USER MOD reduce.3.24.130724 H: found=0, std=0, add=399, rem=0, adj=7 USER MOD reduce.3.24.130724 removed 401 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 171 ASN : amide:sc= -0.158 K(o=-0.61,f=-2.5) USER MOD Set 1.2: A 181 MET CE :methyl 166:sc= -0.45 (180deg=-1.16) USER MOD Single : A 135 CYS SG : rot 180:sc= -0.999 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 168 GLN : amide:sc= -3.08! C(o=-3.1!,f=-3.4!) USER MOD Single : A 175 SER OG : rot 109:sc= 0.00163 USER MOD Single : A 178 LYS NZ :NH3+ 155:sc= -0.0475 (180deg=-0.498) USER MOD Single : A 186 TYR OH : rot 180:sc= 0 USER MOD Single : A 189 LYS NZ :NH3+ -158:sc= 0 (180deg=-0.367) USER MOD ----------------------------------------------------------------- ATOM 1 N CYS A 135 0.801 0.431 -0.921 1.00 0.00 N ATOM 2 CA CYS A 135 2.140 0.047 -1.332 1.00 0.00 C ATOM 3 C CYS A 135 2.055 -1.303 -2.047 1.00 0.00 C ATOM 4 O CYS A 135 2.883 -1.608 -2.904 1.00 0.00 O ATOM 5 CB CYS A 135 3.105 0.004 -0.145 1.00 0.00 C ATOM 6 SG CYS A 135 4.723 0.711 -0.629 1.00 0.00 S ATOM 0 HA CYS A 135 2.541 0.795 -2.016 1.00 0.00 H new ATOM 0 HB2 CYS A 135 2.690 0.564 0.693 1.00 0.00 H new ATOM 0 HB3 CYS A 135 3.234 -1.024 0.192 1.00 0.00 H new ATOM 0 HG CYS A 135 5.535 0.672 0.386 1.00 0.00 H new ATOM 12 N TYR A 136 1.046 -2.074 -1.669 1.00 0.00 N ATOM 13 CA TYR A 136 0.842 -3.384 -2.263 1.00 0.00 C ATOM 14 C TYR A 136 -0.649 -3.690 -2.415 1.00 0.00 C ATOM 15 O TYR A 136 -1.492 -2.969 -1.885 1.00 0.00 O ATOM 16 CB TYR A 136 1.461 -4.390 -1.290 1.00 0.00 C ATOM 17 CG TYR A 136 1.471 -3.921 0.166 1.00 0.00 C ATOM 18 CD1 TYR A 136 0.403 -4.207 0.991 1.00 0.00 C ATOM 19 CD2 TYR A 136 2.550 -3.211 0.655 1.00 0.00 C ATOM 20 CE1 TYR A 136 0.414 -3.766 2.362 1.00 0.00 C ATOM 21 CE2 TYR A 136 2.560 -2.770 2.026 1.00 0.00 C ATOM 22 CZ TYR A 136 1.492 -3.070 2.811 1.00 0.00 C ATOM 23 OH TYR A 136 1.501 -2.653 4.106 1.00 0.00 O ATOM 0 H TYR A 136 0.361 -1.816 -0.959 1.00 0.00 H new ATOM 0 HA TYR A 136 1.293 -3.430 -3.254 1.00 0.00 H new ATOM 0 HB2 TYR A 136 0.911 -5.329 -1.355 1.00 0.00 H new ATOM 0 HB3 TYR A 136 2.485 -4.598 -1.601 1.00 0.00 H new ATOM 0 HD1 TYR A 136 -0.441 -4.762 0.609 1.00 0.00 H new ATOM 0 HD2 TYR A 136 3.386 -2.987 0.009 1.00 0.00 H new ATOM 0 HE1 TYR A 136 -0.415 -3.983 3.019 1.00 0.00 H new ATOM 0 HE2 TYR A 136 3.397 -2.214 2.421 1.00 0.00 H new ATOM 0 HH TYR A 136 2.334 -2.169 4.288 1.00 0.00 H new ATOM 33 N VAL A 137 -0.929 -4.762 -3.142 1.00 0.00 N ATOM 34 CA VAL A 137 -2.304 -5.173 -3.371 1.00 0.00 C ATOM 35 C VAL A 137 -2.394 -6.699 -3.297 1.00 0.00 C ATOM 36 O VAL A 137 -1.383 -7.390 -3.405 1.00 0.00 O ATOM 37 CB VAL A 137 -2.804 -4.608 -4.703 1.00 0.00 C ATOM 38 CG1 VAL A 137 -2.753 -3.080 -4.703 1.00 0.00 C ATOM 39 CG2 VAL A 137 -2.009 -5.184 -5.876 1.00 0.00 C ATOM 0 H VAL A 137 -0.227 -5.358 -3.580 1.00 0.00 H new ATOM 0 HA VAL A 137 -2.957 -4.771 -2.597 1.00 0.00 H new ATOM 0 HB VAL A 137 -3.845 -4.908 -4.825 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -3.113 -2.704 -5.660 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -3.383 -2.695 -3.901 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -1.726 -2.750 -4.547 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -2.384 -4.766 -6.810 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -0.955 -4.929 -5.762 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -2.120 -6.268 -5.893 1.00 0.00 H new ATOM 49 N ARG A 138 -3.616 -7.178 -3.112 1.00 0.00 N ATOM 50 CA ARG A 138 -3.852 -8.609 -3.021 1.00 0.00 C ATOM 51 C ARG A 138 -4.774 -9.067 -4.154 1.00 0.00 C ATOM 52 O ARG A 138 -5.945 -8.693 -4.196 1.00 0.00 O ATOM 53 CB ARG A 138 -4.483 -8.980 -1.678 1.00 0.00 C ATOM 54 CG ARG A 138 -4.907 -10.450 -1.658 1.00 0.00 C ATOM 55 CD ARG A 138 -5.064 -10.955 -0.223 1.00 0.00 C ATOM 56 NE ARG A 138 -3.737 -11.067 0.422 1.00 0.00 N ATOM 57 CZ ARG A 138 -3.538 -11.009 1.747 1.00 0.00 C ATOM 58 NH1 ARG A 138 -4.580 -10.841 2.573 1.00 0.00 N ATOM 59 NH2 ARG A 138 -2.299 -11.118 2.244 1.00 0.00 N ATOM 0 H ARG A 138 -4.452 -6.601 -3.023 1.00 0.00 H new ATOM 0 HA ARG A 138 -2.888 -9.110 -3.106 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -3.772 -8.792 -0.874 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -5.349 -8.345 -1.492 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -5.849 -10.568 -2.194 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -4.165 -11.054 -2.181 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -5.697 -10.272 0.344 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -5.561 -11.925 -0.222 1.00 0.00 H new ATOM 0 HE ARG A 138 -2.923 -11.196 -0.179 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -5.523 -10.757 2.194 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -4.430 -10.797 3.581 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -1.506 -11.245 1.615 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -2.148 -11.074 3.252 1.00 0.00 H new ATOM 73 N ALA A 139 -4.211 -9.873 -5.043 1.00 0.00 N ATOM 74 CA ALA A 139 -4.967 -10.386 -6.172 1.00 0.00 C ATOM 75 C ALA A 139 -5.776 -11.606 -5.726 1.00 0.00 C ATOM 76 O ALA A 139 -5.207 -12.650 -5.410 1.00 0.00 O ATOM 77 CB ALA A 139 -4.012 -10.708 -7.323 1.00 0.00 C ATOM 0 H ALA A 139 -3.240 -10.183 -5.004 1.00 0.00 H new ATOM 0 HA ALA A 139 -5.672 -9.637 -6.534 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -4.580 -11.093 -8.170 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -3.484 -9.803 -7.622 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -3.291 -11.458 -6.998 1.00 0.00 H new ATOM 83 N LEU A 140 -7.089 -11.434 -5.716 1.00 0.00 N ATOM 84 CA LEU A 140 -7.981 -12.509 -5.313 1.00 0.00 C ATOM 85 C LEU A 140 -8.314 -13.371 -6.532 1.00 0.00 C ATOM 86 O LEU A 140 -9.318 -14.082 -6.538 1.00 0.00 O ATOM 87 CB LEU A 140 -9.214 -11.945 -4.604 1.00 0.00 C ATOM 88 CG LEU A 140 -9.683 -10.565 -5.070 1.00 0.00 C ATOM 89 CD1 LEU A 140 -8.835 -9.457 -4.443 1.00 0.00 C ATOM 90 CD2 LEU A 140 -9.700 -10.478 -6.598 1.00 0.00 C ATOM 0 H LEU A 140 -7.557 -10.567 -5.980 1.00 0.00 H new ATOM 0 HA LEU A 140 -7.493 -13.158 -4.586 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -10.036 -12.649 -4.733 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -9.003 -11.893 -3.536 1.00 0.00 H new ATOM 0 HG LEU A 140 -10.708 -10.420 -4.728 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -9.189 -8.487 -4.791 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -8.918 -9.506 -3.357 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -7.793 -9.588 -4.734 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -10.037 -9.487 -6.902 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -8.696 -10.654 -6.984 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -10.379 -11.231 -6.998 1.00 0.00 H new ATOM 102 N PHE A 141 -7.453 -13.281 -7.535 1.00 0.00 N ATOM 103 CA PHE A 141 -7.643 -14.045 -8.757 1.00 0.00 C ATOM 104 C PHE A 141 -6.299 -14.435 -9.374 1.00 0.00 C ATOM 105 O PHE A 141 -5.263 -13.874 -9.020 1.00 0.00 O ATOM 106 CB PHE A 141 -8.397 -13.142 -9.735 1.00 0.00 C ATOM 107 CG PHE A 141 -9.676 -13.766 -10.297 1.00 0.00 C ATOM 108 CD1 PHE A 141 -10.821 -13.748 -9.563 1.00 0.00 C ATOM 109 CD2 PHE A 141 -9.669 -14.338 -11.531 1.00 0.00 C ATOM 110 CE1 PHE A 141 -12.008 -14.327 -10.085 1.00 0.00 C ATOM 111 CE2 PHE A 141 -10.856 -14.917 -12.052 1.00 0.00 C ATOM 112 CZ PHE A 141 -12.000 -14.899 -11.318 1.00 0.00 C ATOM 0 H PHE A 141 -6.621 -12.690 -7.527 1.00 0.00 H new ATOM 0 HA PHE A 141 -8.193 -14.961 -8.542 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -8.651 -12.209 -9.231 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -7.735 -12.887 -10.563 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -10.827 -13.293 -8.583 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -8.760 -14.352 -12.115 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -12.917 -14.313 -9.502 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -10.850 -15.372 -13.032 1.00 0.00 H new ATOM 0 HZ PHE A 141 -12.903 -15.339 -11.715 1.00 0.00 H new ATOM 122 N ASP A 142 -6.360 -15.395 -10.286 1.00 0.00 N ATOM 123 CA ASP A 142 -5.160 -15.867 -10.956 1.00 0.00 C ATOM 124 C ASP A 142 -5.099 -15.271 -12.364 1.00 0.00 C ATOM 125 O ASP A 142 -6.124 -14.889 -12.925 1.00 0.00 O ATOM 126 CB ASP A 142 -5.165 -17.391 -11.087 1.00 0.00 C ATOM 127 CG ASP A 142 -4.404 -17.939 -12.295 1.00 0.00 C ATOM 128 OD1 ASP A 142 -4.972 -17.863 -13.407 1.00 0.00 O ATOM 129 OD2 ASP A 142 -3.271 -18.422 -12.081 1.00 0.00 O ATOM 0 H ASP A 142 -7.221 -15.858 -10.576 1.00 0.00 H new ATOM 0 HA ASP A 142 -4.299 -15.559 -10.362 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -4.736 -17.820 -10.181 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -6.199 -17.732 -11.142 1.00 0.00 H new ATOM 134 N PHE A 143 -3.886 -15.212 -12.894 1.00 0.00 N ATOM 135 CA PHE A 143 -3.678 -14.668 -14.226 1.00 0.00 C ATOM 136 C PHE A 143 -2.206 -14.766 -14.634 1.00 0.00 C ATOM 137 O PHE A 143 -1.316 -14.526 -13.819 1.00 0.00 O ATOM 138 CB PHE A 143 -4.086 -13.194 -14.177 1.00 0.00 C ATOM 139 CG PHE A 143 -4.384 -12.586 -15.549 1.00 0.00 C ATOM 140 CD1 PHE A 143 -5.536 -12.904 -16.198 1.00 0.00 C ATOM 141 CD2 PHE A 143 -3.497 -11.727 -16.119 1.00 0.00 C ATOM 142 CE1 PHE A 143 -5.813 -12.339 -17.471 1.00 0.00 C ATOM 143 CE2 PHE A 143 -3.774 -11.162 -17.392 1.00 0.00 C ATOM 144 CZ PHE A 143 -4.926 -11.480 -18.041 1.00 0.00 C ATOM 0 H PHE A 143 -3.038 -15.531 -12.426 1.00 0.00 H new ATOM 0 HA PHE A 143 -4.267 -15.228 -14.953 1.00 0.00 H new ATOM 0 HB2 PHE A 143 -4.969 -13.093 -13.546 1.00 0.00 H new ATOM 0 HB3 PHE A 143 -3.288 -12.622 -13.703 1.00 0.00 H new ATOM 0 HD1 PHE A 143 -6.240 -13.586 -15.745 1.00 0.00 H new ATOM 0 HD2 PHE A 143 -2.582 -11.475 -15.604 1.00 0.00 H new ATOM 0 HE1 PHE A 143 -6.728 -12.591 -17.986 1.00 0.00 H new ATOM 0 HE2 PHE A 143 -3.070 -10.480 -17.845 1.00 0.00 H new ATOM 0 HZ PHE A 143 -5.137 -11.050 -19.009 1.00 0.00 H new ATOM 243 N LEU A 151 1.333 -8.482 -15.860 1.00 0.00 N ATOM 244 CA LEU A 151 2.016 -9.111 -14.743 1.00 0.00 C ATOM 245 C LEU A 151 1.241 -10.357 -14.313 1.00 0.00 C ATOM 246 O LEU A 151 0.085 -10.263 -13.903 1.00 0.00 O ATOM 247 CB LEU A 151 2.236 -8.102 -13.613 1.00 0.00 C ATOM 248 CG LEU A 151 3.338 -8.449 -12.610 1.00 0.00 C ATOM 249 CD1 LEU A 151 4.703 -8.520 -13.297 1.00 0.00 C ATOM 250 CD2 LEU A 151 3.339 -7.468 -11.436 1.00 0.00 C ATOM 0 HA LEU A 151 3.011 -9.442 -15.042 1.00 0.00 H new ATOM 0 HB2 LEU A 151 2.468 -7.134 -14.057 1.00 0.00 H new ATOM 0 HB3 LEU A 151 1.299 -7.987 -13.068 1.00 0.00 H new ATOM 0 HG LEU A 151 3.130 -9.439 -12.204 1.00 0.00 H new ATOM 0 HD11 LEU A 151 5.468 -8.768 -12.561 1.00 0.00 H new ATOM 0 HD12 LEU A 151 4.681 -9.287 -14.071 1.00 0.00 H new ATOM 0 HD13 LEU A 151 4.934 -7.555 -13.749 1.00 0.00 H new ATOM 0 HD21 LEU A 151 4.132 -7.737 -10.738 1.00 0.00 H new ATOM 0 HD22 LEU A 151 3.509 -6.457 -11.807 1.00 0.00 H new ATOM 0 HD23 LEU A 151 2.377 -7.510 -10.926 1.00 0.00 H new ATOM 262 N PRO A 152 1.926 -11.527 -14.424 1.00 0.00 N ATOM 263 CA PRO A 152 1.314 -12.791 -14.052 1.00 0.00 C ATOM 264 C PRO A 152 1.242 -12.938 -12.530 1.00 0.00 C ATOM 265 O PRO A 152 2.131 -12.478 -11.816 1.00 0.00 O ATOM 266 CB PRO A 152 2.176 -13.855 -14.711 1.00 0.00 C ATOM 267 CG PRO A 152 3.497 -13.178 -15.038 1.00 0.00 C ATOM 268 CD PRO A 152 3.296 -11.677 -14.906 1.00 0.00 C ATOM 0 HA PRO A 152 0.280 -12.872 -14.387 1.00 0.00 H new ATOM 0 HB2 PRO A 152 2.327 -14.704 -14.044 1.00 0.00 H new ATOM 0 HB3 PRO A 152 1.700 -14.239 -15.613 1.00 0.00 H new ATOM 0 HG2 PRO A 152 4.279 -13.520 -14.360 1.00 0.00 H new ATOM 0 HG3 PRO A 152 3.817 -13.433 -16.048 1.00 0.00 H new ATOM 0 HD2 PRO A 152 4.011 -11.242 -14.208 1.00 0.00 H new ATOM 0 HD3 PRO A 152 3.437 -11.173 -15.862 1.00 0.00 H new ATOM 276 N PHE A 153 0.175 -13.581 -12.080 1.00 0.00 N ATOM 277 CA PHE A 153 -0.025 -13.794 -10.657 1.00 0.00 C ATOM 278 C PHE A 153 -0.960 -14.979 -10.406 1.00 0.00 C ATOM 279 O PHE A 153 -1.401 -15.636 -11.347 1.00 0.00 O ATOM 280 CB PHE A 153 -0.671 -12.523 -10.100 1.00 0.00 C ATOM 281 CG PHE A 153 -1.992 -12.151 -10.774 1.00 0.00 C ATOM 282 CD1 PHE A 153 -3.085 -12.945 -10.615 1.00 0.00 C ATOM 283 CD2 PHE A 153 -2.076 -11.024 -11.531 1.00 0.00 C ATOM 284 CE1 PHE A 153 -4.312 -12.599 -11.240 1.00 0.00 C ATOM 285 CE2 PHE A 153 -3.303 -10.677 -12.157 1.00 0.00 C ATOM 286 CZ PHE A 153 -4.395 -11.473 -11.998 1.00 0.00 C ATOM 0 H PHE A 153 -0.560 -13.962 -12.676 1.00 0.00 H new ATOM 0 HA PHE A 153 0.929 -14.010 -10.176 1.00 0.00 H new ATOM 0 HB2 PHE A 153 -0.844 -12.654 -9.032 1.00 0.00 H new ATOM 0 HB3 PHE A 153 0.028 -11.694 -10.211 1.00 0.00 H new ATOM 0 HD1 PHE A 153 -3.019 -13.839 -10.013 1.00 0.00 H new ATOM 0 HD2 PHE A 153 -1.209 -10.392 -11.656 1.00 0.00 H new ATOM 0 HE1 PHE A 153 -5.179 -13.230 -11.113 1.00 0.00 H new ATOM 0 HE2 PHE A 153 -3.369 -9.782 -12.758 1.00 0.00 H new ATOM 0 HZ PHE A 153 -5.328 -11.210 -12.474 1.00 0.00 H new ATOM 296 N LYS A 154 -1.236 -15.214 -9.131 1.00 0.00 N ATOM 297 CA LYS A 154 -2.111 -16.308 -8.745 1.00 0.00 C ATOM 298 C LYS A 154 -3.080 -15.823 -7.664 1.00 0.00 C ATOM 299 O LYS A 154 -2.693 -15.072 -6.770 1.00 0.00 O ATOM 300 CB LYS A 154 -1.289 -17.531 -8.330 1.00 0.00 C ATOM 301 CG LYS A 154 -1.935 -18.248 -7.144 1.00 0.00 C ATOM 302 CD LYS A 154 -1.059 -19.407 -6.661 1.00 0.00 C ATOM 303 CE LYS A 154 -1.917 -20.577 -6.174 1.00 0.00 C ATOM 304 NZ LYS A 154 -1.614 -20.888 -4.759 1.00 0.00 N ATOM 0 H LYS A 154 -0.869 -14.666 -8.353 1.00 0.00 H new ATOM 0 HA LYS A 154 -2.714 -16.631 -9.593 1.00 0.00 H new ATOM 0 HB2 LYS A 154 -1.202 -18.218 -9.172 1.00 0.00 H new ATOM 0 HB3 LYS A 154 -0.278 -17.221 -8.066 1.00 0.00 H new ATOM 0 HG2 LYS A 154 -2.092 -17.542 -6.329 1.00 0.00 H new ATOM 0 HG3 LYS A 154 -2.916 -18.625 -7.433 1.00 0.00 H new ATOM 0 HD2 LYS A 154 -0.410 -19.740 -7.471 1.00 0.00 H new ATOM 0 HD3 LYS A 154 -0.411 -19.066 -5.854 1.00 0.00 H new ATOM 0 HE2 LYS A 154 -2.973 -20.330 -6.280 1.00 0.00 H new ATOM 0 HE3 LYS A 154 -1.731 -21.455 -6.793 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 -2.205 -21.684 -4.444 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 -0.610 -21.144 -4.667 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 -1.814 -20.055 -4.170 1.00 0.00 H new ATOM 318 N LYS A 155 -4.321 -16.272 -7.782 1.00 0.00 N ATOM 319 CA LYS A 155 -5.347 -15.894 -6.827 1.00 0.00 C ATOM 320 C LYS A 155 -4.775 -15.974 -5.410 1.00 0.00 C ATOM 321 O LYS A 155 -4.160 -16.974 -5.041 1.00 0.00 O ATOM 322 CB LYS A 155 -6.606 -16.739 -7.030 1.00 0.00 C ATOM 323 CG LYS A 155 -7.712 -16.318 -6.060 1.00 0.00 C ATOM 324 CD LYS A 155 -7.985 -17.415 -5.029 1.00 0.00 C ATOM 325 CE LYS A 155 -7.192 -17.169 -3.744 1.00 0.00 C ATOM 326 NZ LYS A 155 -7.595 -18.132 -2.694 1.00 0.00 N ATOM 0 H LYS A 155 -4.639 -16.894 -8.525 1.00 0.00 H new ATOM 0 HA LYS A 155 -5.655 -14.861 -6.989 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -6.958 -16.633 -8.056 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -6.369 -17.793 -6.882 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -7.423 -15.399 -5.550 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -8.624 -16.101 -6.615 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -9.051 -17.449 -4.802 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -7.717 -18.386 -5.446 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -6.125 -17.265 -3.944 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -7.360 -16.150 -3.395 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -7.047 -17.951 -1.829 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -8.609 -18.021 -2.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -7.412 -19.101 -3.023 1.00 0.00 H new ATOM 340 N GLY A 156 -4.997 -14.908 -4.656 1.00 0.00 N ATOM 341 CA GLY A 156 -4.510 -14.845 -3.288 1.00 0.00 C ATOM 342 C GLY A 156 -3.019 -14.504 -3.251 1.00 0.00 C ATOM 343 O GLY A 156 -2.272 -15.057 -2.446 1.00 0.00 O ATOM 0 H GLY A 156 -5.507 -14.081 -4.966 1.00 0.00 H new ATOM 0 HA2 GLY A 156 -5.072 -14.094 -2.733 1.00 0.00 H new ATOM 0 HA3 GLY A 156 -4.680 -15.801 -2.793 1.00 0.00 H new ATOM 347 N ASP A 157 -2.630 -13.595 -4.134 1.00 0.00 N ATOM 348 CA ASP A 157 -1.242 -13.174 -4.213 1.00 0.00 C ATOM 349 C ASP A 157 -1.145 -11.685 -3.872 1.00 0.00 C ATOM 350 O ASP A 157 -2.154 -10.984 -3.848 1.00 0.00 O ATOM 351 CB ASP A 157 -0.685 -13.374 -5.624 1.00 0.00 C ATOM 352 CG ASP A 157 0.766 -12.929 -5.816 1.00 0.00 C ATOM 353 OD1 ASP A 157 1.657 -13.723 -5.445 1.00 0.00 O ATOM 354 OD2 ASP A 157 0.952 -11.805 -6.328 1.00 0.00 O ATOM 0 H ASP A 157 -3.253 -13.139 -4.801 1.00 0.00 H new ATOM 0 HA ASP A 157 -0.666 -13.776 -3.510 1.00 0.00 H new ATOM 0 HB2 ASP A 157 -0.762 -14.430 -5.882 1.00 0.00 H new ATOM 0 HB3 ASP A 157 -1.313 -12.827 -6.327 1.00 0.00 H new ATOM 359 N ILE A 158 0.080 -11.248 -3.618 1.00 0.00 N ATOM 360 CA ILE A 158 0.322 -9.857 -3.280 1.00 0.00 C ATOM 361 C ILE A 158 1.206 -9.221 -4.355 1.00 0.00 C ATOM 362 O ILE A 158 2.051 -9.893 -4.946 1.00 0.00 O ATOM 363 CB ILE A 158 0.895 -9.740 -1.866 1.00 0.00 C ATOM 364 CG1 ILE A 158 -0.153 -10.121 -0.818 1.00 0.00 C ATOM 365 CG2 ILE A 158 1.470 -8.344 -1.619 1.00 0.00 C ATOM 366 CD1 ILE A 158 -1.159 -8.988 -0.610 1.00 0.00 C ATOM 0 H ILE A 158 0.915 -11.833 -3.640 1.00 0.00 H new ATOM 0 HA ILE A 158 -0.615 -9.301 -3.267 1.00 0.00 H new ATOM 0 HB ILE A 158 1.719 -10.448 -1.772 1.00 0.00 H new ATOM 0 HG12 ILE A 158 -0.677 -11.023 -1.134 1.00 0.00 H new ATOM 0 HG13 ILE A 158 0.340 -10.352 0.126 1.00 0.00 H new ATOM 0 HG21 ILE A 158 1.870 -8.289 -0.607 1.00 0.00 H new ATOM 0 HG22 ILE A 158 2.267 -8.147 -2.336 1.00 0.00 H new ATOM 0 HG23 ILE A 158 0.683 -7.600 -1.739 1.00 0.00 H new ATOM 0 HD11 ILE A 158 -1.892 -9.286 0.140 1.00 0.00 H new ATOM 0 HD12 ILE A 158 -0.635 -8.094 -0.271 1.00 0.00 H new ATOM 0 HD13 ILE A 158 -1.667 -8.776 -1.550 1.00 0.00 H new ATOM 378 N LEU A 159 0.983 -7.935 -4.577 1.00 0.00 N ATOM 379 CA LEU A 159 1.749 -7.201 -5.570 1.00 0.00 C ATOM 380 C LEU A 159 2.035 -5.792 -5.049 1.00 0.00 C ATOM 381 O LEU A 159 1.162 -5.153 -4.464 1.00 0.00 O ATOM 382 CB LEU A 159 1.032 -7.224 -6.922 1.00 0.00 C ATOM 383 CG LEU A 159 0.395 -8.556 -7.322 1.00 0.00 C ATOM 384 CD1 LEU A 159 -0.894 -8.331 -8.115 1.00 0.00 C ATOM 385 CD2 LEU A 159 1.391 -9.433 -8.082 1.00 0.00 C ATOM 0 H LEU A 159 0.282 -7.381 -4.086 1.00 0.00 H new ATOM 0 HA LEU A 159 2.714 -7.680 -5.738 1.00 0.00 H new ATOM 0 HB2 LEU A 159 0.254 -6.461 -6.911 1.00 0.00 H new ATOM 0 HB3 LEU A 159 1.746 -6.939 -7.694 1.00 0.00 H new ATOM 0 HG LEU A 159 0.123 -9.092 -6.413 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -1.327 -9.294 -8.387 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -1.604 -7.774 -7.504 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -0.671 -7.765 -9.019 1.00 0.00 H new ATOM 0 HD21 LEU A 159 0.913 -10.374 -8.355 1.00 0.00 H new ATOM 0 HD22 LEU A 159 1.716 -8.916 -8.985 1.00 0.00 H new ATOM 0 HD23 LEU A 159 2.255 -9.635 -7.449 1.00 0.00 H new ATOM 397 N ARG A 160 3.262 -5.348 -5.280 1.00 0.00 N ATOM 398 CA ARG A 160 3.675 -4.026 -4.842 1.00 0.00 C ATOM 399 C ARG A 160 3.334 -2.982 -5.907 1.00 0.00 C ATOM 400 O ARG A 160 4.035 -2.863 -6.911 1.00 0.00 O ATOM 401 CB ARG A 160 5.177 -3.984 -4.558 1.00 0.00 C ATOM 402 CG ARG A 160 5.489 -3.048 -3.388 1.00 0.00 C ATOM 403 CD ARG A 160 6.898 -3.298 -2.847 1.00 0.00 C ATOM 404 NE ARG A 160 6.828 -3.710 -1.427 1.00 0.00 N ATOM 405 CZ ARG A 160 6.783 -2.854 -0.397 1.00 0.00 C ATOM 406 NH1 ARG A 160 6.799 -1.533 -0.623 1.00 0.00 N ATOM 407 NH2 ARG A 160 6.721 -3.317 0.858 1.00 0.00 N ATOM 0 H ARG A 160 3.984 -5.881 -5.765 1.00 0.00 H new ATOM 0 HA ARG A 160 3.137 -3.799 -3.922 1.00 0.00 H new ATOM 0 HB2 ARG A 160 5.536 -4.988 -4.331 1.00 0.00 H new ATOM 0 HB3 ARG A 160 5.710 -3.649 -5.448 1.00 0.00 H new ATOM 0 HG2 ARG A 160 5.399 -2.011 -3.713 1.00 0.00 H new ATOM 0 HG3 ARG A 160 4.758 -3.198 -2.593 1.00 0.00 H new ATOM 0 HD2 ARG A 160 7.390 -4.072 -3.435 1.00 0.00 H new ATOM 0 HD3 ARG A 160 7.499 -2.394 -2.943 1.00 0.00 H new ATOM 0 HE ARG A 160 6.813 -4.709 -1.219 1.00 0.00 H new ATOM 0 HH11 ARG A 160 6.845 -1.180 -1.579 1.00 0.00 H new ATOM 0 HH12 ARG A 160 6.765 -0.881 0.161 1.00 0.00 H new ATOM 0 HH21 ARG A 160 6.708 -4.322 1.031 1.00 0.00 H new ATOM 0 HH22 ARG A 160 6.687 -2.664 1.641 1.00 0.00 H new ATOM 421 N ILE A 161 2.257 -2.253 -5.653 1.00 0.00 N ATOM 422 CA ILE A 161 1.815 -1.224 -6.578 1.00 0.00 C ATOM 423 C ILE A 161 2.576 0.072 -6.293 1.00 0.00 C ATOM 424 O ILE A 161 2.544 0.582 -5.174 1.00 0.00 O ATOM 425 CB ILE A 161 0.294 -1.070 -6.522 1.00 0.00 C ATOM 426 CG1 ILE A 161 -0.275 -0.733 -7.901 1.00 0.00 C ATOM 427 CG2 ILE A 161 -0.113 -0.039 -5.466 1.00 0.00 C ATOM 428 CD1 ILE A 161 -0.972 -1.948 -8.518 1.00 0.00 C ATOM 0 H ILE A 161 1.678 -2.355 -4.820 1.00 0.00 H new ATOM 0 HA ILE A 161 2.045 -1.510 -7.604 1.00 0.00 H new ATOM 0 HB ILE A 161 -0.136 -2.026 -6.222 1.00 0.00 H new ATOM 0 HG12 ILE A 161 -0.982 0.092 -7.815 1.00 0.00 H new ATOM 0 HG13 ILE A 161 0.528 -0.397 -8.558 1.00 0.00 H new ATOM 0 HG21 ILE A 161 -1.199 0.052 -5.446 1.00 0.00 H new ATOM 0 HG22 ILE A 161 0.242 -0.361 -4.487 1.00 0.00 H new ATOM 0 HG23 ILE A 161 0.328 0.927 -5.712 1.00 0.00 H new ATOM 0 HD11 ILE A 161 -1.368 -1.682 -9.498 1.00 0.00 H new ATOM 0 HD12 ILE A 161 -0.256 -2.763 -8.625 1.00 0.00 H new ATOM 0 HD13 ILE A 161 -1.789 -2.266 -7.871 1.00 0.00 H new ATOM 440 N ARG A 162 3.242 0.569 -7.326 1.00 0.00 N ATOM 441 CA ARG A 162 4.010 1.796 -7.200 1.00 0.00 C ATOM 442 C ARG A 162 3.527 2.831 -8.219 1.00 0.00 C ATOM 443 O ARG A 162 3.720 4.031 -8.030 1.00 0.00 O ATOM 444 CB ARG A 162 5.501 1.537 -7.415 1.00 0.00 C ATOM 445 CG ARG A 162 6.333 2.757 -7.015 1.00 0.00 C ATOM 446 CD ARG A 162 7.682 2.764 -7.739 1.00 0.00 C ATOM 447 NE ARG A 162 7.883 4.059 -8.425 1.00 0.00 N ATOM 448 CZ ARG A 162 8.869 4.301 -9.300 1.00 0.00 C ATOM 449 NH1 ARG A 162 9.749 3.337 -9.600 1.00 0.00 N ATOM 450 NH2 ARG A 162 8.974 5.507 -9.873 1.00 0.00 N ATOM 0 H ARG A 162 3.265 0.144 -8.253 1.00 0.00 H new ATOM 0 HA ARG A 162 3.861 2.178 -6.190 1.00 0.00 H new ATOM 0 HB2 ARG A 162 5.812 0.672 -6.829 1.00 0.00 H new ATOM 0 HB3 ARG A 162 5.684 1.295 -8.462 1.00 0.00 H new ATOM 0 HG2 ARG A 162 5.785 3.669 -7.252 1.00 0.00 H new ATOM 0 HG3 ARG A 162 6.495 2.753 -5.937 1.00 0.00 H new ATOM 0 HD2 ARG A 162 8.488 2.593 -7.025 1.00 0.00 H new ATOM 0 HD3 ARG A 162 7.719 1.950 -8.463 1.00 0.00 H new ATOM 0 HE ARG A 162 7.230 4.815 -8.219 1.00 0.00 H new ATOM 0 HH11 ARG A 162 9.669 2.419 -9.163 1.00 0.00 H new ATOM 0 HH12 ARG A 162 10.499 3.521 -10.266 1.00 0.00 H new ATOM 0 HH21 ARG A 162 8.304 6.241 -9.643 1.00 0.00 H new ATOM 0 HH22 ARG A 162 9.724 5.692 -10.539 1.00 0.00 H new ATOM 464 N ASP A 163 2.907 2.328 -9.277 1.00 0.00 N ATOM 465 CA ASP A 163 2.395 3.194 -10.326 1.00 0.00 C ATOM 466 C ASP A 163 0.950 2.803 -10.643 1.00 0.00 C ATOM 467 O ASP A 163 0.561 1.651 -10.461 1.00 0.00 O ATOM 468 CB ASP A 163 3.217 3.050 -11.608 1.00 0.00 C ATOM 469 CG ASP A 163 4.249 4.155 -11.843 1.00 0.00 C ATOM 470 OD1 ASP A 163 5.111 4.323 -10.954 1.00 0.00 O ATOM 471 OD2 ASP A 163 4.151 4.807 -12.905 1.00 0.00 O ATOM 0 H ASP A 163 2.748 1.332 -9.430 1.00 0.00 H new ATOM 0 HA ASP A 163 2.455 4.224 -9.974 1.00 0.00 H new ATOM 0 HB2 ASP A 163 3.734 2.090 -11.584 1.00 0.00 H new ATOM 0 HB3 ASP A 163 2.535 3.024 -12.458 1.00 0.00 H new ATOM 476 N LYS A 164 0.195 3.785 -11.114 1.00 0.00 N ATOM 477 CA LYS A 164 -1.198 3.558 -11.458 1.00 0.00 C ATOM 478 C LYS A 164 -1.671 4.663 -12.405 1.00 0.00 C ATOM 479 O LYS A 164 -2.522 5.474 -12.045 1.00 0.00 O ATOM 480 CB LYS A 164 -2.049 3.428 -10.193 1.00 0.00 C ATOM 481 CG LYS A 164 -1.849 4.633 -9.272 1.00 0.00 C ATOM 482 CD LYS A 164 -1.775 4.197 -7.807 1.00 0.00 C ATOM 483 CE LYS A 164 -1.446 5.383 -6.898 1.00 0.00 C ATOM 484 NZ LYS A 164 -2.663 6.176 -6.617 1.00 0.00 N ATOM 0 H LYS A 164 0.522 4.739 -11.265 1.00 0.00 H new ATOM 0 HA LYS A 164 -1.310 2.612 -11.988 1.00 0.00 H new ATOM 0 HB2 LYS A 164 -3.101 3.344 -10.465 1.00 0.00 H new ATOM 0 HB3 LYS A 164 -1.783 2.513 -9.664 1.00 0.00 H new ATOM 0 HG2 LYS A 164 -0.933 5.157 -9.546 1.00 0.00 H new ATOM 0 HG3 LYS A 164 -2.671 5.337 -9.405 1.00 0.00 H new ATOM 0 HD2 LYS A 164 -2.726 3.757 -7.506 1.00 0.00 H new ATOM 0 HD3 LYS A 164 -1.015 3.424 -7.692 1.00 0.00 H new ATOM 0 HE2 LYS A 164 -1.016 5.024 -5.963 1.00 0.00 H new ATOM 0 HE3 LYS A 164 -0.695 6.015 -7.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 -2.421 6.976 -5.999 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 -3.057 6.535 -7.510 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 -3.368 5.575 -6.144 1.00 0.00 H new ATOM 498 N PRO A 165 -1.083 4.658 -13.632 1.00 0.00 N ATOM 499 CA PRO A 165 -1.434 5.650 -14.634 1.00 0.00 C ATOM 500 C PRO A 165 -2.802 5.345 -15.250 1.00 0.00 C ATOM 501 O PRO A 165 -3.236 6.031 -16.175 1.00 0.00 O ATOM 502 CB PRO A 165 -0.303 5.603 -15.648 1.00 0.00 C ATOM 503 CG PRO A 165 0.401 4.274 -15.426 1.00 0.00 C ATOM 504 CD PRO A 165 -0.071 3.713 -14.095 1.00 0.00 C ATOM 0 HA PRO A 165 -1.535 6.652 -14.217 1.00 0.00 H new ATOM 0 HB2 PRO A 165 -0.687 5.676 -16.665 1.00 0.00 H new ATOM 0 HB3 PRO A 165 0.384 6.437 -15.506 1.00 0.00 H new ATOM 0 HG2 PRO A 165 0.172 3.581 -16.235 1.00 0.00 H new ATOM 0 HG3 PRO A 165 1.482 4.411 -15.421 1.00 0.00 H new ATOM 0 HD2 PRO A 165 -0.488 2.713 -14.212 1.00 0.00 H new ATOM 0 HD3 PRO A 165 0.752 3.634 -13.384 1.00 0.00 H new ATOM 512 N GLU A 166 -3.441 4.317 -14.713 1.00 0.00 N ATOM 513 CA GLU A 166 -4.750 3.913 -15.199 1.00 0.00 C ATOM 514 C GLU A 166 -5.740 3.816 -14.037 1.00 0.00 C ATOM 515 O GLU A 166 -5.371 4.029 -12.882 1.00 0.00 O ATOM 516 CB GLU A 166 -4.668 2.589 -15.960 1.00 0.00 C ATOM 517 CG GLU A 166 -3.534 2.617 -16.989 1.00 0.00 C ATOM 518 CD GLU A 166 -3.829 1.673 -18.155 1.00 0.00 C ATOM 519 OE1 GLU A 166 -4.830 1.934 -18.858 1.00 0.00 O ATOM 520 OE2 GLU A 166 -3.047 0.712 -18.320 1.00 0.00 O ATOM 0 H GLU A 166 -3.077 3.751 -13.946 1.00 0.00 H new ATOM 0 HA GLU A 166 -5.108 4.672 -15.894 1.00 0.00 H new ATOM 0 HB2 GLU A 166 -4.507 1.771 -15.258 1.00 0.00 H new ATOM 0 HB3 GLU A 166 -5.615 2.395 -16.463 1.00 0.00 H new ATOM 0 HG2 GLU A 166 -3.402 3.632 -17.363 1.00 0.00 H new ATOM 0 HG3 GLU A 166 -2.597 2.329 -16.511 1.00 0.00 H new ATOM 527 N GLU A 167 -6.978 3.495 -14.381 1.00 0.00 N ATOM 528 CA GLU A 167 -8.025 3.367 -13.381 1.00 0.00 C ATOM 529 C GLU A 167 -8.477 1.909 -13.269 1.00 0.00 C ATOM 530 O GLU A 167 -9.649 1.638 -13.011 1.00 0.00 O ATOM 531 CB GLU A 167 -9.207 4.285 -13.703 1.00 0.00 C ATOM 532 CG GLU A 167 -9.891 3.861 -15.004 1.00 0.00 C ATOM 533 CD GLU A 167 -11.293 4.464 -15.107 1.00 0.00 C ATOM 534 OE1 GLU A 167 -11.385 5.706 -15.011 1.00 0.00 O ATOM 535 OE2 GLU A 167 -12.242 3.669 -15.279 1.00 0.00 O ATOM 0 H GLU A 167 -7.280 3.319 -15.339 1.00 0.00 H new ATOM 0 HA GLU A 167 -7.620 3.676 -12.418 1.00 0.00 H new ATOM 0 HB2 GLU A 167 -9.926 4.259 -12.884 1.00 0.00 H new ATOM 0 HB3 GLU A 167 -8.860 5.315 -13.789 1.00 0.00 H new ATOM 0 HG2 GLU A 167 -9.290 4.180 -15.856 1.00 0.00 H new ATOM 0 HG3 GLU A 167 -9.955 2.774 -15.048 1.00 0.00 H new ATOM 542 N GLN A 168 -7.525 1.010 -13.468 1.00 0.00 N ATOM 543 CA GLN A 168 -7.810 -0.412 -13.392 1.00 0.00 C ATOM 544 C GLN A 168 -6.522 -1.221 -13.554 1.00 0.00 C ATOM 545 O GLN A 168 -6.341 -2.243 -12.892 1.00 0.00 O ATOM 546 CB GLN A 168 -8.848 -0.819 -14.440 1.00 0.00 C ATOM 547 CG GLN A 168 -10.266 -0.720 -13.875 1.00 0.00 C ATOM 548 CD GLN A 168 -11.101 -1.942 -14.270 1.00 0.00 C ATOM 549 OE1 GLN A 168 -10.823 -2.626 -15.241 1.00 0.00 O ATOM 550 NE2 GLN A 168 -12.133 -2.174 -13.465 1.00 0.00 N ATOM 0 H GLN A 168 -6.554 1.239 -13.682 1.00 0.00 H new ATOM 0 HA GLN A 168 -8.230 -0.627 -12.409 1.00 0.00 H new ATOM 0 HB2 GLN A 168 -8.756 -0.177 -15.316 1.00 0.00 H new ATOM 0 HB3 GLN A 168 -8.655 -1.839 -14.771 1.00 0.00 H new ATOM 0 HG2 GLN A 168 -10.224 -0.640 -12.789 1.00 0.00 H new ATOM 0 HG3 GLN A 168 -10.746 0.187 -14.243 1.00 0.00 H new ATOM 0 HE21 GLN A 168 -12.307 -1.560 -12.669 1.00 0.00 H new ATOM 0 HE22 GLN A 168 -12.751 -2.966 -13.643 1.00 0.00 H new ATOM 559 N TRP A 169 -5.661 -0.734 -14.434 1.00 0.00 N ATOM 560 CA TRP A 169 -4.395 -1.400 -14.690 1.00 0.00 C ATOM 561 C TRP A 169 -3.280 -0.544 -14.085 1.00 0.00 C ATOM 562 O TRP A 169 -2.863 0.448 -14.680 1.00 0.00 O ATOM 563 CB TRP A 169 -4.204 -1.660 -16.185 1.00 0.00 C ATOM 564 CG TRP A 169 -4.992 -2.860 -16.714 1.00 0.00 C ATOM 565 CD1 TRP A 169 -6.099 -2.852 -17.468 1.00 0.00 C ATOM 566 CD2 TRP A 169 -4.685 -4.253 -16.496 1.00 0.00 C ATOM 567 NE1 TRP A 169 -6.527 -4.134 -17.751 1.00 0.00 N ATOM 568 CE2 TRP A 169 -5.640 -5.013 -17.141 1.00 0.00 C ATOM 569 CE3 TRP A 169 -3.636 -4.852 -15.777 1.00 0.00 C ATOM 570 CZ2 TRP A 169 -5.640 -6.412 -17.132 1.00 0.00 C ATOM 571 CZ3 TRP A 169 -3.650 -6.252 -15.777 1.00 0.00 C ATOM 572 CH2 TRP A 169 -4.605 -7.031 -16.422 1.00 0.00 C ATOM 0 H TRP A 169 -5.815 0.114 -14.979 1.00 0.00 H new ATOM 0 HA TRP A 169 -4.374 -2.383 -14.219 1.00 0.00 H new ATOM 0 HB2 TRP A 169 -4.502 -0.770 -16.739 1.00 0.00 H new ATOM 0 HB3 TRP A 169 -3.144 -1.819 -16.383 1.00 0.00 H new ATOM 0 HD1 TRP A 169 -6.594 -1.956 -17.811 1.00 0.00 H new ATOM 0 HE1 TRP A 169 -7.344 -4.389 -18.306 1.00 0.00 H new ATOM 0 HE3 TRP A 169 -2.879 -4.277 -15.265 1.00 0.00 H new ATOM 0 HZ2 TRP A 169 -6.399 -6.984 -17.646 1.00 0.00 H new ATOM 0 HZ3 TRP A 169 -2.865 -6.762 -15.239 1.00 0.00 H new ATOM 0 HH2 TRP A 169 -4.548 -8.108 -16.375 1.00 0.00 H new ATOM 583 N TRP A 170 -2.830 -0.959 -12.911 1.00 0.00 N ATOM 584 CA TRP A 170 -1.771 -0.243 -12.219 1.00 0.00 C ATOM 585 C TRP A 170 -0.500 -1.091 -12.293 1.00 0.00 C ATOM 586 O TRP A 170 -0.570 -2.312 -12.414 1.00 0.00 O ATOM 587 CB TRP A 170 -2.183 0.092 -10.784 1.00 0.00 C ATOM 588 CG TRP A 170 -3.434 0.966 -10.684 1.00 0.00 C ATOM 589 CD1 TRP A 170 -4.167 1.477 -11.683 1.00 0.00 C ATOM 590 CD2 TRP A 170 -4.074 1.416 -9.470 1.00 0.00 C ATOM 591 NE1 TRP A 170 -5.228 2.219 -11.205 1.00 0.00 N ATOM 592 CE2 TRP A 170 -5.169 2.181 -9.817 1.00 0.00 C ATOM 593 CE3 TRP A 170 -3.739 1.185 -8.125 1.00 0.00 C ATOM 594 CZ2 TRP A 170 -6.018 2.776 -8.875 1.00 0.00 C ATOM 595 CZ3 TRP A 170 -4.596 1.786 -7.196 1.00 0.00 C ATOM 596 CH2 TRP A 170 -5.703 2.558 -7.528 1.00 0.00 C ATOM 0 H TRP A 170 -3.179 -1.782 -12.420 1.00 0.00 H new ATOM 0 HA TRP A 170 -1.578 0.717 -12.698 1.00 0.00 H new ATOM 0 HB2 TRP A 170 -2.357 -0.837 -10.241 1.00 0.00 H new ATOM 0 HB3 TRP A 170 -1.356 0.601 -10.289 1.00 0.00 H new ATOM 0 HD1 TRP A 170 -3.954 1.327 -12.731 1.00 0.00 H new ATOM 0 HE1 TRP A 170 -5.927 2.706 -11.767 1.00 0.00 H new ATOM 0 HE3 TRP A 170 -2.887 0.590 -7.831 1.00 0.00 H new ATOM 0 HZ2 TRP A 170 -6.869 3.371 -9.171 1.00 0.00 H new ATOM 0 HZ3 TRP A 170 -4.382 1.640 -6.148 1.00 0.00 H new ATOM 0 HH2 TRP A 170 -6.317 2.988 -6.751 1.00 0.00 H new ATOM 607 N ASN A 171 0.634 -0.408 -12.218 1.00 0.00 N ATOM 608 CA ASN A 171 1.919 -1.083 -12.276 1.00 0.00 C ATOM 609 C ASN A 171 2.333 -1.503 -10.864 1.00 0.00 C ATOM 610 O ASN A 171 2.656 -0.659 -10.031 1.00 0.00 O ATOM 611 CB ASN A 171 3.003 -0.156 -12.831 1.00 0.00 C ATOM 612 CG ASN A 171 3.798 -0.845 -13.942 1.00 0.00 C ATOM 613 OD1 ASN A 171 3.270 -1.600 -14.742 1.00 0.00 O ATOM 614 ND2 ASN A 171 5.093 -0.544 -13.946 1.00 0.00 N ATOM 0 H ASN A 171 0.689 0.606 -12.118 1.00 0.00 H new ATOM 0 HA ASN A 171 1.816 -1.949 -12.929 1.00 0.00 H new ATOM 0 HB2 ASN A 171 2.545 0.754 -13.218 1.00 0.00 H new ATOM 0 HB3 ASN A 171 3.677 0.143 -12.028 1.00 0.00 H new ATOM 0 HD21 ASN A 171 5.709 -0.953 -14.648 1.00 0.00 H new ATOM 0 HD22 ASN A 171 5.470 0.096 -13.247 1.00 0.00 H new ATOM 621 N ALA A 172 2.309 -2.808 -10.640 1.00 0.00 N ATOM 622 CA ALA A 172 2.679 -3.352 -9.344 1.00 0.00 C ATOM 623 C ALA A 172 3.691 -4.482 -9.538 1.00 0.00 C ATOM 624 O ALA A 172 3.791 -5.051 -10.625 1.00 0.00 O ATOM 625 CB ALA A 172 1.420 -3.817 -8.608 1.00 0.00 C ATOM 0 H ALA A 172 2.039 -3.505 -11.334 1.00 0.00 H new ATOM 0 HA ALA A 172 3.154 -2.588 -8.729 1.00 0.00 H new ATOM 0 HB1 ALA A 172 1.697 -4.225 -7.636 1.00 0.00 H new ATOM 0 HB2 ALA A 172 0.747 -2.971 -8.468 1.00 0.00 H new ATOM 0 HB3 ALA A 172 0.919 -4.586 -9.195 1.00 0.00 H new ATOM 631 N GLU A 173 4.417 -4.774 -8.470 1.00 0.00 N ATOM 632 CA GLU A 173 5.419 -5.826 -8.509 1.00 0.00 C ATOM 633 C GLU A 173 4.810 -7.156 -8.059 1.00 0.00 C ATOM 634 O GLU A 173 3.807 -7.174 -7.346 1.00 0.00 O ATOM 635 CB GLU A 173 6.632 -5.461 -7.653 1.00 0.00 C ATOM 636 CG GLU A 173 7.604 -4.572 -8.430 1.00 0.00 C ATOM 637 CD GLU A 173 7.232 -3.094 -8.284 1.00 0.00 C ATOM 638 OE1 GLU A 173 6.275 -2.679 -8.974 1.00 0.00 O ATOM 639 OE2 GLU A 173 7.912 -2.413 -7.487 1.00 0.00 O ATOM 0 H GLU A 173 4.332 -4.300 -7.571 1.00 0.00 H new ATOM 0 HA GLU A 173 5.762 -5.935 -9.538 1.00 0.00 H new ATOM 0 HB2 GLU A 173 6.303 -4.945 -6.751 1.00 0.00 H new ATOM 0 HB3 GLU A 173 7.142 -6.369 -7.332 1.00 0.00 H new ATOM 0 HG2 GLU A 173 8.619 -4.733 -8.067 1.00 0.00 H new ATOM 0 HG3 GLU A 173 7.594 -4.851 -9.484 1.00 0.00 H new ATOM 646 N ASP A 174 5.441 -8.236 -8.493 1.00 0.00 N ATOM 647 CA ASP A 174 4.974 -9.567 -8.143 1.00 0.00 C ATOM 648 C ASP A 174 5.668 -10.026 -6.859 1.00 0.00 C ATOM 649 O ASP A 174 6.184 -9.205 -6.102 1.00 0.00 O ATOM 650 CB ASP A 174 5.307 -10.575 -9.246 1.00 0.00 C ATOM 651 CG ASP A 174 4.137 -11.454 -9.694 1.00 0.00 C ATOM 652 OD1 ASP A 174 2.992 -11.096 -9.343 1.00 0.00 O ATOM 653 OD2 ASP A 174 4.415 -12.463 -10.378 1.00 0.00 O ATOM 0 H ASP A 174 6.272 -8.217 -9.084 1.00 0.00 H new ATOM 0 HA ASP A 174 3.893 -9.521 -8.010 1.00 0.00 H new ATOM 0 HB2 ASP A 174 5.686 -10.032 -10.112 1.00 0.00 H new ATOM 0 HB3 ASP A 174 6.113 -11.220 -8.897 1.00 0.00 H new ATOM 658 N SER A 175 5.656 -11.334 -6.652 1.00 0.00 N ATOM 659 CA SER A 175 6.278 -11.911 -5.472 1.00 0.00 C ATOM 660 C SER A 175 7.788 -12.035 -5.684 1.00 0.00 C ATOM 661 O SER A 175 8.485 -12.640 -4.871 1.00 0.00 O ATOM 662 CB SER A 175 5.674 -13.278 -5.144 1.00 0.00 C ATOM 663 OG SER A 175 4.693 -13.194 -4.115 1.00 0.00 O ATOM 0 H SER A 175 5.225 -12.011 -7.281 1.00 0.00 H new ATOM 0 HA SER A 175 6.089 -11.248 -4.627 1.00 0.00 H new ATOM 0 HB2 SER A 175 5.223 -13.700 -6.042 1.00 0.00 H new ATOM 0 HB3 SER A 175 6.466 -13.960 -4.835 1.00 0.00 H new ATOM 0 HG SER A 175 3.804 -13.346 -4.498 1.00 0.00 H new ATOM 669 N GLU A 176 8.250 -11.452 -6.781 1.00 0.00 N ATOM 670 CA GLU A 176 9.665 -11.490 -7.109 1.00 0.00 C ATOM 671 C GLU A 176 10.180 -10.079 -7.401 1.00 0.00 C ATOM 672 O GLU A 176 11.376 -9.881 -7.609 1.00 0.00 O ATOM 673 CB GLU A 176 9.928 -12.424 -8.291 1.00 0.00 C ATOM 674 CG GLU A 176 9.674 -13.882 -7.904 1.00 0.00 C ATOM 675 CD GLU A 176 10.352 -14.838 -8.888 1.00 0.00 C ATOM 676 OE1 GLU A 176 11.598 -14.781 -8.968 1.00 0.00 O ATOM 677 OE2 GLU A 176 9.608 -15.604 -9.540 1.00 0.00 O ATOM 0 H GLU A 176 7.669 -10.951 -7.454 1.00 0.00 H new ATOM 0 HA GLU A 176 10.207 -11.883 -6.249 1.00 0.00 H new ATOM 0 HB2 GLU A 176 9.285 -12.149 -9.127 1.00 0.00 H new ATOM 0 HB3 GLU A 176 10.958 -12.308 -8.629 1.00 0.00 H new ATOM 0 HG2 GLU A 176 10.049 -14.065 -6.897 1.00 0.00 H new ATOM 0 HG3 GLU A 176 8.601 -14.075 -7.885 1.00 0.00 H new ATOM 684 N GLY A 177 9.251 -9.133 -7.407 1.00 0.00 N ATOM 685 CA GLY A 177 9.596 -7.747 -7.671 1.00 0.00 C ATOM 686 C GLY A 177 9.279 -7.368 -9.119 1.00 0.00 C ATOM 687 O GLY A 177 9.312 -6.192 -9.477 1.00 0.00 O ATOM 0 H GLY A 177 8.260 -9.300 -7.233 1.00 0.00 H new ATOM 0 HA2 GLY A 177 9.045 -7.096 -6.992 1.00 0.00 H new ATOM 0 HA3 GLY A 177 10.656 -7.589 -7.474 1.00 0.00 H new ATOM 691 N LYS A 178 8.980 -8.387 -9.911 1.00 0.00 N ATOM 692 CA LYS A 178 8.657 -8.176 -11.312 1.00 0.00 C ATOM 693 C LYS A 178 7.549 -7.125 -11.423 1.00 0.00 C ATOM 694 O LYS A 178 6.411 -7.373 -11.027 1.00 0.00 O ATOM 695 CB LYS A 178 8.314 -9.504 -11.990 1.00 0.00 C ATOM 696 CG LYS A 178 9.563 -10.370 -12.160 1.00 0.00 C ATOM 697 CD LYS A 178 9.676 -10.895 -13.593 1.00 0.00 C ATOM 698 CE LYS A 178 10.576 -12.129 -13.656 1.00 0.00 C ATOM 699 NZ LYS A 178 9.933 -13.275 -12.976 1.00 0.00 N ATOM 0 H LYS A 178 8.955 -9.361 -9.609 1.00 0.00 H new ATOM 0 HA LYS A 178 9.523 -7.786 -11.847 1.00 0.00 H new ATOM 0 HB2 LYS A 178 7.574 -10.040 -11.396 1.00 0.00 H new ATOM 0 HB3 LYS A 178 7.864 -9.314 -12.964 1.00 0.00 H new ATOM 0 HG2 LYS A 178 10.450 -9.788 -11.911 1.00 0.00 H new ATOM 0 HG3 LYS A 178 9.526 -11.208 -11.464 1.00 0.00 H new ATOM 0 HD2 LYS A 178 8.685 -11.144 -13.972 1.00 0.00 H new ATOM 0 HD3 LYS A 178 10.078 -10.114 -14.239 1.00 0.00 H new ATOM 0 HE2 LYS A 178 10.781 -12.384 -14.696 1.00 0.00 H new ATOM 0 HE3 LYS A 178 11.535 -11.911 -13.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 178 10.307 -14.164 -13.365 1.00 0.00 H new ATOM 0 HZ2 LYS A 178 10.135 -13.231 -11.957 1.00 0.00 H new ATOM 0 HZ3 LYS A 178 8.905 -13.236 -13.127 1.00 0.00 H new ATOM 713 N ARG A 179 7.922 -5.974 -11.963 1.00 0.00 N ATOM 714 CA ARG A 179 6.974 -4.885 -12.131 1.00 0.00 C ATOM 715 C ARG A 179 6.235 -5.026 -13.463 1.00 0.00 C ATOM 716 O ARG A 179 6.860 -5.100 -14.519 1.00 0.00 O ATOM 717 CB ARG A 179 7.680 -3.529 -12.088 1.00 0.00 C ATOM 718 CG ARG A 179 8.836 -3.544 -11.086 1.00 0.00 C ATOM 719 CD ARG A 179 10.098 -2.931 -11.695 1.00 0.00 C ATOM 720 NE ARG A 179 11.117 -3.981 -11.912 1.00 0.00 N ATOM 721 CZ ARG A 179 12.114 -3.888 -12.803 1.00 0.00 C ATOM 722 NH1 ARG A 179 12.232 -2.791 -13.565 1.00 0.00 N ATOM 723 NH2 ARG A 179 12.993 -4.891 -12.932 1.00 0.00 N ATOM 0 H ARG A 179 8.867 -5.772 -12.290 1.00 0.00 H new ATOM 0 HA ARG A 179 6.260 -4.936 -11.309 1.00 0.00 H new ATOM 0 HB2 ARG A 179 8.057 -3.280 -13.080 1.00 0.00 H new ATOM 0 HB3 ARG A 179 6.966 -2.752 -11.814 1.00 0.00 H new ATOM 0 HG2 ARG A 179 8.553 -2.989 -10.191 1.00 0.00 H new ATOM 0 HG3 ARG A 179 9.039 -4.569 -10.775 1.00 0.00 H new ATOM 0 HD2 ARG A 179 9.857 -2.446 -12.641 1.00 0.00 H new ATOM 0 HD3 ARG A 179 10.493 -2.160 -11.033 1.00 0.00 H new ATOM 0 HE ARG A 179 11.057 -4.829 -11.348 1.00 0.00 H new ATOM 0 HH11 ARG A 179 11.563 -2.027 -13.467 1.00 0.00 H new ATOM 0 HH12 ARG A 179 12.991 -2.720 -14.243 1.00 0.00 H new ATOM 0 HH21 ARG A 179 12.903 -5.725 -12.352 1.00 0.00 H new ATOM 0 HH22 ARG A 179 13.752 -4.820 -13.610 1.00 0.00 H new ATOM 737 N GLY A 180 4.913 -5.056 -13.369 1.00 0.00 N ATOM 738 CA GLY A 180 4.082 -5.187 -14.555 1.00 0.00 C ATOM 739 C GLY A 180 2.689 -4.602 -14.313 1.00 0.00 C ATOM 740 O GLY A 180 2.463 -3.915 -13.319 1.00 0.00 O ATOM 0 H GLY A 180 4.397 -4.992 -12.491 1.00 0.00 H new ATOM 0 HA2 GLY A 180 4.555 -4.676 -15.394 1.00 0.00 H new ATOM 0 HA3 GLY A 180 3.997 -6.238 -14.830 1.00 0.00 H new ATOM 744 N MET A 181 1.790 -4.895 -15.242 1.00 0.00 N ATOM 745 CA MET A 181 0.426 -4.409 -15.144 1.00 0.00 C ATOM 746 C MET A 181 -0.453 -5.389 -14.365 1.00 0.00 C ATOM 747 O MET A 181 -0.573 -6.555 -14.742 1.00 0.00 O ATOM 748 CB MET A 181 -0.150 -4.211 -16.547 1.00 0.00 C ATOM 749 CG MET A 181 0.568 -3.075 -17.279 1.00 0.00 C ATOM 750 SD MET A 181 -0.550 -1.704 -17.521 1.00 0.00 S ATOM 751 CE MET A 181 -0.434 -0.924 -15.919 1.00 0.00 C ATOM 0 H MET A 181 1.981 -5.464 -16.067 1.00 0.00 H new ATOM 0 HA MET A 181 0.439 -3.459 -14.610 1.00 0.00 H new ATOM 0 HB2 MET A 181 -0.053 -5.135 -17.118 1.00 0.00 H new ATOM 0 HB3 MET A 181 -1.215 -3.989 -16.479 1.00 0.00 H new ATOM 0 HG2 MET A 181 1.435 -2.751 -16.704 1.00 0.00 H new ATOM 0 HG3 MET A 181 0.938 -3.428 -18.242 1.00 0.00 H new ATOM 0 HE1 MET A 181 -0.867 0.075 -15.969 1.00 0.00 H new ATOM 0 HE2 MET A 181 -0.977 -1.519 -15.185 1.00 0.00 H new ATOM 0 HE3 MET A 181 0.613 -0.852 -15.624 1.00 0.00 H new ATOM 761 N ILE A 182 -1.044 -4.883 -13.293 1.00 0.00 N ATOM 762 CA ILE A 182 -1.907 -5.701 -12.458 1.00 0.00 C ATOM 763 C ILE A 182 -3.302 -5.074 -12.407 1.00 0.00 C ATOM 764 O ILE A 182 -3.437 -3.852 -12.380 1.00 0.00 O ATOM 765 CB ILE A 182 -1.277 -5.911 -11.080 1.00 0.00 C ATOM 766 CG1 ILE A 182 0.004 -6.741 -11.184 1.00 0.00 C ATOM 767 CG2 ILE A 182 -2.282 -6.529 -10.105 1.00 0.00 C ATOM 768 CD1 ILE A 182 0.889 -6.540 -9.952 1.00 0.00 C ATOM 0 H ILE A 182 -0.942 -3.917 -12.983 1.00 0.00 H new ATOM 0 HA ILE A 182 -2.019 -6.697 -12.887 1.00 0.00 H new ATOM 0 HB ILE A 182 -0.998 -4.936 -10.680 1.00 0.00 H new ATOM 0 HG12 ILE A 182 -0.249 -7.796 -11.286 1.00 0.00 H new ATOM 0 HG13 ILE A 182 0.554 -6.457 -12.081 1.00 0.00 H new ATOM 0 HG21 ILE A 182 -1.808 -6.668 -9.133 1.00 0.00 H new ATOM 0 HG22 ILE A 182 -3.141 -5.866 -9.999 1.00 0.00 H new ATOM 0 HG23 ILE A 182 -2.614 -7.494 -10.488 1.00 0.00 H new ATOM 0 HD11 ILE A 182 1.793 -7.141 -10.051 1.00 0.00 H new ATOM 0 HD12 ILE A 182 1.160 -5.488 -9.867 1.00 0.00 H new ATOM 0 HD13 ILE A 182 0.345 -6.848 -9.059 1.00 0.00 H new ATOM 780 N PRO A 183 -4.332 -5.963 -12.393 1.00 0.00 N ATOM 781 CA PRO A 183 -5.712 -5.510 -12.347 1.00 0.00 C ATOM 782 C PRO A 183 -6.078 -5.013 -10.946 1.00 0.00 C ATOM 783 O PRO A 183 -5.783 -5.675 -9.951 1.00 0.00 O ATOM 784 CB PRO A 183 -6.534 -6.710 -12.783 1.00 0.00 C ATOM 785 CG PRO A 183 -5.631 -7.921 -12.612 1.00 0.00 C ATOM 786 CD PRO A 183 -4.209 -7.418 -12.423 1.00 0.00 C ATOM 0 HA PRO A 183 -5.898 -4.658 -13.001 1.00 0.00 H new ATOM 0 HB2 PRO A 183 -7.435 -6.807 -12.177 1.00 0.00 H new ATOM 0 HB3 PRO A 183 -6.856 -6.607 -13.819 1.00 0.00 H new ATOM 0 HG2 PRO A 183 -5.944 -8.513 -11.752 1.00 0.00 H new ATOM 0 HG3 PRO A 183 -5.694 -8.570 -13.485 1.00 0.00 H new ATOM 0 HD2 PRO A 183 -3.774 -7.798 -11.499 1.00 0.00 H new ATOM 0 HD3 PRO A 183 -3.562 -7.744 -13.237 1.00 0.00 H new ATOM 794 N VAL A 184 -6.713 -3.851 -10.913 1.00 0.00 N ATOM 795 CA VAL A 184 -7.122 -3.257 -9.652 1.00 0.00 C ATOM 796 C VAL A 184 -8.415 -3.923 -9.175 1.00 0.00 C ATOM 797 O VAL A 184 -8.647 -4.050 -7.974 1.00 0.00 O ATOM 798 CB VAL A 184 -7.252 -1.741 -9.805 1.00 0.00 C ATOM 799 CG1 VAL A 184 -7.977 -1.129 -8.605 1.00 0.00 C ATOM 800 CG2 VAL A 184 -5.882 -1.091 -10.008 1.00 0.00 C ATOM 0 H VAL A 184 -6.954 -3.305 -11.740 1.00 0.00 H new ATOM 0 HA VAL A 184 -6.366 -3.429 -8.886 1.00 0.00 H new ATOM 0 HB VAL A 184 -7.851 -1.544 -10.694 1.00 0.00 H new ATOM 0 HG11 VAL A 184 -8.056 -0.050 -8.739 1.00 0.00 H new ATOM 0 HG12 VAL A 184 -8.975 -1.559 -8.525 1.00 0.00 H new ATOM 0 HG13 VAL A 184 -7.417 -1.341 -7.694 1.00 0.00 H new ATOM 0 HG21 VAL A 184 -6.003 -0.013 -10.114 1.00 0.00 H new ATOM 0 HG22 VAL A 184 -5.248 -1.302 -9.147 1.00 0.00 H new ATOM 0 HG23 VAL A 184 -5.418 -1.494 -10.908 1.00 0.00 H new ATOM 810 N PRO A 185 -9.246 -4.342 -10.168 1.00 0.00 N ATOM 811 CA PRO A 185 -10.509 -4.991 -9.861 1.00 0.00 C ATOM 812 C PRO A 185 -10.286 -6.430 -9.393 1.00 0.00 C ATOM 813 O PRO A 185 -11.085 -6.969 -8.628 1.00 0.00 O ATOM 814 CB PRO A 185 -11.318 -4.903 -11.146 1.00 0.00 C ATOM 815 CG PRO A 185 -10.313 -4.627 -12.253 1.00 0.00 C ATOM 816 CD PRO A 185 -9.005 -4.209 -11.601 1.00 0.00 C ATOM 0 HA PRO A 185 -11.039 -4.512 -9.038 1.00 0.00 H new ATOM 0 HB2 PRO A 185 -11.858 -5.831 -11.332 1.00 0.00 H new ATOM 0 HB3 PRO A 185 -12.061 -4.108 -11.086 1.00 0.00 H new ATOM 0 HG2 PRO A 185 -10.167 -5.516 -12.866 1.00 0.00 H new ATOM 0 HG3 PRO A 185 -10.679 -3.841 -12.913 1.00 0.00 H new ATOM 0 HD2 PRO A 185 -8.181 -4.844 -11.924 1.00 0.00 H new ATOM 0 HD3 PRO A 185 -8.741 -3.185 -11.865 1.00 0.00 H new ATOM 824 N TYR A 186 -9.197 -7.014 -9.872 1.00 0.00 N ATOM 825 CA TYR A 186 -8.859 -8.379 -9.511 1.00 0.00 C ATOM 826 C TYR A 186 -7.847 -8.410 -8.364 1.00 0.00 C ATOM 827 O TYR A 186 -7.271 -9.455 -8.068 1.00 0.00 O ATOM 828 CB TYR A 186 -8.220 -8.998 -10.756 1.00 0.00 C ATOM 829 CG TYR A 186 -9.229 -9.470 -11.804 1.00 0.00 C ATOM 830 CD1 TYR A 186 -10.098 -8.566 -12.382 1.00 0.00 C ATOM 831 CD2 TYR A 186 -9.270 -10.800 -12.174 1.00 0.00 C ATOM 832 CE1 TYR A 186 -11.048 -9.011 -13.369 1.00 0.00 C ATOM 833 CE2 TYR A 186 -10.220 -11.243 -13.161 1.00 0.00 C ATOM 834 CZ TYR A 186 -11.062 -10.328 -13.709 1.00 0.00 C ATOM 835 OH TYR A 186 -11.958 -10.747 -14.641 1.00 0.00 O ATOM 0 H TYR A 186 -8.537 -6.565 -10.508 1.00 0.00 H new ATOM 0 HA TYR A 186 -9.747 -8.920 -9.183 1.00 0.00 H new ATOM 0 HB2 TYR A 186 -7.554 -8.266 -11.212 1.00 0.00 H new ATOM 0 HB3 TYR A 186 -7.604 -9.844 -10.453 1.00 0.00 H new ATOM 0 HD1 TYR A 186 -10.065 -7.526 -12.094 1.00 0.00 H new ATOM 0 HD2 TYR A 186 -8.590 -11.507 -11.723 1.00 0.00 H new ATOM 0 HE1 TYR A 186 -11.734 -8.315 -13.829 1.00 0.00 H new ATOM 0 HE2 TYR A 186 -10.262 -12.280 -13.459 1.00 0.00 H new ATOM 0 HH TYR A 186 -11.853 -11.711 -14.785 1.00 0.00 H new ATOM 845 N VAL A 187 -7.663 -7.251 -7.750 1.00 0.00 N ATOM 846 CA VAL A 187 -6.730 -7.132 -6.642 1.00 0.00 C ATOM 847 C VAL A 187 -7.221 -6.044 -5.683 1.00 0.00 C ATOM 848 O VAL A 187 -7.874 -5.090 -6.102 1.00 0.00 O ATOM 849 CB VAL A 187 -5.320 -6.868 -7.171 1.00 0.00 C ATOM 850 CG1 VAL A 187 -5.048 -7.686 -8.435 1.00 0.00 C ATOM 851 CG2 VAL A 187 -5.097 -5.376 -7.424 1.00 0.00 C ATOM 0 H VAL A 187 -8.144 -6.386 -7.998 1.00 0.00 H new ATOM 0 HA VAL A 187 -6.683 -8.065 -6.081 1.00 0.00 H new ATOM 0 HB VAL A 187 -4.611 -7.185 -6.406 1.00 0.00 H new ATOM 0 HG11 VAL A 187 -4.039 -7.480 -8.791 1.00 0.00 H new ATOM 0 HG12 VAL A 187 -5.144 -8.748 -8.209 1.00 0.00 H new ATOM 0 HG13 VAL A 187 -5.768 -7.413 -9.207 1.00 0.00 H new ATOM 0 HG21 VAL A 187 -4.086 -5.218 -7.800 1.00 0.00 H new ATOM 0 HG22 VAL A 187 -5.818 -5.020 -8.160 1.00 0.00 H new ATOM 0 HG23 VAL A 187 -5.228 -4.825 -6.492 1.00 0.00 H new ATOM 861 N GLU A 188 -6.889 -6.226 -4.413 1.00 0.00 N ATOM 862 CA GLU A 188 -7.288 -5.273 -3.391 1.00 0.00 C ATOM 863 C GLU A 188 -6.138 -4.313 -3.082 1.00 0.00 C ATOM 864 O GLU A 188 -4.984 -4.731 -2.990 1.00 0.00 O ATOM 865 CB GLU A 188 -7.757 -5.992 -2.124 1.00 0.00 C ATOM 866 CG GLU A 188 -9.220 -5.664 -1.819 1.00 0.00 C ATOM 867 CD GLU A 188 -9.508 -5.789 -0.321 1.00 0.00 C ATOM 868 OE1 GLU A 188 -8.851 -6.641 0.315 1.00 0.00 O ATOM 869 OE2 GLU A 188 -10.379 -5.030 0.154 1.00 0.00 O ATOM 0 H GLU A 188 -6.348 -7.019 -4.069 1.00 0.00 H new ATOM 0 HA GLU A 188 -8.128 -4.692 -3.772 1.00 0.00 H new ATOM 0 HB2 GLU A 188 -7.640 -7.069 -2.248 1.00 0.00 H new ATOM 0 HB3 GLU A 188 -7.131 -5.698 -1.281 1.00 0.00 H new ATOM 0 HG2 GLU A 188 -9.447 -4.652 -2.154 1.00 0.00 H new ATOM 0 HG3 GLU A 188 -9.871 -6.338 -2.376 1.00 0.00 H new ATOM 876 N LYS A 189 -6.491 -3.046 -2.932 1.00 0.00 N ATOM 877 CA LYS A 189 -5.502 -2.023 -2.636 1.00 0.00 C ATOM 878 C LYS A 189 -5.291 -1.947 -1.122 1.00 0.00 C ATOM 879 O LYS A 189 -6.121 -1.395 -0.403 1.00 0.00 O ATOM 880 CB LYS A 189 -5.905 -0.690 -3.268 1.00 0.00 C ATOM 881 CG LYS A 189 -7.111 -0.083 -2.548 1.00 0.00 C ATOM 882 CD LYS A 189 -7.988 0.711 -3.518 1.00 0.00 C ATOM 883 CE LYS A 189 -7.657 2.203 -3.461 1.00 0.00 C ATOM 884 NZ LYS A 189 -7.993 2.859 -4.744 1.00 0.00 N ATOM 0 H LYS A 189 -7.449 -2.703 -3.010 1.00 0.00 H new ATOM 0 HA LYS A 189 -4.541 -2.282 -3.080 1.00 0.00 H new ATOM 0 HB2 LYS A 189 -5.066 0.004 -3.227 1.00 0.00 H new ATOM 0 HB3 LYS A 189 -6.144 -0.840 -4.321 1.00 0.00 H new ATOM 0 HG2 LYS A 189 -7.700 -0.876 -2.086 1.00 0.00 H new ATOM 0 HG3 LYS A 189 -6.769 0.569 -1.745 1.00 0.00 H new ATOM 0 HD2 LYS A 189 -7.841 0.341 -4.533 1.00 0.00 H new ATOM 0 HD3 LYS A 189 -9.039 0.558 -3.272 1.00 0.00 H new ATOM 0 HE2 LYS A 189 -8.212 2.674 -2.649 1.00 0.00 H new ATOM 0 HE3 LYS A 189 -6.598 2.338 -3.243 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 -7.446 3.739 -4.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 -7.760 2.221 -5.532 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 -9.009 3.079 -4.766 1.00 0.00 H new