -9.174 1.00 0.00 H new ATOM 0 HD1 PHE A 185 -10.488 5.716 -7.017 1.00 0.00 H new ATOM 0 HD2 PHE A 185 -12.456 7.948 -10.066 1.00 0.00 H new ATOM 0 HE1 PHE A 185 -10.499 7.692 -5.560 1.00 0.00 H new ATOM 0 HE2 PHE A 185 -12.469 9.926 -8.611 1.00 0.00 H new ATOM 0 HZ PHE A 185 -11.490 9.803 -6.355 1.00 0.00 H new ATOM 798 N HIS A 186 -10.300 2.414 -9.117 1.00 0.00 N ATOM 799 CA HIS A 186 -10.466 0.998 -9.431 1.00 0.00 C ATOM 800 C HIS A 186 -11.708 0.432 -8.752 1.00 0.00 C ATOM 801 O HIS A 186 -12.244 1.029 -7.817 1.00 0.00 O ATOM 802 CB HIS A 186 -9.231 0.208 -8.993 1.00 0.00 C ATOM 803 CG HIS A 186 -8.083 0.304 -9.951 1.00 0.00 C ATOM 804 ND1 HIS A 186 -8.242 0.553 -11.299 1.00 0.00 N ATOM 805 CD2 HIS A 186 -6.750 0.181 -9.748 1.00 0.00 C ATOM 806 CE1 HIS A 186 -7.056 0.579 -11.882 1.00 0.00 C ATOM 807 NE2 HIS A 186 -6.135 0.356 -10.962 1.00 0.00 N ATOM 0 H HIS A 186 -10.194 2.616 -8.123 1.00 0.00 H new ATOM 0 HA HIS A 186 -10.587 0.904 -10.510 1.00 0.00 H new ATOM 0 HB2 HIS A 186 -8.908 0.568 -8.016 1.00 0.00 H new ATOM 0 HB3 HIS A 186 -9.505 -0.840 -8.872 1.00 0.00 H new ATOM 0 HD2 HIS A 186 -6.262 -0.018 -8.806 1.00 0.00 H new ATOM 0 HE1 HIS A 186 -6.872 0.753 -12.932 1.00 0.00 H new ATOM 0 HE2 HIS A 186 -5.129 0.320 -11.127 1.00 0.00 H new ATOM 815 N LEU A 187 -12.158 -0.725 -9.224 1.00 0.00 N ATOM 816 CA LEU A 187 -13.334 -1.377 -8.660 1.00 0.00 C ATOM 817 C LEU A 187 -12.972 -2.137 -7.386 1.00 0.00 C ATOM 818 O LEU A 187 -11.895 -2.725 -7.290 1.00 0.00 O ATOM 819 CB LEU A 187 -13.952 -2.330 -9.687 1.00 0.00 C ATOM 820 CG LEU A 187 -15.480 -2.320 -9.744 1.00 0.00 C ATOM 821 CD1 LEU A 187 -15.978 -1.120 -10.536 1.00 0.00 C ATOM 822 CD2 LEU A 187 -15.999 -3.615 -10.351 1.00 0.00 C ATOM 0 H LEU A 187 -11.726 -1.231 -9.997 1.00 0.00 H new ATOM 0 HA LEU A 187 -14.064 -0.609 -8.405 1.00 0.00 H new ATOM 0 HB2 LEU A 187 -13.565 -2.076 -10.674 1.00 0.00 H new ATOM 0 HB3 LEU A 187 -13.619 -3.344 -9.465 1.00 0.00 H new ATOM 0 HG LEU A 187 -15.862 -2.240 -8.726 1.00 0.00 H new ATOM 0 HD11 LEU A 187 -17.068 -1.130 -10.565 1.00 0.00 H new ATOM 0 HD12 LEU A 187 -15.637 -0.202 -10.058 1.00 0.00 H new ATOM 0 HD13 LEU A 187 -15.587 -1.167 -11.552 1.00 0.00 H new ATOM 0 HD21 LEU A 187 -17.088 -3.591 -10.384 1.00 0.00 H new ATOM 0 HD22 LEU A 187 -15.608 -3.725 -11.362 1.00 0.00 H new ATOM 0 HD23 LEU A 187 -15.673 -4.458 -9.742 1.00 0.00 H new ATOM 834 N LEU A 188 -13.872 -2.115 -6.408 1.00 0.00 N ATOM 835 CA LEU A 188 -13.636 -2.796 -5.139 1.00 0.00 C ATOM 836 C LEU A 188 -13.522 -4.315 -5.314 1.00 0.00 C ATOM 837 O LEU A 188 -12.735 -4.957 -4.619 1.00 0.00 O ATOM 838 CB LEU A 188 -14.739 -2.460 -4.126 1.00 0.00 C ATOM 839 CG LEU A 188 -14.236 -1.949 -2.774 1.00 0.00 C ATOM 840 CD1 LEU A 188 -14.327 -0.432 -2.707 1.00 0.00 C ATOM 841 CD2 LEU A 188 -15.024 -2.583 -1.636 1.00 0.00 C ATOM 0 H LEU A 188 -14.770 -1.634 -6.469 1.00 0.00 H new ATOM 0 HA LEU A 188 -12.682 -2.435 -4.756 1.00 0.00 H new ATOM 0 HB2 LEU A 188 -15.395 -1.707 -4.562 1.00 0.00 H new ATOM 0 HB3 LEU A 188 -15.343 -3.352 -3.959 1.00 0.00 H new ATOM 0 HG LEU A 188 -13.189 -2.234 -2.668 1.00 0.00 H new ATOM 0 HD11 LEU A 188 -13.965 -0.088 -1.738 1.00 0.00 H new ATOM 0 HD12 LEU A 188 -13.717 0.004 -3.498 1.00 0.00 H new ATOM 0 HD13 LEU A 188 -15.364 -0.124 -2.837 1.00 0.00 H new ATOM 0 HD21 LEU A 188 -14.652 -2.208 -0.683 1.00 0.00 H new ATOM 0 HD22 LEU A 188 -16.079 -2.330 -1.739 1.00 0.00 H new ATOM 0 HD23 LEU A 188 -14.906 -3.666 -1.671 1.00 0.00 H new ATOM 853 N PRO A 189 -14.297 -4.926 -6.237 1.00 0.00 N ATOM 854 CA PRO A 189 -14.248 -6.375 -6.465 1.00 0.00 C ATOM 855 C PRO A 189 -12.989 -6.799 -7.222 1.00 0.00 C ATOM 856 O PRO A 189 -13.069 -7.414 -8.285 1.00 0.00 O ATOM 857 CB PRO A 189 -15.503 -6.662 -7.309 1.00 0.00 C ATOM 858 CG PRO A 189 -16.275 -5.382 -7.345 1.00 0.00 C ATOM 859 CD PRO A 189 -15.273 -4.287 -7.127 1.00 0.00 C ATOM 0 HA PRO A 189 -14.221 -6.928 -5.526 1.00 0.00 H new ATOM 0 HB2 PRO A 189 -15.232 -6.983 -8.315 1.00 0.00 H new ATOM 0 HB3 PRO A 189 -16.096 -7.463 -6.867 1.00 0.00 H new ATOM 0 HG2 PRO A 189 -16.784 -5.260 -8.301 1.00 0.00 H new ATOM 0 HG3 PRO A 189 -17.043 -5.368 -6.571 1.00 0.00 H new ATOM 0 HD2 PRO A 189 -14.818 -3.961 -8.062 1.00 0.00 H new ATOM 0 HD3 PRO A 189 -15.726 -3.407 -6.669 1.00 0.00 H new ATOM 867 N ASP A 190 -11.827 -6.469 -6.665 1.00 0.00 N ATOM 868 CA ASP A 190 -10.553 -6.818 -7.287 1.00 0.00 C ATOM 869 C ASP A 190 -9.383 -6.375 -6.415 1.00 0.00 C ATOM 870 O ASP A 190 -8.357 -5.918 -6.921 1.00 0.00 O ATOM 871 CB ASP A 190 -10.445 -6.174 -8.671 1.00 0.00 C ATOM 872 CG ASP A 190 -9.378 -6.826 -9.529 1.00 0.00 C ATOM 873 OD1 ASP A 190 -9.553 -8.007 -9.895 1.00 0.00 O ATOM 874 OD2 ASP A 190 -8.369 -6.158 -9.833 1.00 0.00 O ATOM 0 H ASP A 190 -11.741 -5.961 -5.785 1.00 0.00 H new ATOM 0 HA ASP A 190 -10.513 -7.902 -7.394 1.00 0.00 H new ATOM 0 HB2 ASP A 190 -11.408 -6.244 -9.177 1.00 0.00 H new ATOM 0 HB3 ASP A 190 -10.220 -5.113 -8.559 1.00 0.00 H new