USER MOD reduce.3.24.130724 H: found=0, std=0, add=403, rem=0, adj=7 USER MOD reduce.3.24.130724 removed 405 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 Single : A 136 TYR OH : rot 180:sc= 0 USER MOD Single : A 154 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 164 LYS NZ :NH3+ -116:sc= 0.149 (180deg=-0.125) USER MOD Single : A 168 GLN : amide:sc= -0.0121 K(o=-0.012,f=-0.98) USER MOD Single : A 171 ASN : amide:sc= -0.0877 K(o=-0.088,f=-1.2) USER MOD Single : A 175 SER OG : rot 180:sc= 0 USER MOD Single : A 178 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 181 MET CE :methyl 176:sc= -0.735 (180deg=-0.839) USER MOD Single : A 186 TYR OH : rot 159:sc= 0.754 USER MOD Single : A 189 LYS NZ :NH3+ -125:sc= 0.637 (180deg=0) USER MOD Single : A 190 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 19 N TYR A 136 -1.600 -1.751 -1.154 1.00 0.00 N ATOM 20 CA TYR A 136 -2.765 -2.606 -0.997 1.00 0.00 C ATOM 21 C TYR A 136 -4.053 -1.780 -0.986 1.00 0.00 C ATOM 22 O TYR A 136 -4.008 -0.552 -0.924 1.00 0.00 O ATOM 23 CB TYR A 136 -2.603 -3.296 0.359 1.00 0.00 C ATOM 24 CG TYR A 136 -1.597 -4.448 0.354 1.00 0.00 C ATOM 25 CD1 TYR A 136 -0.247 -4.186 0.237 1.00 0.00 C ATOM 26 CD2 TYR A 136 -2.040 -5.750 0.466 1.00 0.00 C ATOM 27 CE1 TYR A 136 0.700 -5.271 0.233 1.00 0.00 C ATOM 28 CE2 TYR A 136 -1.093 -6.835 0.462 1.00 0.00 C ATOM 29 CZ TYR A 136 0.230 -6.542 0.346 1.00 0.00 C ATOM 30 OH TYR A 136 1.124 -7.567 0.342 1.00 0.00 O ATOM 0 HA TYR A 136 -2.834 -3.316 -1.821 1.00 0.00 H new ATOM 0 HB2 TYR A 136 -2.290 -2.557 1.096 1.00 0.00 H new ATOM 0 HB3 TYR A 136 -3.573 -3.675 0.680 1.00 0.00 H new ATOM 0 HD1 TYR A 136 0.099 -3.167 0.148 1.00 0.00 H new ATOM 0 HD2 TYR A 136 -3.096 -5.955 0.557 1.00 0.00 H new ATOM 0 HE1 TYR A 136 1.759 -5.080 0.142 1.00 0.00 H new ATOM 0 HE2 TYR A 136 -1.426 -7.859 0.549 1.00 0.00 H new ATOM 0 HH TYR A 136 0.646 -8.418 0.431 1.00 0.00 H new ATOM 40 N VAL A 137 -5.172 -2.487 -1.044 1.00 0.00 N ATOM 41 CA VAL A 137 -6.470 -1.834 -1.041 1.00 0.00 C ATOM 42 C VAL A 137 -7.359 -2.484 0.021 1.00 0.00 C ATOM 43 O VAL A 137 -7.053 -3.567 0.515 1.00 0.00 O ATOM 44 CB VAL A 137 -7.082 -1.880 -2.443 1.00 0.00 C ATOM 45 CG1 VAL A 137 -8.583 -1.588 -2.395 1.00 0.00 C ATOM 46 CG2 VAL A 137 -6.364 -0.914 -3.386 1.00 0.00 C ATOM 0 H VAL A 137 -5.207 -3.505 -1.093 1.00 0.00 H new ATOM 0 HA VAL A 137 -6.368 -0.781 -0.780 1.00 0.00 H new ATOM 0 HB VAL A 137 -6.950 -2.889 -2.834 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -8.994 -1.627 -3.404 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -9.079 -2.333 -1.773 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -8.747 -0.596 -1.974 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -6.818 -0.966 -4.375 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -6.450 0.102 -3.001 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -5.311 -1.188 -3.455 1.00 0.00 H new ATOM 56 N ARG A 138 -8.445 -1.794 0.341 1.00 0.00 N ATOM 57 CA ARG A 138 -9.380 -2.289 1.336 1.00 0.00 C ATOM 58 C ARG A 138 -10.802 -1.832 1.002 1.00 0.00 C ATOM 59 O ARG A 138 -11.022 -0.667 0.677 1.00 0.00 O ATOM 60 CB ARG A 138 -9.009 -1.795 2.735 1.00 0.00 C ATOM 61 CG ARG A 138 -8.080 -2.787 3.438 1.00 0.00 C ATOM 62 CD ARG A 138 -6.674 -2.203 3.596 1.00 0.00 C ATOM 63 NE ARG A 138 -5.904 -2.995 4.580 1.00 0.00 N ATOM 64 CZ ARG A 138 -6.180 -3.038 5.891 1.00 0.00 C ATOM 65 NH1 ARG A 138 -7.209 -2.334 6.382 1.00 0.00 N ATOM 66 NH2 ARG A 138 -5.428 -3.785 6.711 1.00 0.00 N ATOM 0 H ARG A 138 -8.697 -0.896 -0.072 1.00 0.00 H new ATOM 0 HA ARG A 138 -9.332 -3.378 1.323 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -8.522 -0.823 2.664 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -9.913 -1.656 3.327 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -8.485 -3.039 4.418 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -8.031 -3.713 2.866 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -6.161 -2.204 2.634 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -6.737 -1.165 3.922 1.00 0.00 H new ATOM 0 HE ARG A 138 -5.114 -3.543 4.240 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -7.782 -1.766 5.758 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -7.419 -2.366 7.380 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -4.645 -4.321 6.338 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -5.639 -3.817 7.708 1.00 0.00 H new ATOM 80 N ALA A 139 -11.729 -2.775 1.093 1.00 0.00 N ATOM 81 CA ALA A 139 -13.122 -2.484 0.804 1.00 0.00 C ATOM 82 C ALA A 139 -13.840 -2.107 2.102 1.00 0.00 C ATOM 83 O ALA A 139 -13.809 -2.861 3.074 1.00 0.00 O ATOM 84 CB ALA A 139 -13.764 -3.688 0.112 1.00 0.00 C ATOM 0 H ALA A 139 -11.542 -3.741 1.363 1.00 0.00 H new ATOM 0 HA ALA A 139 -13.203 -1.636 0.124 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -14.810 -3.468 -0.104 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -13.237 -3.896 -0.819 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -13.704 -4.558 0.766 1.00 0.00 H new ATOM 90 N LEU A 140 -14.469 -0.942 2.076 1.00 0.00 N ATOM 91 CA LEU A 140 -15.193 -0.456 3.239 1.00 0.00 C ATOM 92 C LEU A 140 -16.695 -0.480 2.946 1.00 0.00 C ATOM 93 O LEU A 140 -17.398 0.496 3.203 1.00 0.00 O ATOM 94 CB LEU A 140 -14.671 0.919 3.659 1.00 0.00 C ATOM 95 CG LEU A 140 -14.067 1.777 2.545 1.00 0.00 C ATOM 96 CD1 LEU A 140 -14.235 3.267 2.849 1.00 0.00 C ATOM 97 CD2 LEU A 140 -12.605 1.404 2.296 1.00 0.00 C ATOM 0 H LEU A 140 -14.493 -0.320 1.268 1.00 0.00 H new ATOM 0 HA LEU A 140 -15.024 -1.111 4.094 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -15.492 1.474 4.113 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -13.915 0.778 4.432 1.00 0.00 H new ATOM 0 HG LEU A 140 -14.612 1.573 1.623 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -13.797 3.855 2.042 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -15.296 3.503 2.936 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -13.732 3.506 3.786 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -12.201 2.029 1.500 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -12.029 1.561 3.208 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -12.542 0.356 2.002 1.00 0.00 H new ATOM 109 N PHE A 141 -17.143 -1.606 2.410 1.00 0.00 N ATOM 110 CA PHE A 141 -18.548 -1.770 2.080 1.00 0.00 C ATOM 111 C PHE A 141 -18.837 -3.196 1.604 1.00 0.00 C ATOM 112 O PHE A 141 -18.204 -3.681 0.668 1.00 0.00 O ATOM 113 CB PHE A 141 -18.857 -0.794 0.943 1.00 0.00 C ATOM 114 CG PHE A 141 -19.247 0.609 1.416 1.00 0.00 C ATOM 115 CD1 PHE A 141 -20.259 0.768 2.311 1.00 0.00 C ATOM 116 CD2 PHE A 141 -18.581 1.695 0.942 1.00 0.00 C ATOM 117 CE1 PHE A 141 -20.619 2.069 2.749 1.00 0.00 C ATOM 118 CE2 PHE A 141 -18.942 2.996 1.381 1.00 0.00 C ATOM 119 CZ PHE A 141 -19.953 3.157 2.276 1.00 0.00 C ATOM 0 H PHE A 141 -16.558 -2.413 2.196 1.00 0.00 H new ATOM 0 HA PHE A 141 -19.162 -1.578 2.960 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -17.984 -0.718 0.295 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -19.668 -1.201 0.339 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -20.788 -0.095 2.688 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -17.777 1.568 0.232 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -21.423 2.196 3.459 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -18.413 3.859 1.004 1.00 0.00 H new ATOM 0 HZ PHE A 141 -20.227 4.147 2.611 1.00 0.00 H new ATOM 129 N ASP A 142 -19.793 -3.825 2.270 1.00 0.00 N ATOM 130 CA ASP A 142 -20.174 -5.185 1.927 1.00 0.00 C ATOM 131 C ASP A 142 -21.100 -5.160 0.710 1.00 0.00 C ATOM 132 O ASP A 142 -22.170 -4.554 0.752 1.00 0.00 O ATOM 133 CB ASP A 142 -20.924 -5.855 3.079 1.00 0.00 C ATOM 134 CG ASP A 142 -21.555 -7.207 2.741 1.00 0.00 C ATOM 135 OD1 ASP A 142 -21.012 -7.875 1.835 1.00 0.00 O ATOM 136 OD2 ASP A 142 -22.564 -7.543 3.397 1.00 0.00 O ATOM 0 H ASP A 142 -20.316 -3.418 3.046 1.00 0.00 H new ATOM 0 HA ASP A 142 -19.264 -5.746 1.716 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -20.234 -5.991 3.911 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -21.708 -5.181 3.423 1.00 0.00 H new ATOM 141 N PHE A 143 -20.656 -5.825 -0.346 1.00 0.00 N ATOM 142 CA PHE A 143 -21.432 -5.886 -1.573 1.00 0.00 C ATOM 143 C PHE A 143 -21.230 -7.226 -2.283 1.00 0.00 C ATOM 144 O PHE A 143 -20.135 -7.785 -2.262 1.00 0.00 O ATOM 145 CB PHE A 143 -20.926 -4.762 -2.479 1.00 0.00 C ATOM 146 CG PHE A 143 -22.001 -3.744 -2.867 1.00 0.00 C ATOM 147 CD1 PHE A 143 -22.555 -2.944 -1.917 1.00 0.00 C ATOM 148 CD2 PHE A 143 -22.403 -3.639 -4.162 1.00 0.00 C ATOM 149 CE1 PHE A 143 -23.553 -2.000 -2.277 1.00 0.00 C ATOM 150 CE2 PHE A 143 -23.400 -2.695 -4.523 1.00 0.00 C ATOM 151 CZ PHE A 143 -23.953 -1.895 -3.572 1.00 0.00 C ATOM 0 H PHE A 143 -19.768 -6.327 -0.377 1.00 0.00 H new ATOM 0 HA PHE A 143 -22.493 -5.780 -1.347 1.00 0.00 H new ATOM 0 HB2 PHE A 143 -20.112 -4.241 -1.975 1.00 0.00 H new ATOM 0 HB3 PHE A 143 -20.510 -5.200 -3.386 1.00 0.00 H new ATOM 0 HD1 PHE A 143 -22.236 -3.027 -0.889 1.00 0.00 H new ATOM 0 HD2 PHE A 143 -21.963 -4.274 -4.917 1.00 0.00 H new ATOM 0 HE1 PHE A 143 -23.994 -1.366 -1.522 1.00 0.00 H new ATOM 0 HE2 PHE A 143 -23.719 -2.612 -5.551 1.00 0.00 H new ATOM 0 HZ PHE A 143 -24.711 -1.176 -3.846 1.00 0.00 H new ATOM 250 N LEU A 151 -14.843 -9.105 -8.137 1.00 0.00 N ATOM 251 CA LEU A 151 -14.658 -9.824 -6.888 1.00 0.00 C ATOM 252 C LEU A 151 -15.572 -9.223 -5.818 1.00 0.00 C ATOM 253 O LEU A 151 -15.738 -8.005 -5.750 1.00 0.00 O ATOM 254 CB LEU A 151 -13.180 -9.844 -6.495 1.00 0.00 C ATOM 255 CG LEU A 151 -12.848 -10.529 -5.168 1.00 0.00 C ATOM 256 CD1 LEU A 151 -12.679 -12.037 -5.357 1.00 0.00 C ATOM 257 CD2 LEU A 151 -11.620 -9.892 -4.514 1.00 0.00 C ATOM 0 HA LEU A 151 -14.947 -10.869 -7.003 1.00 0.00 H new ATOM 0 HB2 LEU A 151 -12.620 -10.341 -7.288 1.00 0.00 H new ATOM 0 HB3 LEU A 151 -12.823 -8.815 -6.449 1.00 0.00 H new ATOM 0 HG LEU A 151 -13.687 -10.382 -4.488 1.00 0.00 H new ATOM 0 HD11 LEU A 151 -12.444 -12.500 -4.399 1.00 0.00 H new ATOM 0 HD12 LEU A 151 -13.604 -12.461 -5.747 1.00 0.00 H new ATOM 0 HD13 LEU A 151 -11.868 -12.227 -6.060 1.00 0.00 H new ATOM 0 HD21 LEU A 151 -11.406 -10.398 -3.572 1.00 0.00 H new ATOM 0 HD22 LEU A 151 -10.763 -9.987 -5.180 1.00 0.00 H new ATOM 0 HD23 LEU A 151 -11.816 -8.837 -4.323 1.00 0.00 H new ATOM 269 N PRO A 152 -16.155 -10.126 -4.987 1.00 0.00 N ATOM 270 CA PRO A 152 -17.048 -9.698 -3.922 1.00 0.00 C ATOM 271 C PRO A 152 -16.262 -9.084 -2.762 1.00 0.00 C ATOM 272 O PRO A 152 -15.349 -9.711 -2.226 1.00 0.00 O ATOM 273 CB PRO A 152 -17.816 -10.947 -3.526 1.00 0.00 C ATOM 274 CG PRO A 152 -17.005 -12.120 -4.053 1.00 0.00 C ATOM 275 CD PRO A 152 -15.982 -11.575 -5.036 1.00 0.00 C ATOM 0 HA PRO A 152 -17.733 -8.911 -4.237 1.00 0.00 H new ATOM 0 HB2 PRO A 152 -17.932 -11.007 -2.444 1.00 0.00 H new ATOM 0 HB3 PRO A 152 -18.818 -10.941 -3.954 1.00 0.00 H new ATOM 0 HG2 PRO A 152 -16.508 -12.639 -3.234 1.00 0.00 H new ATOM 0 HG3 PRO A 152 -17.656 -12.845 -4.542 1.00 0.00 H new ATOM 0 HD2 PRO A 152 -14.969 -11.863 -4.753 1.00 0.00 H new ATOM 0 HD3 PRO A 152 -16.154 -11.960 -6.041 1.00 0.00 H new ATOM 283 N PHE A 153 -16.646 -7.867 -2.407 1.00 0.00 N ATOM 284 CA PHE A 153 -15.988 -7.163 -1.319 1.00 0.00 C ATOM 285 C PHE A 153 -16.833 -7.214 -0.043 1.00 0.00 C ATOM 286 O PHE A 153 -18.060 -7.212 -0.107 1.00 0.00 O ATOM 287 CB PHE A 153 -15.837 -5.705 -1.758 1.00 0.00 C ATOM 288 CG PHE A 153 -16.482 -5.390 -3.108 1.00 0.00 C ATOM 289 CD1 PHE A 153 -15.927 -5.869 -4.255 1.00 0.00 C ATOM 290 CD2 PHE A 153 -17.611 -4.635 -3.163 1.00 0.00 C ATOM 291 CE1 PHE A 153 -16.526 -5.577 -5.509 1.00 0.00 C ATOM 292 CE2 PHE A 153 -18.210 -4.343 -4.417 1.00 0.00 C ATOM 293 CZ PHE A 153 -17.655 -4.820 -5.563 1.00 0.00 C ATOM 0 H PHE A 153 -17.404 -7.350 -2.853 1.00 0.00 H new ATOM 0 HA PHE A 153 -15.025 -7.626 -1.104 1.00 0.00 H new ATOM 0 HB2 PHE A 153 -16.278 -5.060 -0.998 1.00 0.00 H new ATOM 0 HB3 PHE A 153 -14.776 -5.460 -1.808 1.00 0.00 H new ATOM 0 HD1 PHE A 153 -15.031 -6.471 -4.211 1.00 0.00 H new ATOM 0 HD2 PHE A 153 -18.053 -4.257 -2.253 1.00 0.00 H new ATOM 0 HE1 PHE A 153 -16.085 -5.956 -6.419 1.00 0.00 H new ATOM 0 HE2 PHE A 153 -19.106 -3.742 -4.460 1.00 0.00 H new ATOM 0 HZ PHE A 153 -18.111 -4.598 -6.517 1.00 0.00 H new ATOM 303 N LYS A 154 -16.139 -7.259 1.084 1.00 0.00 N ATOM 304 CA LYS A 154 -16.810 -7.310 2.373 1.00 0.00 C ATOM 305 C LYS A 154 -16.558 -6.003 3.127 1.00 0.00 C ATOM 306 O LYS A 154 -15.560 -5.326 2.885 1.00 0.00 O ATOM 307 CB LYS A 154 -16.385 -8.560 3.149 1.00 0.00 C ATOM 308 CG LYS A 154 -16.682 -8.406 4.641 1.00 0.00 C ATOM 309 CD LYS A 154 -16.074 -9.557 5.444 1.00 0.00 C ATOM 310 CE LYS A 154 -16.345 -9.387 6.940 1.00 0.00 C ATOM 311 NZ LYS A 154 -15.560 -10.368 7.723 1.00 0.00 N ATOM 0 H LYS A 154 -15.120 -7.261 1.132 1.00 0.00 H new ATOM 0 HA LYS A 154 -17.888 -7.397 2.238 1.00 0.00 H new ATOM 0 HB2 LYS A 154 -16.910 -9.431 2.758 1.00 0.00 H new ATOM 0 HB3 LYS A 154 -15.320 -8.738 3.003 1.00 0.00 H new ATOM 0 HG2 LYS A 154 -16.282 -7.457 4.999 1.00 0.00 H new ATOM 0 HG3 LYS A 154 -17.760 -8.377 4.800 1.00 0.00 H new ATOM 0 HD2 LYS A 154 -16.491 -10.504 5.101 1.00 0.00 H new ATOM 0 HD3 LYS A 154 -14.999 -9.599 5.268 1.00 0.00 H new ATOM 0 HE2 LYS A 154 -16.086 -8.375 7.250 1.00 0.00 H new ATOM 0 HE3 LYS A 154 -17.408 -9.520 7.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 -15.755 -10.239 8.736 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 -15.827 -11.332 7.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 -14.546 -10.223 7.545 1.00 0.00 H new ATOM 325 N LYS A 155 -17.478 -5.688 4.025 1.00 0.00 N ATOM 326 CA LYS A 155 -17.369 -4.475 4.816 1.00 0.00 C ATOM 327 C LYS A 155 -16.030 -4.472 5.557 1.00 0.00 C ATOM 328 O LYS A 155 -15.875 -5.156 6.568 1.00 0.00 O ATOM 329 CB LYS A 155 -18.582 -4.323 5.737 1.00 0.00 C ATOM 330 CG LYS A 155 -19.159 -2.908 5.655 1.00 0.00 C ATOM 331 CD LYS A 155 -18.169 -1.879 6.202 1.00 0.00 C ATOM 332 CE LYS A 155 -18.066 -1.973 7.725 1.00 0.00 C ATOM 333 NZ LYS A 155 -19.043 -1.065 8.368 1.00 0.00 N ATOM 0 H LYS A 155 -18.304 -6.253 4.223 1.00 0.00 H new ATOM 0 HA LYS A 155 -17.378 -3.598 4.169 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -19.347 -5.048 5.459 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -18.293 -4.543 6.765 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -19.401 -2.670 4.619 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -20.090 -2.858 6.220 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -17.187 -2.041 5.757 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -18.487 -0.876 5.917 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -18.249 -2.999 8.045 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -17.056 -1.715 8.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -18.960 -1.141 9.402 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -18.851 -0.085 8.076 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -20.006 -1.330 8.078 1.00 0.00 H new ATOM 347 N GLY A 156 -15.097 -3.698 5.026 1.00 0.00 N ATOM 348 CA GLY A 156 -13.776 -3.598 5.624 1.00 0.00 C ATOM 349 C GLY A 156 -12.947 -4.849 5.331 1.00 0.00 C ATOM 350 O GLY A 156 -12.340 -5.422 6.235 1.00 0.00 O ATOM 0 H GLY A 156 -15.229 -3.133 4.187 1.00 0.00 H new ATOM 0 HA2 GLY A 156 -13.263 -2.718 5.236 1.00 0.00 H new ATOM 0 HA3 GLY A 156 -13.870 -3.463 6.702 1.00 0.00 H new ATOM 354 N ASP A 157 -12.946 -5.238 4.065 1.00 0.00 N ATOM 355 CA ASP A 157 -12.200 -6.410 3.641 1.00 0.00 C ATOM 356 C ASP A 157 -10.838 -5.975 3.098 1.00 0.00 C ATOM 357 O ASP A 157 -10.628 -4.797 2.810 1.00 0.00 O ATOM 358 CB ASP A 157 -12.936 -7.159 2.528 1.00 0.00 C ATOM 359 CG ASP A 157 -12.606 -8.649 2.422 1.00 0.00 C ATOM 360 OD1 ASP A 157 -11.557 -9.038 2.979 1.00 0.00 O ATOM 361 OD2 ASP A 157 -13.409 -9.365 1.787 1.00 0.00 O ATOM 0 H ASP A 157 -13.451 -4.761 3.318 1.00 0.00 H new ATOM 0 HA ASP A 157 -12.086 -7.067 4.504 1.00 0.00 H new ATOM 0 HB2 ASP A 157 -14.009 -7.050 2.686 1.00 0.00 H new ATOM 0 HB3 ASP A 157 -12.704 -6.682 1.575 1.00 0.00 H new ATOM 366 N ILE A 158 -9.948 -6.948 2.974 1.00 0.00 N ATOM 367 CA ILE A 158 -8.611 -6.680 2.470 1.00 0.00 C ATOM 368 C ILE A 158 -8.524 -7.121 1.008 1.00 0.00 C ATOM 369 O ILE A 158 -8.925 -8.232 0.665 1.00 0.00 O ATOM 370 CB ILE A 158 -7.559 -7.328 3.372 1.00 0.00 C ATOM 371 CG1 ILE A 158 -7.153 -6.386 4.507 1.00 0.00 C ATOM 372 CG2 ILE A 158 -6.352 -7.797 2.556 1.00 0.00 C ATOM 373 CD1 ILE A 158 -6.012 -6.984 5.333 1.00 0.00 C ATOM 0 H ILE A 158 -10.126 -7.923 3.214 1.00 0.00 H new ATOM 0 HA ILE A 158 -8.402 -5.610 2.493 1.00 0.00 H new ATOM 0 HB ILE A 158 -8.001 -8.212 3.831 1.00 0.00 H new ATOM 0 HG12 ILE A 158 -6.844 -5.426 4.095 1.00 0.00 H new ATOM 0 HG13 ILE A 158 -8.012 -6.195 5.151 1.00 0.00 H new ATOM 0 HG21 ILE A 158 -5.619 -8.254 3.221 1.00 0.00 H new ATOM 0 HG22 ILE A 158 -6.676 -8.528 1.815 1.00 0.00 H new ATOM 0 HG23 ILE A 158 -5.901 -6.943 2.050 1.00 0.00 H new ATOM 0 HD11 ILE A 158 -5.742 -6.295 6.133 1.00 0.00 H new ATOM 0 HD12 ILE A 158 -6.333 -7.932 5.764 1.00 0.00 H new ATOM 0 HD13 ILE A 158 -5.147 -7.151 4.691 1.00 0.00 H new ATOM 385 N LEU A 159 -7.999 -6.226 0.184 1.00 0.00 N ATOM 386 CA LEU A 159 -7.854 -6.508 -1.234 1.00 0.00 C ATOM 387 C LEU A 159 -6.548 -5.893 -1.742 1.00 0.00 C ATOM 388 O LEU A 159 -6.388 -4.674 -1.734 1.00 0.00 O ATOM 389 CB LEU A 159 -9.092 -6.041 -2.002 1.00 0.00 C ATOM 390 CG LEU A 159 -10.420 -6.680 -1.587 1.00 0.00 C ATOM 391 CD1 LEU A 159 -11.504 -5.618 -1.399 1.00 0.00 C ATOM 392 CD2 LEU A 159 -10.843 -7.760 -2.584 1.00 0.00 C ATOM 0 H LEU A 159 -7.669 -5.305 0.471 1.00 0.00 H new ATOM 0 HA LEU A 159 -7.788 -7.583 -1.403 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -9.180 -4.961 -1.887 1.00 0.00 H new ATOM 0 HB3 LEU A 159 -8.933 -6.237 -3.062 1.00 0.00 H new ATOM 0 HG LEU A 159 -10.278 -7.169 -0.623 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -12.437 -6.099 -1.104 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -11.196 -4.917 -0.623 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -11.653 -5.080 -2.335 1.00 0.00 H new ATOM 0 HD21 LEU A 159 -11.789 -8.198 -2.266 1.00 0.00 H new ATOM 0 HD22 LEU A 159 -10.962 -7.316 -3.572 1.00 0.00 H new ATOM 0 HD23 LEU A 159 -10.079 -8.537 -2.625 1.00 0.00 H new ATOM 404 N ARG A 160 -5.648 -6.766 -2.170 1.00 0.00 N ATOM 405 CA ARG A 160 -4.361 -6.325 -2.680 1.00 0.00 C ATOM 406 C ARG A 160 -4.449 -6.056 -4.183 1.00 0.00 C ATOM 407 O ARG A 160 -4.879 -6.919 -4.948 1.00 0.00 O ATOM 408 CB ARG A 160 -3.277 -7.372 -2.419 1.00 0.00 C ATOM 409 CG ARG A 160 -2.067 -7.148 -3.330 1.00 0.00 C ATOM 410 CD ARG A 160 -1.434 -5.779 -3.073 1.00 0.00 C ATOM 411 NE ARG A 160 -0.417 -5.490 -4.109 1.00 0.00 N ATOM 412 CZ ARG A 160 0.856 -5.907 -4.048 1.00 0.00 C ATOM 413 NH1 ARG A 160 1.275 -6.631 -3.003 1.00 0.00 N ATOM 414 NH2 ARG A 160 1.708 -5.596 -5.034 1.00 0.00 N ATOM 0 H ARG A 160 -5.785 -7.777 -2.174 1.00 0.00 H new ATOM 0 HA ARG A 160 -4.095 -5.406 -2.158 1.00 0.00 H new ATOM 0 HB2 ARG A 160 -2.965 -7.325 -1.376 1.00 0.00 H new ATOM 0 HB3 ARG A 160 -3.683 -8.370 -2.586 1.00 0.00 H new ATOM 0 HG2 ARG A 160 -1.329 -7.932 -3.160 1.00 0.00 H new ATOM 0 HG3 ARG A 160 -2.374 -7.221 -4.373 1.00 0.00 H new ATOM 0 HD2 ARG A 160 -2.203 -5.006 -3.081 1.00 0.00 H new ATOM 0 HD3 ARG A 160 -0.974 -5.761 -2.085 1.00 0.00 H new ATOM 0 HE ARG A 160 -0.702 -4.940 -4.919 1.00 0.00 H new ATOM 0 HH11 ARG A 160 0.626 -6.866 -2.252 1.00 0.00 H new ATOM 0 HH12 ARG A 160 2.244 -6.948 -2.958 1.00 0.00 H new ATOM 0 HH21 ARG A 160 1.388 -5.043 -5.829 1.00 0.00 H new ATOM 0 HH22 ARG A 160 2.677 -5.912 -4.990 1.00 0.00 H new ATOM 428 N ILE A 161 -4.037 -4.856 -4.563 1.00 0.00 N ATOM 429 CA ILE A 161 -4.064 -4.461 -5.961 1.00 0.00 C ATOM 430 C ILE A 161 -2.826 -5.017 -6.667 1.00 0.00 C ATOM 431 O ILE A 161 -1.703 -4.823 -6.202 1.00 0.00 O ATOM 432 CB ILE A 161 -4.217 -2.944 -6.088 1.00 0.00 C ATOM 433 CG1 ILE A 161 -5.407 -2.586 -6.979 1.00 0.00 C ATOM 434 CG2 ILE A 161 -2.919 -2.303 -6.581 1.00 0.00 C ATOM 435 CD1 ILE A 161 -6.695 -2.484 -6.158 1.00 0.00 C ATOM 0 H ILE A 161 -3.682 -4.143 -3.926 1.00 0.00 H new ATOM 0 HA ILE A 161 -4.934 -4.887 -6.460 1.00 0.00 H new ATOM 0 HB ILE A 161 -4.422 -2.537 -5.098 1.00 0.00 H new ATOM 0 HG12 ILE A 161 -5.217 -1.638 -7.483 1.00 0.00 H new ATOM 0 HG13 ILE A 161 -5.525 -3.342 -7.755 1.00 0.00 H new ATOM 0 HG21 ILE A 161 -3.054 -1.224 -6.663 1.00 0.00 H new ATOM 0 HG22 ILE A 161 -2.117 -2.516 -5.874 1.00 0.00 H new ATOM 0 HG23 ILE A 161 -2.660 -2.711 -7.558 1.00 0.00 H new ATOM 0 HD11 ILE A 161 -7.526 -2.228 -6.815 1.00 0.00 H new ATOM 0 HD12 ILE A 161 -6.895 -3.440 -5.675 1.00 0.00 H new ATOM 0 HD13 ILE A 161 -6.582 -1.711 -5.398 1.00 0.00 H new ATOM 447 N ARG A 162 -3.071 -5.696 -7.778 1.00 0.00 N ATOM 448 CA ARG A 162 -1.989 -6.280 -8.553 1.00 0.00 C ATOM 449 C ARG A 162 -2.045 -5.785 -9.999 1.00 0.00 C ATOM 450 O ARG A 162 -1.010 -5.507 -10.603 1.00 0.00 O ATOM 451 CB ARG A 162 -2.066 -7.808 -8.540 1.00 0.00 C ATOM 452 CG ARG A 162 -1.391 -8.381 -7.292 1.00 0.00 C ATOM 453 CD ARG A 162 -2.094 -9.658 -6.826 1.00 0.00 C ATOM 454 NE ARG A 162 -1.574 -10.824 -7.576 1.00 0.00 N ATOM 455 CZ ARG A 162 -0.347 -11.335 -7.413 1.00 0.00 C ATOM 456 NH1 ARG A 162 0.494 -10.789 -6.526 1.00 0.00 N ATOM 457 NH2 ARG A 162 0.038 -12.395 -8.137 1.00 0.00 N ATOM 0 H ARG A 162 -4.003 -5.855 -8.160 1.00 0.00 H new ATOM 0 HA ARG A 162 -1.049 -5.971 -8.096 1.00 0.00 H new ATOM 0 HB2 ARG A 162 -3.109 -8.123 -8.571 1.00 0.00 H new ATOM 0 HB3 ARG A 162 -1.586 -8.207 -9.433 1.00 0.00 H new ATOM 0 HG2 ARG A 162 -0.344 -8.595 -7.506 1.00 0.00 H new ATOM 0 HG3 ARG A 162 -1.407 -7.640 -6.493 1.00 0.00 H new ATOM 0 HD2 ARG A 162 -1.934 -9.802 -5.757 1.00 0.00 H new ATOM 0 HD3 ARG A 162 -3.170 -9.567 -6.978 1.00 0.00 H new ATOM 0 HE ARG A 162 -2.189 -11.266 -8.260 1.00 0.00 H new ATOM 0 HH11 ARG A 162 0.200 -9.983 -5.974 1.00 0.00 H new ATOM 0 HH12 ARG A 162 1.428 -11.179 -6.402 1.00 0.00 H new ATOM 0 HH21 ARG A 162 -0.603 -12.812 -8.812 1.00 0.00 H new ATOM 0 HH22 ARG A 162 0.972 -12.785 -8.013 1.00 0.00 H new ATOM 471 N ASP A 163 -3.263 -5.690 -10.512 1.00 0.00 N ATOM 472 CA ASP A 163 -3.467 -5.233 -11.876 1.00 0.00 C ATOM 473 C ASP A 163 -4.326 -3.968 -11.863 1.00 0.00 C ATOM 474 O ASP A 163 -5.275 -3.866 -11.086 1.00 0.00 O ATOM 475 CB ASP A 163 -4.195 -6.291 -12.708 1.00 0.00 C ATOM 476 CG ASP A 163 -3.770 -6.365 -14.176 1.00 0.00 C ATOM 477 OD1 ASP A 163 -2.970 -5.493 -14.579 1.00 0.00 O ATOM 478 OD2 ASP A 163 -4.254 -7.292 -14.861 1.00 0.00 O ATOM 0 H ASP A 163 -4.119 -5.922 -10.007 1.00 0.00 H new ATOM 0 HA ASP A 163 -2.489 -5.038 -12.316 1.00 0.00 H new ATOM 0 HB2 ASP A 163 -4.034 -7.266 -12.249 1.00 0.00 H new ATOM 0 HB3 ASP A 163 -5.266 -6.092 -12.665 1.00 0.00 H new ATOM 483 N LYS A 164 -3.964 -3.035 -12.732 1.00 0.00 N ATOM 484 CA LYS A 164 -4.690 -1.781 -12.830 1.00 0.00 C ATOM 485 C LYS A 164 -4.886 -1.424 -14.304 1.00 0.00 C ATOM 486 O LYS A 164 -4.434 -0.374 -14.758 1.00 0.00 O ATOM 487 CB LYS A 164 -3.986 -0.689 -12.021 1.00 0.00 C ATOM 488 CG LYS A 164 -4.804 0.603 -12.015 1.00 0.00 C ATOM 489 CD LYS A 164 -3.941 1.801 -12.417 1.00 0.00 C ATOM 490 CE LYS A 164 -2.878 2.091 -11.356 1.00 0.00 C ATOM 491 NZ LYS A 164 -3.500 2.659 -10.140 1.00 0.00 N ATOM 0 H LYS A 164 -3.177 -3.123 -13.375 1.00 0.00 H new ATOM 0 HA LYS A 164 -5.683 -1.881 -12.391 1.00 0.00 H new ATOM 0 HB2 LYS A 164 -3.833 -1.031 -10.998 1.00 0.00 H new ATOM 0 HB3 LYS A 164 -3.000 -0.497 -12.444 1.00 0.00 H new ATOM 0 HG2 LYS A 164 -5.644 0.509 -12.703 1.00 0.00 H new ATOM 0 HG3 LYS A 164 -5.222 0.768 -11.022 1.00 0.00 H new ATOM 0 HD2 LYS A 164 -3.460 1.602 -13.374 1.00 0.00 H new ATOM 0 HD3 LYS A 164 -4.572 2.679 -12.554 1.00 0.00 H new ATOM 0 HE2 LYS A 164 -2.347 1.173 -11.105 1.00 0.00 H new ATOM 0 HE3 LYS A 164 -2.140 2.788 -11.753 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 -3.155 3.629 -9.995 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 -4.534 2.672 -10.252 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 -3.249 2.076 -9.317 1.00 0.00 H new ATOM 505 N PRO A 165 -5.580 -2.341 -15.029 1.00 0.00 N ATOM 506 CA PRO A 165 -5.842 -2.134 -16.444 1.00 0.00 C ATOM 507 C PRO A 165 -6.941 -1.088 -16.651 1.00 0.00 C ATOM 508 O PRO A 165 -6.693 -0.028 -17.224 1.00 0.00 O ATOM 509 CB PRO A 165 -6.219 -3.504 -16.980 1.00 0.00 C ATOM 510 CG PRO A 165 -6.606 -4.334 -15.767 1.00 0.00 C ATOM 511 CD PRO A 165 -6.131 -3.595 -14.525 1.00 0.00 C ATOM 0 HA PRO A 165 -4.978 -1.737 -16.977 1.00 0.00 H new ATOM 0 HB2 PRO A 165 -7.047 -3.433 -17.685 1.00 0.00 H new ATOM 0 HB3 PRO A 165 -5.384 -3.958 -17.514 1.00 0.00 H new ATOM 0 HG2 PRO A 165 -7.685 -4.481 -15.734 1.00 0.00 H new ATOM 0 HG3 PRO A 165 -6.151 -5.323 -15.820 1.00 0.00 H new ATOM 0 HD2 PRO A 165 -6.953 -3.416 -13.832 1.00 0.00 H new ATOM 0 HD3 PRO A 165 -5.378 -4.170 -13.986 1.00 0.00 H new ATOM 519 N GLU A 166 -8.130 -1.424 -16.173 1.00 0.00 N ATOM 520 CA GLU A 166 -9.266 -0.527 -16.298 1.00 0.00 C ATOM 521 C GLU A 166 -9.003 0.773 -15.536 1.00 0.00 C ATOM 522 O GLU A 166 -7.982 0.907 -14.864 1.00 0.00 O ATOM 523 CB GLU A 166 -10.550 -1.199 -15.808 1.00 0.00 C ATOM 524 CG GLU A 166 -10.901 -2.410 -16.675 1.00 0.00 C ATOM 525 CD GLU A 166 -11.693 -1.985 -17.913 1.00 0.00 C ATOM 526 OE1 GLU A 166 -11.442 -0.857 -18.389 1.00 0.00 O ATOM 527 OE2 GLU A 166 -12.532 -2.799 -18.358 1.00 0.00 O ATOM 0 H GLU A 166 -8.331 -2.304 -15.699 1.00 0.00 H new ATOM 0 HA GLU A 166 -9.400 -0.286 -17.353 1.00 0.00 H new ATOM 0 HB2 GLU A 166 -10.428 -1.513 -14.771 1.00 0.00 H new ATOM 0 HB3 GLU A 166 -11.371 -0.482 -15.829 1.00 0.00 H new ATOM 0 HG2 GLU A 166 -9.988 -2.920 -16.980 1.00 0.00 H new ATOM 0 HG3 GLU A 166 -11.485 -3.123 -16.092 1.00 0.00 H new ATOM 534 N GLU A 167 -9.942 1.699 -15.668 1.00 0.00 N ATOM 535 CA GLU A 167 -9.824 2.985 -15.001 1.00 0.00 C ATOM 536 C GLU A 167 -10.966 3.170 -14.000 1.00 0.00 C ATOM 537 O GLU A 167 -11.361 4.297 -13.705 1.00 0.00 O ATOM 538 CB GLU A 167 -9.794 4.128 -16.016 1.00 0.00 C ATOM 539 CG GLU A 167 -11.121 4.227 -16.770 1.00 0.00 C ATOM 540 CD GLU A 167 -11.589 5.681 -16.867 1.00 0.00 C ATOM 541 OE1 GLU A 167 -11.770 6.292 -15.792 1.00 0.00 O ATOM 542 OE2 GLU A 167 -11.756 6.148 -18.015 1.00 0.00 O ATOM 0 H GLU A 167 -10.788 1.584 -16.227 1.00 0.00 H new ATOM 0 HA GLU A 167 -8.881 3.004 -14.454 1.00 0.00 H new ATOM 0 HB2 GLU A 167 -9.592 5.069 -15.504 1.00 0.00 H new ATOM 0 HB3 GLU A 167 -8.980 3.969 -16.724 1.00 0.00 H new ATOM 0 HG2 GLU A 167 -11.007 3.810 -17.771 1.00 0.00 H new ATOM 0 HG3 GLU A 167 -11.878 3.631 -16.261 1.00 0.00 H new ATOM 549 N GLN A 168 -11.465 2.046 -13.506 1.00 0.00 N ATOM 550 CA GLN A 168 -12.555 2.071 -12.545 1.00 0.00 C ATOM 551 C GLN A 168 -12.450 0.877 -11.593 1.00 0.00 C ATOM 552 O GLN A 168 -12.557 1.037 -10.378 1.00 0.00 O ATOM 553 CB GLN A 168 -13.910 2.089 -13.253 1.00 0.00 C ATOM 554 CG GLN A 168 -14.410 3.523 -13.444 1.00 0.00 C ATOM 555 CD GLN A 168 -15.851 3.537 -13.957 1.00 0.00 C ATOM 556 OE1 GLN A 168 -16.642 2.648 -13.689 1.00 0.00 O ATOM 557 NE2 GLN A 168 -16.147 4.595 -14.709 1.00 0.00 N ATOM 0 H GLN A 168 -11.135 1.113 -13.753 1.00 0.00 H new ATOM 0 HA GLN A 168 -12.476 2.987 -11.959 1.00 0.00 H new ATOM 0 HB2 GLN A 168 -13.824 1.598 -14.222 1.00 0.00 H new ATOM 0 HB3 GLN A 168 -14.636 1.521 -12.671 1.00 0.00 H new ATOM 0 HG2 GLN A 168 -14.352 4.061 -12.498 1.00 0.00 H new ATOM 0 HG3 GLN A 168 -13.764 4.046 -14.149 1.00 0.00 H new ATOM 0 HE21 GLN A 168 -15.437 5.303 -14.895 1.00 0.00 H new ATOM 0 HE22 GLN A 168 -17.084 4.697 -15.099 1.00 0.00 H new ATOM 566 N TRP A 169 -12.241 -0.292 -12.181 1.00 0.00 N ATOM 567 CA TRP A 169 -12.119 -1.511 -11.401 1.00 0.00 C ATOM 568 C TRP A 169 -10.690 -2.033 -11.556 1.00 0.00 C ATOM 569 O TRP A 169 -10.169 -2.102 -12.668 1.00 0.00 O ATOM 570 CB TRP A 169 -13.178 -2.535 -11.817 1.00 0.00 C ATOM 571 CG TRP A 169 -14.616 -2.023 -11.709 1.00 0.00 C ATOM 572 CD1 TRP A 169 -15.187 -1.019 -12.387 1.00 0.00 C ATOM 573 CD2 TRP A 169 -15.648 -2.536 -10.840 1.00 0.00 C ATOM 574 NE1 TRP A 169 -16.507 -0.847 -12.021 1.00 0.00 N ATOM 575 CE2 TRP A 169 -16.795 -1.799 -11.049 1.00 0.00 C ATOM 576 CE3 TRP A 169 -15.613 -3.588 -9.907 1.00 0.00 C ATOM 577 CZ2 TRP A 169 -17.994 -2.035 -10.365 1.00 0.00 C ATOM 578 CZ3 TRP A 169 -16.818 -3.811 -9.231 1.00 0.00 C ATOM 579 CH2 TRP A 169 -17.982 -3.078 -9.430 1.00 0.00 C ATOM 0 H TRP A 169 -12.153 -0.420 -13.189 1.00 0.00 H new ATOM 0 HA TRP A 169 -12.303 -1.313 -10.345 1.00 0.00 H new ATOM 0 HB2 TRP A 169 -12.988 -2.841 -12.846 1.00 0.00 H new ATOM 0 HB3 TRP A 169 -13.072 -3.424 -11.196 1.00 0.00 H new ATOM 0 HD1 TRP A 169 -14.679 -0.419 -13.127 1.00 0.00 H new ATOM 0 HE1 TRP A 169 -17.152 -0.150 -12.394 1.00 0.00 H new ATOM 0 HE3 TRP A 169 -14.726 -4.177 -9.726 1.00 0.00 H new ATOM 0 HZ2 TRP A 169 -18.880 -1.445 -10.548 1.00 0.00 H new ATOM 0 HZ3 TRP A 169 -16.845 -4.609 -8.504 1.00 0.00 H new ATOM 0 HH2 TRP A 169 -18.873 -3.312 -8.866 1.00 0.00 H new ATOM 590 N TRP A 170 -10.096 -2.384 -10.425 1.00 0.00 N ATOM 591 CA TRP A 170 -8.736 -2.896 -10.422 1.00 0.00 C ATOM 592 C TRP A 170 -8.785 -4.361 -9.986 1.00 0.00 C ATOM 593 O TRP A 170 -9.659 -4.755 -9.215 1.00 0.00 O ATOM 594 CB TRP A 170 -7.829 -2.039 -9.537 1.00 0.00 C ATOM 595 CG TRP A 170 -7.622 -0.613 -10.054 1.00 0.00 C ATOM 596 CD1 TRP A 170 -7.632 -0.187 -11.324 1.00 0.00 C ATOM 597 CD2 TRP A 170 -7.374 0.562 -9.256 1.00 0.00 C ATOM 598 NE1 TRP A 170 -7.408 1.173 -11.403 1.00 0.00 N ATOM 599 CE2 TRP A 170 -7.246 1.643 -10.105 1.00 0.00 C ATOM 600 CE3 TRP A 170 -7.259 0.709 -7.863 1.00 0.00 C ATOM 601 CZ2 TRP A 170 -6.997 2.946 -9.657 1.00 0.00 C ATOM 602 CZ3 TRP A 170 -7.011 2.018 -7.430 1.00 0.00 C ATOM 603 CH2 TRP A 170 -6.880 3.115 -8.272 1.00 0.00 C ATOM 0 H TRP A 170 -10.531 -2.324 -9.505 1.00 0.00 H new ATOM 0 HA TRP A 170 -8.301 -2.843 -11.420 1.00 0.00 H new ATOM 0 HB2 TRP A 170 -8.255 -1.993 -8.535 1.00 0.00 H new ATOM 0 HB3 TRP A 170 -6.858 -2.527 -9.449 1.00 0.00 H new ATOM 0 HD1 TRP A 170 -7.795 -0.827 -12.179 1.00 0.00 H new ATOM 0 HE1 TRP A 170 -7.369 1.730 -12.256 1.00 0.00 H new ATOM 0 HE3 TRP A 170 -7.354 -0.122 -7.180 1.00 0.00 H new ATOM 0 HZ2 TRP A 170 -6.900 3.775 -10.342 1.00 0.00 H new ATOM 0 HZ3 TRP A 170 -6.915 2.186 -6.367 1.00 0.00 H new ATOM 0 HH2 TRP A 170 -6.689 4.095 -7.860 1.00 0.00 H new ATOM 614 N ASN A 171 -7.834 -5.130 -10.498 1.00 0.00 N ATOM 615 CA ASN A 171 -7.756 -6.544 -10.171 1.00 0.00 C ATOM 616 C ASN A 171 -6.911 -6.726 -8.910 1.00 0.00 C ATOM 617 O ASN A 171 -5.682 -6.696 -8.972 1.00 0.00 O ATOM 618 CB ASN A 171 -7.097 -7.335 -11.302 1.00 0.00 C ATOM 619 CG ASN A 171 -7.546 -8.797 -11.283 1.00 0.00 C ATOM 620 OD1 ASN A 171 -8.714 -9.116 -11.439 1.00 0.00 O ATOM 621 ND2 ASN A 171 -6.558 -9.665 -11.083 1.00 0.00 N ATOM 0 H ASN A 171 -7.111 -4.800 -11.137 1.00 0.00 H new ATOM 0 HA ASN A 171 -8.771 -6.911 -10.019 1.00 0.00 H new ATOM 0 HB2 ASN A 171 -7.352 -6.885 -12.262 1.00 0.00 H new ATOM 0 HB3 ASN A 171 -6.013 -7.283 -11.203 1.00 0.00 H new ATOM 0 HD21 ASN A 171 -6.756 -10.665 -11.053 1.00 0.00 H new ATOM 0 HD22 ASN A 171 -5.602 -9.330 -10.960 1.00 0.00 H new ATOM 628 N ALA A 172 -7.601 -6.910 -7.794 1.00 0.00 N ATOM 629 CA ALA A 172 -6.928 -7.097 -6.520 1.00 0.00 C ATOM 630 C ALA A 172 -7.208 -8.509 -6.002 1.00 0.00 C ATOM 631 O ALA A 172 -8.135 -9.172 -6.466 1.00 0.00 O ATOM 632 CB ALA A 172 -7.383 -6.015 -5.539 1.00 0.00 C ATOM 0 H ALA A 172 -8.620 -6.934 -7.746 1.00 0.00 H new ATOM 0 HA ALA A 172 -5.849 -6.998 -6.638 1.00 0.00 H new ATOM 0 HB1 ALA A 172 -6.878 -6.155 -4.583 1.00 0.00 H new ATOM 0 HB2 ALA A 172 -7.134 -5.032 -5.940 1.00 0.00 H new ATOM 0 HB3 ALA A 172 -8.461 -6.086 -5.394 1.00 0.00 H new ATOM 638 N GLU A 173 -6.391 -8.928 -5.047 1.00 0.00 N ATOM 639 CA GLU A 173 -6.540 -10.249 -4.461 1.00 0.00 C ATOM 640 C GLU A 173 -7.025 -10.137 -3.015 1.00 0.00 C ATOM 641 O GLU A 173 -6.274 -9.717 -2.135 1.00 0.00 O ATOM 642 CB GLU A 173 -5.229 -11.035 -4.540 1.00 0.00 C ATOM 643 CG GLU A 173 -5.368 -12.402 -3.867 1.00 0.00 C ATOM 644 CD GLU A 173 -4.438 -12.513 -2.656 1.00 0.00 C ATOM 645 OE1 GLU A 173 -3.238 -12.208 -2.832 1.00 0.00 O ATOM 646 OE2 GLU A 173 -4.948 -12.899 -1.583 1.00 0.00 O ATOM 0 H GLU A 173 -5.623 -8.376 -4.664 1.00 0.00 H new ATOM 0 HA GLU A 173 -7.289 -10.796 -5.033 1.00 0.00 H new ATOM 0 HB2 GLU A 173 -4.942 -11.167 -5.583 1.00 0.00 H new ATOM 0 HB3 GLU A 173 -4.432 -10.468 -4.059 1.00 0.00 H new ATOM 0 HG2 GLU A 173 -6.401 -12.553 -3.552 1.00 0.00 H new ATOM 0 HG3 GLU A 173 -5.134 -13.190 -4.583 1.00 0.00 H new ATOM 653 N ASP A 174 -8.278 -10.519 -2.812 1.00 0.00 N ATOM 654 CA ASP A 174 -8.871 -10.467 -1.487 1.00 0.00 C ATOM 655 C ASP A 174 -8.002 -11.264 -0.512 1.00 0.00 C ATOM 656 O ASP A 174 -6.996 -11.849 -0.908 1.00 0.00 O ATOM 657 CB ASP A 174 -10.271 -11.085 -1.487 1.00 0.00 C ATOM 658 CG ASP A 174 -11.387 -10.155 -1.007 1.00 0.00 C ATOM 659 OD1 ASP A 174 -11.051 -9.186 -0.293 1.00 0.00 O ATOM 660 OD2 ASP A 174 -12.552 -10.435 -1.364 1.00 0.00 O ATOM 0 H ASP A 174 -8.898 -10.866 -3.544 1.00 0.00 H new ATOM 0 HA ASP A 174 -8.938 -9.421 -1.188 1.00 0.00 H new ATOM 0 HB2 ASP A 174 -10.505 -11.418 -2.498 1.00 0.00 H new ATOM 0 HB3 ASP A 174 -10.260 -11.972 -0.854 1.00 0.00 H new ATOM 665 N SER A 175 -8.424 -11.259 0.744 1.00 0.00 N ATOM 666 CA SER A 175 -7.697 -11.974 1.779 1.00 0.00 C ATOM 667 C SER A 175 -8.089 -13.453 1.768 1.00 0.00 C ATOM 668 O SER A 175 -8.023 -14.125 2.797 1.00 0.00 O ATOM 669 CB SER A 175 -7.961 -11.366 3.159 1.00 0.00 C ATOM 670 OG SER A 175 -9.325 -11.500 3.549 1.00 0.00 O ATOM 0 H SER A 175 -9.259 -10.772 1.068 1.00 0.00 H new ATOM 0 HA SER A 175 -6.631 -11.885 1.570 1.00 0.00 H new ATOM 0 HB2 SER A 175 -7.323 -11.852 3.897 1.00 0.00 H new ATOM 0 HB3 SER A 175 -7.689 -10.311 3.148 1.00 0.00 H new ATOM 0 HG SER A 175 -9.453 -11.101 4.435 1.00 0.00 H new ATOM 676 N GLU A 176 -8.487 -13.918 0.593 1.00 0.00 N ATOM 677 CA GLU A 176 -8.889 -15.305 0.434 1.00 0.00 C ATOM 678 C GLU A 176 -8.176 -15.931 -0.766 1.00 0.00 C ATOM 679 O GLU A 176 -8.301 -17.129 -1.011 1.00 0.00 O ATOM 680 CB GLU A 176 -10.408 -15.422 0.290 1.00 0.00 C ATOM 681 CG GLU A 176 -11.115 -14.994 1.578 1.00 0.00 C ATOM 682 CD GLU A 176 -12.632 -14.943 1.381 1.00 0.00 C ATOM 683 OE1 GLU A 176 -13.056 -14.247 0.432 1.00 0.00 O ATOM 684 OE2 GLU A 176 -13.331 -15.598 2.183 1.00 0.00 O ATOM 0 H GLU A 176 -8.540 -13.359 -0.258 1.00 0.00 H new ATOM 0 HA GLU A 176 -8.598 -15.852 1.331 1.00 0.00 H new ATOM 0 HB2 GLU A 176 -10.747 -14.801 -0.539 1.00 0.00 H new ATOM 0 HB3 GLU A 176 -10.676 -16.451 0.048 1.00 0.00 H new ATOM 0 HG2 GLU A 176 -10.872 -15.692 2.379 1.00 0.00 H new ATOM 0 HG3 GLU A 176 -10.752 -14.014 1.888 1.00 0.00 H new ATOM 691 N GLY A 177 -7.442 -15.090 -1.481 1.00 0.00 N ATOM 692 CA GLY A 177 -6.708 -15.546 -2.650 1.00 0.00 C ATOM 693 C GLY A 177 -7.509 -15.301 -3.931 1.00 0.00 C ATOM 694 O GLY A 177 -7.024 -15.562 -5.030 1.00 0.00 O ATOM 0 H GLY A 177 -7.340 -14.097 -1.274 1.00 0.00 H new ATOM 0 HA2 GLY A 177 -5.752 -15.025 -2.709 1.00 0.00 H new ATOM 0 HA3 GLY A 177 -6.487 -16.609 -2.553 1.00 0.00 H new ATOM 698 N LYS A 178 -8.722 -14.801 -3.745 1.00 0.00 N ATOM 699 CA LYS A 178 -9.595 -14.518 -4.872 1.00 0.00 C ATOM 700 C LYS A 178 -9.158 -13.208 -5.533 1.00 0.00 C ATOM 701 O LYS A 178 -9.261 -12.141 -4.932 1.00 0.00 O ATOM 702 CB LYS A 178 -11.060 -14.524 -4.430 1.00 0.00 C ATOM 703 CG LYS A 178 -11.469 -15.903 -3.909 1.00 0.00 C ATOM 704 CD LYS A 178 -12.967 -16.143 -4.109 1.00 0.00 C ATOM 705 CE LYS A 178 -13.387 -17.495 -3.532 1.00 0.00 C ATOM 706 NZ LYS A 178 -13.565 -18.488 -4.616 1.00 0.00 N ATOM 0 H LYS A 178 -9.121 -14.585 -2.831 1.00 0.00 H new ATOM 0 HA LYS A 178 -9.510 -15.301 -5.626 1.00 0.00 H new ATOM 0 HB2 LYS A 178 -11.212 -13.777 -3.651 1.00 0.00 H new ATOM 0 HB3 LYS A 178 -11.698 -14.244 -5.268 1.00 0.00 H new ATOM 0 HG2 LYS A 178 -10.901 -16.675 -4.428 1.00 0.00 H new ATOM 0 HG3 LYS A 178 -11.222 -15.983 -2.850 1.00 0.00 H new ATOM 0 HD2 LYS A 178 -13.534 -15.346 -3.628 1.00 0.00 H new ATOM 0 HD3 LYS A 178 -13.206 -16.107 -5.172 1.00 0.00 H new ATOM 0 HE2 LYS A 178 -12.633 -17.847 -2.828 1.00 0.00 H new ATOM 0 HE3 LYS A 178 -14.317 -17.386 -2.974 1.00 0.00 H new ATOM 0 HZ1 LYS A 178 -13.850 -19.401 -4.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 178 -14.301 -18.157 -5.272 1.00 0.00 H new ATOM 0 HZ3 LYS A 178 -12.669 -18.604 -5.131 1.00 0.00 H new ATOM 720 N ARG A 179 -8.679 -13.335 -6.763 1.00 0.00 N ATOM 721 CA ARG A 179 -8.227 -12.175 -7.512 1.00 0.00 C ATOM 722 C ARG A 179 -9.256 -11.798 -8.579 1.00 0.00 C ATOM 723 O ARG A 179 -9.508 -12.569 -9.504 1.00 0.00 O ATOM 724 CB ARG A 179 -6.880 -12.446 -8.184 1.00 0.00 C ATOM 725 CG ARG A 179 -5.841 -12.914 -7.164 1.00 0.00 C ATOM 726 CD ARG A 179 -5.585 -14.417 -7.291 1.00 0.00 C ATOM 727 NE ARG A 179 -4.552 -14.669 -8.321 1.00 0.00 N ATOM 728 CZ ARG A 179 -3.233 -14.654 -8.080 1.00 0.00 C ATOM 729 NH1 ARG A 179 -2.781 -14.400 -6.845 1.00 0.00 N ATOM 730 NH2 ARG A 179 -2.369 -14.894 -9.076 1.00 0.00 N ATOM 0 H ARG A 179 -8.594 -14.223 -7.258 1.00 0.00 H new ATOM 0 HA ARG A 179 -8.110 -11.350 -6.809 1.00 0.00 H new ATOM 0 HB2 ARG A 179 -7.002 -13.204 -8.958 1.00 0.00 H new ATOM 0 HB3 ARG A 179 -6.527 -11.540 -8.678 1.00 0.00 H new ATOM 0 HG2 ARG A 179 -4.909 -12.369 -7.313 1.00 0.00 H new ATOM 0 HG3 ARG A 179 -6.187 -12.684 -6.156 1.00 0.00 H new ATOM 0 HD2 ARG A 179 -5.261 -14.821 -6.332 1.00 0.00 H new ATOM 0 HD3 ARG A 179 -6.509 -14.930 -7.557 1.00 0.00 H new ATOM 0 HE ARG A 179 -4.863 -14.866 -9.272 1.00 0.00 H new ATOM 0 HH11 ARG A 179 -3.440 -14.218 -6.088 1.00 0.00 H new ATOM 0 HH12 ARG A 179 -1.778 -14.389 -6.661 1.00 0.00 H new ATOM 0 HH21 ARG A 179 -2.715 -15.088 -10.016 1.00 0.00 H new ATOM 0 HH22 ARG A 179 -1.365 -14.883 -8.894 1.00 0.00 H new ATOM 744 N GLY A 180 -9.823 -10.612 -8.415 1.00 0.00 N ATOM 745 CA GLY A 180 -10.819 -10.123 -9.354 1.00 0.00 C ATOM 746 C GLY A 180 -10.848 -8.593 -9.376 1.00 0.00 C ATOM 747 O GLY A 180 -10.034 -7.944 -8.721 1.00 0.00 O ATOM 0 H GLY A 180 -9.612 -9.975 -7.646 1.00 0.00 H new ATOM 0 HA2 GLY A 180 -10.599 -10.500 -10.353 1.00 0.00 H new ATOM 0 HA3 GLY A 180 -11.802 -10.505 -9.079 1.00 0.00 H new ATOM 751 N MET A 181 -11.794 -8.062 -10.137 1.00 0.00 N ATOM 752 CA MET A 181 -11.939 -6.621 -10.253 1.00 0.00 C ATOM 753 C MET A 181 -12.807 -6.065 -9.123 1.00 0.00 C ATOM 754 O MET A 181 -13.887 -6.586 -8.851 1.00 0.00 O ATOM 755 CB MET A 181 -12.577 -6.279 -11.601 1.00 0.00 C ATOM 756 CG MET A 181 -11.576 -5.567 -12.515 1.00 0.00 C ATOM 757 SD MET A 181 -11.769 -6.140 -14.194 1.00 0.00 S ATOM 758 CE MET A 181 -13.050 -5.030 -14.755 1.00 0.00 C ATOM 0 H MET A 181 -12.467 -8.604 -10.679 1.00 0.00 H new ATOM 0 HA MET A 181 -10.950 -6.168 -10.183 1.00 0.00 H new ATOM 0 HB2 MET A 181 -12.930 -7.191 -12.082 1.00 0.00 H new ATOM 0 HB3 MET A 181 -13.448 -5.643 -11.444 1.00 0.00 H new ATOM 0 HG2 MET A 181 -11.732 -4.489 -12.470 1.00 0.00 H new ATOM 0 HG3 MET A 181 -10.559 -5.756 -12.172 1.00 0.00 H new ATOM 0 HE1 MET A 181 -13.244 -5.204 -15.813 1.00 0.00 H new ATOM 0 HE2 MET A 181 -13.962 -5.209 -14.185 1.00 0.00 H new ATOM 0 HE3 MET A 181 -12.727 -3.999 -14.610 1.00 0.00 H new ATOM 768 N ILE A 182 -12.302 -5.013 -8.494 1.00 0.00 N ATOM 769 CA ILE A 182 -13.017 -4.380 -7.399 1.00 0.00 C ATOM 770 C ILE A 182 -13.088 -2.872 -7.646 1.00 0.00 C ATOM 771 O ILE A 182 -12.331 -2.336 -8.455 1.00 0.00 O ATOM 772 CB ILE A 182 -12.383 -4.755 -6.058 1.00 0.00 C ATOM 773 CG1 ILE A 182 -11.257 -3.786 -5.694 1.00 0.00 C ATOM 774 CG2 ILE A 182 -11.910 -6.209 -6.063 1.00 0.00 C ATOM 775 CD1 ILE A 182 -10.082 -3.921 -6.666 1.00 0.00 C ATOM 0 H ILE A 182 -11.406 -4.583 -8.722 1.00 0.00 H new ATOM 0 HA ILE A 182 -14.043 -4.744 -7.353 1.00 0.00 H new ATOM 0 HB ILE A 182 -13.145 -4.668 -5.283 1.00 0.00 H new ATOM 0 HG12 ILE A 182 -11.633 -2.763 -5.712 1.00 0.00 H new ATOM 0 HG13 ILE A 182 -10.917 -3.983 -4.677 1.00 0.00 H new ATOM 0 HG21 ILE A 182 -11.463 -6.450 -5.098 1.00 0.00 H new ATOM 0 HG22 ILE A 182 -12.760 -6.867 -6.244 1.00 0.00 H new ATOM 0 HG23 ILE A 182 -11.169 -6.348 -6.850 1.00 0.00 H new ATOM 0 HD11 ILE A 182 -9.295 -3.221 -6.385 1.00 0.00 H new ATOM 0 HD12 ILE A 182 -9.693 -4.939 -6.628 1.00 0.00 H new ATOM 0 HD13 ILE A 182 -10.420 -3.699 -7.678 1.00 0.00 H new ATOM 787 N PRO A 183 -14.026 -2.213 -6.916 1.00 0.00 N ATOM 788 CA PRO A 183 -14.206 -0.777 -7.048 1.00 0.00 C ATOM 789 C PRO A 183 -13.078 -0.018 -6.346 1.00 0.00 C ATOM 790 O PRO A 183 -12.656 -0.394 -5.254 1.00 0.00 O ATOM 791 CB PRO A 183 -15.573 -0.494 -6.449 1.00 0.00 C ATOM 792 CG PRO A 183 -15.909 -1.702 -5.589 1.00 0.00 C ATOM 793 CD PRO A 183 -14.939 -2.815 -5.949 1.00 0.00 C ATOM 0 HA PRO A 183 -14.163 -0.441 -8.084 1.00 0.00 H new ATOM 0 HB2 PRO A 183 -15.557 0.418 -5.852 1.00 0.00 H new ATOM 0 HB3 PRO A 183 -16.320 -0.351 -7.230 1.00 0.00 H new ATOM 0 HG2 PRO A 183 -15.827 -1.452 -4.531 1.00 0.00 H new ATOM 0 HG3 PRO A 183 -16.937 -2.020 -5.763 1.00 0.00 H new ATOM 0 HD2 PRO A 183 -14.404 -3.174 -5.070 1.00 0.00 H new ATOM 0 HD3 PRO A 183 -15.460 -3.672 -6.377 1.00 0.00 H new ATOM 801 N VAL A 184 -12.620 1.038 -7.003 1.00 0.00 N ATOM 802 CA VAL A 184 -11.549 1.854 -6.457 1.00 0.00 C ATOM 803 C VAL A 184 -12.130 2.831 -5.434 1.00 0.00 C ATOM 804 O VAL A 184 -11.464 3.190 -4.464 1.00 0.00 O ATOM 805 CB VAL A 184 -10.794 2.553 -7.589 1.00 0.00 C ATOM 806 CG1 VAL A 184 -9.850 3.624 -7.039 1.00 0.00 C ATOM 807 CG2 VAL A 184 -10.033 1.540 -8.447 1.00 0.00 C ATOM 0 H VAL A 184 -12.972 1.347 -7.909 1.00 0.00 H new ATOM 0 HA VAL A 184 -10.822 1.231 -5.936 1.00 0.00 H new ATOM 0 HB VAL A 184 -11.527 3.048 -8.226 1.00 0.00 H new ATOM 0 HG11 VAL A 184 -9.326 4.105 -7.864 1.00 0.00 H new ATOM 0 HG12 VAL A 184 -10.426 4.370 -6.491 1.00 0.00 H new ATOM 0 HG13 VAL A 184 -9.125 3.161 -6.370 1.00 0.00 H new ATOM 0 HG21 VAL A 184 -9.505 2.063 -9.244 1.00 0.00 H new ATOM 0 HG22 VAL A 184 -9.315 1.004 -7.826 1.00 0.00 H new ATOM 0 HG23 VAL A 184 -10.737 0.830 -8.882 1.00 0.00 H new ATOM 817 N PRO A 185 -13.400 3.245 -5.690 1.00 0.00 N ATOM 818 CA PRO A 185 -14.079 4.174 -4.802 1.00 0.00 C ATOM 819 C PRO A 185 -14.530 3.476 -3.519 1.00 0.00 C ATOM 820 O PRO A 185 -14.292 3.974 -2.419 1.00 0.00 O ATOM 821 CB PRO A 185 -15.237 4.723 -5.618 1.00 0.00 C ATOM 822 CG PRO A 185 -15.442 3.744 -6.763 1.00 0.00 C ATOM 823 CD PRO A 185 -14.221 2.841 -6.829 1.00 0.00 C ATOM 0 HA PRO A 185 -13.430 4.981 -4.463 1.00 0.00 H new ATOM 0 HB2 PRO A 185 -16.138 4.807 -5.010 1.00 0.00 H new ATOM 0 HB3 PRO A 185 -15.012 5.721 -5.993 1.00 0.00 H new ATOM 0 HG2 PRO A 185 -16.345 3.154 -6.604 1.00 0.00 H new ATOM 0 HG3 PRO A 185 -15.572 4.279 -7.704 1.00 0.00 H new ATOM 0 HD2 PRO A 185 -14.502 1.790 -6.762 1.00 0.00 H new ATOM 0 HD3 PRO A 185 -13.684 2.968 -7.769 1.00 0.00 H new ATOM 831 N TYR A 186 -15.171 2.331 -3.700 1.00 0.00 N ATOM 832 CA TYR A 186 -15.658 1.559 -2.569 1.00 0.00 C ATOM 833 C TYR A 186 -14.500 1.101 -1.679 1.00 0.00 C ATOM 834 O TYR A 186 -14.659 0.971 -0.467 1.00 0.00 O ATOM 835 CB TYR A 186 -16.346 0.328 -3.164 1.00 0.00 C ATOM 836 CG TYR A 186 -17.850 0.263 -2.893 1.00 0.00 C ATOM 837 CD1 TYR A 186 -18.670 1.293 -3.305 1.00 0.00 C ATOM 838 CD2 TYR A 186 -18.386 -0.825 -2.235 1.00 0.00 C ATOM 839 CE1 TYR A 186 -20.086 1.233 -3.050 1.00 0.00 C ATOM 840 CE2 TYR A 186 -19.802 -0.886 -1.980 1.00 0.00 C ATOM 841 CZ TYR A 186 -20.582 0.146 -2.400 1.00 0.00 C ATOM 842 OH TYR A 186 -21.919 0.089 -2.158 1.00 0.00 O ATOM 0 H TYR A 186 -15.365 1.919 -4.613 1.00 0.00 H new ATOM 0 HA TYR A 186 -16.331 2.159 -1.956 1.00 0.00 H new ATOM 0 HB2 TYR A 186 -16.181 0.318 -4.241 1.00 0.00 H new ATOM 0 HB3 TYR A 186 -15.876 -0.569 -2.761 1.00 0.00 H new ATOM 0 HD1 TYR A 186 -18.250 2.145 -3.819 1.00 0.00 H new ATOM 0 HD2 TYR A 186 -17.744 -1.631 -1.911 1.00 0.00 H new ATOM 0 HE1 TYR A 186 -20.739 2.033 -3.367 1.00 0.00 H new ATOM 0 HE2 TYR A 186 -20.235 -1.732 -1.467 1.00 0.00 H new ATOM 0 HH TYR A 186 -22.184 -0.842 -2.005 1.00 0.00 H new ATOM 852 N VAL A 187 -13.362 0.869 -2.316 1.00 0.00 N ATOM 853 CA VAL A 187 -12.179 0.429 -1.597 1.00 0.00 C ATOM 854 C VAL A 187 -11.309 1.643 -1.263 1.00 0.00 C ATOM 855 O VAL A 187 -11.676 2.776 -1.569 1.00 0.00 O ATOM 856 CB VAL A 187 -11.436 -0.631 -2.412 1.00 0.00 C ATOM 857 CG1 VAL A 187 -12.381 -1.758 -2.836 1.00 0.00 C ATOM 858 CG2 VAL A 187 -10.747 -0.008 -3.627 1.00 0.00 C ATOM 0 H VAL A 187 -13.234 0.977 -3.322 1.00 0.00 H new ATOM 0 HA VAL A 187 -12.458 -0.041 -0.654 1.00 0.00 H new ATOM 0 HB VAL A 187 -10.664 -1.062 -1.775 1.00 0.00 H new ATOM 0 HG11 VAL A 187 -11.828 -2.498 -3.414 1.00 0.00 H new ATOM 0 HG12 VAL A 187 -12.804 -2.231 -1.950 1.00 0.00 H new ATOM 0 HG13 VAL A 187 -13.185 -1.348 -3.447 1.00 0.00 H new ATOM 0 HG21 VAL A 187 -10.227 -0.784 -4.188 1.00 0.00 H new ATOM 0 HG22 VAL A 187 -11.493 0.463 -4.266 1.00 0.00 H new ATOM 0 HG23 VAL A 187 -10.029 0.742 -3.294 1.00 0.00 H new ATOM 868 N GLU A 188 -10.174 1.364 -0.640 1.00 0.00 N ATOM 869 CA GLU A 188 -9.250 2.419 -0.260 1.00 0.00 C ATOM 870 C GLU A 188 -7.805 1.933 -0.396 1.00 0.00 C ATOM 871 O GLU A 188 -7.523 0.751 -0.204 1.00 0.00 O ATOM 872 CB GLU A 188 -9.532 2.911 1.160 1.00 0.00 C ATOM 873 CG GLU A 188 -9.244 1.815 2.188 1.00 0.00 C ATOM 874 CD GLU A 188 -9.527 2.307 3.608 1.00 0.00 C ATOM 875 OE1 GLU A 188 -9.214 3.489 3.872 1.00 0.00 O ATOM 876 OE2 GLU A 188 -10.047 1.491 4.398 1.00 0.00 O ATOM 0 H GLU A 188 -9.873 0.422 -0.389 1.00 0.00 H new ATOM 0 HA GLU A 188 -9.395 3.262 -0.935 1.00 0.00 H new ATOM 0 HB2 GLU A 188 -8.918 3.786 1.374 1.00 0.00 H new ATOM 0 HB3 GLU A 188 -10.573 3.225 1.240 1.00 0.00 H new ATOM 0 HG2 GLU A 188 -9.858 0.940 1.973 1.00 0.00 H new ATOM 0 HG3 GLU A 188 -8.203 1.502 2.109 1.00 0.00 H new ATOM 883 N LYS A 189 -6.928 2.870 -0.725 1.00 0.00 N ATOM 884 CA LYS A 189 -5.520 2.552 -0.888 1.00 0.00 C ATOM 885 C LYS A 189 -4.821 2.639 0.470 1.00 0.00 C ATOM 886 O LYS A 189 -4.569 3.733 0.974 1.00 0.00 O ATOM 887 CB LYS A 189 -4.890 3.441 -1.962 1.00 0.00 C ATOM 888 CG LYS A 189 -4.417 2.610 -3.156 1.00 0.00 C ATOM 889 CD LYS A 189 -4.822 3.267 -4.477 1.00 0.00 C ATOM 890 CE LYS A 189 -3.593 3.574 -5.335 1.00 0.00 C ATOM 891 NZ LYS A 189 -3.945 3.544 -6.773 1.00 0.00 N ATOM 0 H LYS A 189 -7.165 3.849 -0.883 1.00 0.00 H new ATOM 0 HA LYS A 189 -5.400 1.529 -1.244 1.00 0.00 H new ATOM 0 HB2 LYS A 189 -5.615 4.183 -2.296 1.00 0.00 H new ATOM 0 HB3 LYS A 189 -4.047 3.987 -1.538 1.00 0.00 H new ATOM 0 HG2 LYS A 189 -3.333 2.498 -3.119 1.00 0.00 H new ATOM 0 HG3 LYS A 189 -4.843 1.609 -3.098 1.00 0.00 H new ATOM 0 HD2 LYS A 189 -5.496 2.608 -5.024 1.00 0.00 H new ATOM 0 HD3 LYS A 189 -5.370 4.188 -4.277 1.00 0.00 H new ATOM 0 HE2 LYS A 189 -3.194 4.554 -5.072 1.00 0.00 H new ATOM 0 HE3 LYS A 189 -2.808 2.845 -5.131 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 -3.319 2.879 -7.270 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 -4.933 3.237 -6.882 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 -3.831 4.495 -7.178 1.00 0.00 H new ATOM 905 N TYR A 190 -4.527 1.472 1.025 1.00 0.00 N ATOM 906 CA TYR A 190 -3.863 1.404 2.315 1.00 0.00 C ATOM 907 C TYR A 190 -2.351 1.596 2.165 1.00 0.00 C ATOM 908 O TYR A 190 -1.777 1.246 1.135 1.00 0.00 O ATOM 909 CB TYR A 190 -4.135 -0.002 2.855 1.00 0.00 C ATOM 910 CG TYR A 190 -3.236 -0.403 4.026 1.00 0.00 C ATOM 911 CD1 TYR A 190 -3.531 0.030 5.303 1.00 0.00 C ATOM 912 CD2 TYR A 190 -2.130 -1.200 3.807 1.00 0.00 C ATOM 913 CE1 TYR A 190 -2.686 -0.347 6.405 1.00 0.00 C ATOM 914 CE2 TYR A 190 -1.284 -1.577 4.909 1.00 0.00 C ATOM 915 CZ TYR A 190 -1.604 -1.133 6.154 1.00 0.00 C ATOM 916 OH TYR A 190 -0.805 -1.490 7.195 1.00 0.00 O ATOM 0 H TYR A 190 -4.737 0.567 0.605 1.00 0.00 H new ATOM 0 HA TYR A 190 -4.232 2.186 2.978 1.00 0.00 H new ATOM 0 HB2 TYR A 190 -5.176 -0.063 3.172 1.00 0.00 H new ATOM 0 HB3 TYR A 190 -4.005 -0.722 2.047 1.00 0.00 H new ATOM 0 HD1 TYR A 190 -4.397 0.652 5.475 1.00 0.00 H new ATOM 0 HD2 TYR A 190 -1.899 -1.541 2.808 1.00 0.00 H new ATOM 0 HE1 TYR A 190 -2.906 -0.014 7.409 1.00 0.00 H new ATOM 0 HE2 TYR A 190 -0.415 -2.198 4.751 1.00 0.00 H new ATOM 0 HH TYR A 190 -0.072 -2.052 6.867 1.00 0.00 H new