USER MOD reduce.3.24.130724 H: found=0, std=0, add=403, rem=0, adj=6 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 168 GLN : amide:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 171 ASN : amide:sc= -0.176 K(o=-0.18,f=-3!) USER MOD Single : A 175 SER OG : rot 180:sc= 0 USER MOD Single : A 178 LYS NZ :NH3+ 134:sc= -0.549 (180deg=-1.82!) USER MOD Single : A 181 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 186 TYR OH : rot 180:sc= 0 USER MOD Single : A 189 LYS NZ :NH3+ -141:sc= -0.221 (180deg=-0.99) USER MOD Single : A 190 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 19 N TYR A 136 -1.890 -2.108 -1.020 1.00 0.00 N ATOM 20 CA TYR A 136 -3.050 -2.853 -0.562 1.00 0.00 C ATOM 21 C TYR A 136 -4.295 -1.965 -0.531 1.00 0.00 C ATOM 22 O TYR A 136 -4.206 -0.775 -0.232 1.00 0.00 O ATOM 23 CB TYR A 136 -2.724 -3.305 0.863 1.00 0.00 C ATOM 24 CG TYR A 136 -1.354 -3.970 1.007 1.00 0.00 C ATOM 25 CD1 TYR A 136 -1.183 -5.287 0.630 1.00 0.00 C ATOM 26 CD2 TYR A 136 -0.289 -3.254 1.514 1.00 0.00 C ATOM 27 CE1 TYR A 136 0.107 -5.913 0.766 1.00 0.00 C ATOM 28 CE2 TYR A 136 1.001 -3.881 1.650 1.00 0.00 C ATOM 29 CZ TYR A 136 1.135 -5.179 1.268 1.00 0.00 C ATOM 30 OH TYR A 136 2.353 -5.771 1.396 1.00 0.00 O ATOM 0 HA TYR A 136 -3.257 -3.690 -1.229 1.00 0.00 H new ATOM 0 HB2 TYR A 136 -2.769 -2.441 1.526 1.00 0.00 H new ATOM 0 HB3 TYR A 136 -3.492 -4.003 1.196 1.00 0.00 H new ATOM 0 HD1 TYR A 136 -2.016 -5.848 0.233 1.00 0.00 H new ATOM 0 HD2 TYR A 136 -0.422 -2.224 1.809 1.00 0.00 H new ATOM 0 HE1 TYR A 136 0.254 -6.943 0.476 1.00 0.00 H new ATOM 0 HE2 TYR A 136 1.843 -3.332 2.046 1.00 0.00 H new ATOM 0 HH TYR A 136 2.992 -5.127 1.767 1.00 0.00 H new ATOM 40 N VAL A 137 -5.428 -2.577 -0.843 1.00 0.00 N ATOM 41 CA VAL A 137 -6.690 -1.856 -0.854 1.00 0.00 C ATOM 42 C VAL A 137 -7.601 -2.417 0.239 1.00 0.00 C ATOM 43 O VAL A 137 -7.351 -3.498 0.767 1.00 0.00 O ATOM 44 CB VAL A 137 -7.317 -1.922 -2.248 1.00 0.00 C ATOM 45 CG1 VAL A 137 -8.081 -0.634 -2.567 1.00 0.00 C ATOM 46 CG2 VAL A 137 -6.257 -2.208 -3.313 1.00 0.00 C ATOM 0 H VAL A 137 -5.499 -3.564 -1.090 1.00 0.00 H new ATOM 0 HA VAL A 137 -6.530 -0.800 -0.634 1.00 0.00 H new ATOM 0 HB VAL A 137 -8.030 -2.746 -2.256 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -8.517 -0.707 -3.563 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -8.874 -0.490 -1.833 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -7.396 0.213 -2.532 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -6.729 -2.250 -4.294 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -5.509 -1.415 -3.304 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -5.776 -3.163 -3.101 1.00 0.00 H new ATOM 56 N ARG A 138 -8.641 -1.654 0.546 1.00 0.00 N ATOM 57 CA ARG A 138 -9.592 -2.062 1.566 1.00 0.00 C ATOM 58 C ARG A 138 -10.995 -1.564 1.213 1.00 0.00 C ATOM 59 O ARG A 138 -11.217 -0.361 1.083 1.00 0.00 O ATOM 60 CB ARG A 138 -9.195 -1.515 2.939 1.00 0.00 C ATOM 61 CG ARG A 138 -8.765 -2.645 3.876 1.00 0.00 C ATOM 62 CD ARG A 138 -8.939 -2.240 5.341 1.00 0.00 C ATOM 63 NE ARG A 138 -7.626 -2.234 6.024 1.00 0.00 N ATOM 64 CZ ARG A 138 -7.468 -2.359 7.348 1.00 0.00 C ATOM 65 NH1 ARG A 138 -8.539 -2.500 8.141 1.00 0.00 N ATOM 66 NH2 ARG A 138 -6.239 -2.343 7.881 1.00 0.00 N ATOM 0 H ARG A 138 -8.845 -0.757 0.106 1.00 0.00 H new ATOM 0 HA ARG A 138 -9.589 -3.151 1.606 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -8.380 -0.800 2.828 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -10.035 -0.975 3.376 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -9.355 -3.538 3.669 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -7.723 -2.901 3.687 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -9.394 -1.252 5.402 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -9.615 -2.934 5.841 1.00 0.00 H new ATOM 0 HE ARG A 138 -6.789 -2.128 5.450 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -9.475 -2.512 7.736 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -8.418 -2.595 9.149 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -5.423 -2.236 7.278 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -6.119 -2.438 8.889 1.00 0.00 H new ATOM 80 N ALA A 139 -11.906 -2.514 1.069 1.00 0.00 N ATOM 81 CA ALA A 139 -13.282 -2.188 0.735 1.00 0.00 C ATOM 82 C ALA A 139 -14.057 -1.885 2.018 1.00 0.00 C ATOM 83 O ALA A 139 -14.101 -2.709 2.930 1.00 0.00 O ATOM 84 CB ALA A 139 -13.901 -3.338 -0.063 1.00 0.00 C ATOM 0 H ALA A 139 -11.718 -3.511 1.178 1.00 0.00 H new ATOM 0 HA ALA A 139 -13.323 -1.297 0.108 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -14.933 -3.093 -0.313 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -13.332 -3.492 -0.980 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -13.879 -4.249 0.535 1.00 0.00 H new ATOM 90 N LEU A 140 -14.649 -0.700 2.048 1.00 0.00 N ATOM 91 CA LEU A 140 -15.421 -0.279 3.205 1.00 0.00 C ATOM 92 C LEU A 140 -16.910 -0.300 2.856 1.00 0.00 C ATOM 93 O LEU A 140 -17.632 0.656 3.135 1.00 0.00 O ATOM 94 CB LEU A 140 -14.928 1.078 3.711 1.00 0.00 C ATOM 95 CG LEU A 140 -13.532 1.501 3.248 1.00 0.00 C ATOM 96 CD1 LEU A 140 -13.404 3.025 3.214 1.00 0.00 C ATOM 97 CD2 LEU A 140 -12.449 0.853 4.112 1.00 0.00 C ATOM 0 H LEU A 140 -14.610 -0.018 1.290 1.00 0.00 H new ATOM 0 HA LEU A 140 -15.278 -0.975 4.032 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -15.640 1.841 3.396 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -14.938 1.062 4.801 1.00 0.00 H new ATOM 0 HG LEU A 140 -13.387 1.144 2.229 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -12.403 3.299 2.882 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -14.140 3.437 2.524 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -13.578 3.427 4.212 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -11.466 1.170 3.762 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -12.580 1.159 5.150 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -12.527 -0.232 4.040 1.00 0.00 H new ATOM 109 N PHE A 141 -17.327 -1.402 2.249 1.00 0.00 N ATOM 110 CA PHE A 141 -18.718 -1.561 1.858 1.00 0.00 C ATOM 111 C PHE A 141 -18.935 -2.893 1.137 1.00 0.00 C ATOM 112 O PHE A 141 -18.157 -3.262 0.258 1.00 0.00 O ATOM 113 CB PHE A 141 -19.047 -0.415 0.899 1.00 0.00 C ATOM 114 CG PHE A 141 -19.836 0.727 1.542 1.00 0.00 C ATOM 115 CD1 PHE A 141 -20.964 0.457 2.255 1.00 0.00 C ATOM 116 CD2 PHE A 141 -19.413 2.011 1.401 1.00 0.00 C ATOM 117 CE1 PHE A 141 -21.697 1.516 2.852 1.00 0.00 C ATOM 118 CE2 PHE A 141 -20.147 3.070 1.997 1.00 0.00 C ATOM 119 CZ PHE A 141 -21.273 2.801 2.709 1.00 0.00 C ATOM 0 H PHE A 141 -16.726 -2.193 2.018 1.00 0.00 H new ATOM 0 HA PHE A 141 -19.357 -1.548 2.741 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -18.117 -0.017 0.492 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -19.619 -0.810 0.059 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -21.301 -0.563 2.366 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -18.518 2.226 0.835 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -22.591 1.302 3.419 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -19.810 4.090 1.885 1.00 0.00 H new ATOM 0 HZ PHE A 141 -21.831 3.607 3.161 1.00 0.00 H new ATOM 129 N ASP A 142 -19.997 -3.577 1.534 1.00 0.00 N ATOM 130 CA ASP A 142 -20.328 -4.860 0.937 1.00 0.00 C ATOM 131 C ASP A 142 -21.000 -4.628 -0.419 1.00 0.00 C ATOM 132 O ASP A 142 -21.723 -3.649 -0.598 1.00 0.00 O ATOM 133 CB ASP A 142 -21.300 -5.644 1.819 1.00 0.00 C ATOM 134 CG ASP A 142 -21.955 -6.853 1.146 1.00 0.00 C ATOM 135 OD1 ASP A 142 -21.247 -7.513 0.354 1.00 0.00 O ATOM 136 OD2 ASP A 142 -23.147 -7.089 1.436 1.00 0.00 O ATOM 0 H ASP A 142 -20.640 -3.267 2.262 1.00 0.00 H new ATOM 0 HA ASP A 142 -19.405 -5.429 0.826 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -20.767 -5.986 2.706 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -22.084 -4.968 2.159 1.00 0.00 H new ATOM 141 N PHE A 143 -20.738 -5.546 -1.338 1.00 0.00 N ATOM 142 CA PHE A 143 -21.309 -5.454 -2.671 1.00 0.00 C ATOM 143 C PHE A 143 -21.439 -6.839 -3.307 1.00 0.00 C ATOM 144 O PHE A 143 -20.514 -7.647 -3.240 1.00 0.00 O ATOM 145 CB PHE A 143 -20.350 -4.607 -3.510 1.00 0.00 C ATOM 146 CG PHE A 143 -21.048 -3.676 -4.503 1.00 0.00 C ATOM 147 CD1 PHE A 143 -21.981 -4.171 -5.359 1.00 0.00 C ATOM 148 CD2 PHE A 143 -20.736 -2.353 -4.528 1.00 0.00 C ATOM 149 CE1 PHE A 143 -22.628 -3.307 -6.281 1.00 0.00 C ATOM 150 CE2 PHE A 143 -21.385 -1.488 -5.449 1.00 0.00 C ATOM 151 CZ PHE A 143 -22.318 -1.983 -6.306 1.00 0.00 C ATOM 0 H PHE A 143 -20.138 -6.357 -1.186 1.00 0.00 H new ATOM 0 HA PHE A 143 -22.304 -5.012 -2.621 1.00 0.00 H new ATOM 0 HB2 PHE A 143 -19.730 -4.009 -2.842 1.00 0.00 H new ATOM 0 HB3 PHE A 143 -19.681 -5.270 -4.058 1.00 0.00 H new ATOM 0 HD1 PHE A 143 -22.230 -5.222 -5.338 1.00 0.00 H new ATOM 0 HD2 PHE A 143 -19.995 -1.960 -3.848 1.00 0.00 H new ATOM 0 HE1 PHE A 143 -23.367 -3.701 -6.963 1.00 0.00 H new ATOM 0 HE2 PHE A 143 -21.138 -0.437 -5.469 1.00 0.00 H new ATOM 0 HZ PHE A 143 -22.812 -1.325 -7.006 1.00 0.00 H new ATOM 250 N LEU A 151 -15.258 -9.720 -8.198 1.00 0.00 N ATOM 251 CA LEU A 151 -15.379 -10.779 -7.210 1.00 0.00 C ATOM 252 C LEU A 151 -16.278 -10.305 -6.067 1.00 0.00 C ATOM 253 O LEU A 151 -16.368 -9.107 -5.798 1.00 0.00 O ATOM 254 CB LEU A 151 -13.995 -11.244 -6.751 1.00 0.00 C ATOM 255 CG LEU A 151 -13.373 -10.458 -5.595 1.00 0.00 C ATOM 256 CD1 LEU A 151 -12.967 -11.392 -4.453 1.00 0.00 C ATOM 257 CD2 LEU A 151 -12.201 -9.603 -6.080 1.00 0.00 C ATOM 0 HA LEU A 151 -15.856 -11.656 -7.648 1.00 0.00 H new ATOM 0 HB2 LEU A 151 -14.065 -12.291 -6.456 1.00 0.00 H new ATOM 0 HB3 LEU A 151 -13.317 -11.197 -7.603 1.00 0.00 H new ATOM 0 HG LEU A 151 -14.127 -9.776 -5.201 1.00 0.00 H new ATOM 0 HD11 LEU A 151 -12.528 -10.808 -3.644 1.00 0.00 H new ATOM 0 HD12 LEU A 151 -13.847 -11.919 -4.084 1.00 0.00 H new ATOM 0 HD13 LEU A 151 -12.237 -12.115 -4.816 1.00 0.00 H new ATOM 0 HD21 LEU A 151 -11.778 -9.055 -5.238 1.00 0.00 H new ATOM 0 HD22 LEU A 151 -11.437 -10.247 -6.515 1.00 0.00 H new ATOM 0 HD23 LEU A 151 -12.552 -8.897 -6.833 1.00 0.00 H new ATOM 269 N PRO A 152 -16.940 -11.293 -5.409 1.00 0.00 N ATOM 270 CA PRO A 152 -17.829 -10.989 -4.301 1.00 0.00 C ATOM 271 C PRO A 152 -17.036 -10.633 -3.042 1.00 0.00 C ATOM 272 O PRO A 152 -16.146 -11.377 -2.634 1.00 0.00 O ATOM 273 CB PRO A 152 -18.686 -12.233 -4.132 1.00 0.00 C ATOM 274 CG PRO A 152 -17.939 -13.353 -4.836 1.00 0.00 C ATOM 275 CD PRO A 152 -16.859 -12.722 -5.699 1.00 0.00 C ATOM 0 HA PRO A 152 -18.452 -10.115 -4.489 1.00 0.00 H new ATOM 0 HB2 PRO A 152 -18.834 -12.465 -3.077 1.00 0.00 H new ATOM 0 HB3 PRO A 152 -19.674 -12.088 -4.568 1.00 0.00 H new ATOM 0 HG2 PRO A 152 -17.497 -14.034 -4.108 1.00 0.00 H new ATOM 0 HG3 PRO A 152 -18.622 -13.941 -5.449 1.00 0.00 H new ATOM 0 HD2 PRO A 152 -15.874 -13.120 -5.455 1.00 0.00 H new ATOM 0 HD3 PRO A 152 -17.030 -12.922 -6.757 1.00 0.00 H new ATOM 283 N PHE A 153 -17.389 -9.496 -2.461 1.00 0.00 N ATOM 284 CA PHE A 153 -16.721 -9.032 -1.257 1.00 0.00 C ATOM 285 C PHE A 153 -17.713 -8.370 -0.299 1.00 0.00 C ATOM 286 O PHE A 153 -18.830 -8.035 -0.692 1.00 0.00 O ATOM 287 CB PHE A 153 -15.682 -7.997 -1.691 1.00 0.00 C ATOM 288 CG PHE A 153 -16.277 -6.775 -2.393 1.00 0.00 C ATOM 289 CD1 PHE A 153 -16.881 -6.913 -3.604 1.00 0.00 C ATOM 290 CD2 PHE A 153 -16.202 -5.551 -1.806 1.00 0.00 C ATOM 291 CE1 PHE A 153 -17.434 -5.778 -4.255 1.00 0.00 C ATOM 292 CE2 PHE A 153 -16.755 -4.416 -2.457 1.00 0.00 C ATOM 293 CZ PHE A 153 -17.359 -4.554 -3.668 1.00 0.00 C ATOM 0 H PHE A 153 -18.129 -8.882 -2.802 1.00 0.00 H new ATOM 0 HA PHE A 153 -16.264 -9.875 -0.739 1.00 0.00 H new ATOM 0 HB2 PHE A 153 -15.127 -7.665 -0.814 1.00 0.00 H new ATOM 0 HB3 PHE A 153 -14.966 -8.475 -2.360 1.00 0.00 H new ATOM 0 HD1 PHE A 153 -16.940 -7.885 -4.070 1.00 0.00 H new ATOM 0 HD2 PHE A 153 -15.722 -5.442 -0.845 1.00 0.00 H new ATOM 0 HE1 PHE A 153 -17.914 -5.887 -5.216 1.00 0.00 H new ATOM 0 HE2 PHE A 153 -16.696 -3.444 -1.991 1.00 0.00 H new ATOM 0 HZ PHE A 153 -17.779 -3.691 -4.163 1.00 0.00 H new ATOM 303 N LYS A 154 -17.271 -8.200 0.938 1.00 0.00 N ATOM 304 CA LYS A 154 -18.107 -7.583 1.954 1.00 0.00 C ATOM 305 C LYS A 154 -17.434 -6.303 2.454 1.00 0.00 C ATOM 306 O LYS A 154 -16.303 -6.003 2.072 1.00 0.00 O ATOM 307 CB LYS A 154 -18.425 -8.585 3.066 1.00 0.00 C ATOM 308 CG LYS A 154 -19.282 -9.737 2.538 1.00 0.00 C ATOM 309 CD LYS A 154 -20.198 -10.286 3.634 1.00 0.00 C ATOM 310 CE LYS A 154 -21.654 -10.327 3.162 1.00 0.00 C ATOM 311 NZ LYS A 154 -22.561 -9.897 4.249 1.00 0.00 N ATOM 0 H LYS A 154 -16.344 -8.479 1.260 1.00 0.00 H new ATOM 0 HA LYS A 154 -19.069 -7.294 1.532 1.00 0.00 H new ATOM 0 HB2 LYS A 154 -17.497 -8.978 3.482 1.00 0.00 H new ATOM 0 HB3 LYS A 154 -18.949 -8.079 3.877 1.00 0.00 H new ATOM 0 HG2 LYS A 154 -19.882 -9.392 1.696 1.00 0.00 H new ATOM 0 HG3 LYS A 154 -18.638 -10.533 2.165 1.00 0.00 H new ATOM 0 HD2 LYS A 154 -19.875 -11.288 3.915 1.00 0.00 H new ATOM 0 HD3 LYS A 154 -20.118 -9.664 4.525 1.00 0.00 H new ATOM 0 HE2 LYS A 154 -21.781 -9.677 2.296 1.00 0.00 H new ATOM 0 HE3 LYS A 154 -21.911 -11.337 2.843 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 -23.545 -9.930 3.914 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 -22.452 -10.533 5.064 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 -22.325 -8.925 4.534 1.00 0.00 H new ATOM 325 N LYS A 155 -18.157 -5.584 3.299 1.00 0.00 N ATOM 326 CA LYS A 155 -17.644 -4.343 3.855 1.00 0.00 C ATOM 327 C LYS A 155 -16.459 -4.651 4.771 1.00 0.00 C ATOM 328 O LYS A 155 -16.497 -5.610 5.541 1.00 0.00 O ATOM 329 CB LYS A 155 -18.766 -3.560 4.541 1.00 0.00 C ATOM 330 CG LYS A 155 -19.160 -4.215 5.866 1.00 0.00 C ATOM 331 CD LYS A 155 -18.356 -3.629 7.028 1.00 0.00 C ATOM 332 CE LYS A 155 -18.783 -2.190 7.321 1.00 0.00 C ATOM 333 NZ LYS A 155 -19.113 -2.028 8.755 1.00 0.00 N ATOM 0 H LYS A 155 -19.094 -5.837 3.613 1.00 0.00 H new ATOM 0 HA LYS A 155 -17.273 -3.694 3.062 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -18.442 -2.535 4.720 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -19.634 -3.510 3.884 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -20.225 -4.068 6.046 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -18.992 -5.290 5.808 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -18.497 -4.242 7.918 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -17.293 -3.655 6.789 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -17.982 -1.504 7.047 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -19.648 -1.930 6.711 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -19.401 -1.045 8.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -19.892 -2.669 9.006 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -18.278 -2.256 9.331 1.00 0.00 H new ATOM 347 N GLY A 156 -15.433 -3.820 4.658 1.00 0.00 N ATOM 348 CA GLY A 156 -14.238 -3.992 5.467 1.00 0.00 C ATOM 349 C GLY A 156 -13.382 -5.146 4.943 1.00 0.00 C ATOM 350 O GLY A 156 -12.713 -5.829 5.717 1.00 0.00 O ATOM 0 H GLY A 156 -15.405 -3.026 4.019 1.00 0.00 H new ATOM 0 HA2 GLY A 156 -13.655 -3.071 5.462 1.00 0.00 H new ATOM 0 HA3 GLY A 156 -14.520 -4.185 6.502 1.00 0.00 H new ATOM 354 N ASP A 157 -13.432 -5.329 3.632 1.00 0.00 N ATOM 355 CA ASP A 157 -12.669 -6.388 2.995 1.00 0.00 C ATOM 356 C ASP A 157 -11.247 -5.894 2.721 1.00 0.00 C ATOM 357 O ASP A 157 -11.002 -4.690 2.678 1.00 0.00 O ATOM 358 CB ASP A 157 -13.295 -6.791 1.659 1.00 0.00 C ATOM 359 CG ASP A 157 -12.729 -8.071 1.039 1.00 0.00 C ATOM 360 OD1 ASP A 157 -11.797 -8.635 1.652 1.00 0.00 O ATOM 361 OD2 ASP A 157 -13.243 -8.457 -0.033 1.00 0.00 O ATOM 0 H ASP A 157 -13.989 -4.761 2.993 1.00 0.00 H new ATOM 0 HA ASP A 157 -12.663 -7.248 3.665 1.00 0.00 H new ATOM 0 HB2 ASP A 157 -14.368 -6.918 1.801 1.00 0.00 H new ATOM 0 HB3 ASP A 157 -13.162 -5.973 0.951 1.00 0.00 H new ATOM 366 N ILE A 158 -10.346 -6.849 2.542 1.00 0.00 N ATOM 367 CA ILE A 158 -8.955 -6.526 2.272 1.00 0.00 C ATOM 368 C ILE A 158 -8.554 -7.110 0.917 1.00 0.00 C ATOM 369 O ILE A 158 -8.557 -8.327 0.736 1.00 0.00 O ATOM 370 CB ILE A 158 -8.065 -6.986 3.428 1.00 0.00 C ATOM 371 CG1 ILE A 158 -7.942 -5.895 4.494 1.00 0.00 C ATOM 372 CG2 ILE A 158 -6.698 -7.445 2.919 1.00 0.00 C ATOM 373 CD1 ILE A 158 -9.116 -5.951 5.474 1.00 0.00 C ATOM 0 H ILE A 158 -10.552 -7.847 2.579 1.00 0.00 H new ATOM 0 HA ILE A 158 -8.820 -5.446 2.206 1.00 0.00 H new ATOM 0 HB ILE A 158 -8.538 -7.847 3.901 1.00 0.00 H new ATOM 0 HG12 ILE A 158 -7.005 -6.016 5.037 1.00 0.00 H new ATOM 0 HG13 ILE A 158 -7.909 -4.916 4.016 1.00 0.00 H new ATOM 0 HG21 ILE A 158 -6.085 -7.767 3.761 1.00 0.00 H new ATOM 0 HG22 ILE A 158 -6.828 -8.277 2.226 1.00 0.00 H new ATOM 0 HG23 ILE A 158 -6.205 -6.619 2.406 1.00 0.00 H new ATOM 0 HD11 ILE A 158 -9.004 -5.165 6.221 1.00 0.00 H new ATOM 0 HD12 ILE A 158 -10.050 -5.805 4.931 1.00 0.00 H new ATOM 0 HD13 ILE A 158 -9.131 -6.922 5.968 1.00 0.00 H new ATOM 385 N LEU A 159 -8.217 -6.216 -0.001 1.00 0.00 N ATOM 386 CA LEU A 159 -7.815 -6.627 -1.335 1.00 0.00 C ATOM 387 C LEU A 159 -6.674 -5.730 -1.818 1.00 0.00 C ATOM 388 O LEU A 159 -6.793 -4.506 -1.802 1.00 0.00 O ATOM 389 CB LEU A 159 -9.020 -6.650 -2.276 1.00 0.00 C ATOM 390 CG LEU A 159 -10.251 -7.407 -1.772 1.00 0.00 C ATOM 391 CD1 LEU A 159 -11.385 -6.440 -1.427 1.00 0.00 C ATOM 392 CD2 LEU A 159 -10.691 -8.471 -2.780 1.00 0.00 C ATOM 0 H LEU A 159 -8.214 -5.208 0.153 1.00 0.00 H new ATOM 0 HA LEU A 159 -7.434 -7.648 -1.320 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -9.312 -5.621 -2.486 1.00 0.00 H new ATOM 0 HB3 LEU A 159 -8.708 -7.092 -3.222 1.00 0.00 H new ATOM 0 HG LEU A 159 -9.980 -7.927 -0.853 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -12.248 -7.003 -1.071 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -11.053 -5.754 -0.648 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -11.663 -5.873 -2.316 1.00 0.00 H new ATOM 0 HD21 LEU A 159 -11.567 -8.994 -2.398 1.00 0.00 H new ATOM 0 HD22 LEU A 159 -10.938 -7.994 -3.728 1.00 0.00 H new ATOM 0 HD23 LEU A 159 -9.881 -9.184 -2.933 1.00 0.00 H new ATOM 404 N ARG A 160 -5.594 -6.372 -2.236 1.00 0.00 N ATOM 405 CA ARG A 160 -4.432 -5.647 -2.723 1.00 0.00 C ATOM 406 C ARG A 160 -4.525 -5.452 -4.238 1.00 0.00 C ATOM 407 O ARG A 160 -5.366 -6.062 -4.896 1.00 0.00 O ATOM 408 CB ARG A 160 -3.138 -6.392 -2.390 1.00 0.00 C ATOM 409 CG ARG A 160 -3.082 -7.742 -3.108 1.00 0.00 C ATOM 410 CD ARG A 160 -2.284 -7.637 -4.410 1.00 0.00 C ATOM 411 NE ARG A 160 -0.837 -7.549 -4.110 1.00 0.00 N ATOM 412 CZ ARG A 160 -0.052 -8.610 -3.879 1.00 0.00 C ATOM 413 NH1 ARG A 160 -0.568 -9.846 -3.911 1.00 0.00 N ATOM 414 NH2 ARG A 160 1.250 -8.435 -3.616 1.00 0.00 N ATOM 0 H ARG A 160 -5.498 -7.387 -2.248 1.00 0.00 H new ATOM 0 HA ARG A 160 -4.416 -4.676 -2.228 1.00 0.00 H new ATOM 0 HB2 ARG A 160 -2.280 -5.786 -2.681 1.00 0.00 H new ATOM 0 HB3 ARG A 160 -3.070 -6.546 -1.313 1.00 0.00 H new ATOM 0 HG2 ARG A 160 -2.625 -8.486 -2.456 1.00 0.00 H new ATOM 0 HG3 ARG A 160 -4.094 -8.086 -3.324 1.00 0.00 H new ATOM 0 HD2 ARG A 160 -2.482 -8.505 -5.039 1.00 0.00 H new ATOM 0 HD3 ARG A 160 -2.602 -6.758 -4.971 1.00 0.00 H new ATOM 0 HE ARG A 160 -0.411 -6.623 -4.077 1.00 0.00 H new ATOM 0 HH11 ARG A 160 -1.559 -9.980 -4.111 1.00 0.00 H new ATOM 0 HH12 ARG A 160 0.030 -10.653 -3.735 1.00 0.00 H new ATOM 0 HH21 ARG A 160 1.643 -7.494 -3.592 1.00 0.00 H new ATOM 0 HH22 ARG A 160 1.848 -9.243 -3.440 1.00 0.00 H new ATOM 428 N ILE A 161 -3.649 -4.598 -4.747 1.00 0.00 N ATOM 429 CA ILE A 161 -3.622 -4.315 -6.172 1.00 0.00 C ATOM 430 C ILE A 161 -2.726 -5.338 -6.874 1.00 0.00 C ATOM 431 O ILE A 161 -1.585 -5.554 -6.464 1.00 0.00 O ATOM 432 CB ILE A 161 -3.210 -2.863 -6.422 1.00 0.00 C ATOM 433 CG1 ILE A 161 -4.260 -1.893 -5.873 1.00 0.00 C ATOM 434 CG2 ILE A 161 -2.926 -2.621 -7.905 1.00 0.00 C ATOM 435 CD1 ILE A 161 -5.630 -2.158 -6.500 1.00 0.00 C ATOM 0 H ILE A 161 -2.953 -4.093 -4.198 1.00 0.00 H new ATOM 0 HA ILE A 161 -4.619 -4.417 -6.600 1.00 0.00 H new ATOM 0 HB ILE A 161 -2.282 -2.673 -5.882 1.00 0.00 H new ATOM 0 HG12 ILE A 161 -4.325 -1.997 -4.790 1.00 0.00 H new ATOM 0 HG13 ILE A 161 -3.955 -0.867 -6.077 1.00 0.00 H new ATOM 0 HG21 ILE A 161 -2.635 -1.581 -8.055 1.00 0.00 H new ATOM 0 HG22 ILE A 161 -2.117 -3.275 -8.232 1.00 0.00 H new ATOM 0 HG23 ILE A 161 -3.823 -2.834 -8.487 1.00 0.00 H new ATOM 0 HD11 ILE A 161 -6.358 -1.456 -6.094 1.00 0.00 H new ATOM 0 HD12 ILE A 161 -5.567 -2.030 -7.581 1.00 0.00 H new ATOM 0 HD13 ILE A 161 -5.943 -3.177 -6.273 1.00 0.00 H new ATOM 447 N ARG A 162 -3.274 -5.939 -7.920 1.00 0.00 N ATOM 448 CA ARG A 162 -2.538 -6.933 -8.681 1.00 0.00 C ATOM 449 C ARG A 162 -2.392 -6.485 -10.137 1.00 0.00 C ATOM 450 O ARG A 162 -1.302 -6.548 -10.703 1.00 0.00 O ATOM 451 CB ARG A 162 -3.243 -8.290 -8.641 1.00 0.00 C ATOM 452 CG ARG A 162 -2.308 -9.409 -9.105 1.00 0.00 C ATOM 453 CD ARG A 162 -2.459 -9.662 -10.606 1.00 0.00 C ATOM 454 NE ARG A 162 -2.875 -11.062 -10.843 1.00 0.00 N ATOM 455 CZ ARG A 162 -3.966 -11.414 -11.537 1.00 0.00 C ATOM 456 NH1 ARG A 162 -4.758 -10.471 -12.066 1.00 0.00 N ATOM 457 NH2 ARG A 162 -4.267 -12.710 -11.701 1.00 0.00 N ATOM 0 H ARG A 162 -4.219 -5.756 -8.258 1.00 0.00 H new ATOM 0 HA ARG A 162 -1.552 -7.035 -8.227 1.00 0.00 H new ATOM 0 HB2 ARG A 162 -3.586 -8.495 -7.627 1.00 0.00 H new ATOM 0 HB3 ARG A 162 -4.127 -8.263 -9.278 1.00 0.00 H new ATOM 0 HG2 ARG A 162 -1.276 -9.142 -8.880 1.00 0.00 H new ATOM 0 HG3 ARG A 162 -2.528 -10.324 -8.554 1.00 0.00 H new ATOM 0 HD2 ARG A 162 -3.197 -8.978 -11.026 1.00 0.00 H new ATOM 0 HD3 ARG A 162 -1.515 -9.463 -11.114 1.00 0.00 H new ATOM 0 HE ARG A 162 -2.295 -11.806 -10.454 1.00 0.00 H new ATOM 0 HH11 ARG A 162 -4.530 -9.485 -11.940 1.00 0.00 H new ATOM 0 HH12 ARG A 162 -5.588 -10.740 -12.594 1.00 0.00 H new ATOM 0 HH21 ARG A 162 -3.666 -13.428 -11.298 1.00 0.00 H new ATOM 0 HH22 ARG A 162 -5.097 -12.978 -12.229 1.00 0.00 H new ATOM 471 N ASP A 163 -3.507 -6.041 -10.701 1.00 0.00 N ATOM 472 CA ASP A 163 -3.516 -5.583 -12.080 1.00 0.00 C ATOM 473 C ASP A 163 -4.555 -4.471 -12.234 1.00 0.00 C ATOM 474 O ASP A 163 -5.546 -4.436 -11.508 1.00 0.00 O ATOM 475 CB ASP A 163 -3.891 -6.717 -13.035 1.00 0.00 C ATOM 476 CG ASP A 163 -2.993 -6.848 -14.266 1.00 0.00 C ATOM 477 OD1 ASP A 163 -2.135 -5.958 -14.440 1.00 0.00 O ATOM 478 OD2 ASP A 163 -3.187 -7.837 -15.007 1.00 0.00 O ATOM 0 H ASP A 163 -4.409 -5.989 -10.228 1.00 0.00 H new ATOM 0 HA ASP A 163 -2.516 -5.224 -12.324 1.00 0.00 H new ATOM 0 HB2 ASP A 163 -3.868 -7.658 -12.485 1.00 0.00 H new ATOM 0 HB3 ASP A 163 -4.918 -6.567 -13.367 1.00 0.00 H new ATOM 483 N LYS A 164 -4.293 -3.589 -13.189 1.00 0.00 N ATOM 484 CA LYS A 164 -5.193 -2.478 -13.448 1.00 0.00 C ATOM 485 C LYS A 164 -5.329 -2.281 -14.960 1.00 0.00 C ATOM 486 O LYS A 164 -5.201 -1.163 -15.457 1.00 0.00 O ATOM 487 CB LYS A 164 -4.727 -1.225 -12.704 1.00 0.00 C ATOM 488 CG LYS A 164 -4.591 -1.497 -11.204 1.00 0.00 C ATOM 489 CD LYS A 164 -3.469 -0.655 -10.594 1.00 0.00 C ATOM 490 CE LYS A 164 -4.031 0.399 -9.638 1.00 0.00 C ATOM 491 NZ LYS A 164 -3.145 1.584 -9.593 1.00 0.00 N ATOM 0 H LYS A 164 -3.471 -3.622 -13.792 1.00 0.00 H new ATOM 0 HA LYS A 164 -6.189 -2.696 -13.063 1.00 0.00 H new ATOM 0 HB2 LYS A 164 -3.769 -0.894 -13.106 1.00 0.00 H new ATOM 0 HB3 LYS A 164 -5.438 -0.415 -12.867 1.00 0.00 H new ATOM 0 HG2 LYS A 164 -5.533 -1.272 -10.703 1.00 0.00 H new ATOM 0 HG3 LYS A 164 -4.387 -2.555 -11.040 1.00 0.00 H new ATOM 0 HD2 LYS A 164 -2.774 -1.302 -10.059 1.00 0.00 H new ATOM 0 HD3 LYS A 164 -2.904 -0.167 -11.388 1.00 0.00 H new ATOM 0 HE2 LYS A 164 -5.029 0.696 -9.961 1.00 0.00 H new ATOM 0 HE3 LYS A 164 -4.132 -0.025 -8.639 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 -3.541 2.289 -8.939 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 -2.201 1.299 -9.264 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 -3.070 1.997 -10.544 1.00 0.00 H new ATOM 505 N PRO A 165 -5.593 -3.412 -15.666 1.00 0.00 N ATOM 506 CA PRO A 165 -5.748 -3.375 -17.109 1.00 0.00 C ATOM 507 C PRO A 165 -7.100 -2.775 -17.500 1.00 0.00 C ATOM 508 O PRO A 165 -7.465 -2.771 -18.675 1.00 0.00 O ATOM 509 CB PRO A 165 -5.587 -4.818 -17.560 1.00 0.00 C ATOM 510 CG PRO A 165 -5.811 -5.669 -16.321 1.00 0.00 C ATOM 511 CD PRO A 165 -5.750 -4.753 -15.110 1.00 0.00 C ATOM 0 HA PRO A 165 -5.011 -2.735 -17.594 1.00 0.00 H new ATOM 0 HB2 PRO A 165 -6.307 -5.066 -18.340 1.00 0.00 H new ATOM 0 HB3 PRO A 165 -4.594 -4.989 -17.977 1.00 0.00 H new ATOM 0 HG2 PRO A 165 -6.777 -6.171 -16.372 1.00 0.00 H new ATOM 0 HG3 PRO A 165 -5.051 -6.447 -16.250 1.00 0.00 H new ATOM 0 HD2 PRO A 165 -6.657 -4.829 -14.510 1.00 0.00 H new ATOM 0 HD3 PRO A 165 -4.915 -5.012 -14.459 1.00 0.00 H new ATOM 519 N GLU A 166 -7.805 -2.280 -16.494 1.00 0.00 N ATOM 520 CA GLU A 166 -9.109 -1.679 -16.717 1.00 0.00 C ATOM 521 C GLU A 166 -9.201 -0.330 -15.999 1.00 0.00 C ATOM 522 O GLU A 166 -8.258 0.085 -15.328 1.00 0.00 O ATOM 523 CB GLU A 166 -10.230 -2.616 -16.269 1.00 0.00 C ATOM 524 CG GLU A 166 -9.856 -4.079 -16.521 1.00 0.00 C ATOM 525 CD GLU A 166 -9.375 -4.751 -15.233 1.00 0.00 C ATOM 526 OE1 GLU A 166 -8.874 -4.011 -14.359 1.00 0.00 O ATOM 527 OE2 GLU A 166 -9.520 -5.990 -15.152 1.00 0.00 O ATOM 0 H GLU A 166 -7.498 -2.283 -15.521 1.00 0.00 H new ATOM 0 HA GLU A 166 -9.230 -1.509 -17.787 1.00 0.00 H new ATOM 0 HB2 GLU A 166 -10.432 -2.466 -15.208 1.00 0.00 H new ATOM 0 HB3 GLU A 166 -11.147 -2.374 -16.806 1.00 0.00 H new ATOM 0 HG2 GLU A 166 -10.719 -4.616 -16.915 1.00 0.00 H new ATOM 0 HG3 GLU A 166 -9.074 -4.133 -17.278 1.00 0.00 H new ATOM 534 N GLU A 167 -10.346 0.315 -16.165 1.00 0.00 N ATOM 535 CA GLU A 167 -10.574 1.607 -15.541 1.00 0.00 C ATOM 536 C GLU A 167 -11.688 1.503 -14.497 1.00 0.00 C ATOM 537 O GLU A 167 -12.644 0.752 -14.678 1.00 0.00 O ATOM 538 CB GLU A 167 -10.903 2.672 -16.589 1.00 0.00 C ATOM 539 CG GLU A 167 -9.626 3.250 -17.204 1.00 0.00 C ATOM 540 CD GLU A 167 -9.441 4.716 -16.807 1.00 0.00 C ATOM 541 OE1 GLU A 167 -10.119 5.562 -17.430 1.00 0.00 O ATOM 542 OE2 GLU A 167 -8.626 4.957 -15.891 1.00 0.00 O ATOM 0 H GLU A 167 -11.126 -0.033 -16.723 1.00 0.00 H new ATOM 0 HA GLU A 167 -9.657 1.912 -15.037 1.00 0.00 H new ATOM 0 HB2 GLU A 167 -11.523 2.237 -17.372 1.00 0.00 H new ATOM 0 HB3 GLU A 167 -11.484 3.472 -16.130 1.00 0.00 H new ATOM 0 HG2 GLU A 167 -8.764 2.669 -16.875 1.00 0.00 H new ATOM 0 HG3 GLU A 167 -9.671 3.166 -18.290 1.00 0.00 H new ATOM 549 N GLN A 168 -11.526 2.270 -13.428 1.00 0.00 N ATOM 550 CA GLN A 168 -12.505 2.273 -12.355 1.00 0.00 C ATOM 551 C GLN A 168 -12.358 1.015 -11.497 1.00 0.00 C ATOM 552 O GLN A 168 -12.239 1.102 -10.276 1.00 0.00 O ATOM 553 CB GLN A 168 -13.927 2.394 -12.910 1.00 0.00 C ATOM 554 CG GLN A 168 -14.061 3.625 -13.808 1.00 0.00 C ATOM 555 CD GLN A 168 -15.192 3.443 -14.823 1.00 0.00 C ATOM 556 OE1 GLN A 168 -16.189 2.786 -14.568 1.00 0.00 O ATOM 557 NE2 GLN A 168 -14.984 4.060 -15.982 1.00 0.00 N ATOM 0 H GLN A 168 -10.732 2.893 -13.283 1.00 0.00 H new ATOM 0 HA GLN A 168 -12.320 3.143 -11.725 1.00 0.00 H new ATOM 0 HB2 GLN A 168 -14.178 1.497 -13.476 1.00 0.00 H new ATOM 0 HB3 GLN A 168 -14.638 2.461 -12.087 1.00 0.00 H new ATOM 0 HG2 GLN A 168 -14.255 4.506 -13.196 1.00 0.00 H new ATOM 0 HG3 GLN A 168 -13.122 3.801 -14.332 1.00 0.00 H new ATOM 0 HE21 GLN A 168 -14.127 4.593 -16.129 1.00 0.00 H new ATOM 0 HE22 GLN A 168 -15.681 4.000 -16.724 1.00 0.00 H new ATOM 566 N TRP A 169 -12.370 -0.126 -12.170 1.00 0.00 N ATOM 567 CA TRP A 169 -12.238 -1.400 -11.484 1.00 0.00 C ATOM 568 C TRP A 169 -10.827 -1.934 -11.742 1.00 0.00 C ATOM 569 O TRP A 169 -10.330 -1.865 -12.865 1.00 0.00 O ATOM 570 CB TRP A 169 -13.334 -2.375 -11.922 1.00 0.00 C ATOM 571 CG TRP A 169 -14.753 -1.819 -11.781 1.00 0.00 C ATOM 572 CD1 TRP A 169 -15.348 -0.878 -12.526 1.00 0.00 C ATOM 573 CD2 TRP A 169 -15.736 -2.212 -10.801 1.00 0.00 C ATOM 574 NE1 TRP A 169 -16.638 -0.636 -12.100 1.00 0.00 N ATOM 575 CE2 TRP A 169 -16.882 -1.472 -11.017 1.00 0.00 C ATOM 576 CE3 TRP A 169 -15.661 -3.161 -9.766 1.00 0.00 C ATOM 577 CZ2 TRP A 169 -18.038 -1.605 -10.239 1.00 0.00 C ATOM 578 CZ3 TRP A 169 -16.826 -3.280 -8.997 1.00 0.00 C ATOM 579 CH2 TRP A 169 -17.986 -2.544 -9.202 1.00 0.00 C ATOM 0 H TRP A 169 -12.469 -0.195 -13.183 1.00 0.00 H new ATOM 0 HA TRP A 169 -12.371 -1.274 -10.410 1.00 0.00 H new ATOM 0 HB2 TRP A 169 -13.165 -2.652 -12.962 1.00 0.00 H new ATOM 0 HB3 TRP A 169 -13.252 -3.287 -11.332 1.00 0.00 H new ATOM 0 HD1 TRP A 169 -14.877 -0.372 -13.356 1.00 0.00 H new ATOM 0 HE1 TRP A 169 -17.292 0.033 -12.505 1.00 0.00 H new ATOM 0 HE3 TRP A 169 -14.776 -3.751 -9.579 1.00 0.00 H new ATOM 0 HZ2 TRP A 169 -18.922 -1.015 -10.429 1.00 0.00 H new ATOM 0 HZ3 TRP A 169 -16.822 -3.995 -8.187 1.00 0.00 H new ATOM 0 HH2 TRP A 169 -18.844 -2.696 -8.564 1.00 0.00 H new ATOM 590 N TRP A 170 -10.222 -2.452 -10.683 1.00 0.00 N ATOM 591 CA TRP A 170 -8.878 -2.996 -10.781 1.00 0.00 C ATOM 592 C TRP A 170 -8.911 -4.433 -10.260 1.00 0.00 C ATOM 593 O TRP A 170 -9.791 -4.794 -9.479 1.00 0.00 O ATOM 594 CB TRP A 170 -7.874 -2.113 -10.038 1.00 0.00 C ATOM 595 CG TRP A 170 -7.814 -0.671 -10.549 1.00 0.00 C ATOM 596 CD1 TRP A 170 -8.087 -0.222 -11.782 1.00 0.00 C ATOM 597 CD2 TRP A 170 -7.444 0.497 -9.787 1.00 0.00 C ATOM 598 NE1 TRP A 170 -7.922 1.146 -11.869 1.00 0.00 N ATOM 599 CE2 TRP A 170 -7.518 1.596 -10.617 1.00 0.00 C ATOM 600 CE3 TRP A 170 -7.061 0.620 -8.440 1.00 0.00 C ATOM 601 CZ2 TRP A 170 -7.222 2.898 -10.194 1.00 0.00 C ATOM 602 CZ3 TRP A 170 -6.769 1.927 -8.033 1.00 0.00 C ATOM 603 CH2 TRP A 170 -6.838 3.044 -8.856 1.00 0.00 C ATOM 0 H TRP A 170 -10.638 -2.506 -9.753 1.00 0.00 H new ATOM 0 HA TRP A 170 -8.542 -3.010 -11.818 1.00 0.00 H new ATOM 0 HB2 TRP A 170 -8.130 -2.102 -8.979 1.00 0.00 H new ATOM 0 HB3 TRP A 170 -6.883 -2.559 -10.121 1.00 0.00 H new ATOM 0 HD1 TRP A 170 -8.397 -0.851 -12.604 1.00 0.00 H new ATOM 0 HE1 TRP A 170 -8.069 1.721 -12.699 1.00 0.00 H new ATOM 0 HE3 TRP A 170 -6.997 -0.227 -7.772 1.00 0.00 H new ATOM 0 HZ2 TRP A 170 -7.287 3.743 -10.864 1.00 0.00 H new ATOM 0 HZ3 TRP A 170 -6.469 2.078 -7.007 1.00 0.00 H new ATOM 0 HH2 TRP A 170 -6.596 4.021 -8.465 1.00 0.00 H new ATOM 614 N ASN A 171 -7.941 -5.215 -10.712 1.00 0.00 N ATOM 615 CA ASN A 171 -7.848 -6.606 -10.300 1.00 0.00 C ATOM 616 C ASN A 171 -7.085 -6.692 -8.977 1.00 0.00 C ATOM 617 O ASN A 171 -5.860 -6.796 -8.968 1.00 0.00 O ATOM 618 CB ASN A 171 -7.090 -7.437 -11.337 1.00 0.00 C ATOM 619 CG ASN A 171 -8.058 -8.220 -12.226 1.00 0.00 C ATOM 620 OD1 ASN A 171 -9.089 -8.706 -11.789 1.00 0.00 O ATOM 621 ND2 ASN A 171 -7.672 -8.314 -13.495 1.00 0.00 N ATOM 0 H ASN A 171 -7.213 -4.912 -11.359 1.00 0.00 H new ATOM 0 HA ASN A 171 -8.861 -6.995 -10.195 1.00 0.00 H new ATOM 0 HB2 ASN A 171 -6.474 -6.782 -11.953 1.00 0.00 H new ATOM 0 HB3 ASN A 171 -6.415 -8.128 -10.832 1.00 0.00 H new ATOM 0 HD21 ASN A 171 -8.251 -8.816 -14.168 1.00 0.00 H new ATOM 0 HD22 ASN A 171 -6.797 -7.884 -13.795 1.00 0.00 H new ATOM 628 N ALA A 172 -7.842 -6.643 -7.890 1.00 0.00 N ATOM 629 CA ALA A 172 -7.253 -6.714 -6.564 1.00 0.00 C ATOM 630 C ALA A 172 -7.181 -8.177 -6.120 1.00 0.00 C ATOM 631 O ALA A 172 -8.025 -8.986 -6.500 1.00 0.00 O ATOM 632 CB ALA A 172 -8.066 -5.851 -5.597 1.00 0.00 C ATOM 0 H ALA A 172 -8.858 -6.555 -7.901 1.00 0.00 H new ATOM 0 HA ALA A 172 -6.236 -6.322 -6.575 1.00 0.00 H new ATOM 0 HB1 ALA A 172 -7.624 -5.904 -4.602 1.00 0.00 H new ATOM 0 HB2 ALA A 172 -8.062 -4.817 -5.941 1.00 0.00 H new ATOM 0 HB3 ALA A 172 -9.092 -6.216 -5.558 1.00 0.00 H new ATOM 638 N GLU A 173 -6.166 -8.470 -5.320 1.00 0.00 N ATOM 639 CA GLU A 173 -5.973 -9.821 -4.821 1.00 0.00 C ATOM 640 C GLU A 173 -6.379 -9.905 -3.349 1.00 0.00 C ATOM 641 O GLU A 173 -5.704 -9.351 -2.482 1.00 0.00 O ATOM 642 CB GLU A 173 -4.526 -10.277 -5.018 1.00 0.00 C ATOM 643 CG GLU A 173 -4.379 -11.773 -4.734 1.00 0.00 C ATOM 644 CD GLU A 173 -3.731 -12.012 -3.370 1.00 0.00 C ATOM 645 OE1 GLU A 173 -3.850 -11.104 -2.518 1.00 0.00 O ATOM 646 OE2 GLU A 173 -3.132 -13.097 -3.207 1.00 0.00 O ATOM 0 H GLU A 173 -5.469 -7.795 -5.005 1.00 0.00 H new ATOM 0 HA GLU A 173 -6.612 -10.494 -5.393 1.00 0.00 H new ATOM 0 HB2 GLU A 173 -4.210 -10.064 -6.039 1.00 0.00 H new ATOM 0 HB3 GLU A 173 -3.870 -9.711 -4.357 1.00 0.00 H new ATOM 0 HG2 GLU A 173 -5.359 -12.250 -4.764 1.00 0.00 H new ATOM 0 HG3 GLU A 173 -3.775 -12.237 -5.514 1.00 0.00 H new ATOM 653 N ASP A 174 -7.480 -10.603 -3.110 1.00 0.00 N ATOM 654 CA ASP A 174 -7.984 -10.766 -1.757 1.00 0.00 C ATOM 655 C ASP A 174 -6.894 -11.390 -0.884 1.00 0.00 C ATOM 656 O ASP A 174 -5.838 -11.774 -1.383 1.00 0.00 O ATOM 657 CB ASP A 174 -9.200 -11.695 -1.731 1.00 0.00 C ATOM 658 CG ASP A 174 -10.461 -11.091 -1.110 1.00 0.00 C ATOM 659 OD1 ASP A 174 -10.315 -10.432 -0.058 1.00 0.00 O ATOM 660 OD2 ASP A 174 -11.542 -11.304 -1.701 1.00 0.00 O ATOM 0 H ASP A 174 -8.037 -11.062 -3.831 1.00 0.00 H new ATOM 0 HA ASP A 174 -8.272 -9.784 -1.383 1.00 0.00 H new ATOM 0 HB2 ASP A 174 -9.427 -12.001 -2.752 1.00 0.00 H new ATOM 0 HB3 ASP A 174 -8.937 -12.597 -1.179 1.00 0.00 H new ATOM 665 N SER A 175 -7.188 -11.471 0.405 1.00 0.00 N ATOM 666 CA SER A 175 -6.246 -12.041 1.353 1.00 0.00 C ATOM 667 C SER A 175 -6.375 -13.565 1.368 1.00 0.00 C ATOM 668 O SER A 175 -6.074 -14.208 2.372 1.00 0.00 O ATOM 669 CB SER A 175 -6.468 -11.477 2.758 1.00 0.00 C ATOM 670 OG SER A 175 -5.239 -11.176 3.413 1.00 0.00 O ATOM 0 H SER A 175 -8.065 -11.151 0.815 1.00 0.00 H new ATOM 0 HA SER A 175 -5.239 -11.771 1.037 1.00 0.00 H new ATOM 0 HB2 SER A 175 -7.075 -10.574 2.694 1.00 0.00 H new ATOM 0 HB3 SER A 175 -7.029 -12.197 3.353 1.00 0.00 H new ATOM 0 HG SER A 175 -5.424 -10.817 4.306 1.00 0.00 H new ATOM 676 N GLU A 176 -6.824 -14.100 0.241 1.00 0.00 N ATOM 677 CA GLU A 176 -6.997 -15.537 0.111 1.00 0.00 C ATOM 678 C GLU A 176 -6.463 -16.015 -1.241 1.00 0.00 C ATOM 679 O GLU A 176 -6.503 -17.207 -1.541 1.00 0.00 O ATOM 680 CB GLU A 176 -8.464 -15.931 0.292 1.00 0.00 C ATOM 681 CG GLU A 176 -8.827 -16.023 1.777 1.00 0.00 C ATOM 682 CD GLU A 176 -10.344 -15.985 1.973 1.00 0.00 C ATOM 683 OE1 GLU A 176 -11.006 -15.317 1.150 1.00 0.00 O ATOM 684 OE2 GLU A 176 -10.807 -16.626 2.941 1.00 0.00 O ATOM 0 H GLU A 176 -7.073 -13.564 -0.590 1.00 0.00 H new ATOM 0 HA GLU A 176 -6.424 -16.026 0.899 1.00 0.00 H new ATOM 0 HB2 GLU A 176 -9.105 -15.198 -0.198 1.00 0.00 H new ATOM 0 HB3 GLU A 176 -8.649 -16.890 -0.192 1.00 0.00 H new ATOM 0 HG2 GLU A 176 -8.425 -16.945 2.197 1.00 0.00 H new ATOM 0 HG3 GLU A 176 -8.366 -15.198 2.320 1.00 0.00 H new ATOM 691 N GLY A 177 -5.978 -15.060 -2.022 1.00 0.00 N ATOM 692 CA GLY A 177 -5.438 -15.369 -3.335 1.00 0.00 C ATOM 693 C GLY A 177 -6.488 -15.147 -4.425 1.00 0.00 C ATOM 694 O GLY A 177 -6.187 -15.254 -5.613 1.00 0.00 O ATOM 0 H GLY A 177 -5.948 -14.072 -1.770 1.00 0.00 H new ATOM 0 HA2 GLY A 177 -4.567 -14.743 -3.531 1.00 0.00 H new ATOM 0 HA3 GLY A 177 -5.098 -16.404 -3.358 1.00 0.00 H new ATOM 698 N LYS A 178 -7.698 -14.839 -3.983 1.00 0.00 N ATOM 699 CA LYS A 178 -8.795 -14.600 -4.906 1.00 0.00 C ATOM 700 C LYS A 178 -8.558 -13.279 -5.641 1.00 0.00 C ATOM 701 O LYS A 178 -8.787 -12.206 -5.085 1.00 0.00 O ATOM 702 CB LYS A 178 -10.136 -14.665 -4.175 1.00 0.00 C ATOM 703 CG LYS A 178 -11.289 -14.288 -5.107 1.00 0.00 C ATOM 704 CD LYS A 178 -11.737 -15.492 -5.939 1.00 0.00 C ATOM 705 CE LYS A 178 -11.475 -15.257 -7.428 1.00 0.00 C ATOM 706 NZ LYS A 178 -10.172 -15.837 -7.824 1.00 0.00 N ATOM 0 H LYS A 178 -7.943 -14.749 -2.997 1.00 0.00 H new ATOM 0 HA LYS A 178 -8.834 -15.384 -5.662 1.00 0.00 H new ATOM 0 HB2 LYS A 178 -10.293 -15.671 -3.785 1.00 0.00 H new ATOM 0 HB3 LYS A 178 -10.120 -13.990 -3.319 1.00 0.00 H new ATOM 0 HG2 LYS A 178 -12.128 -13.914 -4.520 1.00 0.00 H new ATOM 0 HG3 LYS A 178 -10.977 -13.480 -5.769 1.00 0.00 H new ATOM 0 HD2 LYS A 178 -11.206 -16.385 -5.609 1.00 0.00 H new ATOM 0 HD3 LYS A 178 -12.799 -15.675 -5.777 1.00 0.00 H new ATOM 0 HE2 LYS A 178 -12.274 -15.705 -8.019 1.00 0.00 H new ATOM 0 HE3 LYS A 178 -11.483 -14.188 -7.640 1.00 0.00 H new ATOM 0 HZ1 LYS A 178 -10.285 -16.372 -8.709 1.00 0.00 H new ATOM 0 HZ2 LYS A 178 -9.481 -15.073 -7.967 1.00 0.00 H new ATOM 0 HZ3 LYS A 178 -9.834 -16.474 -7.075 1.00 0.00 H new ATOM 720 N ARG A 179 -8.103 -13.400 -6.879 1.00 0.00 N ATOM 721 CA ARG A 179 -7.833 -12.230 -7.696 1.00 0.00 C ATOM 722 C ARG A 179 -9.045 -11.900 -8.568 1.00 0.00 C ATOM 723 O ARG A 179 -9.439 -12.697 -9.417 1.00 0.00 O ATOM 724 CB ARG A 179 -6.613 -12.453 -8.593 1.00 0.00 C ATOM 725 CG ARG A 179 -5.389 -12.852 -7.766 1.00 0.00 C ATOM 726 CD ARG A 179 -4.384 -13.630 -8.616 1.00 0.00 C ATOM 727 NE ARG A 179 -3.677 -14.626 -7.779 1.00 0.00 N ATOM 728 CZ ARG A 179 -2.560 -14.367 -7.085 1.00 0.00 C ATOM 729 NH1 ARG A 179 -2.016 -13.143 -7.123 1.00 0.00 N ATOM 730 NH2 ARG A 179 -1.988 -15.332 -6.352 1.00 0.00 N ATOM 0 H ARG A 179 -7.914 -14.292 -7.337 1.00 0.00 H new ATOM 0 HA ARG A 179 -7.628 -11.397 -7.024 1.00 0.00 H new ATOM 0 HB2 ARG A 179 -6.832 -13.232 -9.324 1.00 0.00 H new ATOM 0 HB3 ARG A 179 -6.397 -11.543 -9.152 1.00 0.00 H new ATOM 0 HG2 ARG A 179 -4.913 -11.959 -7.360 1.00 0.00 H new ATOM 0 HG3 ARG A 179 -5.701 -13.461 -6.918 1.00 0.00 H new ATOM 0 HD2 ARG A 179 -4.899 -14.131 -9.435 1.00 0.00 H new ATOM 0 HD3 ARG A 179 -3.666 -12.943 -9.064 1.00 0.00 H new ATOM 0 HE ARG A 179 -4.064 -15.568 -7.727 1.00 0.00 H new ATOM 0 HH11 ARG A 179 -2.452 -12.408 -7.680 1.00 0.00 H new ATOM 0 HH12 ARG A 179 -1.166 -12.946 -6.595 1.00 0.00 H new ATOM 0 HH21 ARG A 179 -2.403 -16.263 -6.322 1.00 0.00 H new ATOM 0 HH22 ARG A 179 -1.138 -15.135 -5.824 1.00 0.00 H new ATOM 744 N GLY A 180 -9.603 -10.722 -8.328 1.00 0.00 N ATOM 745 CA GLY A 180 -10.763 -10.277 -9.081 1.00 0.00 C ATOM 746 C GLY A 180 -10.801 -8.750 -9.178 1.00 0.00 C ATOM 747 O GLY A 180 -9.871 -8.073 -8.742 1.00 0.00 O ATOM 0 H GLY A 180 -9.273 -10.063 -7.623 1.00 0.00 H new ATOM 0 HA2 GLY A 180 -10.739 -10.708 -10.082 1.00 0.00 H new ATOM 0 HA3 GLY A 180 -11.673 -10.637 -8.601 1.00 0.00 H new ATOM 751 N MET A 181 -11.885 -8.252 -9.754 1.00 0.00 N ATOM 752 CA MET A 181 -12.056 -6.818 -9.915 1.00 0.00 C ATOM 753 C MET A 181 -12.624 -6.187 -8.642 1.00 0.00 C ATOM 754 O MET A 181 -13.495 -6.767 -7.992 1.00 0.00 O ATOM 755 CB MET A 181 -13.001 -6.544 -11.086 1.00 0.00 C ATOM 756 CG MET A 181 -12.232 -6.024 -12.301 1.00 0.00 C ATOM 757 SD MET A 181 -13.348 -5.202 -13.425 1.00 0.00 S ATOM 758 CE MET A 181 -13.467 -6.441 -14.705 1.00 0.00 C ATOM 0 H MET A 181 -12.654 -8.816 -10.115 1.00 0.00 H new ATOM 0 HA MET A 181 -11.080 -6.375 -10.113 1.00 0.00 H new ATOM 0 HB2 MET A 181 -13.532 -7.458 -11.351 1.00 0.00 H new ATOM 0 HB3 MET A 181 -13.753 -5.814 -10.788 1.00 0.00 H new ATOM 0 HG2 MET A 181 -11.452 -5.333 -11.980 1.00 0.00 H new ATOM 0 HG3 MET A 181 -11.736 -6.851 -12.809 1.00 0.00 H new ATOM 0 HE1 MET A 181 -14.132 -6.087 -15.493 1.00 0.00 H new ATOM 0 HE2 MET A 181 -12.478 -6.630 -15.122 1.00 0.00 H new ATOM 0 HE3 MET A 181 -13.864 -7.364 -14.282 1.00 0.00 H new ATOM 768 N ILE A 182 -12.110 -5.009 -8.322 1.00 0.00 N ATOM 769 CA ILE A 182 -12.556 -4.294 -7.139 1.00 0.00 C ATOM 770 C ILE A 182 -12.652 -2.800 -7.457 1.00 0.00 C ATOM 771 O ILE A 182 -11.849 -2.271 -8.225 1.00 0.00 O ATOM 772 CB ILE A 182 -11.648 -4.610 -5.948 1.00 0.00 C ATOM 773 CG1 ILE A 182 -12.235 -5.740 -5.097 1.00 0.00 C ATOM 774 CG2 ILE A 182 -11.370 -3.354 -5.120 1.00 0.00 C ATOM 775 CD1 ILE A 182 -13.489 -5.272 -4.357 1.00 0.00 C ATOM 0 H ILE A 182 -11.388 -4.531 -8.862 1.00 0.00 H new ATOM 0 HA ILE A 182 -13.553 -4.624 -6.848 1.00 0.00 H new ATOM 0 HB ILE A 182 -10.690 -4.959 -6.332 1.00 0.00 H new ATOM 0 HG12 ILE A 182 -12.480 -6.590 -5.734 1.00 0.00 H new ATOM 0 HG13 ILE A 182 -11.491 -6.083 -4.378 1.00 0.00 H new ATOM 0 HG21 ILE A 182 -10.723 -3.608 -4.281 1.00 0.00 H new ATOM 0 HG22 ILE A 182 -10.879 -2.608 -5.745 1.00 0.00 H new ATOM 0 HG23 ILE A 182 -12.310 -2.950 -4.744 1.00 0.00 H new ATOM 0 HD11 ILE A 182 -13.887 -6.093 -3.760 1.00 0.00 H new ATOM 0 HD12 ILE A 182 -13.236 -4.437 -3.703 1.00 0.00 H new ATOM 0 HD13 ILE A 182 -14.240 -4.952 -5.080 1.00 0.00 H new ATOM 787 N PRO A 183 -13.669 -2.145 -6.835 1.00 0.00 N ATOM 788 CA PRO A 183 -13.883 -0.723 -7.044 1.00 0.00 C ATOM 789 C PRO A 183 -12.841 0.104 -6.288 1.00 0.00 C ATOM 790 O PRO A 183 -12.510 -0.203 -5.143 1.00 0.00 O ATOM 791 CB PRO A 183 -15.303 -0.464 -6.572 1.00 0.00 C ATOM 792 CG PRO A 183 -15.671 -1.646 -5.690 1.00 0.00 C ATOM 793 CD PRO A 183 -14.640 -2.739 -5.920 1.00 0.00 C ATOM 0 HA PRO A 183 -13.766 -0.429 -8.087 1.00 0.00 H new ATOM 0 HB2 PRO A 183 -15.365 0.472 -6.017 1.00 0.00 H new ATOM 0 HB3 PRO A 183 -15.986 -0.380 -7.417 1.00 0.00 H new ATOM 0 HG2 PRO A 183 -15.685 -1.350 -4.641 1.00 0.00 H new ATOM 0 HG3 PRO A 183 -16.670 -2.007 -5.933 1.00 0.00 H new ATOM 0 HD2 PRO A 183 -14.169 -3.042 -4.985 1.00 0.00 H new ATOM 0 HD3 PRO A 183 -15.097 -3.630 -6.351 1.00 0.00 H new ATOM 801 N VAL A 184 -12.352 1.137 -6.959 1.00 0.00 N ATOM 802 CA VAL A 184 -11.355 2.011 -6.364 1.00 0.00 C ATOM 803 C VAL A 184 -12.046 3.000 -5.423 1.00 0.00 C ATOM 804 O VAL A 184 -11.472 3.408 -4.414 1.00 0.00 O ATOM 805 CB VAL A 184 -10.541 2.700 -7.462 1.00 0.00 C ATOM 806 CG1 VAL A 184 -9.501 3.647 -6.860 1.00 0.00 C ATOM 807 CG2 VAL A 184 -9.880 1.670 -8.380 1.00 0.00 C ATOM 0 H VAL A 184 -12.628 1.388 -7.908 1.00 0.00 H new ATOM 0 HA VAL A 184 -10.649 1.434 -5.767 1.00 0.00 H new ATOM 0 HB VAL A 184 -11.226 3.296 -8.065 1.00 0.00 H new ATOM 0 HG11 VAL A 184 -8.936 4.124 -7.661 1.00 0.00 H new ATOM 0 HG12 VAL A 184 -10.004 4.410 -6.267 1.00 0.00 H new ATOM 0 HG13 VAL A 184 -8.821 3.082 -6.223 1.00 0.00 H new ATOM 0 HG21 VAL A 184 -9.308 2.185 -9.152 1.00 0.00 H new ATOM 0 HG22 VAL A 184 -9.213 1.036 -7.795 1.00 0.00 H new ATOM 0 HG23 VAL A 184 -10.648 1.054 -8.848 1.00 0.00 H new ATOM 817 N PRO A 185 -13.300 3.368 -5.796 1.00 0.00 N ATOM 818 CA PRO A 185 -14.076 4.302 -4.997 1.00 0.00 C ATOM 819 C PRO A 185 -14.612 3.628 -3.733 1.00 0.00 C ATOM 820 O PRO A 185 -14.688 4.253 -2.676 1.00 0.00 O ATOM 821 CB PRO A 185 -15.178 4.792 -5.922 1.00 0.00 C ATOM 822 CG PRO A 185 -15.260 3.774 -7.048 1.00 0.00 C ATOM 823 CD PRO A 185 -14.012 2.907 -6.985 1.00 0.00 C ATOM 0 HA PRO A 185 -13.480 5.139 -4.632 1.00 0.00 H new ATOM 0 HB2 PRO A 185 -16.128 4.866 -5.393 1.00 0.00 H new ATOM 0 HB3 PRO A 185 -14.950 5.785 -6.309 1.00 0.00 H new ATOM 0 HG2 PRO A 185 -16.156 3.162 -6.944 1.00 0.00 H new ATOM 0 HG3 PRO A 185 -15.327 4.277 -8.013 1.00 0.00 H new ATOM 0 HD2 PRO A 185 -14.267 1.850 -6.909 1.00 0.00 H new ATOM 0 HD3 PRO A 185 -13.403 3.024 -7.881 1.00 0.00 H new ATOM 831 N TYR A 186 -14.970 2.361 -3.882 1.00 0.00 N ATOM 832 CA TYR A 186 -15.497 1.595 -2.766 1.00 0.00 C ATOM 833 C TYR A 186 -14.376 0.861 -2.027 1.00 0.00 C ATOM 834 O TYR A 186 -14.581 -0.239 -1.517 1.00 0.00 O ATOM 835 CB TYR A 186 -16.450 0.565 -3.373 1.00 0.00 C ATOM 836 CG TYR A 186 -17.931 0.913 -3.206 1.00 0.00 C ATOM 837 CD1 TYR A 186 -18.519 1.845 -4.037 1.00 0.00 C ATOM 838 CD2 TYR A 186 -18.678 0.294 -2.225 1.00 0.00 C ATOM 839 CE1 TYR A 186 -19.913 2.172 -3.879 1.00 0.00 C ATOM 840 CE2 TYR A 186 -20.071 0.622 -2.066 1.00 0.00 C ATOM 841 CZ TYR A 186 -20.620 1.544 -2.902 1.00 0.00 C ATOM 842 OH TYR A 186 -21.936 1.853 -2.753 1.00 0.00 O ATOM 0 H TYR A 186 -14.905 1.846 -4.760 1.00 0.00 H new ATOM 0 HA TYR A 186 -15.992 2.251 -2.050 1.00 0.00 H new ATOM 0 HB2 TYR A 186 -16.229 0.462 -4.435 1.00 0.00 H new ATOM 0 HB3 TYR A 186 -16.261 -0.405 -2.913 1.00 0.00 H new ATOM 0 HD1 TYR A 186 -17.934 2.329 -4.805 1.00 0.00 H new ATOM 0 HD2 TYR A 186 -18.218 -0.437 -1.576 1.00 0.00 H new ATOM 0 HE1 TYR A 186 -20.386 2.900 -4.522 1.00 0.00 H new ATOM 0 HE2 TYR A 186 -20.666 0.147 -1.300 1.00 0.00 H new ATOM 0 HH TYR A 186 -22.314 1.327 -2.018 1.00 0.00 H new ATOM 852 N VAL A 187 -13.216 1.500 -1.993 1.00 0.00 N ATOM 853 CA VAL A 187 -12.063 0.922 -1.324 1.00 0.00 C ATOM 854 C VAL A 187 -11.146 2.046 -0.834 1.00 0.00 C ATOM 855 O VAL A 187 -11.417 3.221 -1.073 1.00 0.00 O ATOM 856 CB VAL A 187 -11.355 -0.062 -2.258 1.00 0.00 C ATOM 857 CG1 VAL A 187 -12.296 -1.195 -2.672 1.00 0.00 C ATOM 858 CG2 VAL A 187 -10.788 0.657 -3.484 1.00 0.00 C ATOM 0 H VAL A 187 -13.050 2.412 -2.418 1.00 0.00 H new ATOM 0 HA VAL A 187 -12.375 0.352 -0.449 1.00 0.00 H new ATOM 0 HB VAL A 187 -10.520 -0.502 -1.713 1.00 0.00 H new ATOM 0 HG11 VAL A 187 -11.770 -1.881 -3.336 1.00 0.00 H new ATOM 0 HG12 VAL A 187 -12.630 -1.733 -1.785 1.00 0.00 H new ATOM 0 HG13 VAL A 187 -13.160 -0.779 -3.191 1.00 0.00 H new ATOM 0 HG21 VAL A 187 -10.290 -0.065 -4.131 1.00 0.00 H new ATOM 0 HG22 VAL A 187 -11.599 1.137 -4.032 1.00 0.00 H new ATOM 0 HG23 VAL A 187 -10.070 1.412 -3.163 1.00 0.00 H new ATOM 868 N GLU A 188 -10.079 1.643 -0.159 1.00 0.00 N ATOM 869 CA GLU A 188 -9.121 2.600 0.366 1.00 0.00 C ATOM 870 C GLU A 188 -7.722 1.985 0.405 1.00 0.00 C ATOM 871 O GLU A 188 -7.571 0.768 0.296 1.00 0.00 O ATOM 872 CB GLU A 188 -9.542 3.095 1.752 1.00 0.00 C ATOM 873 CG GLU A 188 -8.877 4.432 2.083 1.00 0.00 C ATOM 874 CD GLU A 188 -9.890 5.419 2.666 1.00 0.00 C ATOM 875 OE1 GLU A 188 -10.750 4.955 3.446 1.00 0.00 O ATOM 876 OE2 GLU A 188 -9.781 6.615 2.320 1.00 0.00 O ATOM 0 H GLU A 188 -9.857 0.667 0.036 1.00 0.00 H new ATOM 0 HA GLU A 188 -9.098 3.463 -0.300 1.00 0.00 H new ATOM 0 HB2 GLU A 188 -10.626 3.205 1.789 1.00 0.00 H new ATOM 0 HB3 GLU A 188 -9.271 2.354 2.504 1.00 0.00 H new ATOM 0 HG2 GLU A 188 -8.067 4.273 2.795 1.00 0.00 H new ATOM 0 HG3 GLU A 188 -8.431 4.853 1.182 1.00 0.00 H new ATOM 883 N LYS A 189 -6.732 2.851 0.563 1.00 0.00 N ATOM 884 CA LYS A 189 -5.349 2.407 0.619 1.00 0.00 C ATOM 885 C LYS A 189 -4.993 2.041 2.062 1.00 0.00 C ATOM 886 O LYS A 189 -4.960 2.907 2.935 1.00 0.00 O ATOM 887 CB LYS A 189 -4.424 3.458 0.004 1.00 0.00 C ATOM 888 CG LYS A 189 -4.413 4.737 0.843 1.00 0.00 C ATOM 889 CD LYS A 189 -4.519 5.977 -0.047 1.00 0.00 C ATOM 890 CE LYS A 189 -5.978 6.279 -0.398 1.00 0.00 C ATOM 891 NZ LYS A 189 -6.361 5.590 -1.650 1.00 0.00 N ATOM 0 H LYS A 189 -6.860 3.859 0.654 1.00 0.00 H new ATOM 0 HA LYS A 189 -5.213 1.507 0.019 1.00 0.00 H new ATOM 0 HB2 LYS A 189 -3.412 3.059 -0.070 1.00 0.00 H new ATOM 0 HB3 LYS A 189 -4.751 3.687 -1.010 1.00 0.00 H new ATOM 0 HG2 LYS A 189 -5.243 4.720 1.549 1.00 0.00 H new ATOM 0 HG3 LYS A 189 -3.496 4.783 1.430 1.00 0.00 H new ATOM 0 HD2 LYS A 189 -4.080 6.834 0.464 1.00 0.00 H new ATOM 0 HD3 LYS A 189 -3.946 5.823 -0.961 1.00 0.00 H new ATOM 0 HE2 LYS A 189 -6.628 5.957 0.415 1.00 0.00 H new ATOM 0 HE3 LYS A 189 -6.117 7.354 -0.510 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 -6.972 6.213 -2.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 -5.506 5.357 -2.194 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 -6.875 4.715 -1.422 1.00 0.00 H new ATOM 905 N TYR A 190 -4.737 0.757 2.267 1.00 0.00 N ATOM 906 CA TYR A 190 -4.384 0.267 3.588 1.00 0.00 C ATOM 907 C TYR A 190 -2.932 0.606 3.930 1.00 0.00 C ATOM 908 O TYR A 190 -2.649 1.118 5.013 1.00 0.00 O ATOM 909 CB TYR A 190 -4.539 -1.254 3.529 1.00 0.00 C ATOM 910 CG TYR A 190 -3.721 -2.004 4.581 1.00 0.00 C ATOM 911 CD1 TYR A 190 -3.659 -1.529 5.875 1.00 0.00 C ATOM 912 CD2 TYR A 190 -3.045 -3.157 4.236 1.00 0.00 C ATOM 913 CE1 TYR A 190 -2.889 -2.235 6.866 1.00 0.00 C ATOM 914 CE2 TYR A 190 -2.275 -3.864 5.227 1.00 0.00 C ATOM 915 CZ TYR A 190 -2.235 -3.368 6.493 1.00 0.00 C ATOM 916 OH TYR A 190 -1.507 -4.036 7.428 1.00 0.00 O ATOM 0 H TYR A 190 -4.767 0.042 1.540 1.00 0.00 H new ATOM 0 HA TYR A 190 -5.018 0.723 4.348 1.00 0.00 H new ATOM 0 HB2 TYR A 190 -5.592 -1.507 3.654 1.00 0.00 H new ATOM 0 HB3 TYR A 190 -4.244 -1.601 2.539 1.00 0.00 H new ATOM 0 HD1 TYR A 190 -4.188 -0.627 6.145 1.00 0.00 H new ATOM 0 HD2 TYR A 190 -3.093 -3.529 3.223 1.00 0.00 H new ATOM 0 HE1 TYR A 190 -2.832 -1.873 7.882 1.00 0.00 H new ATOM 0 HE2 TYR A 190 -1.742 -4.767 4.971 1.00 0.00 H new ATOM 0 HH TYR A 190 -1.096 -4.826 7.019 1.00 0.00 H new