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 -137:sc= -0.625 USER MOD Set 1.2: A 182 CYS SG : rot -170:sc= 0.0591 USER MOD Set 1.3: A 186 HIS : no HD1:sc= -2.44 K(o=-3,f=-1.4) USER MOD Set 2.1: A 138 CYS SG : rot -95:sc= -4! USER MOD Set 2.2: A 143 CYS SG : rot 180:sc= 0 USER MOD Set 2.3: A 160 CYS SG : rot -44:sc= -0.669 USER MOD Set 2.4: A 163 CYS SG : rot 147:sc= -0.813 USER MOD Single : A 139 GLN : amide:sc= -0.162 K(o=-0.16,f=-1!) USER MOD Single : A 148 SER OG : rot 180:sc= 0 USER MOD Single : A 151 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.178) USER MOD Single : A 153 TYR OH : rot 180:sc= 0 USER MOD Single : A 154 HIS : no HD1:sc= -6.6! C(o=-6.6!,f=-6.3!) USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 157 HIS : no HD1:sc= -4.86 K(o=-4.9,f=-5.4!) USER MOD Single : A 165 THR OG1 : rot 70:sc= 0.0803 USER MOD Single : A 167 SER OG : rot 180:sc= 0 USER MOD Single : A 175 ASN : amide:sc= -0.0371 K(o=-0.037,f=-1.1) USER MOD Single : A 176 LYS NZ :NH3+ -144:sc= -0.21 (180deg=-2.38!) USER MOD Single : A 178 TYR OH : rot -61:sc= 1.45 USER MOD Single : A 180 GLN : amide:sc= 0 K(o=0,f=-0.58) 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 -8.351 20.426 -12.114 1.00 0.00 N ATOM 18 CA ALA A 136 -8.391 19.831 -10.782 1.00 0.00 C ATOM 19 C ALA A 136 -9.785 19.943 -10.173 1.00 0.00 C ATOM 20 O ALA A 136 -10.156 20.987 -9.637 1.00 0.00 O ATOM 21 CB ALA A 136 -7.363 20.495 -9.879 1.00 0.00 C ATOM 0 HA ALA A 136 -8.148 18.772 -10.875 1.00 0.00 H new ATOM 0 HB1 ALA A 136 -7.403 20.042 -8.888 1.00 0.00 H new ATOM 0 HB2 ALA A 136 -6.367 20.359 -10.300 1.00 0.00 H new ATOM 0 HB3 ALA A 136 -7.582 21.560 -9.800 1.00 0.00 H new ATOM 27 N ARG A 137 -10.553 18.862 -10.260 1.00 0.00 N ATOM 28 CA ARG A 137 -11.908 18.842 -9.718 1.00 0.00 C ATOM 29 C ARG A 137 -12.387 17.410 -9.501 1.00 0.00 C ATOM 30 O ARG A 137 -12.515 16.638 -10.451 1.00 0.00 O ATOM 31 CB ARG A 137 -12.863 19.577 -10.665 1.00 0.00 C ATOM 32 CG ARG A 137 -14.314 19.559 -10.207 1.00 0.00 C ATOM 33 CD ARG A 137 -14.799 20.949 -9.822 1.00 0.00 C ATOM 34 NE ARG A 137 -15.680 21.521 -10.836 1.00 0.00 N ATOM 35 CZ ARG A 137 -16.974 21.228 -10.948 1.00 0.00 C ATOM 36 NH1 ARG A 137 -17.539 20.361 -10.117 1.00 0.00 N ATOM 37 NH2 ARG A 137 -17.704 21.802 -11.895 1.00 0.00 N ATOM 0 H ARG A 137 -10.261 17.989 -10.700 1.00 0.00 H new ATOM 0 HA ARG A 137 -11.898 19.349 -8.753 1.00 0.00 H new ATOM 0 HB2 ARG A 137 -12.536 20.612 -10.765 1.00 0.00 H new ATOM 0 HB3 ARG A 137 -12.798 19.125 -11.655 1.00 0.00 H new ATOM 0 HG2 ARG A 137 -14.942 19.162 -11.004 1.00 0.00 H new ATOM 0 HG3 ARG A 137 -14.418 18.888 -9.354 1.00 0.00 H new ATOM 0 HD2 ARG A 137 -15.327 20.898 -8.870 1.00 0.00 H new ATOM 0 HD3 ARG A 137 -13.941 21.605 -9.676 1.00 0.00 H new ATOM 0 HE ARG A 137 -15.280 22.185 -11.499 1.00 0.00 H new ATOM 0 HH11 ARG A 137 -16.982 19.916 -9.388 1.00 0.00 H new ATOM 0 HH12 ARG A 137 -18.531 20.140 -10.207 1.00 0.00 H new ATOM 0 HH21 ARG A 137 -17.274 22.468 -12.537 1.00 0.00 H new ATOM 0 HH22 ARG A 137 -18.695 21.578 -11.981 1.00 0.00 H new ATOM 51 N CYS A 138 -12.659 17.060 -8.245 1.00 0.00 N ATOM 52 CA CYS A 138 -13.131 15.720 -7.915 1.00 0.00 C ATOM 53 C CYS A 138 -14.445 15.430 -8.631 1.00 0.00 C ATOM 54 O CYS A 138 -15.515 15.850 -8.186 1.00 0.00 O ATOM 55 CB CYS A 138 -13.309 15.573 -6.403 1.00 0.00 C ATOM 56 SG CYS A 138 -13.499 13.862 -5.850 1.00 0.00 S ATOM 0 H CYS A 138 -12.561 17.684 -7.444 1.00 0.00 H new ATOM 0 HA CYS A 138 -12.385 14.999 -8.248 1.00 0.00 H new ATOM 0 HB2 CYS A 138 -12.447 16.013 -5.901 1.00 0.00 H new ATOM 0 HB3 CYS A 138 -14.184 16.144 -6.093 1.00 0.00 H new ATOM 0 HG CYS A 138 -14.763 13.574 -5.756 1.00 0.00 H new ATOM 61 N GLN A 139 -14.350 14.723 -9.754 1.00 0.00 N ATOM 62 CA GLN A 139 -15.522 14.387 -10.559 1.00 0.00 C ATOM 63 C GLN A 139 -16.181 13.085 -10.107 1.00 0.00 C ATOM 64 O GLN A 139 -16.600 12.276 -10.937 1.00 0.00 O ATOM 65 CB GLN A 139 -15.126 14.278 -12.035 1.00 0.00 C ATOM 66 CG GLN A 139 -13.900 13.409 -12.273 1.00 0.00 C ATOM 67 CD GLN A 139 -14.180 12.238 -13.197 1.00 0.00 C ATOM 68 OE1 GLN A 139 -15.047 12.313 -14.068 1.00 0.00 O ATOM 69 NE2 GLN A 139 -13.445 11.149 -13.007 1.00 0.00 N ATOM 0 H GLN A 139 -13.469 14.370 -10.129 1.00 0.00 H new ATOM 0 HA GLN A 139 -16.249 15.188 -10.424 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -15.965 13.870 -12.599 1.00 0.00 H new ATOM 0 HB3 GLN A 139 -14.935 15.277 -12.426 1.00 0.00 H new ATOM 0 HG2 GLN A 139 -13.104 14.020 -12.699 1.00 0.00 H new ATOM 0 HG3 GLN A 139 -13.536 13.033 -11.317 1.00 0.00 H new ATOM 0 HE21 GLN A 139 -12.738 11.133 -12.272 1.00 0.00 H new ATOM 0 HE22 GLN A 139 -13.588 10.328 -13.596 1.00 0.00 H new ATOM 78 N VAL A 140 -16.292 12.887 -8.798 1.00 0.00 N ATOM 79 CA VAL A 140 -16.923 11.685 -8.271 1.00 0.00 C ATOM 80 C VAL A 140 -18.424 11.914 -8.079 1.00 0.00 C ATOM 81 O VAL A 140 -18.827 12.871 -7.420 1.00 0.00 O ATOM 82 CB VAL A 140 -16.298 11.251 -6.930 1.00 0.00 C ATOM 83 CG1 VAL A 140 -16.828 9.890 -6.503 1.00 0.00 C ATOM 84 CG2 VAL A 140 -14.781 11.231 -7.032 1.00 0.00 C ATOM 0 H VAL A 140 -15.956 13.538 -8.088 1.00 0.00 H new ATOM 0 HA VAL A 140 -16.760 10.889 -8.998 1.00 0.00 H new ATOM 0 HB VAL A 140 -16.581 11.978 -6.168 1.00 0.00 H new ATOM 0 HG11 VAL A 140 -16.374 9.604 -5.555 1.00 0.00 H new ATOM 0 HG12 VAL A 140 -17.910 9.941 -6.386 1.00 0.00 H new ATOM 0 HG13 VAL A 140 -16.580 9.148 -7.262 1.00 0.00 H new ATOM 0 HG21 VAL A 140 -14.356 10.923 -6.077 1.00 0.00 H new ATOM 0 HG22 VAL A 140 -14.478 10.528 -7.808 1.00 0.00 H new ATOM 0 HG23 VAL A 140 -14.420 12.228 -7.285 1.00 0.00 H new ATOM 94 N PRO A 141 -19.278 11.047 -8.657 1.00 0.00 N ATOM 95 CA PRO A 141 -20.732 11.178 -8.544 1.00 0.00 C ATOM 96 C PRO A 141 -21.183 11.454 -7.113 1.00 0.00 C ATOM 97 O PRO A 141 -21.894 12.424 -6.853 1.00 0.00 O ATOM 98 CB PRO A 141 -21.270 9.821 -9.031 1.00 0.00 C ATOM 99 CG PRO A 141 -20.070 8.955 -9.253 1.00 0.00 C ATOM 100 CD PRO A 141 -18.908 9.880 -9.465 1.00 0.00 C ATOM 0 HA PRO A 141 -21.103 12.022 -9.125 1.00 0.00 H new ATOM 0 HB2 PRO A 141 -21.939 9.379 -8.292 1.00 0.00 H new ATOM 0 HB3 PRO A 141 -21.843 9.936 -9.951 1.00 0.00 H new ATOM 0 HG2 PRO A 141 -19.897 8.305 -8.395 1.00 0.00 H new ATOM 0 HG3 PRO A 141 -20.214 8.308 -10.119 1.00 0.00 H new ATOM 0 HD2 PRO A 141 -17.970 9.436 -9.131 1.00 0.00 H new ATOM 0 HD3 PRO A 141 -18.782 10.138 -10.516 1.00 0.00 H new ATOM 108 N ASP A 142 -20.766 10.597 -6.189 1.00 0.00 N ATOM 109 CA ASP A 142 -21.130 10.751 -4.785 1.00 0.00 C ATOM 110 C ASP A 142 -20.364 11.905 -4.141 1.00 0.00 C ATOM 111 O ASP A 142 -20.816 12.484 -3.153 1.00 0.00 O ATOM 112 CB ASP A 142 -20.857 9.455 -4.020 1.00 0.00 C ATOM 113 CG ASP A 142 -19.457 8.923 -4.263 1.00 0.00 C ATOM 114 OD1 ASP A 142 -19.090 8.737 -5.441 1.00 0.00 O ATOM 115 OD2 ASP A 142 -18.731 8.694 -3.274 1.00 0.00 O ATOM 0 H ASP A 142 -20.176 9.789 -6.386 1.00 0.00 H new ATOM 0 HA ASP A 142 -22.195 10.977 -4.738 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -20.996 9.630 -2.953 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -21.586 8.701 -4.317 1.00 0.00 H new ATOM 120 N CYS A 143 -19.201 12.233 -4.700 1.00 0.00 N ATOM 121 CA CYS A 143 -18.381 13.317 -4.168 1.00 0.00 C ATOM 122 C CYS A 143 -17.983 14.302 -5.264 1.00 0.00 C ATOM 123 O CYS A 143 -16.965 14.123 -5.936 1.00 0.00 O ATOM 124 CB CYS A 143 -17.128 12.750 -3.494 1.00 0.00 C ATOM 125 SG CYS A 143 -16.054 14.005 -2.758 1.00 0.00 S ATOM 0 H CYS A 143 -18.808 11.766 -5.517 1.00 0.00 H new ATOM 0 HA CYS A 143 -18.976 13.855 -3.429 1.00 0.00 H new ATOM 0 HB2 CYS A 143 -17.432 12.047 -2.718 1.00 0.00 H new ATOM 0 HB3 CYS A 143 -16.557 12.185 -4.230 1.00 0.00 H new ATOM 0 HG CYS A 143 -15.024 13.429 -2.212 1.00 0.00 H new ATOM 130 N GLU A 144 -18.788 15.346 -5.433 1.00 0.00 N ATOM 131 CA GLU A 144 -18.516 16.366 -6.439 1.00 0.00 C ATOM 132 C GLU A 144 -17.750 17.531 -5.820 1.00 0.00 C ATOM 133 O GLU A 144 -18.316 18.594 -5.563 1.00 0.00 O ATOM 134 CB GLU A 144 -19.822 16.865 -7.058 1.00 0.00 C ATOM 135 CG GLU A 144 -20.583 15.793 -7.821 1.00 0.00 C ATOM 136 CD GLU A 144 -19.965 15.488 -9.171 1.00 0.00 C ATOM 137 OE1 GLU A 144 -18.882 14.867 -9.203 1.00 0.00 O ATOM 138 OE2 GLU A 144 -20.564 15.872 -10.198 1.00 0.00 O ATOM 0 H GLU A 144 -19.634 15.508 -4.886 1.00 0.00 H new ATOM 0 HA GLU A 144 -17.904 15.922 -7.224 1.00 0.00 H new ATOM 0 HB2 GLU A 144 -20.461 17.260 -6.268 1.00 0.00 H new ATOM 0 HB3 GLU A 144 -19.602 17.692 -7.733 1.00 0.00 H new ATOM 0 HG2 GLU A 144 -20.613 14.881 -7.225 1.00 0.00 H new ATOM 0 HG3 GLU A 144 -21.614 16.116 -7.962 1.00 0.00 H new ATOM 145 N ALA A 145 -16.463 17.316 -5.572 1.00 0.00 N ATOM 146 CA ALA A 145 -15.618 18.341 -4.970 1.00 0.00 C ATOM 147 C ALA A 145 -14.960 19.219 -6.029 1.00 0.00 C ATOM 148 O ALA A 145 -14.774 18.799 -7.171 1.00 0.00 O ATOM 149 CB ALA A 145 -14.558 17.697 -4.088 1.00 0.00 C ATOM 0 H ALA A 145 -15.982 16.441 -5.779 1.00 0.00 H new ATOM 0 HA ALA A 145 -16.255 18.980 -4.358 1.00 0.00 H new ATOM 0 HB1 ALA A 145 -13.934 18.472 -3.644 1.00 0.00 H new ATOM 0 HB2 ALA A 145 -15.042 17.124 -3.297 1.00 0.00 H new ATOM 0 HB3 ALA A 145 -13.938 17.033 -4.690 1.00 0.00 H new ATOM 155 N ASP A 146 -14.607 20.440 -5.638 1.00 0.00 N ATOM 156 CA ASP A 146 -13.964 21.381 -6.548 1.00 0.00 C ATOM 157 C ASP A 146 -12.559 21.726 -6.063 1.00 0.00 C ATOM 158 O ASP A 146 -12.330 22.797 -5.501 1.00 0.00 O ATOM 159 CB ASP A 146 -14.802 22.656 -6.674 1.00 0.00 C ATOM 160 CG ASP A 146 -14.214 23.642 -7.664 1.00 0.00 C ATOM 161 OD1 ASP A 146 -13.248 23.273 -8.369 1.00 0.00 O ATOM 162 OD2 ASP A 146 -14.717 24.782 -7.738 1.00 0.00 O ATOM 0 H ASP A 146 -14.756 20.801 -4.696 1.00 0.00 H new ATOM 0 HA ASP A 146 -13.887 20.909 -7.528 1.00 0.00 H new ATOM 0 HB2 ASP A 146 -15.813 22.393 -6.985 1.00 0.00 H new ATOM 0 HB3 ASP A 146 -14.883 23.132 -5.697 1.00 0.00 H new ATOM 167 N ILE A 147 -11.624 20.808 -6.284 1.00 0.00 N ATOM 168 CA ILE A 147 -10.241 21.009 -5.872 1.00 0.00 C ATOM 169 C ILE A 147 -9.474 21.841 -6.896 1.00 0.00 C ATOM 170 O ILE A 147 -8.559 21.345 -7.555 1.00 0.00 O ATOM 171 CB ILE A 147 -9.515 19.663 -5.669 1.00 0.00 C ATOM 172 CG1 ILE A 147 -9.718 18.761 -6.888 1.00 0.00 C ATOM 173 CG2 ILE A 147 -10.014 18.978 -4.406 1.00 0.00 C ATOM 174 CD1 ILE A 147 -8.529 17.875 -7.189 1.00 0.00 C ATOM 0 H ILE A 147 -11.800 19.916 -6.747 1.00 0.00 H new ATOM 0 HA ILE A 147 -10.269 21.546 -4.924 1.00 0.00 H new ATOM 0 HB ILE A 147 -8.448 19.855 -5.557 1.00 0.00 H new ATOM 0 HG12 ILE A 147 -10.595 18.135 -6.725 1.00 0.00 H new ATOM 0 HG13 ILE A 147 -9.928 19.382 -7.759 1.00 0.00 H new ATOM 0 HG21 ILE A 147 -9.493 18.030 -4.276 1.00 0.00 H new ATOM 0 HG22 ILE A 147 -9.822 19.618 -3.545 1.00 0.00 H new ATOM 0 HG23 ILE A 147 -11.085 18.795 -4.491 1.00 0.00 H new ATOM 0 HD11 ILE A 147 -8.744 17.263 -8.065 1.00 0.00 H new ATOM 0 HD12 ILE A 147 -7.654 18.495 -7.384 1.00 0.00 H new ATOM 0 HD13 ILE A 147 -8.332 17.228 -6.334 1.00 0.00 H new ATOM 186 N SER A 148 -9.851 23.110 -7.026 1.00 0.00 N ATOM 187 CA SER A 148 -9.194 24.007 -7.970 1.00 0.00 C ATOM 188 C SER A 148 -8.113 24.833 -7.278 1.00 0.00 C ATOM 189 O SER A 148 -7.765 25.923 -7.733 1.00 0.00 O ATOM 190 CB SER A 148 -10.222 24.936 -8.620 1.00 0.00 C ATOM 191 OG SER A 148 -11.000 25.601 -7.642 1.00 0.00 O ATOM 0 H SER A 148 -10.606 23.539 -6.491 1.00 0.00 H new ATOM 0 HA SER A 148 -8.722 23.399 -8.741 1.00 0.00 H new ATOM 0 HB2 SER A 148 -9.711 25.670 -9.243 1.00 0.00 H new ATOM 0 HB3 SER A 148 -10.873 24.359 -9.277 1.00 0.00 H new ATOM 0 HG SER A 148 -11.648 26.189 -8.084 1.00 0.00 H new ATOM 197 N GLU A 149 -7.584 24.309 -6.176 1.00 0.00 N ATOM 198 CA GLU A 149 -6.542 24.998 -5.425 1.00 0.00 C ATOM 199 C GLU A 149 -5.777 24.022 -4.536 1.00 0.00 C ATOM 200 O GLU A 149 -5.270 24.399 -3.479 1.00 0.00 O ATOM 201 CB GLU A 149 -7.152 26.113 -4.573 1.00 0.00 C ATOM 202 CG GLU A 149 -8.356 25.667 -3.761 1.00 0.00 C ATOM 203 CD GLU A 149 -8.352 26.232 -2.353 1.00 0.00 C ATOM 204 OE1 GLU A 149 -7.978 27.412 -2.190 1.00 0.00 O ATOM 205 OE2 GLU A 149 -8.721 25.493 -1.416 1.00 0.00 O ATOM 0 H GLU A 149 -7.861 23.409 -5.784 1.00 0.00 H new ATOM 0 HA GLU A 149 -5.843 25.436 -6.138 1.00 0.00 H new ATOM 0 HB2 GLU A 149 -6.390 26.500 -3.896 1.00 0.00 H new ATOM 0 HB3 GLU A 149 -7.448 26.936 -5.224 1.00 0.00 H new ATOM 0 HG2 GLU A 149 -9.268 25.977 -4.270 1.00 0.00 H new ATOM 0 HG3 GLU A 149 -8.373 24.578 -3.712 1.00 0.00 H new ATOM 212 N LEU A 150 -5.697 22.768 -4.970 1.00 0.00 N ATOM 213 CA LEU A 150 -4.994 21.739 -4.212 1.00 0.00 C ATOM 214 C LEU A 150 -3.613 21.477 -4.806 1.00 0.00 C ATOM 215 O LEU A 150 -3.366 21.763 -5.979 1.00 0.00 O ATOM 216 CB LEU A 150 -5.813 20.446 -4.187 1.00 0.00 C ATOM 217 CG LEU A 150 -6.201 19.953 -2.790 1.00 0.00 C ATOM 218 CD1 LEU A 150 -7.150 20.938 -2.126 1.00 0.00 C ATOM 219 CD2 LEU A 150 -6.830 18.567 -2.867 1.00 0.00 C ATOM 0 H LEU A 150 -6.110 22.440 -5.843 1.00 0.00 H new ATOM 0 HA LEU A 150 -4.866 22.095 -3.190 1.00 0.00 H new ATOM 0 HB2 LEU A 150 -6.723 20.599 -4.768 1.00 0.00 H new ATOM 0 HB3 LEU A 150 -5.243 19.663 -4.687 1.00 0.00 H new ATOM 0 HG LEU A 150 -5.298 19.883 -2.184 1.00 0.00 H new ATOM 0 HD11 LEU A 150 -7.417 20.574 -1.134 1.00 0.00 H new ATOM 0 HD12 LEU A 150 -6.663 21.909 -2.037 1.00 0.00 H new ATOM 0 HD13 LEU A 150 -8.052 21.038 -2.730 1.00 0.00 H new ATOM 0 HD21 LEU A 150 -7.099 18.233 -1.865 1.00 0.00 H new ATOM 0 HD22 LEU A 150 -7.725 18.607 -3.488 1.00 0.00 H new ATOM 0 HD23 LEU A 150 -6.117 17.867 -3.303 1.00 0.00 H new ATOM 231 N LYS A 151 -2.716 20.933 -3.990 1.00 0.00 N ATOM 232 CA LYS A 151 -1.362 20.632 -4.435 1.00 0.00 C ATOM 233 C LYS A 151 -0.953 19.220 -4.024 1.00 0.00 C ATOM 234 O LYS A 151 -0.820 18.924 -2.838 1.00 0.00 O ATOM 235 CB LYS A 151 -0.376 21.650 -3.859 1.00 0.00 C ATOM 236 CG LYS A 151 -0.690 23.087 -4.244 1.00 0.00 C ATOM 237 CD LYS A 151 -0.755 23.993 -3.023 1.00 0.00 C ATOM 238 CE LYS A 151 0.634 24.368 -2.534 1.00 0.00 C ATOM 239 NZ LYS A 151 1.100 23.466 -1.444 1.00 0.00 N ATOM 0 H LYS A 151 -2.903 20.692 -3.017 1.00 0.00 H new ATOM 0 HA LYS A 151 -1.343 20.693 -5.523 1.00 0.00 H new ATOM 0 HB2 LYS A 151 -0.374 21.566 -2.772 1.00 0.00 H new ATOM 0 HB3 LYS A 151 0.629 21.403 -4.200 1.00 0.00 H new ATOM 0 HG2 LYS A 151 0.072 23.455 -4.931 1.00 0.00 H new ATOM 0 HG3 LYS A 151 -1.641 23.122 -4.775 1.00 0.00 H new ATOM 0 HD2 LYS A 151 -1.312 24.897 -3.269 1.00 0.00 H new ATOM 0 HD3 LYS A 151 -1.300 23.490 -2.224 1.00 0.00 H new ATOM 0 HE2 LYS A 151 1.336 24.325 -3.367 1.00 0.00 H new ATOM 0 HE3 LYS A 151 0.627 25.397 -2.176 1.00 0.00 H new ATOM 0 HZ1 LYS A 151 1.950 23.868 -1.000 1.00 0.00 H new ATOM 0 HZ2 LYS A 151 0.350 23.368 -0.730 1.00 0.00 H new ATOM 0 HZ3 LYS A 151 1.326 22.531 -1.840 1.00 0.00 H new ATOM 253 N GLY A 152 -0.754 18.356 -5.015 1.00 0.00 N ATOM 254 CA GLY A 152 -0.363 16.987 -4.735 1.00 0.00 C ATOM 255 C GLY A 152 -0.557 16.072 -5.928 1.00 0.00 C ATOM 256 O GLY A 152 -0.488 16.515 -7.075 1.00 0.00 O ATOM 0 H GLY A 152 -0.856 18.579 -6.005 1.00 0.00 H new ATOM 0 HA2 GLY A 152 0.684 16.966 -4.432 1.00 0.00 H new ATOM 0 HA3 GLY A 152 -0.946 16.611 -3.894 1.00 0.00 H new ATOM 260 N TYR A 153 -0.800 14.795 -5.658 1.00 0.00 N ATOM 261 CA TYR A 153 -1.005 13.815 -6.718 1.00 0.00 C ATOM 262 C TYR A 153 -2.474 13.750 -7.122 1.00 0.00 C ATOM 263 O TYR A 153 -2.800 13.540 -8.290 1.00 0.00 O ATOM 264 CB TYR A 153 -0.528 12.434 -6.263 1.00 0.00 C ATOM 265 CG TYR A 153 -1.061 12.026 -4.910 1.00 0.00 C ATOM 266 CD1 TYR A 153 -2.322 11.458 -4.781 1.00 0.00 C ATOM 267 CD2 TYR A 153 -0.303 12.209 -3.759 1.00 0.00 C ATOM 268 CE1 TYR A 153 -2.814 11.084 -3.544 1.00 0.00 C ATOM 269 CE2 TYR A 153 -0.787 11.837 -2.519 1.00 0.00 C ATOM 270 CZ TYR A 153 -2.043 11.275 -2.417 1.00 0.00 C ATOM 271 OH TYR A 153 -2.529 10.905 -1.185 1.00 0.00 O ATOM 0 H TYR A 153 -0.860 14.414 -4.714 1.00 0.00 H new ATOM 0 HA TYR A 153 -0.422 14.127 -7.585 1.00 0.00 H new ATOM 0 HB2 TYR A 153 -0.831 11.692 -7.002 1.00 0.00 H new ATOM 0 HB3 TYR A 153 0.562 12.427 -6.232 1.00 0.00 H new ATOM 0 HD1 TYR A 153 -2.928 11.306 -5.662 1.00 0.00 H new ATOM 0 HD2 TYR A 153 0.680 12.649 -3.835 1.00 0.00 H new ATOM 0 HE1 TYR A 153 -3.797 10.645 -3.461 1.00 0.00 H new ATOM 0 HE2 TYR A 153 -0.185 11.985 -1.635 1.00 0.00 H new ATOM 0 HH TYR A 153 -1.862 11.106 -0.496 1.00 0.00 H new ATOM 281 N HIS A 154 -3.359 13.937 -6.146 1.00 0.00 N ATOM 282 CA HIS A 154 -4.796 13.902 -6.400 1.00 0.00 C ATOM 283 C HIS A 154 -5.204 14.970 -7.411 1.00 0.00 C ATOM 284 O HIS A 154 -6.264 14.875 -8.031 1.00 0.00 O ATOM 285 CB HIS A 154 -5.573 14.096 -5.096 1.00 0.00 C ATOM 286 CG HIS A 154 -5.023 15.183 -4.222 1.00 0.00 C ATOM 287 ND1 HIS A 154 -4.589 14.962 -2.932 1.00 0.00 N ATOM 288 CD2 HIS A 154 -4.836 16.502 -4.460 1.00 0.00 C ATOM 289 CE1 HIS A 154 -4.162 16.099 -2.413 1.00 0.00 C ATOM 290 NE2 HIS A 154 -4.301 17.049 -3.319 1.00 0.00 N ATOM 0 H HIS A 154 -3.107 14.114 -5.174 1.00 0.00 H new ATOM 0 HA HIS A 154 -5.037 12.925 -6.818 1.00 0.00 H new ATOM 0 HB2 HIS A 154 -6.612 14.324 -5.333 1.00 0.00 H new ATOM 0 HB3 HIS A 154 -5.571 13.159 -4.540 1.00 0.00 H new ATOM 0 HD2 HIS A 154 -5.065 17.027 -5.376 1.00 0.00 H new ATOM 0 HE1 HIS A 154 -3.766 16.229 -1.417 1.00 0.00 H new ATOM 0 HE2 HIS A 154 -4.052 18.030 -3.192 1.00 0.00 H new ATOM 298 N LYS A 155 -4.362 15.985 -7.574 1.00 0.00 N ATOM 299 CA LYS A 155 -4.642 17.066 -8.511 1.00 0.00 C ATOM 300 C LYS A 155 -4.617 16.560 -9.950 1.00 0.00 C ATOM 301 O LYS A 155 -5.401 17.002 -10.789 1.00 0.00 O ATOM 302 CB LYS A 155 -3.623 18.195 -8.338 1.00 0.00 C ATOM 303 CG LYS A 155 -3.900 19.405 -9.215 1.00 0.00 C ATOM 304 CD LYS A 155 -2.979 19.442 -10.425 1.00 0.00 C ATOM 305 CE LYS A 155 -3.684 18.950 -11.678 1.00 0.00 C ATOM 306 NZ LYS A 155 -3.255 19.703 -12.888 1.00 0.00 N ATOM 0 H LYS A 155 -3.481 16.081 -7.070 1.00 0.00 H new ATOM 0 HA LYS A 155 -5.640 17.449 -8.297 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -3.614 18.508 -7.294 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -2.628 17.813 -8.565 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -4.938 19.384 -9.547 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -3.771 20.316 -8.631 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -2.624 20.461 -10.582 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -2.101 18.825 -10.234 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -3.477 17.889 -11.818 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -4.762 19.050 -11.551 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -3.759 19.337 -13.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -3.476 20.712 -12.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -2.231 19.587 -13.024 1.00 0.00 H new ATOM 320 N ARG A 156 -3.707 15.631 -10.228 1.00 0.00 N ATOM 321 CA ARG A 156 -3.574 15.064 -11.565 1.00 0.00 C ATOM 322 C ARG A 156 -4.450 13.823 -11.740 1.00 0.00 C ATOM 323 O ARG A 156 -4.188 12.990 -12.609 1.00 0.00 O ATOM 324 CB ARG A 156 -2.111 14.709 -11.842 1.00 0.00 C ATOM 325 CG ARG A 156 -1.792 14.558 -13.321 1.00 0.00 C ATOM 326 CD ARG A 156 -0.515 13.762 -13.537 1.00 0.00 C ATOM 327 NE ARG A 156 -0.642 12.808 -14.636 1.00 0.00 N ATOM 328 CZ ARG A 156 -0.815 13.161 -15.908 1.00 0.00 C ATOM 329 NH1 ARG A 156 -0.882 14.443 -16.245 1.00 0.00 N ATOM 330 NH2 ARG A 156 -0.923 12.230 -16.845 1.00 0.00 N ATOM 0 H ARG A 156 -3.050 15.255 -9.544 1.00 0.00 H new ATOM 0 HA ARG A 156 -3.909 15.816 -12.279 1.00 0.00 H new ATOM 0 HB2 ARG A 156 -1.471 15.483 -11.418 1.00 0.00 H new ATOM 0 HB3 ARG A 156 -1.868 13.778 -11.329 1.00 0.00 H new ATOM 0 HG2 ARG A 156 -2.621 14.061 -13.824 1.00 0.00 H new ATOM 0 HG3 ARG A 156 -1.689 15.544 -13.775 1.00 0.00 H new ATOM 0 HD2 ARG A 156 0.308 14.446 -13.745 1.00 0.00 H new ATOM 0 HD3 ARG A 156 -0.262 13.228 -12.621 1.00 0.00 H new ATOM 0 HE ARG A 156 -0.595 11.813 -14.416 1.00 0.00 H new ATOM 0 HH11 ARG A 156 -0.801 15.164 -15.528 1.00 0.00 H new ATOM 0 HH12 ARG A 156 -1.015 14.707 -17.221 1.00 0.00 H new ATOM 0 HH21 ARG A 156 -0.874 11.243 -16.592 1.00 0.00 H new ATOM 0 HH22 ARG A 156 -1.056 12.500 -17.820 1.00 0.00 H new ATOM 344 N HIS A 157 -5.487 13.699 -10.918 1.00 0.00 N ATOM 345 CA HIS A 157 -6.387 12.553 -10.998 1.00 0.00 C ATOM 346 C HIS A 157 -7.840 12.967 -10.769 1.00 0.00 C ATOM 347 O HIS A 157 -8.696 12.127 -10.495 1.00 0.00 O ATOM 348 CB HIS A 157 -5.980 11.491 -9.976 1.00 0.00 C ATOM 349 CG HIS A 157 -4.977 10.511 -10.502 1.00 0.00 C ATOM 350 ND1 HIS A 157 -5.328 9.390 -11.226 1.00 0.00 N ATOM 351 CD2 HIS A 157 -3.627 10.487 -10.409 1.00 0.00 C ATOM 352 CE1 HIS A 157 -4.238 8.720 -11.553 1.00 0.00 C ATOM 353 NE2 HIS A 157 -3.193 9.366 -11.070 1.00 0.00 N ATOM 0 H HIS A 157 -5.725 14.375 -10.192 1.00 0.00 H new ATOM 0 HA HIS A 157 -6.309 12.137 -12.002 1.00 0.00 H new ATOM 0 HB2 HIS A 157 -5.568 11.984 -9.096 1.00 0.00 H new ATOM 0 HB3 HIS A 157 -6.869 10.950 -9.651 1.00 0.00 H new ATOM 0 HD2 HIS A 157 -3.007 11.215 -9.908 1.00 0.00 H new ATOM 0 HE1 HIS A 157 -4.207 7.801 -12.119 1.00 0.00 H new ATOM 0 HE2 HIS A 157 -2.220 9.078 -11.172 1.00 0.00 H new ATOM 361 N ARG A 158 -8.114 14.266 -10.886 1.00 0.00 N ATOM 362 CA ARG A 158 -9.467 14.787 -10.695 1.00 0.00 C ATOM 363 C ARG A 158 -10.111 14.212 -9.435 1.00 0.00 C ATOM 364 O ARG A 158 -11.177 13.598 -9.493 1.00 0.00 O ATOM 365 CB ARG A 158 -10.332 14.471 -11.917 1.00 0.00 C ATOM 366 CG ARG A 158 -10.078 15.395 -13.097 1.00 0.00 C ATOM 367 CD ARG A 158 -11.100 15.180 -14.203 1.00 0.00 C ATOM 368 NE ARG A 158 -11.190 13.778 -14.602 1.00 0.00 N ATOM 369 CZ ARG A 158 -12.013 13.326 -15.545 1.00 0.00 C ATOM 370 NH1 ARG A 158 -12.818 14.162 -16.189 1.00 0.00 N ATOM 371 NH2 ARG A 158 -12.033 12.035 -15.846 1.00 0.00 N ATOM 0 H ARG A 158 -7.418 14.976 -11.112 1.00 0.00 H new ATOM 0 HA ARG A 158 -9.396 15.868 -10.575 1.00 0.00 H new ATOM 0 HB2 ARG A 158 -10.148 13.442 -12.226 1.00 0.00 H new ATOM 0 HB3 ARG A 158 -11.383 14.536 -11.635 1.00 0.00 H new ATOM 0 HG2 ARG A 158 -10.114 16.432 -12.763 1.00 0.00 H new ATOM 0 HG3 ARG A 158 -9.075 15.221 -13.488 1.00 0.00 H new ATOM 0 HD2 ARG A 158 -12.077 15.524 -13.865 1.00 0.00 H new ATOM 0 HD3 ARG A 158 -10.831 15.786 -15.068 1.00 0.00 H new ATOM 0 HE ARG A 158 -10.586 13.105 -14.130 1.00 0.00 H new ATOM 0 HH11 ARG A 158 -12.808 15.156 -15.962 1.00 0.00 H new ATOM 0 HH12 ARG A 158 -13.447 13.810 -16.911 1.00 0.00 H new ATOM 0 HH21 ARG A 158 -11.417 11.387 -15.355 1.00 0.00 H new ATOM 0 HH22 ARG A 158 -12.664 11.690 -16.569 1.00 0.00 H new ATOM 385 N VAL A 159 -9.455 14.415 -8.298 1.00 0.00 N ATOM 386 CA VAL A 159 -9.960 13.919 -7.024 1.00 0.00 C ATOM 387 C VAL A 159 -9.491 14.804 -5.872 1.00 0.00 C ATOM 388 O VAL A 159 -8.436 15.433 -5.952 1.00 0.00 O ATOM 389 CB VAL A 159 -9.509 12.465 -6.772 1.00 0.00 C ATOM 390 CG1 VAL A 159 -7.992 12.363 -6.786 1.00 0.00 C ATOM 391 CG2 VAL A 159 -10.075 11.943 -5.459 1.00 0.00 C ATOM 0 H VAL A 159 -8.571 14.920 -8.233 1.00 0.00 H new ATOM 0 HA VAL A 159 -11.049 13.945 -7.074 1.00 0.00 H new ATOM 0 HB VAL A 159 -9.899 11.843 -7.578 1.00 0.00 H new ATOM 0 HG11 VAL A 159 -7.695 11.330 -6.606 1.00 0.00 H new ATOM 0 HG12 VAL A 159 -7.615 12.686 -7.756 1.00 0.00 H new ATOM 0 HG13 VAL A 159 -7.577 13.001 -6.005 1.00 0.00 H new ATOM 0 HG21 VAL A 159 -9.744 10.916 -5.303 1.00 0.00 H new ATOM 0 HG22 VAL A 159 -9.723 12.567 -4.637 1.00 0.00 H new ATOM 0 HG23 VAL A 159 -11.164 11.971 -5.495 1.00 0.00 H new ATOM 401 N CYS A 160 -10.283 14.854 -4.806 1.00 0.00 N ATOM 402 CA CYS A 160 -9.947 15.670 -3.645 1.00 0.00 C ATOM 403 C CYS A 160 -9.096 14.884 -2.650 1.00 0.00 C ATOM 404 O CYS A 160 -9.053 13.655 -2.688 1.00 0.00 O ATOM 405 CB CYS A 160 -11.222 16.188 -2.970 1.00 0.00 C ATOM 406 SG CYS A 160 -12.156 14.933 -2.061 1.00 0.00 S ATOM 0 H CYS A 160 -11.160 14.340 -4.722 1.00 0.00 H new ATOM 0 HA CYS A 160 -9.362 16.523 -3.988 1.00 0.00 H new ATOM 0 HB2 CYS A 160 -10.953 16.991 -2.283 1.00 0.00 H new ATOM 0 HB3 CYS A 160 -11.869 16.623 -3.731 1.00 0.00 H new ATOM 0 HG CYS A 160 -12.221 13.844 -2.768 1.00 0.00 H new ATOM 411 N LEU A 161 -8.414 15.606 -1.765 1.00 0.00 N ATOM 412 CA LEU A 161 -7.557 14.981 -0.762 1.00 0.00 C ATOM 413 C LEU A 161 -8.342 14.002 0.105 1.00 0.00 C ATOM 414 O LEU A 161 -7.852 12.921 0.435 1.00 0.00 O ATOM 415 CB LEU A 161 -6.910 16.053 0.119 1.00 0.00 C ATOM 416 CG LEU A 161 -5.815 15.544 1.059 1.00 0.00 C ATOM 417 CD1 LEU A 161 -4.710 16.579 1.202 1.00 0.00 C ATOM 418 CD2 LEU A 161 -6.403 15.198 2.420 1.00 0.00 C ATOM 0 H LEU A 161 -8.438 16.625 -1.722 1.00 0.00 H new ATOM 0 HA LEU A 161 -6.780 14.424 -1.285 1.00 0.00 H new ATOM 0 HB2 LEU A 161 -6.486 16.823 -0.525 1.00 0.00 H new ATOM 0 HB3 LEU A 161 -7.688 16.529 0.716 1.00 0.00 H new ATOM 0 HG LEU A 161 -5.383 14.640 0.629 1.00 0.00 H new ATOM 0 HD11 LEU A 161 -3.941 16.199 1.874 1.00 0.00 H new ATOM 0 HD12 LEU A 161 -4.271 16.780 0.225 1.00 0.00 H new ATOM 0 HD13 LEU A 161 -5.125 17.501 1.610 1.00 0.00 H new ATOM 0 HD21 LEU A 161 -5.612 14.837 3.077 1.00 0.00 H new ATOM 0 HD22 LEU A 161 -6.860 16.087 2.856 1.00 0.00 H new ATOM 0 HD23 LEU A 161 -7.159 14.422 2.303 1.00 0.00 H new ATOM 430 N ARG A 162 -9.559 14.385 0.476 1.00 0.00 N ATOM 431 CA ARG A 162 -10.410 13.540 1.310 1.00 0.00 C ATOM 432 C ARG A 162 -10.582 12.154 0.696 1.00 0.00 C ATOM 433 O ARG A 162 -10.614 11.149 1.406 1.00 0.00 O ATOM 434 CB ARG A 162 -11.777 14.196 1.507 1.00 0.00 C ATOM 435 CG ARG A 162 -12.678 13.445 2.474 1.00 0.00 C ATOM 436 CD ARG A 162 -14.128 13.469 2.020 1.00 0.00 C ATOM 437 NE ARG A 162 -15.026 12.906 3.025 1.00 0.00 N ATOM 438 CZ ARG A 162 -15.318 13.506 4.177 1.00 0.00 C ATOM 439 NH1 ARG A 162 -14.783 14.684 4.473 1.00 0.00 N ATOM 440 NH2 ARG A 162 -16.145 12.925 5.035 1.00 0.00 N ATOM 0 H ARG A 162 -9.980 15.276 0.213 1.00 0.00 H new ATOM 0 HA ARG A 162 -9.923 13.426 2.279 1.00 0.00 H new ATOM 0 HB2 ARG A 162 -11.634 15.213 1.872 1.00 0.00 H new ATOM 0 HB3 ARG A 162 -12.277 14.272 0.541 1.00 0.00 H new ATOM 0 HG2 ARG A 162 -12.340 12.412 2.560 1.00 0.00 H new ATOM 0 HG3 ARG A 162 -12.599 13.890 3.466 1.00 0.00 H new ATOM 0 HD2 ARG A 162 -14.423 14.496 1.805 1.00 0.00 H new ATOM 0 HD3 ARG A 162 -14.226 12.908 1.091 1.00 0.00 H new ATOM 0 HE ARG A 162 -15.454 12.000 2.833 1.00 0.00 H new ATOM 0 HH11 ARG A 162 -14.145 15.134 3.817 1.00 0.00 H new ATOM 0 HH12 ARG A 162 -15.010 15.140 5.357 1.00 0.00 H new ATOM 0 HH21 ARG A 162 -16.557 12.019 4.812 1.00 0.00 H new ATOM 0 HH22 ARG A 162 -16.369 13.384 5.918 1.00 0.00 H new ATOM 454 N CYS A 163 -10.694 12.105 -0.628 1.00 0.00 N ATOM 455 CA CYS A 163 -10.863 10.842 -1.333 1.00 0.00 C ATOM 456 C CYS A 163 -9.555 10.059 -1.360 1.00 0.00 C ATOM 457 O CYS A 163 -9.551 8.831 -1.278 1.00 0.00 O ATOM 458 CB CYS A 163 -11.353 11.090 -2.759 1.00 0.00 C ATOM 459 SG CYS A 163 -13.149 11.224 -2.911 1.00 0.00 S ATOM 0 H CYS A 163 -10.671 12.926 -1.233 1.00 0.00 H new ATOM 0 HA CYS A 163 -11.609 10.253 -0.800 1.00 0.00 H new ATOM 0 HB2 CYS A 163 -10.898 12.007 -3.133 1.00 0.00 H new ATOM 0 HB3 CYS A 163 -11.005 10.278 -3.397 1.00 0.00 H new ATOM 0 HG CYS A 163 -13.443 12.071 -3.852 1.00 0.00 H new ATOM 464 N ALA A 164 -8.444 10.780 -1.470 1.00 0.00 N ATOM 465 CA ALA A 164 -7.127 10.157 -1.503 1.00 0.00 C ATOM 466 C ALA A 164 -6.794 9.517 -0.159 1.00 0.00 C ATOM 467 O ALA A 164 -6.086 8.513 -0.095 1.00 0.00 O ATOM 468 CB ALA A 164 -6.069 11.183 -1.881 1.00 0.00 C ATOM 0 H ALA A 164 -8.430 11.798 -1.538 1.00 0.00 H new ATOM 0 HA ALA A 164 -7.138 9.371 -2.258 1.00 0.00 H new ATOM 0 HB1 ALA A 164 -5.090 10.705 -1.902 1.00 0.00 H new ATOM 0 HB2 ALA A 164 -6.294 11.592 -2.866 1.00 0.00 H new ATOM 0 HB3 ALA A 164 -6.064 11.988 -1.146 1.00 0.00 H new ATOM 474 N THR A 165 -7.313 10.108 0.913 1.00 0.00 N ATOM 475 CA THR A 165 -7.074 9.602 2.259 1.00 0.00 C ATOM 476 C THR A 165 -8.137 8.584 2.657 1.00 0.00 C ATOM 477 O THR A 165 -7.855 7.622 3.371 1.00 0.00 O ATOM 478 CB THR A 165 -7.059 10.744 3.292 1.00 0.00 C ATOM 479 OG1 THR A 165 -6.145 11.766 2.878 1.00 0.00 O ATOM 480 CG2 THR A 165 -6.659 10.228 4.666 1.00 0.00 C ATOM 0 H THR A 165 -7.903 10.939 0.875 1.00 0.00 H new ATOM 0 HA THR A 165 -6.097 9.119 2.249 1.00 0.00 H new ATOM 0 HB THR A 165 -8.065 11.158 3.356 1.00 0.00 H new ATOM 0 HG1 THR A 165 -6.508 12.233 2.097 1.00 0.00 H new ATOM 0 HG21 THR A 165 -6.656 11.053 5.378 1.00 0.00 H new ATOM 0 HG22 THR A 165 -7.372 9.471 4.992 1.00 0.00 H new ATOM 0 HG23 THR A 165 -5.662 9.790 4.614 1.00 0.00 H new ATOM 488 N ALA A 166 -9.362 8.803 2.189 1.00 0.00 N ATOM 489 CA ALA A 166 -10.470 7.907 2.495 1.00 0.00 C ATOM 490 C ALA A 166 -10.204 6.503 1.962 1.00 0.00 C ATOM 491 O ALA A 166 -9.366 6.311 1.083 1.00 0.00 O ATOM 492 CB ALA A 166 -11.766 8.456 1.918 1.00 0.00 C ATOM 0 H ALA A 166 -9.612 9.594 1.596 1.00 0.00 H new ATOM 0 HA ALA A 166 -10.565 7.843 3.579 1.00 0.00 H new ATOM 0 HB1 ALA A 166 -12.586 7.777 2.154 1.00 0.00 H new ATOM 0 HB2 ALA A 166 -11.970 9.436 2.350 1.00 0.00 H new ATOM 0 HB3 ALA A 166 -11.672 8.549 0.836 1.00 0.00 H new ATOM 498 N SER A 167 -10.924 5.524 2.503 1.00 0.00 N ATOM 499 CA SER A 167 -10.766 4.138 2.082 1.00 0.00 C ATOM 500 C SER A 167 -11.380 3.913 0.704 1.00 0.00 C ATOM 501 O SER A 167 -10.690 3.525 -0.238 1.00 0.00 O ATOM 502 CB SER A 167 -11.411 3.197 3.100 1.00 0.00 C ATOM 503 OG SER A 167 -11.140 3.616 4.427 1.00 0.00 O ATOM 0 H SER A 167 -11.622 5.666 3.233 1.00 0.00 H new ATOM 0 HA SER A 167 -9.699 3.923 2.023 1.00 0.00 H new ATOM 0 HB2 SER A 167 -12.488 3.165 2.938 1.00 0.00 H new ATOM 0 HB3 SER A 167 -11.036 2.184 2.952 1.00 0.00 H new ATOM 0 HG SER A 167 -11.565 2.999 5.058 1.00 0.00 H new ATOM 509 N PHE A 168 -12.680 4.161 0.596 1.00 0.00 N ATOM 510 CA PHE A 168 -13.390 3.986 -0.667 1.00 0.00 C ATOM 511 C PHE A 168 -14.477 5.042 -0.831 1.00 0.00 C ATOM 512 O PHE A 168 -14.701 5.862 0.061 1.00 0.00 O ATOM 513 CB PHE A 168 -14.004 2.588 -0.743 1.00 0.00 C ATOM 514 CG PHE A 168 -14.914 2.270 0.410 1.00 0.00 C ATOM 515 CD1 PHE A 168 -14.397 1.823 1.616 1.00 0.00 C ATOM 516 CD2 PHE A 168 -16.286 2.419 0.287 1.00 0.00 C ATOM 517 CE1 PHE A 168 -15.233 1.530 2.677 1.00 0.00 C ATOM 518 CE2 PHE A 168 -17.127 2.127 1.344 1.00 0.00 C ATOM 519 CZ PHE A 168 -16.599 1.682 2.542 1.00 0.00 C ATOM 0 H PHE A 168 -13.264 4.484 1.367 1.00 0.00 H new ATOM 0 HA PHE A 168 -12.671 4.103 -1.478 1.00 0.00 H new ATOM 0 HB2 PHE A 168 -14.564 2.496 -1.674 1.00 0.00 H new ATOM 0 HB3 PHE A 168 -13.203 1.849 -0.778 1.00 0.00 H new ATOM 0 HD1 PHE A 168 -13.330 1.702 1.728 1.00 0.00 H new ATOM 0 HD2 PHE A 168 -16.703 2.768 -0.646 1.00 0.00 H new ATOM 0 HE1 PHE A 168 -14.818 1.182 3.611 1.00 0.00 H new ATOM 0 HE2 PHE A 168 -18.195 2.246 1.235 1.00 0.00 H new ATOM 0 HZ PHE A 168 -17.253 1.454 3.370 1.00 0.00 H new ATOM 529 N VAL A 169 -15.153 5.016 -1.975 1.00 0.00 N ATOM 530 CA VAL A 169 -16.219 5.971 -2.256 1.00 0.00 C ATOM 531 C VAL A 169 -17.361 5.311 -3.019 1.00 0.00 C ATOM 532 O VAL A 169 -17.143 4.392 -3.809 1.00 0.00 O ATOM 533 CB VAL A 169 -15.699 7.169 -3.070 1.00 0.00 C ATOM 534 CG1 VAL A 169 -14.776 8.033 -2.222 1.00 0.00 C ATOM 535 CG2 VAL A 169 -14.988 6.693 -4.327 1.00 0.00 C ATOM 0 H VAL A 169 -14.981 4.344 -2.723 1.00 0.00 H new ATOM 0 HA VAL A 169 -16.586 6.327 -1.293 1.00 0.00 H new ATOM 0 HB VAL A 169 -16.552 7.777 -3.371 1.00 0.00 H new ATOM 0 HG11 VAL A 169 -14.419 8.875 -2.815 1.00 0.00 H new ATOM 0 HG12 VAL A 169 -15.321 8.406 -1.355 1.00 0.00 H new ATOM 0 HG13 VAL A 169 -13.926 7.438 -1.888 1.00 0.00 H new ATOM 0 HG21 VAL A 169 -14.627 7.554 -4.889 1.00 0.00 H new ATOM 0 HG22 VAL A 169 -14.144 6.061 -4.050 1.00 0.00 H new ATOM 0 HG23 VAL A 169 -15.682 6.122 -4.944 1.00 0.00 H new ATOM 545 N VAL A 170 -18.578 5.783 -2.779 1.00 0.00 N ATOM 546 CA VAL A 170 -19.755 5.239 -3.444 1.00 0.00 C ATOM 547 C VAL A 170 -19.962 5.888 -4.810 1.00 0.00 C ATOM 548 O VAL A 170 -20.880 6.687 -4.997 1.00 0.00 O ATOM 549 CB VAL A 170 -21.026 5.435 -2.593 1.00 0.00 C ATOM 550 CG1 VAL A 170 -22.212 4.726 -3.230 1.00 0.00 C ATOM 551 CG2 VAL A 170 -20.800 4.938 -1.173 1.00 0.00 C ATOM 0 H VAL A 170 -18.776 6.543 -2.128 1.00 0.00 H new ATOM 0 HA VAL A 170 -19.580 4.171 -3.575 1.00 0.00 H new ATOM 0 HB VAL A 170 -21.250 6.501 -2.550 1.00 0.00 H new ATOM 0 HG11 VAL A 170 -23.099 4.876 -2.615 1.00 0.00 H new ATOM 0 HG12 VAL A 170 -22.388 5.134 -4.226 1.00 0.00 H new ATOM 0 HG13 VAL A 170 -22.000 3.660 -3.307 1.00 0.00 H new ATOM 0 HG21 VAL A 170 -21.708 5.085 -0.587 1.00 0.00 H new ATOM 0 HG22 VAL A 170 -20.549 3.877 -1.194 1.00 0.00 H new ATOM 0 HG23 VAL A 170 -19.981 5.495 -0.718 1.00 0.00 H new ATOM 561 N LEU A 171 -19.102 5.542 -5.761 1.00 0.00 N ATOM 562 CA LEU A 171 -19.189 6.090 -7.109 1.00 0.00 C ATOM 563 C LEU A 171 -20.551 5.790 -7.732 1.00 0.00 C ATOM 564 O LEU A 171 -21.458 5.304 -7.055 1.00 0.00 O ATOM 565 CB LEU A 171 -18.071 5.521 -7.985 1.00 0.00 C ATOM 566 CG LEU A 171 -17.491 6.497 -9.013 1.00 0.00 C ATOM 567 CD1 LEU A 171 -16.157 7.046 -8.534 1.00 0.00 C ATOM 568 CD2 LEU A 171 -17.334 5.818 -10.367 1.00 0.00 C ATOM 0 H LEU A 171 -18.335 4.883 -5.623 1.00 0.00 H new ATOM 0 HA LEU A 171 -19.073 7.172 -7.045 1.00 0.00 H new ATOM 0 HB2 LEU A 171 -17.264 5.176 -7.339 1.00 0.00 H new ATOM 0 HB3 LEU A 171 -18.453 4.647 -8.512 1.00 0.00 H new ATOM 0 HG LEU A 171 -18.185 7.330 -9.125 1.00 0.00 H new ATOM 0 HD11 LEU A 171 -15.760 7.738 -9.277 1.00 0.00 H new ATOM 0 HD12 LEU A 171 -16.298 7.570 -7.589 1.00 0.00 H new ATOM 0 HD13 LEU A 171 -15.455 6.224 -8.392 1.00 0.00 H new ATOM 0 HD21 LEU A 171 -16.921 6.527 -11.084 1.00 0.00 H new ATOM 0 HD22 LEU A 171 -16.661 4.966 -10.271 1.00 0.00 H new ATOM 0 HD23 LEU A 171 -18.307 5.474 -10.717 1.00 0.00 H new ATOM 580 N ASP A 172 -20.689 6.085 -9.021 1.00 0.00 N ATOM 581 CA ASP A 172 -21.943 5.849 -9.732 1.00 0.00 C ATOM 582 C ASP A 172 -22.376 4.391 -9.613 1.00 0.00 C ATOM 583 O ASP A 172 -22.008 3.555 -10.439 1.00 0.00 O ATOM 584 CB ASP A 172 -21.796 6.231 -11.206 1.00 0.00 C ATOM 585 CG ASP A 172 -23.051 6.875 -11.763 1.00 0.00 C ATOM 586 OD1 ASP A 172 -24.159 6.472 -11.349 1.00 0.00 O ATOM 587 OD2 ASP A 172 -22.927 7.783 -12.612 1.00 0.00 O ATOM 0 H ASP A 172 -19.949 6.488 -9.595 1.00 0.00 H new ATOM 0 HA ASP A 172 -22.711 6.473 -9.275 1.00 0.00 H new ATOM 0 HB2 ASP A 172 -20.957 6.918 -11.319 1.00 0.00 H new ATOM 0 HB3 ASP A 172 -21.559 5.340 -11.788 1.00 0.00 H new ATOM 592 N GLY A 173 -23.162 4.093 -8.582 1.00 0.00 N ATOM 593 CA GLY A 173 -23.637 2.737 -8.374 1.00 0.00 C ATOM 594 C GLY A 173 -22.511 1.721 -8.339 1.00 0.00 C ATOM 595 O GLY A 173 -22.712 0.551 -8.665 1.00 0.00 O ATOM 0 H GLY A 173 -23.479 4.768 -7.886 1.00 0.00 H new ATOM 0 HA2 GLY A 173 -24.192 2.691 -7.437 1.00 0.00 H new ATOM 0 HA3 GLY A 173 -24.333 2.474 -9.170 1.00 0.00 H new ATOM 599 N GLU A 174 -21.323 2.168 -7.947 1.00 0.00 N ATOM 600 CA GLU A 174 -20.163 1.288 -7.874 1.00 0.00 C ATOM 601 C GLU A 174 -19.124 1.834 -6.898 1.00 0.00 C ATOM 602 O GLU A 174 -18.604 2.934 -7.083 1.00 0.00 O ATOM 603 CB GLU A 174 -19.538 1.117 -9.259 1.00 0.00 C ATOM 604 CG GLU A 174 -20.241 0.082 -10.120 1.00 0.00 C ATOM 605 CD GLU A 174 -19.271 -0.762 -10.927 1.00 0.00 C ATOM 606 OE1 GLU A 174 -18.483 -1.511 -10.312 1.00 0.00 O ATOM 607 OE2 GLU A 174 -19.301 -0.672 -12.172 1.00 0.00 O ATOM 0 H GLU A 174 -21.138 3.134 -7.675 1.00 0.00 H new ATOM 0 HA GLU A 174 -20.499 0.316 -7.512 1.00 0.00 H new ATOM 0 HB2 GLU A 174 -19.552 2.077 -9.776 1.00 0.00 H new ATOM 0 HB3 GLU A 174 -18.492 0.832 -9.144 1.00 0.00 H new ATOM 0 HG2 GLU A 174 -20.840 -0.569 -9.483 1.00 0.00 H new ATOM 0 HG3 GLU A 174 -20.930 0.586 -10.798 1.00 0.00 H new ATOM 614 N ASN A 175 -18.827 1.056 -5.864 1.00 0.00 N ATOM 615 CA ASN A 175 -17.848 1.461 -4.860 1.00 0.00 C ATOM 616 C ASN A 175 -16.430 1.311 -5.399 1.00 0.00 C ATOM 617 O ASN A 175 -15.914 0.198 -5.517 1.00 0.00 O ATOM 618 CB ASN A 175 -18.016 0.627 -3.589 1.00 0.00 C ATOM 619 CG ASN A 175 -19.450 0.605 -3.097 1.00 0.00 C ATOM 620 OD1 ASN A 175 -20.254 1.465 -3.454 1.00 0.00 O ATOM 621 ND2 ASN A 175 -19.778 -0.383 -2.272 1.00 0.00 N ATOM 0 H ASN A 175 -19.249 0.142 -5.698 1.00 0.00 H new ATOM 0 HA ASN A 175 -18.019 2.511 -4.620 1.00 0.00 H new ATOM 0 HB2 ASN A 175 -17.685 -0.394 -3.781 1.00 0.00 H new ATOM 0 HB3 ASN A 175 -17.372 1.029 -2.806 1.00 0.00 H new ATOM 0 HD21 ASN A 175 -20.729 -0.450 -1.909 1.00 0.00 H new ATOM 0 HD22 ASN A 175 -19.079 -1.075 -2.002 1.00 0.00 H new ATOM 628 N LYS A 176 -15.805 2.435 -5.729 1.00 0.00 N ATOM 629 CA LYS A 176 -14.447 2.426 -6.260 1.00 0.00 C ATOM 630 C LYS A 176 -13.424 2.651 -5.151 1.00 0.00 C ATOM 631 O LYS A 176 -13.717 3.297 -4.144 1.00 0.00 O ATOM 632 CB LYS A 176 -14.291 3.500 -7.338 1.00 0.00 C ATOM 633 CG LYS A 176 -15.053 3.192 -8.617 1.00 0.00 C ATOM 634 CD LYS A 176 -14.132 2.654 -9.699 1.00 0.00 C ATOM 635 CE LYS A 176 -14.550 3.138 -11.080 1.00 0.00 C ATOM 636 NZ LYS A 176 -14.418 2.067 -12.106 1.00 0.00 N ATOM 0 H LYS A 176 -16.217 3.364 -5.638 1.00 0.00 H new ATOM 0 HA LYS A 176 -14.265 1.446 -6.702 1.00 0.00 H new ATOM 0 HB2 LYS A 176 -14.635 4.455 -6.941 1.00 0.00 H new ATOM 0 HB3 LYS A 176 -13.233 3.616 -7.574 1.00 0.00 H new ATOM 0 HG2 LYS A 176 -15.836 2.463 -8.409 1.00 0.00 H new ATOM 0 HG3 LYS A 176 -15.546 4.096 -8.974 1.00 0.00 H new ATOM 0 HD2 LYS A 176 -13.108 2.969 -9.496 1.00 0.00 H new ATOM 0 HD3 LYS A 176 -14.140 1.564 -9.676 1.00 0.00 H new ATOM 0 HE2 LYS A 176 -15.583 3.484 -11.046 1.00 0.00 H new ATOM 0 HE3 LYS A 176 -13.937 3.993 -11.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 176 -14.109 2.485 -13.007 1.00 0.00 H new ATOM 0 HZ2 LYS A 176 -13.716 1.368 -11.790 1.00 0.00 H new ATOM 0 HZ3 LYS A 176 -15.337 1.599 -12.239 1.00 0.00 H new ATOM 650 N ARG A 177 -12.223 2.117 -5.345 1.00 0.00 N ATOM 651 CA ARG A 177 -11.153 2.260 -4.365 1.00 0.00 C ATOM 652 C ARG A 177 -9.935 2.937 -4.987 1.00 0.00 C ATOM 653 O ARG A 177 -9.382 2.453 -5.975 1.00 0.00 O ATOM 654 CB ARG A 177 -10.759 0.892 -3.804 1.00 0.00 C ATOM 655 CG ARG A 177 -10.003 0.969 -2.487 1.00 0.00 C ATOM 656 CD ARG A 177 -10.872 0.538 -1.316 1.00 0.00 C ATOM 657 NE ARG A 177 -10.120 -0.249 -0.338 1.00 0.00 N ATOM 658 CZ ARG A 177 -10.646 -0.730 0.786 1.00 0.00 C ATOM 659 NH1 ARG A 177 -11.921 -0.508 1.080 1.00 0.00 N ATOM 660 NH2 ARG A 177 -9.893 -1.438 1.619 1.00 0.00 N ATOM 0 H ARG A 177 -11.966 1.580 -6.173 1.00 0.00 H new ATOM 0 HA ARG A 177 -11.520 2.886 -3.551 1.00 0.00 H new ATOM 0 HB2 ARG A 177 -11.659 0.294 -3.662 1.00 0.00 H new ATOM 0 HB3 ARG A 177 -10.143 0.372 -4.537 1.00 0.00 H new ATOM 0 HG2 ARG A 177 -9.118 0.334 -2.537 1.00 0.00 H new ATOM 0 HG3 ARG A 177 -9.655 1.989 -2.326 1.00 0.00 H new ATOM 0 HD2 ARG A 177 -11.288 1.420 -0.829 1.00 0.00 H new ATOM 0 HD3 ARG A 177 -11.713 -0.049 -1.685 1.00 0.00 H new ATOM 0 HE ARG A 177 -9.136 -0.440 -0.529 1.00 0.00 H new ATOM 0 HH11 ARG A 177 -12.504 0.034 0.443 1.00 0.00 H new ATOM 0 HH12 ARG A 177 -12.318 -0.880 1.943 1.00 0.00 H new ATOM 0 HH21 ARG A 177 -8.913 -1.613 1.397 1.00 0.00 H new ATOM 0 HH22 ARG A 177 -10.295 -1.807 2.481 1.00 0.00 H new ATOM 674 N TYR A 178 -9.526 4.058 -4.405 1.00 0.00 N ATOM 675 CA TYR A 178 -8.376 4.802 -4.905 1.00 0.00 C ATOM 676 C TYR A 178 -7.117 3.941 -4.890 1.00 0.00 C ATOM 677 O TYR A 178 -6.630 3.551 -3.829 1.00 0.00 O ATOM 678 CB TYR A 178 -8.155 6.064 -4.069 1.00 0.00 C ATOM 679 CG TYR A 178 -7.046 6.950 -4.590 1.00 0.00 C ATOM 680 CD1 TYR A 178 -5.717 6.676 -4.300 1.00 0.00 C ATOM 681 CD2 TYR A 178 -7.332 8.061 -5.376 1.00 0.00 C ATOM 682 CE1 TYR A 178 -4.701 7.483 -4.776 1.00 0.00 C ATOM 683 CE2 TYR A 178 -6.321 8.872 -5.856 1.00 0.00 C ATOM 684 CZ TYR A 178 -5.009 8.579 -5.554 1.00 0.00 C ATOM 685 OH TYR A 178 -4.001 9.385 -6.030 1.00 0.00 O ATOM 0 H TYR A 178 -9.973 4.472 -3.587 1.00 0.00 H new ATOM 0 HA TYR A 178 -8.584 5.088 -5.936 1.00 0.00 H new ATOM 0 HB2 TYR A 178 -9.082 6.637 -4.039 1.00 0.00 H new ATOM 0 HB3 TYR A 178 -7.926 5.775 -3.043 1.00 0.00 H new ATOM 0 HD1 TYR A 178 -5.472 5.818 -3.692 1.00 0.00 H new ATOM 0 HD2 TYR A 178 -8.359 8.294 -5.615 1.00 0.00 H new ATOM 0 HE1 TYR A 178 -3.672 7.257 -4.540 1.00 0.00 H new ATOM 0 HE2 TYR A 178 -6.558 9.732 -6.465 1.00 0.00 H new ATOM 0 HH TYR A 178 -3.506 9.769 -5.277 1.00 0.00 H new ATOM 695 N CYS A 179 -6.594 3.647 -6.077 1.00 0.00 N ATOM 696 CA CYS A 179 -5.391 2.834 -6.207 1.00 0.00 C ATOM 697 C CYS A 179 -4.140 3.696 -6.085 1.00 0.00 C ATOM 698 O CYS A 179 -3.860 4.524 -6.949 1.00 0.00 O ATOM 699 CB CYS A 179 -5.394 2.101 -7.550 1.00 0.00 C ATOM 700 SG CYS A 179 -4.088 0.862 -7.724 1.00 0.00 S ATOM 0 H CYS A 179 -6.987 3.961 -6.964 1.00 0.00 H new ATOM 0 HA CYS A 179 -5.384 2.101 -5.401 1.00 0.00 H new ATOM 0 HB2 CYS A 179 -6.360 1.615 -7.683 1.00 0.00 H new ATOM 0 HB3 CYS A 179 -5.293 2.834 -8.351 1.00 0.00 H new ATOM 0 HG CYS A 179 -3.554 0.957 -8.905 1.00 0.00 H new ATOM 705 N GLN A 180 -3.392 3.498 -5.005 1.00 0.00 N ATOM 706 CA GLN A 180 -2.172 4.263 -4.769 1.00 0.00 C ATOM 707 C GLN A 180 -1.055 3.854 -5.730 1.00 0.00 C ATOM 708 O GLN A 180 -0.011 4.503 -5.787 1.00 0.00 O ATOM 709 CB GLN A 180 -1.704 4.078 -3.324 1.00 0.00 C ATOM 710 CG GLN A 180 -2.333 5.061 -2.350 1.00 0.00 C ATOM 711 CD GLN A 180 -2.067 4.697 -0.903 1.00 0.00 C ATOM 712 OE1 GLN A 180 -1.142 3.943 -0.599 1.00 0.00 O ATOM 713 NE2 GLN A 180 -2.881 5.232 0.001 1.00 0.00 N ATOM 0 H GLN A 180 -3.609 2.815 -4.279 1.00 0.00 H new ATOM 0 HA GLN A 180 -2.402 5.313 -4.947 1.00 0.00 H new ATOM 0 HB2 GLN A 180 -1.936 3.063 -3.003 1.00 0.00 H new ATOM 0 HB3 GLN A 180 -0.620 4.185 -3.286 1.00 0.00 H new ATOM 0 HG2 GLN A 180 -1.945 6.061 -2.547 1.00 0.00 H new ATOM 0 HG3 GLN A 180 -3.409 5.097 -2.520 1.00 0.00 H new ATOM 0 HE21 GLN A 180 -3.635 5.852 -0.295 1.00 0.00 H new ATOM 0 HE22 GLN A 180 -2.752 5.023 0.991 1.00 0.00 H new ATOM 722 N GLN A 181 -1.273 2.776 -6.479 1.00 0.00 N ATOM 723 CA GLN A 181 -0.275 2.292 -7.425 1.00 0.00 C ATOM 724 C GLN A 181 -0.467 2.917 -8.806 1.00 0.00 C ATOM 725 O GLN A 181 0.488 3.059 -9.569 1.00 0.00 O ATOM 726 CB GLN A 181 -0.346 0.766 -7.527 1.00 0.00 C ATOM 727 CG GLN A 181 0.646 0.175 -8.515 1.00 0.00 C ATOM 728 CD GLN A 181 1.702 -0.682 -7.843 1.00 0.00 C ATOM 729 OE1 GLN A 181 2.825 -0.235 -7.609 1.00 0.00 O ATOM 730 NE2 GLN A 181 1.345 -1.921 -7.527 1.00 0.00 N ATOM 0 H GLN A 181 -2.130 2.223 -6.448 1.00 0.00 H new ATOM 0 HA GLN A 181 0.708 2.585 -7.056 1.00 0.00 H new ATOM 0 HB2 GLN A 181 -0.165 0.336 -6.542 1.00 0.00 H new ATOM 0 HB3 GLN A 181 -1.355 0.476 -7.821 1.00 0.00 H new ATOM 0 HG2 GLN A 181 0.108 -0.427 -9.248 1.00 0.00 H new ATOM 0 HG3 GLN A 181 1.133 0.983 -9.061 1.00 0.00 H new ATOM 0 HE21 GLN A 181 0.403 -2.250 -7.739 1.00 0.00 H new ATOM 0 HE22 GLN A 181 2.012 -2.544 -7.072 1.00 0.00 H new ATOM 739 N CYS A 182 -1.705 3.282 -9.126 1.00 0.00 N ATOM 740 CA CYS A 182 -2.011 3.884 -10.423 1.00 0.00 C ATOM 741 C CYS A 182 -2.520 5.315 -10.267 1.00 0.00 C ATOM 742 O CYS A 182 -2.368 6.137 -11.171 1.00 0.00 O ATOM 743 CB CYS A 182 -3.048 3.041 -11.165 1.00 0.00 C ATOM 744 SG CYS A 182 -2.576 1.308 -11.376 1.00 0.00 S ATOM 0 H CYS A 182 -2.510 3.173 -8.509 1.00 0.00 H new ATOM 0 HA CYS A 182 -1.088 3.914 -11.002 1.00 0.00 H new ATOM 0 HB2 CYS A 182 -3.992 3.086 -10.623 1.00 0.00 H new ATOM 0 HB3 CYS A 182 -3.223 3.481 -12.147 1.00 0.00 H new ATOM 0 HG CYS A 182 -3.408 0.727 -12.189 1.00 0.00 H new ATOM 749 N GLY A 183 -3.126 5.607 -9.123 1.00 0.00 N ATOM 750 CA GLY A 183 -3.649 6.938 -8.878 1.00 0.00 C ATOM 751 C GLY A 183 -5.119 7.056 -9.223 1.00 0.00 C ATOM 752 O GLY A 183 -5.887 7.680 -8.491 1.00 0.00 O ATOM 0 H GLY A 183 -3.265 4.945 -8.359 1.00 0.00 H new ATOM 0 HA2 GLY A 183 -3.504 7.195 -7.829 1.00 0.00 H new ATOM 0 HA3 GLY A 183 -3.082 7.661 -9.464 1.00 0.00 H new ATOM 756 N LYS A 184 -5.514 6.456 -10.342 1.00 0.00 N ATOM 757 CA LYS A 184 -6.904 6.498 -10.783 1.00 0.00 C ATOM 758 C LYS A 184 -7.796 5.678 -9.856 1.00 0.00 C ATOM 759 O LYS A 184 -7.323 5.091 -8.882 1.00 0.00 O ATOM 760 CB LYS A 184 -7.023 5.980 -12.217 1.00 0.00 C ATOM 761 CG LYS A 184 -6.638 4.517 -12.370 1.00 0.00 C ATOM 762 CD LYS A 184 -7.243 3.911 -13.626 1.00 0.00 C ATOM 763 CE LYS A 184 -6.606 4.483 -14.881 1.00 0.00 C ATOM 764 NZ LYS A 184 -6.574 3.489 -15.991 1.00 0.00 N ATOM 0 H LYS A 184 -4.891 5.935 -10.960 1.00 0.00 H new ATOM 0 HA LYS A 184 -7.237 7.535 -10.751 1.00 0.00 H new ATOM 0 HB2 LYS A 184 -8.049 6.115 -12.559 1.00 0.00 H new ATOM 0 HB3 LYS A 184 -6.389 6.584 -12.866 1.00 0.00 H new ATOM 0 HG2 LYS A 184 -5.552 4.427 -12.408 1.00 0.00 H new ATOM 0 HG3 LYS A 184 -6.974 3.958 -11.497 1.00 0.00 H new ATOM 0 HD2 LYS A 184 -7.110 2.829 -13.610 1.00 0.00 H new ATOM 0 HD3 LYS A 184 -8.316 4.100 -13.642 1.00 0.00 H new ATOM 0 HE2 LYS A 184 -7.161 5.365 -15.200 1.00 0.00 H new ATOM 0 HE3 LYS A 184 -5.590 4.809 -14.656 1.00 0.00 H new ATOM 0 HZ1 LYS A 184 -6.132 3.918 -16.829 1.00 0.00 H new ATOM 0 HZ2 LYS A 184 -6.023 2.657 -15.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 184 -7.545 3.197 -16.223 1.00 0.00 H new ATOM 778 N PHE A 185 -9.089 5.642 -10.165 1.00 0.00 N ATOM 779 CA PHE A 185 -10.047 4.894 -9.360 1.00 0.00 C ATOM 780 C PHE A 185 -10.230 3.479 -9.903 1.00 0.00 C ATOM 781 O PHE A 185 -10.287 3.271 -11.115 1.00 0.00 O ATOM 782 CB PHE A 185 -11.394 5.616 -9.329 1.00 0.00 C ATOM 783 CG PHE A 185 -11.404 6.837 -8.452 1.00 0.00 C ATOM 784 CD1 PHE A 185 -10.917 6.779 -7.156 1.00 0.00 C ATOM 785 CD2 PHE A 185 -11.900 8.042 -8.926 1.00 0.00 C ATOM 786 CE1 PHE A 185 -10.925 7.899 -6.348 1.00 0.00 C ATOM 787 CE2 PHE A 185 -11.911 9.165 -8.122 1.00 0.00 C ATOM 788 CZ PHE A 185 -11.423 9.094 -6.831 1.00 0.00 C ATOM 0 H PHE A 185 -9.497 6.122 -10.967 1.00 0.00 H new ATOM 0 HA PHE A 185 -9.654 4.827 -8.346 1.00 0.00 H new ATOM 0 HB2 PHE A 185 -11.664 5.906 -10.344 1.00 0.00 H new ATOM 0 HB3 PHE A 185 -12.160 4.923 -8.981 1.00 0.00 H new ATOM 0 HD1 PHE A 185 -10.527 5.847 -6.773 1.00 0.00 H new ATOM 0 HD2 PHE A 185 -12.282 8.103 -9.934 1.00 0.00 H new ATOM 0 HE1 PHE A 185 -10.542 7.841 -5.340 1.00 0.00 H new ATOM 0 HE2 PHE A 185 -12.301 10.098 -8.502 1.00 0.00 H new ATOM 0 HZ PHE A 185 -11.431 9.971 -6.201 1.00 0.00 H new ATOM 798 N HIS A 186 -10.324 2.511 -8.997 1.00 0.00 N ATOM 799 CA HIS A 186 -10.503 1.115 -9.381 1.00 0.00 C ATOM 800 C HIS A 186 -11.768 0.539 -8.753 1.00 0.00 C ATOM 801 O HIS A 186 -12.433 1.200 -7.957 1.00 0.00 O ATOM 802 CB HIS A 186 -9.290 0.286 -8.958 1.00 0.00 C ATOM 803 CG HIS A 186 -8.121 0.405 -9.886 1.00 0.00 C ATOM 804 ND1 HIS A 186 -8.241 0.772 -11.211 1.00 0.00 N ATOM 805 CD2 HIS A 186 -6.800 0.202 -9.673 1.00 0.00 C ATOM 806 CE1 HIS A 186 -7.043 0.790 -11.770 1.00 0.00 C ATOM 807 NE2 HIS A 186 -6.152 0.450 -10.858 1.00 0.00 N ATOM 0 H HIS A 186 -10.279 2.668 -7.990 1.00 0.00 H new ATOM 0 HA HIS A 186 -10.602 1.073 -10.466 1.00 0.00 H new ATOM 0 HB2 HIS A 186 -8.982 0.595 -7.959 1.00 0.00 H new ATOM 0 HB3 HIS A 186 -9.583 -0.762 -8.891 1.00 0.00 H new ATOM 0 HD2 HIS A 186 -6.341 -0.099 -8.743 1.00 0.00 H new ATOM 0 HE1 HIS A 186 -6.830 1.041 -12.799 1.00 0.00 H new ATOM 0 HE2 HIS A 186 -5.145 0.382 -11.009 1.00 0.00 H new ATOM 815 N LEU A 187 -12.091 -0.699 -9.114 1.00 0.00 N ATOM 816 CA LEU A 187 -13.274 -1.364 -8.581 1.00 0.00 C ATOM 817 C LEU A 187 -12.939 -2.130 -7.305 1.00 0.00 C ATOM 818 O LEU A 187 -11.851 -2.692 -7.174 1.00 0.00 O ATOM 819 CB LEU A 187 -13.866 -2.314 -9.627 1.00 0.00 C ATOM 820 CG LEU A 187 -15.295 -1.985 -10.063 1.00 0.00 C ATOM 821 CD1 LEU A 187 -15.302 -0.807 -11.025 1.00 0.00 C ATOM 822 CD2 LEU A 187 -15.948 -3.201 -10.702 1.00 0.00 C ATOM 0 H LEU A 187 -11.551 -1.261 -9.772 1.00 0.00 H new ATOM 0 HA LEU A 187 -14.013 -0.600 -8.338 1.00 0.00 H new ATOM 0 HB2 LEU A 187 -13.223 -2.308 -10.507 1.00 0.00 H new ATOM 0 HB3 LEU A 187 -13.848 -3.328 -9.227 1.00 0.00 H new ATOM 0 HG LEU A 187 -15.871 -1.709 -9.180 1.00 0.00 H new ATOM 0 HD11 LEU A 187 -16.327 -0.588 -11.324 1.00 0.00 H new ATOM 0 HD12 LEU A 187 -14.873 0.066 -10.534 1.00 0.00 H new ATOM 0 HD13 LEU A 187 -14.712 -1.054 -11.907 1.00 0.00 H new ATOM 0 HD21 LEU A 187 -16.964 -2.950 -11.007 1.00 0.00 H new ATOM 0 HD22 LEU A 187 -15.372 -3.506 -11.576 1.00 0.00 H new ATOM 0 HD23 LEU A 187 -15.976 -4.019 -9.982 1.00 0.00 H new ATOM 834 N LEU A 188 -13.881 -2.150 -6.368 1.00 0.00 N ATOM 835 CA LEU A 188 -13.686 -2.847 -5.102 1.00 0.00 C ATOM 836 C LEU A 188 -13.665 -4.369 -5.282 1.00 0.00 C ATOM 837 O LEU A 188 -12.873 -5.053 -4.633 1.00 0.00 O ATOM 838 CB LEU A 188 -14.774 -2.447 -4.098 1.00 0.00 C ATOM 839 CG LEU A 188 -14.259 -1.763 -2.831 1.00 0.00 C ATOM 840 CD1 LEU A 188 -15.291 -0.780 -2.299 1.00 0.00 C ATOM 841 CD2 LEU A 188 -13.910 -2.799 -1.771 1.00 0.00 C ATOM 0 H LEU A 188 -14.787 -1.691 -6.462 1.00 0.00 H new ATOM 0 HA LEU A 188 -12.712 -2.549 -4.714 1.00 0.00 H new ATOM 0 HB2 LEU A 188 -15.478 -1.779 -4.594 1.00 0.00 H new ATOM 0 HB3 LEU A 188 -15.330 -3.340 -3.811 1.00 0.00 H new ATOM 0 HG LEU A 188 -13.354 -1.209 -3.081 1.00 0.00 H new ATOM 0 HD11 LEU A 188 -14.908 -0.303 -1.397 1.00 0.00 H new ATOM 0 HD12 LEU A 188 -15.493 -0.020 -3.054 1.00 0.00 H new ATOM 0 HD13 LEU A 188 -16.213 -1.312 -2.064 1.00 0.00 H new ATOM 0 HD21 LEU A 188 -13.545 -2.295 -0.876 1.00 0.00 H new ATOM 0 HD22 LEU A 188 -14.798 -3.380 -1.524 1.00 0.00 H new ATOM 0 HD23 LEU A 188 -13.136 -3.465 -2.154 1.00 0.00 H new ATOM 853 N PRO A 189 -14.526 -4.937 -6.158 1.00 0.00 N ATOM 854 CA PRO A 189 -14.561 -6.388 -6.376 1.00 0.00 C ATOM 855 C PRO A 189 -13.321 -6.901 -7.102 1.00 0.00 C ATOM 856 O PRO A 189 -13.095 -8.109 -7.184 1.00 0.00 O ATOM 857 CB PRO A 189 -15.809 -6.594 -7.235 1.00 0.00 C ATOM 858 CG PRO A 189 -16.004 -5.297 -7.937 1.00 0.00 C ATOM 859 CD PRO A 189 -15.523 -4.233 -6.992 1.00 0.00 C ATOM 0 HA PRO A 189 -14.583 -6.936 -5.434 1.00 0.00 H new ATOM 0 HB2 PRO A 189 -15.671 -7.411 -7.944 1.00 0.00 H new ATOM 0 HB3 PRO A 189 -16.674 -6.846 -6.622 1.00 0.00 H new ATOM 0 HG2 PRO A 189 -15.442 -5.271 -8.871 1.00 0.00 H new ATOM 0 HG3 PRO A 189 -17.053 -5.146 -8.192 1.00 0.00 H new ATOM 0 HD2 PRO A 189 -15.078 -3.393 -7.526 1.00 0.00 H new ATOM 0 HD3 PRO A 189 -16.339 -3.832 -6.390 1.00 0.00 H new ATOM 867 N ASP A 190 -12.517 -5.981 -7.628 1.00 0.00 N ATOM 868 CA ASP A 190 -11.301 -6.348 -8.343 1.00 0.00 C ATOM 869 C ASP A 190 -10.079 -6.221 -7.436 1.00 0.00 C ATOM 870 O ASP A 190 -8.980 -5.917 -7.900 1.00 0.00 O ATOM 871 CB ASP A 190 -11.125 -5.468 -9.581 1.00 0.00 C ATOM 872 CG ASP A 190 -12.024 -5.895 -10.725 1.00 0.00 C ATOM 873 OD1 ASP A 190 -13.259 -5.890 -10.544 1.00 0.00 O ATOM 874 OD2 ASP A 190 -11.491 -6.234 -11.802 1.00 0.00 O ATOM 0 H ASP A 190 -12.687 -4.977 -7.572 1.00 0.00 H new ATOM 0 HA ASP A 190 -11.394 -7.388 -8.657 1.00 0.00 H new ATOM 0 HB2 ASP A 190 -11.340 -4.432 -9.321 1.00 0.00 H new ATOM 0 HB3 ASP A 190 -10.085 -5.506 -9.906 1.00 0.00 H new