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+ -160:sc= -1.05 (180deg=-1.65!) USER MOD Single : A 168 GLN : amide:sc= -0.796 X(o=-0.8,f=-0.95) USER MOD Single : A 171 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 175 SER OG : rot 180:sc= 0 USER MOD Single : A 178 LYS NZ :NH3+ 147:sc= -0.0621 (180deg=-0.448) 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 190 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 19 N TYR A 136 -1.907 -2.390 -0.517 1.00 0.00 N ATOM 20 CA TYR A 136 -3.231 -2.945 -0.734 1.00 0.00 C ATOM 21 C TYR A 136 -4.318 -1.950 -0.322 1.00 0.00 C ATOM 22 O TYR A 136 -4.044 -0.984 0.388 1.00 0.00 O ATOM 23 CB TYR A 136 -3.323 -4.181 0.163 1.00 0.00 C ATOM 24 CG TYR A 136 -2.001 -4.935 0.320 1.00 0.00 C ATOM 25 CD1 TYR A 136 -1.257 -5.262 -0.795 1.00 0.00 C ATOM 26 CD2 TYR A 136 -1.551 -5.287 1.577 1.00 0.00 C ATOM 27 CE1 TYR A 136 -0.012 -5.972 -0.647 1.00 0.00 C ATOM 28 CE2 TYR A 136 -0.307 -5.997 1.725 1.00 0.00 C ATOM 29 CZ TYR A 136 0.401 -6.304 0.605 1.00 0.00 C ATOM 30 OH TYR A 136 1.577 -6.973 0.744 1.00 0.00 O ATOM 0 HA TYR A 136 -3.379 -3.181 -1.788 1.00 0.00 H new ATOM 0 HB2 TYR A 136 -3.675 -3.877 1.149 1.00 0.00 H new ATOM 0 HB3 TYR A 136 -4.070 -4.860 -0.247 1.00 0.00 H new ATOM 0 HD1 TYR A 136 -1.608 -4.986 -1.778 1.00 0.00 H new ATOM 0 HD2 TYR A 136 -2.133 -5.030 2.450 1.00 0.00 H new ATOM 0 HE1 TYR A 136 0.580 -6.235 -1.511 1.00 0.00 H new ATOM 0 HE2 TYR A 136 0.055 -6.279 2.702 1.00 0.00 H new ATOM 0 HH TYR A 136 1.746 -7.143 1.694 1.00 0.00 H new ATOM 40 N VAL A 137 -5.530 -2.220 -0.785 1.00 0.00 N ATOM 41 CA VAL A 137 -6.659 -1.361 -0.474 1.00 0.00 C ATOM 42 C VAL A 137 -7.597 -2.087 0.492 1.00 0.00 C ATOM 43 O VAL A 137 -7.372 -3.250 0.825 1.00 0.00 O ATOM 44 CB VAL A 137 -7.354 -0.921 -1.764 1.00 0.00 C ATOM 45 CG1 VAL A 137 -6.340 -0.379 -2.775 1.00 0.00 C ATOM 46 CG2 VAL A 137 -8.169 -2.067 -2.366 1.00 0.00 C ATOM 0 H VAL A 137 -5.754 -3.022 -1.374 1.00 0.00 H new ATOM 0 HA VAL A 137 -6.320 -0.452 0.023 1.00 0.00 H new ATOM 0 HB VAL A 137 -8.044 -0.114 -1.515 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -6.860 -0.073 -3.683 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -5.822 0.479 -2.347 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -5.615 -1.157 -3.016 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -8.653 -1.728 -3.282 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -7.508 -2.903 -2.593 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -8.928 -2.388 -1.652 1.00 0.00 H new ATOM 56 N ARG A 138 -8.628 -1.371 0.916 1.00 0.00 N ATOM 57 CA ARG A 138 -9.602 -1.933 1.837 1.00 0.00 C ATOM 58 C ARG A 138 -11.010 -1.460 1.475 1.00 0.00 C ATOM 59 O ARG A 138 -11.244 -0.263 1.310 1.00 0.00 O ATOM 60 CB ARG A 138 -9.290 -1.530 3.280 1.00 0.00 C ATOM 61 CG ARG A 138 -8.710 -2.709 4.065 1.00 0.00 C ATOM 62 CD ARG A 138 -9.329 -2.794 5.461 1.00 0.00 C ATOM 63 NE ARG A 138 -8.293 -3.158 6.453 1.00 0.00 N ATOM 64 CZ ARG A 138 -8.381 -2.894 7.764 1.00 0.00 C ATOM 65 NH1 ARG A 138 -9.459 -2.264 8.249 1.00 0.00 N ATOM 66 NH2 ARG A 138 -7.392 -3.261 8.589 1.00 0.00 N ATOM 0 H ARG A 138 -8.810 -0.406 0.639 1.00 0.00 H new ATOM 0 HA ARG A 138 -9.549 -3.019 1.755 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -8.582 -0.701 3.285 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -10.199 -1.176 3.767 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -8.895 -3.637 3.524 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -7.629 -2.599 4.149 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -9.779 -1.837 5.727 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -10.128 -3.535 5.469 1.00 0.00 H new ATOM 0 HE ARG A 138 -7.459 -3.640 6.118 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -10.213 -1.985 7.621 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -9.526 -2.063 9.247 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -6.572 -3.742 8.220 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -7.459 -3.060 9.587 1.00 0.00 H new ATOM 80 N ALA A 139 -11.913 -2.423 1.362 1.00 0.00 N ATOM 81 CA ALA A 139 -13.293 -2.119 1.021 1.00 0.00 C ATOM 82 C ALA A 139 -14.063 -1.772 2.297 1.00 0.00 C ATOM 83 O ALA A 139 -14.100 -2.563 3.239 1.00 0.00 O ATOM 84 CB ALA A 139 -13.908 -3.304 0.273 1.00 0.00 C ATOM 0 H ALA A 139 -11.716 -3.414 1.500 1.00 0.00 H new ATOM 0 HA ALA A 139 -13.344 -1.255 0.359 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -14.943 -3.076 0.018 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -13.342 -3.492 -0.639 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -13.878 -4.190 0.907 1.00 0.00 H new ATOM 90 N LEU A 140 -14.659 -0.589 2.288 1.00 0.00 N ATOM 91 CA LEU A 140 -15.427 -0.127 3.432 1.00 0.00 C ATOM 92 C LEU A 140 -16.919 -0.229 3.114 1.00 0.00 C ATOM 93 O LEU A 140 -17.717 0.570 3.601 1.00 0.00 O ATOM 94 CB LEU A 140 -14.980 1.276 3.845 1.00 0.00 C ATOM 95 CG LEU A 140 -13.576 1.692 3.400 1.00 0.00 C ATOM 96 CD1 LEU A 140 -13.464 3.214 3.292 1.00 0.00 C ATOM 97 CD2 LEU A 140 -12.510 1.103 4.326 1.00 0.00 C ATOM 0 H LEU A 140 -14.626 0.064 1.506 1.00 0.00 H new ATOM 0 HA LEU A 140 -15.242 -0.763 4.298 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -15.694 1.996 3.445 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -15.031 1.347 4.932 1.00 0.00 H new ATOM 0 HG LEU A 140 -13.398 1.284 2.405 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -12.457 3.483 2.974 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -14.185 3.581 2.562 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -13.670 3.664 4.263 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -11.522 1.414 3.987 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -12.674 1.460 5.343 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -12.574 0.015 4.308 1.00 0.00 H new ATOM 109 N PHE A 141 -17.252 -1.221 2.300 1.00 0.00 N ATOM 110 CA PHE A 141 -18.636 -1.437 1.912 1.00 0.00 C ATOM 111 C PHE A 141 -18.827 -2.837 1.326 1.00 0.00 C ATOM 112 O PHE A 141 -18.139 -3.218 0.380 1.00 0.00 O ATOM 113 CB PHE A 141 -18.968 -0.399 0.840 1.00 0.00 C ATOM 114 CG PHE A 141 -19.223 1.006 1.390 1.00 0.00 C ATOM 115 CD1 PHE A 141 -20.139 1.191 2.379 1.00 0.00 C ATOM 116 CD2 PHE A 141 -18.535 2.068 0.892 1.00 0.00 C ATOM 117 CE1 PHE A 141 -20.376 2.495 2.891 1.00 0.00 C ATOM 118 CE2 PHE A 141 -18.772 3.371 1.404 1.00 0.00 C ATOM 119 CZ PHE A 141 -19.688 3.557 2.392 1.00 0.00 C ATOM 0 H PHE A 141 -16.588 -1.883 1.899 1.00 0.00 H new ATOM 0 HA PHE A 141 -19.286 -1.344 2.782 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -18.146 -0.354 0.125 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -19.850 -0.728 0.291 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -20.685 0.347 2.774 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -17.808 1.920 0.107 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -21.102 2.643 3.676 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -18.225 4.214 1.009 1.00 0.00 H new ATOM 0 HZ PHE A 141 -19.869 4.548 2.780 1.00 0.00 H new ATOM 129 N ASP A 142 -19.766 -3.566 1.912 1.00 0.00 N ATOM 130 CA ASP A 142 -20.058 -4.916 1.460 1.00 0.00 C ATOM 131 C ASP A 142 -20.716 -4.856 0.080 1.00 0.00 C ATOM 132 O ASP A 142 -21.482 -3.938 -0.206 1.00 0.00 O ATOM 133 CB ASP A 142 -21.023 -5.620 2.415 1.00 0.00 C ATOM 134 CG ASP A 142 -21.763 -6.819 1.817 1.00 0.00 C ATOM 135 OD1 ASP A 142 -21.070 -7.682 1.236 1.00 0.00 O ATOM 136 OD2 ASP A 142 -23.005 -6.845 1.956 1.00 0.00 O ATOM 0 H ASP A 142 -20.335 -3.247 2.696 1.00 0.00 H new ATOM 0 HA ASP A 142 -19.120 -5.470 1.423 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -20.465 -5.955 3.290 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -21.758 -4.895 2.764 1.00 0.00 H new ATOM 141 N PHE A 143 -20.393 -5.847 -0.739 1.00 0.00 N ATOM 142 CA PHE A 143 -20.944 -5.918 -2.081 1.00 0.00 C ATOM 143 C PHE A 143 -22.307 -6.613 -2.078 1.00 0.00 C ATOM 144 O PHE A 143 -22.765 -7.085 -1.038 1.00 0.00 O ATOM 145 CB PHE A 143 -19.967 -6.741 -2.923 1.00 0.00 C ATOM 146 CG PHE A 143 -20.392 -8.197 -3.125 1.00 0.00 C ATOM 147 CD1 PHE A 143 -20.235 -9.097 -2.119 1.00 0.00 C ATOM 148 CD2 PHE A 143 -20.928 -8.589 -4.312 1.00 0.00 C ATOM 149 CE1 PHE A 143 -20.630 -10.448 -2.308 1.00 0.00 C ATOM 150 CE2 PHE A 143 -21.324 -9.939 -4.501 1.00 0.00 C ATOM 151 CZ PHE A 143 -21.166 -10.840 -3.494 1.00 0.00 C ATOM 0 H PHE A 143 -19.757 -6.607 -0.498 1.00 0.00 H new ATOM 0 HA PHE A 143 -21.079 -4.913 -2.481 1.00 0.00 H new ATOM 0 HB2 PHE A 143 -19.856 -6.267 -3.898 1.00 0.00 H new ATOM 0 HB3 PHE A 143 -18.987 -6.722 -2.446 1.00 0.00 H new ATOM 0 HD1 PHE A 143 -19.810 -8.785 -1.176 1.00 0.00 H new ATOM 0 HD2 PHE A 143 -21.052 -7.873 -5.111 1.00 0.00 H new ATOM 0 HE1 PHE A 143 -20.504 -11.164 -1.509 1.00 0.00 H new ATOM 0 HE2 PHE A 143 -21.750 -10.250 -5.443 1.00 0.00 H new ATOM 0 HZ PHE A 143 -21.467 -11.867 -3.637 1.00 0.00 H new ATOM 250 N LEU A 151 -14.992 -8.845 -7.813 1.00 0.00 N ATOM 251 CA LEU A 151 -14.761 -9.798 -6.740 1.00 0.00 C ATOM 252 C LEU A 151 -15.619 -9.417 -5.532 1.00 0.00 C ATOM 253 O LEU A 151 -15.705 -8.244 -5.172 1.00 0.00 O ATOM 254 CB LEU A 151 -13.267 -9.899 -6.426 1.00 0.00 C ATOM 255 CG LEU A 151 -12.845 -11.076 -5.544 1.00 0.00 C ATOM 256 CD1 LEU A 151 -12.775 -12.371 -6.356 1.00 0.00 C ATOM 257 CD2 LEU A 151 -11.528 -10.778 -4.825 1.00 0.00 C ATOM 0 HA LEU A 151 -15.067 -10.798 -7.046 1.00 0.00 H new ATOM 0 HB2 LEU A 151 -12.722 -9.962 -7.368 1.00 0.00 H new ATOM 0 HB3 LEU A 151 -12.955 -8.975 -5.939 1.00 0.00 H new ATOM 0 HG LEU A 151 -13.605 -11.218 -4.776 1.00 0.00 H new ATOM 0 HD11 LEU A 151 -12.473 -13.192 -5.706 1.00 0.00 H new ATOM 0 HD12 LEU A 151 -13.755 -12.587 -6.782 1.00 0.00 H new ATOM 0 HD13 LEU A 151 -12.047 -12.258 -7.160 1.00 0.00 H new ATOM 0 HD21 LEU A 151 -11.251 -11.631 -4.205 1.00 0.00 H new ATOM 0 HD22 LEU A 151 -10.745 -10.595 -5.561 1.00 0.00 H new ATOM 0 HD23 LEU A 151 -11.648 -9.896 -4.196 1.00 0.00 H new ATOM 269 N PRO A 152 -16.249 -10.457 -4.923 1.00 0.00 N ATOM 270 CA PRO A 152 -17.098 -10.243 -3.763 1.00 0.00 C ATOM 271 C PRO A 152 -16.258 -9.974 -2.512 1.00 0.00 C ATOM 272 O PRO A 152 -15.103 -10.390 -2.434 1.00 0.00 O ATOM 273 CB PRO A 152 -17.940 -11.503 -3.653 1.00 0.00 C ATOM 274 CG PRO A 152 -17.213 -12.562 -4.467 1.00 0.00 C ATOM 275 CD PRO A 152 -16.171 -11.859 -5.322 1.00 0.00 C ATOM 0 HA PRO A 152 -17.734 -9.363 -3.864 1.00 0.00 H new ATOM 0 HB2 PRO A 152 -18.045 -11.813 -2.613 1.00 0.00 H new ATOM 0 HB3 PRO A 152 -18.946 -11.336 -4.039 1.00 0.00 H new ATOM 0 HG2 PRO A 152 -16.739 -13.290 -3.809 1.00 0.00 H new ATOM 0 HG3 PRO A 152 -17.916 -13.110 -5.095 1.00 0.00 H new ATOM 0 HD2 PRO A 152 -15.175 -12.266 -5.147 1.00 0.00 H new ATOM 0 HD3 PRO A 152 -16.383 -11.981 -6.384 1.00 0.00 H new ATOM 283 N PHE A 153 -16.871 -9.280 -1.565 1.00 0.00 N ATOM 284 CA PHE A 153 -16.195 -8.951 -0.321 1.00 0.00 C ATOM 285 C PHE A 153 -17.184 -8.413 0.715 1.00 0.00 C ATOM 286 O PHE A 153 -18.338 -8.137 0.392 1.00 0.00 O ATOM 287 CB PHE A 153 -15.171 -7.861 -0.644 1.00 0.00 C ATOM 288 CG PHE A 153 -15.692 -6.778 -1.590 1.00 0.00 C ATOM 289 CD1 PHE A 153 -16.431 -5.746 -1.101 1.00 0.00 C ATOM 290 CD2 PHE A 153 -15.415 -6.845 -2.920 1.00 0.00 C ATOM 291 CE1 PHE A 153 -16.915 -4.741 -1.979 1.00 0.00 C ATOM 292 CE2 PHE A 153 -15.899 -5.840 -3.798 1.00 0.00 C ATOM 293 CZ PHE A 153 -16.639 -4.808 -3.309 1.00 0.00 C ATOM 0 H PHE A 153 -17.829 -8.936 -1.634 1.00 0.00 H new ATOM 0 HA PHE A 153 -15.724 -9.842 0.094 1.00 0.00 H new ATOM 0 HB2 PHE A 153 -14.849 -7.392 0.286 1.00 0.00 H new ATOM 0 HB3 PHE A 153 -14.290 -8.325 -1.089 1.00 0.00 H new ATOM 0 HD1 PHE A 153 -16.650 -5.691 -0.045 1.00 0.00 H new ATOM 0 HD2 PHE A 153 -14.827 -7.663 -3.308 1.00 0.00 H new ATOM 0 HE1 PHE A 153 -17.503 -3.923 -1.590 1.00 0.00 H new ATOM 0 HE2 PHE A 153 -15.680 -5.894 -4.854 1.00 0.00 H new ATOM 0 HZ PHE A 153 -17.007 -4.043 -3.977 1.00 0.00 H new ATOM 303 N LYS A 154 -16.696 -8.280 1.939 1.00 0.00 N ATOM 304 CA LYS A 154 -17.521 -7.780 3.025 1.00 0.00 C ATOM 305 C LYS A 154 -16.985 -6.424 3.485 1.00 0.00 C ATOM 306 O LYS A 154 -15.817 -6.108 3.267 1.00 0.00 O ATOM 307 CB LYS A 154 -17.617 -8.818 4.146 1.00 0.00 C ATOM 308 CG LYS A 154 -16.241 -9.094 4.756 1.00 0.00 C ATOM 309 CD LYS A 154 -15.819 -10.546 4.522 1.00 0.00 C ATOM 310 CE LYS A 154 -16.185 -11.423 5.721 1.00 0.00 C ATOM 311 NZ LYS A 154 -17.208 -12.422 5.340 1.00 0.00 N ATOM 0 H LYS A 154 -15.738 -8.510 2.203 1.00 0.00 H new ATOM 0 HA LYS A 154 -18.544 -7.618 2.684 1.00 0.00 H new ATOM 0 HB2 LYS A 154 -18.297 -8.461 4.920 1.00 0.00 H new ATOM 0 HB3 LYS A 154 -18.038 -9.744 3.754 1.00 0.00 H new ATOM 0 HG2 LYS A 154 -15.503 -8.422 4.317 1.00 0.00 H new ATOM 0 HG3 LYS A 154 -16.265 -8.886 5.826 1.00 0.00 H new ATOM 0 HD2 LYS A 154 -16.305 -10.930 3.625 1.00 0.00 H new ATOM 0 HD3 LYS A 154 -14.744 -10.593 4.347 1.00 0.00 H new ATOM 0 HE2 LYS A 154 -15.295 -11.930 6.094 1.00 0.00 H new ATOM 0 HE3 LYS A 154 -16.561 -10.801 6.533 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 -17.445 -13.009 6.165 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 -18.063 -11.933 5.006 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 -16.836 -13.027 4.580 1.00 0.00 H new ATOM 325 N LYS A 155 -17.865 -5.658 4.114 1.00 0.00 N ATOM 326 CA LYS A 155 -17.494 -4.342 4.608 1.00 0.00 C ATOM 327 C LYS A 155 -16.229 -4.460 5.460 1.00 0.00 C ATOM 328 O LYS A 155 -16.176 -5.264 6.390 1.00 0.00 O ATOM 329 CB LYS A 155 -18.671 -3.694 5.340 1.00 0.00 C ATOM 330 CG LYS A 155 -18.592 -2.168 5.260 1.00 0.00 C ATOM 331 CD LYS A 155 -18.479 -1.551 6.656 1.00 0.00 C ATOM 332 CE LYS A 155 -17.071 -1.739 7.224 1.00 0.00 C ATOM 333 NZ LYS A 155 -16.901 -0.945 8.462 1.00 0.00 N ATOM 0 H LYS A 155 -18.834 -5.923 4.293 1.00 0.00 H new ATOM 0 HA LYS A 155 -17.258 -3.675 3.778 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -19.609 -4.037 4.903 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -18.672 -4.008 6.384 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -17.731 -1.876 4.659 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -19.478 -1.780 4.758 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -18.717 -0.488 6.609 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -19.209 -2.012 7.322 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -16.895 -2.794 7.435 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -16.330 -1.434 6.485 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -15.940 -1.084 8.834 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -17.048 0.063 8.251 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -17.595 -1.255 9.171 1.00 0.00 H new ATOM 347 N GLY A 156 -15.243 -3.647 5.113 1.00 0.00 N ATOM 348 CA GLY A 156 -13.982 -3.650 5.835 1.00 0.00 C ATOM 349 C GLY A 156 -13.104 -4.826 5.402 1.00 0.00 C ATOM 350 O GLY A 156 -12.379 -5.396 6.215 1.00 0.00 O ATOM 0 H GLY A 156 -15.291 -2.982 4.341 1.00 0.00 H new ATOM 0 HA2 GLY A 156 -13.455 -2.713 5.656 1.00 0.00 H new ATOM 0 HA3 GLY A 156 -14.173 -3.709 6.907 1.00 0.00 H new ATOM 354 N ASP A 157 -13.200 -5.154 4.122 1.00 0.00 N ATOM 355 CA ASP A 157 -12.425 -6.253 3.571 1.00 0.00 C ATOM 356 C ASP A 157 -11.058 -5.731 3.120 1.00 0.00 C ATOM 357 O ASP A 157 -10.866 -4.524 2.982 1.00 0.00 O ATOM 358 CB ASP A 157 -13.122 -6.864 2.354 1.00 0.00 C ATOM 359 CG ASP A 157 -12.333 -7.964 1.641 1.00 0.00 C ATOM 360 OD1 ASP A 157 -12.025 -8.970 2.317 1.00 0.00 O ATOM 361 OD2 ASP A 157 -12.056 -7.774 0.438 1.00 0.00 O ATOM 0 H ASP A 157 -13.803 -4.678 3.451 1.00 0.00 H new ATOM 0 HA ASP A 157 -12.320 -7.013 4.345 1.00 0.00 H new ATOM 0 HB2 ASP A 157 -14.081 -7.273 2.671 1.00 0.00 H new ATOM 0 HB3 ASP A 157 -13.335 -6.069 1.639 1.00 0.00 H new ATOM 366 N ILE A 158 -10.145 -6.667 2.904 1.00 0.00 N ATOM 367 CA ILE A 158 -8.804 -6.316 2.472 1.00 0.00 C ATOM 368 C ILE A 158 -8.537 -6.935 1.098 1.00 0.00 C ATOM 369 O ILE A 158 -8.789 -8.120 0.887 1.00 0.00 O ATOM 370 CB ILE A 158 -7.778 -6.714 3.535 1.00 0.00 C ATOM 371 CG1 ILE A 158 -7.941 -5.867 4.799 1.00 0.00 C ATOM 372 CG2 ILE A 158 -6.354 -6.643 2.978 1.00 0.00 C ATOM 373 CD1 ILE A 158 -7.526 -6.655 6.044 1.00 0.00 C ATOM 0 H ILE A 158 -10.308 -7.667 3.020 1.00 0.00 H new ATOM 0 HA ILE A 158 -8.710 -5.236 2.359 1.00 0.00 H new ATOM 0 HB ILE A 158 -7.963 -7.751 3.815 1.00 0.00 H new ATOM 0 HG12 ILE A 158 -7.336 -4.964 4.717 1.00 0.00 H new ATOM 0 HG13 ILE A 158 -8.979 -5.547 4.896 1.00 0.00 H new ATOM 0 HG21 ILE A 158 -5.645 -6.931 3.754 1.00 0.00 H new ATOM 0 HG22 ILE A 158 -6.260 -7.323 2.131 1.00 0.00 H new ATOM 0 HG23 ILE A 158 -6.141 -5.625 2.652 1.00 0.00 H new ATOM 0 HD11 ILE A 158 -7.651 -6.030 6.928 1.00 0.00 H new ATOM 0 HD12 ILE A 158 -8.150 -7.544 6.136 1.00 0.00 H new ATOM 0 HD13 ILE A 158 -6.481 -6.952 5.955 1.00 0.00 H new ATOM 385 N LEU A 159 -8.030 -6.104 0.199 1.00 0.00 N ATOM 386 CA LEU A 159 -7.727 -6.554 -1.149 1.00 0.00 C ATOM 387 C LEU A 159 -6.481 -5.825 -1.657 1.00 0.00 C ATOM 388 O LEU A 159 -6.358 -4.612 -1.494 1.00 0.00 O ATOM 389 CB LEU A 159 -8.947 -6.392 -2.056 1.00 0.00 C ATOM 390 CG LEU A 159 -10.240 -7.048 -1.565 1.00 0.00 C ATOM 391 CD1 LEU A 159 -11.455 -6.175 -1.887 1.00 0.00 C ATOM 392 CD2 LEU A 159 -10.385 -8.463 -2.130 1.00 0.00 C ATOM 0 H LEU A 159 -7.821 -5.122 0.378 1.00 0.00 H new ATOM 0 HA LEU A 159 -7.497 -7.620 -1.152 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -9.133 -5.327 -2.194 1.00 0.00 H new ATOM 0 HB3 LEU A 159 -8.704 -6.803 -3.036 1.00 0.00 H new ATOM 0 HG LEU A 159 -10.187 -7.138 -0.480 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -12.360 -6.664 -1.527 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -11.347 -5.207 -1.398 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -11.524 -6.031 -2.965 1.00 0.00 H new ATOM 0 HD21 LEU A 159 -11.312 -8.907 -1.766 1.00 0.00 H new ATOM 0 HD22 LEU A 159 -10.407 -8.420 -3.219 1.00 0.00 H new ATOM 0 HD23 LEU A 159 -9.540 -9.072 -1.808 1.00 0.00 H new ATOM 404 N ARG A 160 -5.589 -6.595 -2.264 1.00 0.00 N ATOM 405 CA ARG A 160 -4.359 -6.037 -2.797 1.00 0.00 C ATOM 406 C ARG A 160 -4.508 -5.757 -4.294 1.00 0.00 C ATOM 407 O ARG A 160 -5.283 -6.422 -4.980 1.00 0.00 O ATOM 408 CB ARG A 160 -3.182 -6.991 -2.579 1.00 0.00 C ATOM 409 CG ARG A 160 -3.616 -8.447 -2.758 1.00 0.00 C ATOM 410 CD ARG A 160 -2.420 -9.337 -3.107 1.00 0.00 C ATOM 411 NE ARG A 160 -1.829 -8.908 -4.394 1.00 0.00 N ATOM 412 CZ ARG A 160 -0.585 -9.213 -4.788 1.00 0.00 C ATOM 413 NH1 ARG A 160 0.206 -9.951 -3.996 1.00 0.00 N ATOM 414 NH2 ARG A 160 -0.132 -8.780 -5.973 1.00 0.00 N ATOM 0 H ARG A 160 -5.694 -7.601 -2.398 1.00 0.00 H new ATOM 0 HA ARG A 160 -4.161 -5.105 -2.267 1.00 0.00 H new ATOM 0 HB2 ARG A 160 -2.384 -6.756 -3.283 1.00 0.00 H new ATOM 0 HB3 ARG A 160 -2.775 -6.850 -1.578 1.00 0.00 H new ATOM 0 HG2 ARG A 160 -4.086 -8.805 -1.842 1.00 0.00 H new ATOM 0 HG3 ARG A 160 -4.365 -8.513 -3.547 1.00 0.00 H new ATOM 0 HD2 ARG A 160 -1.671 -9.281 -2.317 1.00 0.00 H new ATOM 0 HD3 ARG A 160 -2.737 -10.378 -3.172 1.00 0.00 H new ATOM 0 HE ARG A 160 -2.404 -8.345 -5.020 1.00 0.00 H new ATOM 0 HH11 ARG A 160 -0.139 -10.280 -3.094 1.00 0.00 H new ATOM 0 HH12 ARG A 160 1.153 -10.184 -4.295 1.00 0.00 H new ATOM 0 HH21 ARG A 160 -0.734 -8.218 -6.575 1.00 0.00 H new ATOM 0 HH22 ARG A 160 0.815 -9.012 -6.273 1.00 0.00 H new ATOM 428 N ILE A 161 -3.753 -4.771 -4.756 1.00 0.00 N ATOM 429 CA ILE A 161 -3.792 -4.394 -6.159 1.00 0.00 C ATOM 430 C ILE A 161 -2.838 -5.291 -6.950 1.00 0.00 C ATOM 431 O ILE A 161 -1.661 -5.400 -6.613 1.00 0.00 O ATOM 432 CB ILE A 161 -3.507 -2.900 -6.320 1.00 0.00 C ATOM 433 CG1 ILE A 161 -4.600 -2.058 -5.660 1.00 0.00 C ATOM 434 CG2 ILE A 161 -3.313 -2.534 -7.794 1.00 0.00 C ATOM 435 CD1 ILE A 161 -4.168 -0.596 -5.537 1.00 0.00 C ATOM 0 H ILE A 161 -3.111 -4.222 -4.184 1.00 0.00 H new ATOM 0 HA ILE A 161 -4.790 -4.550 -6.568 1.00 0.00 H new ATOM 0 HB ILE A 161 -2.573 -2.674 -5.806 1.00 0.00 H new ATOM 0 HG12 ILE A 161 -5.517 -2.122 -6.246 1.00 0.00 H new ATOM 0 HG13 ILE A 161 -4.825 -2.459 -4.672 1.00 0.00 H new ATOM 0 HG21 ILE A 161 -3.112 -1.466 -7.880 1.00 0.00 H new ATOM 0 HG22 ILE A 161 -2.472 -3.096 -8.201 1.00 0.00 H new ATOM 0 HG23 ILE A 161 -4.217 -2.779 -8.352 1.00 0.00 H new ATOM 0 HD11 ILE A 161 -4.964 -0.020 -5.064 1.00 0.00 H new ATOM 0 HD12 ILE A 161 -3.265 -0.533 -4.930 1.00 0.00 H new ATOM 0 HD13 ILE A 161 -3.967 -0.191 -6.529 1.00 0.00 H new ATOM 447 N ARG A 162 -3.382 -5.911 -7.987 1.00 0.00 N ATOM 448 CA ARG A 162 -2.595 -6.795 -8.828 1.00 0.00 C ATOM 449 C ARG A 162 -2.401 -6.176 -10.214 1.00 0.00 C ATOM 450 O ARG A 162 -1.274 -6.056 -10.692 1.00 0.00 O ATOM 451 CB ARG A 162 -3.270 -8.160 -8.977 1.00 0.00 C ATOM 452 CG ARG A 162 -2.251 -9.294 -8.839 1.00 0.00 C ATOM 453 CD ARG A 162 -1.211 -9.236 -9.959 1.00 0.00 C ATOM 454 NE ARG A 162 -1.433 -10.345 -10.913 1.00 0.00 N ATOM 455 CZ ARG A 162 -0.931 -11.578 -10.762 1.00 0.00 C ATOM 456 NH1 ARG A 162 -0.176 -11.868 -9.693 1.00 0.00 N ATOM 457 NH2 ARG A 162 -1.184 -12.522 -11.678 1.00 0.00 N ATOM 0 H ARG A 162 -4.359 -5.818 -8.264 1.00 0.00 H new ATOM 0 HA ARG A 162 -1.626 -6.932 -8.348 1.00 0.00 H new ATOM 0 HB2 ARG A 162 -4.047 -8.270 -8.220 1.00 0.00 H new ATOM 0 HB3 ARG A 162 -3.760 -8.223 -9.948 1.00 0.00 H new ATOM 0 HG2 ARG A 162 -1.753 -9.225 -7.872 1.00 0.00 H new ATOM 0 HG3 ARG A 162 -2.765 -10.255 -8.865 1.00 0.00 H new ATOM 0 HD2 ARG A 162 -1.277 -8.280 -10.478 1.00 0.00 H new ATOM 0 HD3 ARG A 162 -0.208 -9.302 -9.539 1.00 0.00 H new ATOM 0 HE ARG A 162 -2.004 -10.159 -11.737 1.00 0.00 H new ATOM 0 HH11 ARG A 162 0.016 -11.150 -8.995 1.00 0.00 H new ATOM 0 HH12 ARG A 162 0.206 -12.807 -9.578 1.00 0.00 H new ATOM 0 HH21 ARG A 162 -1.759 -12.302 -12.491 1.00 0.00 H new ATOM 0 HH22 ARG A 162 -0.801 -13.460 -11.562 1.00 0.00 H new ATOM 471 N ASP A 163 -3.517 -5.799 -10.820 1.00 0.00 N ATOM 472 CA ASP A 163 -3.484 -5.195 -12.141 1.00 0.00 C ATOM 473 C ASP A 163 -4.592 -4.144 -12.244 1.00 0.00 C ATOM 474 O ASP A 163 -5.700 -4.355 -11.753 1.00 0.00 O ATOM 475 CB ASP A 163 -3.722 -6.242 -13.232 1.00 0.00 C ATOM 476 CG ASP A 163 -2.601 -7.271 -13.395 1.00 0.00 C ATOM 477 OD1 ASP A 163 -2.362 -8.009 -12.415 1.00 0.00 O ATOM 478 OD2 ASP A 163 -2.010 -7.295 -14.496 1.00 0.00 O ATOM 0 H ASP A 163 -4.450 -5.900 -10.420 1.00 0.00 H new ATOM 0 HA ASP A 163 -2.501 -4.745 -12.282 1.00 0.00 H new ATOM 0 HB2 ASP A 163 -4.650 -6.770 -13.012 1.00 0.00 H new ATOM 0 HB3 ASP A 163 -3.865 -5.728 -14.183 1.00 0.00 H new ATOM 483 N LYS A 164 -4.254 -3.036 -12.888 1.00 0.00 N ATOM 484 CA LYS A 164 -5.207 -1.953 -13.063 1.00 0.00 C ATOM 485 C LYS A 164 -5.262 -1.562 -14.541 1.00 0.00 C ATOM 486 O LYS A 164 -4.865 -0.458 -14.910 1.00 0.00 O ATOM 487 CB LYS A 164 -4.870 -0.787 -12.130 1.00 0.00 C ATOM 488 CG LYS A 164 -4.485 -1.292 -10.738 1.00 0.00 C ATOM 489 CD LYS A 164 -3.240 -0.571 -10.217 1.00 0.00 C ATOM 490 CE LYS A 164 -3.617 0.500 -9.191 1.00 0.00 C ATOM 491 NZ LYS A 164 -2.455 0.828 -8.335 1.00 0.00 N ATOM 0 H LYS A 164 -3.334 -2.865 -13.295 1.00 0.00 H new ATOM 0 HA LYS A 164 -6.209 -2.277 -12.781 1.00 0.00 H new ATOM 0 HB2 LYS A 164 -4.049 -0.206 -12.550 1.00 0.00 H new ATOM 0 HB3 LYS A 164 -5.727 -0.118 -12.054 1.00 0.00 H new ATOM 0 HG2 LYS A 164 -5.315 -1.136 -10.049 1.00 0.00 H new ATOM 0 HG3 LYS A 164 -4.299 -2.365 -10.775 1.00 0.00 H new ATOM 0 HD2 LYS A 164 -2.561 -1.292 -9.762 1.00 0.00 H new ATOM 0 HD3 LYS A 164 -2.707 -0.111 -11.049 1.00 0.00 H new ATOM 0 HE2 LYS A 164 -3.964 1.397 -9.704 1.00 0.00 H new ATOM 0 HE3 LYS A 164 -4.443 0.146 -8.574 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 -2.786 1.277 -7.458 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 -1.937 -0.044 -8.103 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 -1.824 1.481 -8.842 1.00 0.00 H new ATOM 505 N PRO A 165 -5.773 -2.513 -15.368 1.00 0.00 N ATOM 506 CA PRO A 165 -5.887 -2.279 -16.797 1.00 0.00 C ATOM 507 C PRO A 165 -7.050 -1.335 -17.108 1.00 0.00 C ATOM 508 O PRO A 165 -7.485 -1.236 -18.255 1.00 0.00 O ATOM 509 CB PRO A 165 -6.062 -3.659 -17.409 1.00 0.00 C ATOM 510 CG PRO A 165 -6.506 -4.566 -16.272 1.00 0.00 C ATOM 511 CD PRO A 165 -6.255 -3.831 -14.966 1.00 0.00 C ATOM 0 HA PRO A 165 -5.011 -1.782 -17.213 1.00 0.00 H new ATOM 0 HB2 PRO A 165 -6.804 -3.641 -18.207 1.00 0.00 H new ATOM 0 HB3 PRO A 165 -5.129 -4.012 -17.849 1.00 0.00 H new ATOM 0 HG2 PRO A 165 -7.562 -4.816 -16.373 1.00 0.00 H new ATOM 0 HG3 PRO A 165 -5.953 -5.505 -16.294 1.00 0.00 H new ATOM 0 HD2 PRO A 165 -7.166 -3.755 -14.373 1.00 0.00 H new ATOM 0 HD3 PRO A 165 -5.519 -4.352 -14.354 1.00 0.00 H new ATOM 519 N GLU A 166 -7.521 -0.665 -16.066 1.00 0.00 N ATOM 520 CA GLU A 166 -8.626 0.267 -16.213 1.00 0.00 C ATOM 521 C GLU A 166 -8.436 1.466 -15.281 1.00 0.00 C ATOM 522 O GLU A 166 -7.461 1.529 -14.535 1.00 0.00 O ATOM 523 CB GLU A 166 -9.965 -0.423 -15.952 1.00 0.00 C ATOM 524 CG GLU A 166 -10.185 -1.580 -16.928 1.00 0.00 C ATOM 525 CD GLU A 166 -10.469 -1.061 -18.339 1.00 0.00 C ATOM 526 OE1 GLU A 166 -11.482 -0.344 -18.487 1.00 0.00 O ATOM 527 OE2 GLU A 166 -9.666 -1.393 -19.239 1.00 0.00 O ATOM 0 H GLU A 166 -7.157 -0.749 -15.117 1.00 0.00 H new ATOM 0 HA GLU A 166 -8.636 0.628 -17.241 1.00 0.00 H new ATOM 0 HB2 GLU A 166 -9.992 -0.796 -14.928 1.00 0.00 H new ATOM 0 HB3 GLU A 166 -10.776 0.299 -16.050 1.00 0.00 H new ATOM 0 HG2 GLU A 166 -9.303 -2.220 -16.943 1.00 0.00 H new ATOM 0 HG3 GLU A 166 -11.019 -2.194 -16.588 1.00 0.00 H new ATOM 534 N GLU A 167 -9.383 2.389 -15.356 1.00 0.00 N ATOM 535 CA GLU A 167 -9.333 3.582 -14.529 1.00 0.00 C ATOM 536 C GLU A 167 -10.527 3.616 -13.574 1.00 0.00 C ATOM 537 O GLU A 167 -11.171 4.653 -13.417 1.00 0.00 O ATOM 538 CB GLU A 167 -9.284 4.845 -15.391 1.00 0.00 C ATOM 539 CG GLU A 167 -7.854 5.143 -15.846 1.00 0.00 C ATOM 540 CD GLU A 167 -6.940 5.407 -14.648 1.00 0.00 C ATOM 541 OE1 GLU A 167 -7.047 6.518 -14.087 1.00 0.00 O ATOM 542 OE2 GLU A 167 -6.155 4.490 -14.321 1.00 0.00 O ATOM 0 H GLU A 167 -10.190 2.335 -15.977 1.00 0.00 H new ATOM 0 HA GLU A 167 -8.419 3.551 -13.936 1.00 0.00 H new ATOM 0 HB2 GLU A 167 -9.928 4.721 -16.262 1.00 0.00 H new ATOM 0 HB3 GLU A 167 -9.673 5.691 -14.825 1.00 0.00 H new ATOM 0 HG2 GLU A 167 -7.470 4.302 -16.423 1.00 0.00 H new ATOM 0 HG3 GLU A 167 -7.852 6.010 -16.507 1.00 0.00 H new ATOM 549 N GLN A 168 -10.787 2.471 -12.960 1.00 0.00 N ATOM 550 CA GLN A 168 -11.893 2.358 -12.024 1.00 0.00 C ATOM 551 C GLN A 168 -11.861 0.995 -11.330 1.00 0.00 C ATOM 552 O GLN A 168 -11.653 0.915 -10.120 1.00 0.00 O ATOM 553 CB GLN A 168 -13.232 2.584 -12.728 1.00 0.00 C ATOM 554 CG GLN A 168 -13.756 3.998 -12.469 1.00 0.00 C ATOM 555 CD GLN A 168 -13.984 4.748 -13.782 1.00 0.00 C ATOM 556 OE1 GLN A 168 -14.467 4.204 -14.762 1.00 0.00 O ATOM 557 NE2 GLN A 168 -13.611 6.025 -13.749 1.00 0.00 N ATOM 0 H GLN A 168 -10.251 1.613 -13.092 1.00 0.00 H new ATOM 0 HA GLN A 168 -11.784 3.133 -11.266 1.00 0.00 H new ATOM 0 HB2 GLN A 168 -13.114 2.427 -13.800 1.00 0.00 H new ATOM 0 HB3 GLN A 168 -13.960 1.853 -12.377 1.00 0.00 H new ATOM 0 HG2 GLN A 168 -14.690 3.947 -11.909 1.00 0.00 H new ATOM 0 HG3 GLN A 168 -13.044 4.546 -11.852 1.00 0.00 H new ATOM 0 HE21 GLN A 168 -13.213 6.418 -12.896 1.00 0.00 H new ATOM 0 HE22 GLN A 168 -13.723 6.611 -14.577 1.00 0.00 H new ATOM 566 N TRP A 169 -12.073 -0.043 -12.124 1.00 0.00 N ATOM 567 CA TRP A 169 -12.072 -1.400 -11.602 1.00 0.00 C ATOM 568 C TRP A 169 -10.721 -2.034 -11.936 1.00 0.00 C ATOM 569 O TRP A 169 -10.312 -2.056 -13.096 1.00 0.00 O ATOM 570 CB TRP A 169 -13.260 -2.198 -12.145 1.00 0.00 C ATOM 571 CG TRP A 169 -14.571 -1.412 -12.186 1.00 0.00 C ATOM 572 CD1 TRP A 169 -14.867 -0.340 -12.934 1.00 0.00 C ATOM 573 CD2 TRP A 169 -15.760 -1.682 -11.414 1.00 0.00 C ATOM 574 NE1 TRP A 169 -16.155 0.099 -12.701 1.00 0.00 N ATOM 575 CE2 TRP A 169 -16.714 -0.743 -11.748 1.00 0.00 C ATOM 576 CE3 TRP A 169 -16.020 -2.685 -10.465 1.00 0.00 C ATOM 577 CZ2 TRP A 169 -17.993 -0.715 -11.179 1.00 0.00 C ATOM 578 CZ3 TRP A 169 -17.303 -2.645 -9.906 1.00 0.00 C ATOM 579 CH2 TRP A 169 -18.276 -1.706 -10.231 1.00 0.00 C ATOM 0 H TRP A 169 -12.247 0.027 -13.127 1.00 0.00 H new ATOM 0 HA TRP A 169 -12.196 -1.397 -10.519 1.00 0.00 H new ATOM 0 HB2 TRP A 169 -13.023 -2.543 -13.152 1.00 0.00 H new ATOM 0 HB3 TRP A 169 -13.400 -3.086 -11.529 1.00 0.00 H new ATOM 0 HD1 TRP A 169 -14.184 0.122 -13.631 1.00 0.00 H new ATOM 0 HE1 TRP A 169 -16.612 0.895 -13.146 1.00 0.00 H new ATOM 0 HE3 TRP A 169 -15.287 -3.429 -10.188 1.00 0.00 H new ATOM 0 HZ2 TRP A 169 -18.723 0.031 -11.457 1.00 0.00 H new ATOM 0 HZ3 TRP A 169 -17.555 -3.396 -9.171 1.00 0.00 H new ATOM 0 HH2 TRP A 169 -19.245 -1.741 -9.755 1.00 0.00 H new ATOM 590 N TRP A 170 -10.066 -2.536 -10.899 1.00 0.00 N ATOM 591 CA TRP A 170 -8.769 -3.169 -11.069 1.00 0.00 C ATOM 592 C TRP A 170 -8.858 -4.587 -10.500 1.00 0.00 C ATOM 593 O TRP A 170 -9.750 -4.887 -9.709 1.00 0.00 O ATOM 594 CB TRP A 170 -7.662 -2.334 -10.422 1.00 0.00 C ATOM 595 CG TRP A 170 -7.681 -0.858 -10.824 1.00 0.00 C ATOM 596 CD1 TRP A 170 -8.067 -0.326 -11.992 1.00 0.00 C ATOM 597 CD2 TRP A 170 -7.279 0.261 -10.006 1.00 0.00 C ATOM 598 NE1 TRP A 170 -7.944 1.049 -11.987 1.00 0.00 N ATOM 599 CE2 TRP A 170 -7.450 1.417 -10.740 1.00 0.00 C ATOM 600 CE3 TRP A 170 -6.788 0.295 -8.688 1.00 0.00 C ATOM 601 CZ2 TRP A 170 -7.153 2.692 -10.243 1.00 0.00 C ATOM 602 CZ3 TRP A 170 -6.497 1.577 -8.207 1.00 0.00 C ATOM 603 CH2 TRP A 170 -6.662 2.750 -8.934 1.00 0.00 C ATOM 0 H TRP A 170 -10.409 -2.517 -9.939 1.00 0.00 H new ATOM 0 HA TRP A 170 -8.506 -3.232 -12.125 1.00 0.00 H new ATOM 0 HB2 TRP A 170 -7.753 -2.406 -9.338 1.00 0.00 H new ATOM 0 HB3 TRP A 170 -6.695 -2.761 -10.690 1.00 0.00 H new ATOM 0 HD1 TRP A 170 -8.429 -0.901 -12.832 1.00 0.00 H new ATOM 0 HE1 TRP A 170 -8.173 1.679 -12.756 1.00 0.00 H new ATOM 0 HE3 TRP A 170 -6.647 -0.596 -8.095 1.00 0.00 H new ATOM 0 HZ2 TRP A 170 -7.295 3.582 -10.838 1.00 0.00 H new ATOM 0 HZ3 TRP A 170 -6.117 1.661 -7.199 1.00 0.00 H new ATOM 0 HH2 TRP A 170 -6.412 3.702 -8.490 1.00 0.00 H new ATOM 614 N ASN A 171 -7.920 -5.420 -10.924 1.00 0.00 N ATOM 615 CA ASN A 171 -7.882 -6.799 -10.468 1.00 0.00 C ATOM 616 C ASN A 171 -7.113 -6.872 -9.147 1.00 0.00 C ATOM 617 O ASN A 171 -5.883 -6.874 -9.139 1.00 0.00 O ATOM 618 CB ASN A 171 -7.166 -7.695 -11.481 1.00 0.00 C ATOM 619 CG ASN A 171 -8.171 -8.412 -12.385 1.00 0.00 C ATOM 620 OD1 ASN A 171 -8.427 -8.014 -13.509 1.00 0.00 O ATOM 621 ND2 ASN A 171 -8.723 -9.489 -11.833 1.00 0.00 N ATOM 0 H ASN A 171 -7.180 -5.167 -11.579 1.00 0.00 H new ATOM 0 HA ASN A 171 -8.909 -7.143 -10.346 1.00 0.00 H new ATOM 0 HB2 ASN A 171 -6.489 -7.094 -12.088 1.00 0.00 H new ATOM 0 HB3 ASN A 171 -6.556 -8.429 -10.955 1.00 0.00 H new ATOM 0 HD21 ASN A 171 -9.406 -10.037 -12.356 1.00 0.00 H new ATOM 0 HD22 ASN A 171 -8.463 -9.767 -10.887 1.00 0.00 H new ATOM 628 N ALA A 172 -7.870 -6.931 -8.062 1.00 0.00 N ATOM 629 CA ALA A 172 -7.277 -7.004 -6.737 1.00 0.00 C ATOM 630 C ALA A 172 -7.362 -8.443 -6.225 1.00 0.00 C ATOM 631 O ALA A 172 -8.270 -9.186 -6.594 1.00 0.00 O ATOM 632 CB ALA A 172 -7.978 -6.012 -5.808 1.00 0.00 C ATOM 0 H ALA A 172 -8.890 -6.930 -8.073 1.00 0.00 H new ATOM 0 HA ALA A 172 -6.223 -6.728 -6.772 1.00 0.00 H new ATOM 0 HB1 ALA A 172 -7.533 -6.067 -4.814 1.00 0.00 H new ATOM 0 HB2 ALA A 172 -7.864 -5.002 -6.201 1.00 0.00 H new ATOM 0 HB3 ALA A 172 -9.038 -6.259 -5.745 1.00 0.00 H new ATOM 638 N GLU A 173 -6.403 -8.793 -5.379 1.00 0.00 N ATOM 639 CA GLU A 173 -6.358 -10.130 -4.811 1.00 0.00 C ATOM 640 C GLU A 173 -6.727 -10.090 -3.327 1.00 0.00 C ATOM 641 O GLU A 173 -6.020 -9.483 -2.525 1.00 0.00 O ATOM 642 CB GLU A 173 -4.982 -10.768 -5.017 1.00 0.00 C ATOM 643 CG GLU A 173 -4.992 -12.240 -4.601 1.00 0.00 C ATOM 644 CD GLU A 173 -3.637 -12.657 -4.027 1.00 0.00 C ATOM 645 OE1 GLU A 173 -2.617 -12.266 -4.636 1.00 0.00 O ATOM 646 OE2 GLU A 173 -3.651 -13.356 -2.990 1.00 0.00 O ATOM 0 H GLU A 173 -5.652 -8.174 -5.074 1.00 0.00 H new ATOM 0 HA GLU A 173 -7.090 -10.748 -5.330 1.00 0.00 H new ATOM 0 HB2 GLU A 173 -4.692 -10.684 -6.064 1.00 0.00 H new ATOM 0 HB3 GLU A 173 -4.236 -10.227 -4.435 1.00 0.00 H new ATOM 0 HG2 GLU A 173 -5.772 -12.406 -3.858 1.00 0.00 H new ATOM 0 HG3 GLU A 173 -5.233 -12.863 -5.462 1.00 0.00 H new ATOM 653 N ASP A 174 -7.835 -10.743 -3.007 1.00 0.00 N ATOM 654 CA ASP A 174 -8.306 -10.788 -1.633 1.00 0.00 C ATOM 655 C ASP A 174 -7.304 -11.572 -0.781 1.00 0.00 C ATOM 656 O ASP A 174 -6.309 -12.079 -1.296 1.00 0.00 O ATOM 657 CB ASP A 174 -9.660 -11.493 -1.539 1.00 0.00 C ATOM 658 CG ASP A 174 -10.426 -11.251 -0.237 1.00 0.00 C ATOM 659 OD1 ASP A 174 -9.953 -10.402 0.550 1.00 0.00 O ATOM 660 OD2 ASP A 174 -11.467 -11.919 -0.058 1.00 0.00 O ATOM 0 H ASP A 174 -8.420 -11.245 -3.675 1.00 0.00 H new ATOM 0 HA ASP A 174 -8.407 -9.763 -1.276 1.00 0.00 H new ATOM 0 HB2 ASP A 174 -10.281 -11.168 -2.374 1.00 0.00 H new ATOM 0 HB3 ASP A 174 -9.503 -12.565 -1.657 1.00 0.00 H new ATOM 665 N SER A 175 -7.604 -11.645 0.508 1.00 0.00 N ATOM 666 CA SER A 175 -6.742 -12.357 1.436 1.00 0.00 C ATOM 667 C SER A 175 -7.063 -13.853 1.406 1.00 0.00 C ATOM 668 O SER A 175 -6.911 -14.545 2.411 1.00 0.00 O ATOM 669 CB SER A 175 -6.894 -11.812 2.858 1.00 0.00 C ATOM 670 OG SER A 175 -5.723 -11.127 3.294 1.00 0.00 O ATOM 0 H SER A 175 -8.431 -11.223 0.931 1.00 0.00 H new ATOM 0 HA SER A 175 -5.708 -12.206 1.126 1.00 0.00 H new ATOM 0 HB2 SER A 175 -7.747 -11.134 2.897 1.00 0.00 H new ATOM 0 HB3 SER A 175 -7.109 -12.634 3.541 1.00 0.00 H new ATOM 0 HG SER A 175 -5.860 -10.793 4.205 1.00 0.00 H new ATOM 676 N GLU A 176 -7.501 -14.307 0.240 1.00 0.00 N ATOM 677 CA GLU A 176 -7.845 -15.708 0.065 1.00 0.00 C ATOM 678 C GLU A 176 -7.127 -16.281 -1.159 1.00 0.00 C ATOM 679 O GLU A 176 -7.148 -17.490 -1.385 1.00 0.00 O ATOM 680 CB GLU A 176 -9.359 -15.891 -0.052 1.00 0.00 C ATOM 681 CG GLU A 176 -9.993 -16.110 1.323 1.00 0.00 C ATOM 682 CD GLU A 176 -9.870 -17.573 1.757 1.00 0.00 C ATOM 683 OE1 GLU A 176 -8.756 -17.947 2.183 1.00 0.00 O ATOM 684 OE2 GLU A 176 -10.892 -18.284 1.650 1.00 0.00 O ATOM 0 H GLU A 176 -7.625 -13.730 -0.592 1.00 0.00 H new ATOM 0 HA GLU A 176 -7.514 -16.256 0.947 1.00 0.00 H new ATOM 0 HB2 GLU A 176 -9.800 -15.013 -0.524 1.00 0.00 H new ATOM 0 HB3 GLU A 176 -9.577 -16.742 -0.697 1.00 0.00 H new ATOM 0 HG2 GLU A 176 -9.508 -15.467 2.058 1.00 0.00 H new ATOM 0 HG3 GLU A 176 -11.044 -15.823 1.293 1.00 0.00 H new ATOM 691 N GLY A 177 -6.510 -15.386 -1.917 1.00 0.00 N ATOM 692 CA GLY A 177 -5.788 -15.788 -3.113 1.00 0.00 C ATOM 693 C GLY A 177 -6.654 -15.612 -4.361 1.00 0.00 C ATOM 694 O GLY A 177 -6.199 -15.861 -5.476 1.00 0.00 O ATOM 0 H GLY A 177 -6.495 -14.384 -1.726 1.00 0.00 H new ATOM 0 HA2 GLY A 177 -4.879 -15.194 -3.210 1.00 0.00 H new ATOM 0 HA3 GLY A 177 -5.480 -16.830 -3.023 1.00 0.00 H new ATOM 698 N LYS A 178 -7.888 -15.184 -4.132 1.00 0.00 N ATOM 699 CA LYS A 178 -8.821 -14.973 -5.225 1.00 0.00 C ATOM 700 C LYS A 178 -8.554 -13.608 -5.862 1.00 0.00 C ATOM 701 O LYS A 178 -8.638 -12.579 -5.192 1.00 0.00 O ATOM 702 CB LYS A 178 -10.262 -15.155 -4.742 1.00 0.00 C ATOM 703 CG LYS A 178 -10.634 -14.083 -3.715 1.00 0.00 C ATOM 704 CD LYS A 178 -11.730 -14.585 -2.772 1.00 0.00 C ATOM 705 CE LYS A 178 -12.902 -13.602 -2.720 1.00 0.00 C ATOM 706 NZ LYS A 178 -14.116 -14.213 -3.308 1.00 0.00 N ATOM 0 H LYS A 178 -8.262 -14.978 -3.206 1.00 0.00 H new ATOM 0 HA LYS A 178 -8.672 -15.722 -6.002 1.00 0.00 H new ATOM 0 HB2 LYS A 178 -10.944 -15.103 -5.591 1.00 0.00 H new ATOM 0 HB3 LYS A 178 -10.379 -16.144 -4.300 1.00 0.00 H new ATOM 0 HG2 LYS A 178 -9.752 -13.805 -3.138 1.00 0.00 H new ATOM 0 HG3 LYS A 178 -10.975 -13.184 -4.229 1.00 0.00 H new ATOM 0 HD2 LYS A 178 -12.083 -15.560 -3.106 1.00 0.00 H new ATOM 0 HD3 LYS A 178 -11.320 -14.720 -1.771 1.00 0.00 H new ATOM 0 HE2 LYS A 178 -13.097 -13.313 -1.687 1.00 0.00 H new ATOM 0 HE3 LYS A 178 -12.646 -12.692 -3.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 178 -14.959 -13.855 -2.814 1.00 0.00 H new ATOM 0 HZ2 LYS A 178 -14.175 -13.966 -4.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 178 -14.068 -15.247 -3.207 1.00 0.00 H new ATOM 720 N ARG A 179 -8.236 -13.642 -7.147 1.00 0.00 N ATOM 721 CA ARG A 179 -7.955 -12.420 -7.881 1.00 0.00 C ATOM 722 C ARG A 179 -9.132 -12.067 -8.794 1.00 0.00 C ATOM 723 O ARG A 179 -9.513 -12.857 -9.656 1.00 0.00 O ATOM 724 CB ARG A 179 -6.689 -12.564 -8.727 1.00 0.00 C ATOM 725 CG ARG A 179 -5.511 -13.038 -7.874 1.00 0.00 C ATOM 726 CD ARG A 179 -4.434 -13.693 -8.742 1.00 0.00 C ATOM 727 NE ARG A 179 -3.784 -14.794 -7.997 1.00 0.00 N ATOM 728 CZ ARG A 179 -3.163 -15.831 -8.577 1.00 0.00 C ATOM 729 NH1 ARG A 179 -3.106 -15.914 -9.913 1.00 0.00 N ATOM 730 NH2 ARG A 179 -2.602 -16.784 -7.822 1.00 0.00 N ATOM 0 H ARG A 179 -8.167 -14.497 -7.699 1.00 0.00 H new ATOM 0 HA ARG A 179 -7.803 -11.623 -7.153 1.00 0.00 H new ATOM 0 HB2 ARG A 179 -6.866 -13.274 -9.535 1.00 0.00 H new ATOM 0 HB3 ARG A 179 -6.446 -11.608 -9.190 1.00 0.00 H new ATOM 0 HG2 ARG A 179 -5.084 -12.192 -7.335 1.00 0.00 H new ATOM 0 HG3 ARG A 179 -5.862 -13.749 -7.126 1.00 0.00 H new ATOM 0 HD2 ARG A 179 -4.879 -14.077 -9.660 1.00 0.00 H new ATOM 0 HD3 ARG A 179 -3.690 -12.952 -9.034 1.00 0.00 H new ATOM 0 HE ARG A 179 -3.810 -14.762 -6.978 1.00 0.00 H new ATOM 0 HH11 ARG A 179 -3.535 -15.189 -10.488 1.00 0.00 H new ATOM 0 HH12 ARG A 179 -2.634 -16.703 -10.355 1.00 0.00 H new ATOM 0 HH21 ARG A 179 -2.647 -16.721 -6.805 1.00 0.00 H new ATOM 0 HH22 ARG A 179 -2.130 -17.573 -8.264 1.00 0.00 H new ATOM 744 N GLY A 180 -9.676 -10.880 -8.572 1.00 0.00 N ATOM 745 CA GLY A 180 -10.802 -10.412 -9.363 1.00 0.00 C ATOM 746 C GLY A 180 -10.825 -8.884 -9.433 1.00 0.00 C ATOM 747 O GLY A 180 -9.947 -8.220 -8.886 1.00 0.00 O ATOM 0 H GLY A 180 -9.358 -10.228 -7.855 1.00 0.00 H new ATOM 0 HA2 GLY A 180 -10.740 -10.825 -10.370 1.00 0.00 H new ATOM 0 HA3 GLY A 180 -11.733 -10.774 -8.927 1.00 0.00 H new ATOM 751 N MET A 181 -11.841 -8.370 -10.112 1.00 0.00 N ATOM 752 CA MET A 181 -11.991 -6.933 -10.261 1.00 0.00 C ATOM 753 C MET A 181 -12.666 -6.321 -9.032 1.00 0.00 C ATOM 754 O MET A 181 -13.616 -6.889 -8.494 1.00 0.00 O ATOM 755 CB MET A 181 -12.829 -6.633 -11.506 1.00 0.00 C ATOM 756 CG MET A 181 -12.005 -6.826 -12.781 1.00 0.00 C ATOM 757 SD MET A 181 -11.291 -5.271 -13.287 1.00 0.00 S ATOM 758 CE MET A 181 -12.295 -4.919 -14.719 1.00 0.00 C ATOM 0 H MET A 181 -12.568 -8.924 -10.565 1.00 0.00 H new ATOM 0 HA MET A 181 -10.999 -6.493 -10.364 1.00 0.00 H new ATOM 0 HB2 MET A 181 -13.700 -7.288 -11.529 1.00 0.00 H new ATOM 0 HB3 MET A 181 -13.201 -5.609 -11.460 1.00 0.00 H new ATOM 0 HG2 MET A 181 -11.217 -7.558 -12.607 1.00 0.00 H new ATOM 0 HG3 MET A 181 -12.637 -7.221 -13.576 1.00 0.00 H new ATOM 0 HE1 MET A 181 -11.980 -3.974 -15.161 1.00 0.00 H new ATOM 0 HE2 MET A 181 -12.178 -5.718 -15.451 1.00 0.00 H new ATOM 0 HE3 MET A 181 -13.341 -4.849 -14.422 1.00 0.00 H new ATOM 768 N ILE A 182 -12.150 -5.172 -8.623 1.00 0.00 N ATOM 769 CA ILE A 182 -12.690 -4.477 -7.468 1.00 0.00 C ATOM 770 C ILE A 182 -12.646 -2.969 -7.718 1.00 0.00 C ATOM 771 O ILE A 182 -11.724 -2.469 -8.360 1.00 0.00 O ATOM 772 CB ILE A 182 -11.963 -4.911 -6.193 1.00 0.00 C ATOM 773 CG1 ILE A 182 -12.955 -5.175 -5.058 1.00 0.00 C ATOM 774 CG2 ILE A 182 -10.898 -3.888 -5.795 1.00 0.00 C ATOM 775 CD1 ILE A 182 -12.768 -4.169 -3.921 1.00 0.00 C ATOM 0 H ILE A 182 -11.362 -4.704 -9.072 1.00 0.00 H new ATOM 0 HA ILE A 182 -13.736 -4.745 -7.318 1.00 0.00 H new ATOM 0 HB ILE A 182 -11.449 -5.850 -6.396 1.00 0.00 H new ATOM 0 HG12 ILE A 182 -13.974 -5.113 -5.439 1.00 0.00 H new ATOM 0 HG13 ILE A 182 -12.818 -6.188 -4.679 1.00 0.00 H new ATOM 0 HG21 ILE A 182 -10.396 -4.220 -4.886 1.00 0.00 H new ATOM 0 HG22 ILE A 182 -10.168 -3.792 -6.598 1.00 0.00 H new ATOM 0 HG23 ILE A 182 -11.370 -2.922 -5.616 1.00 0.00 H new ATOM 0 HD11 ILE A 182 -13.485 -4.379 -3.128 1.00 0.00 H new ATOM 0 HD12 ILE A 182 -11.755 -4.251 -3.526 1.00 0.00 H new ATOM 0 HD13 ILE A 182 -12.930 -3.159 -4.298 1.00 0.00 H new ATOM 787 N PRO A 183 -13.681 -2.267 -7.183 1.00 0.00 N ATOM 788 CA PRO A 183 -13.769 -0.825 -7.342 1.00 0.00 C ATOM 789 C PRO A 183 -12.770 -0.111 -6.431 1.00 0.00 C ATOM 790 O PRO A 183 -12.617 -0.475 -5.266 1.00 0.00 O ATOM 791 CB PRO A 183 -15.215 -0.482 -7.023 1.00 0.00 C ATOM 792 CG PRO A 183 -15.765 -1.669 -6.250 1.00 0.00 C ATOM 793 CD PRO A 183 -14.792 -2.825 -6.417 1.00 0.00 C ATOM 0 HA PRO A 183 -13.508 -0.496 -8.348 1.00 0.00 H new ATOM 0 HB2 PRO A 183 -15.278 0.432 -6.432 1.00 0.00 H new ATOM 0 HB3 PRO A 183 -15.786 -0.312 -7.936 1.00 0.00 H new ATOM 0 HG2 PRO A 183 -15.881 -1.417 -5.196 1.00 0.00 H new ATOM 0 HG3 PRO A 183 -16.752 -1.944 -6.623 1.00 0.00 H new ATOM 0 HD2 PRO A 183 -14.457 -3.203 -5.451 1.00 0.00 H new ATOM 0 HD3 PRO A 183 -15.255 -3.660 -6.943 1.00 0.00 H new ATOM 801 N VAL A 184 -12.115 0.893 -6.995 1.00 0.00 N ATOM 802 CA VAL A 184 -11.134 1.662 -6.248 1.00 0.00 C ATOM 803 C VAL A 184 -11.857 2.670 -5.354 1.00 0.00 C ATOM 804 O VAL A 184 -11.368 3.014 -4.278 1.00 0.00 O ATOM 805 CB VAL A 184 -10.142 2.319 -7.209 1.00 0.00 C ATOM 806 CG1 VAL A 184 -9.138 3.189 -6.450 1.00 0.00 C ATOM 807 CG2 VAL A 184 -9.425 1.269 -8.059 1.00 0.00 C ATOM 0 H VAL A 184 -12.245 1.192 -7.962 1.00 0.00 H new ATOM 0 HA VAL A 184 -10.552 1.009 -5.598 1.00 0.00 H new ATOM 0 HB VAL A 184 -10.705 2.966 -7.881 1.00 0.00 H new ATOM 0 HG11 VAL A 184 -8.444 3.644 -7.157 1.00 0.00 H new ATOM 0 HG12 VAL A 184 -9.670 3.971 -5.909 1.00 0.00 H new ATOM 0 HG13 VAL A 184 -8.583 2.572 -5.743 1.00 0.00 H new ATOM 0 HG21 VAL A 184 -8.726 1.763 -8.734 1.00 0.00 H new ATOM 0 HG22 VAL A 184 -8.880 0.585 -7.409 1.00 0.00 H new ATOM 0 HG23 VAL A 184 -10.158 0.710 -8.641 1.00 0.00 H new ATOM 817 N PRO A 185 -13.041 3.128 -5.843 1.00 0.00 N ATOM 818 CA PRO A 185 -13.837 4.089 -5.099 1.00 0.00 C ATOM 819 C PRO A 185 -14.543 3.421 -3.918 1.00 0.00 C ATOM 820 O PRO A 185 -14.962 4.095 -2.978 1.00 0.00 O ATOM 821 CB PRO A 185 -14.803 4.671 -6.118 1.00 0.00 C ATOM 822 CG PRO A 185 -14.829 3.688 -7.277 1.00 0.00 C ATOM 823 CD PRO A 185 -13.652 2.741 -7.111 1.00 0.00 C ATOM 0 HA PRO A 185 -13.233 4.876 -4.648 1.00 0.00 H new ATOM 0 HB2 PRO A 185 -15.797 4.794 -5.688 1.00 0.00 H new ATOM 0 HB3 PRO A 185 -14.475 5.656 -6.449 1.00 0.00 H new ATOM 0 HG2 PRO A 185 -15.767 3.133 -7.286 1.00 0.00 H new ATOM 0 HG3 PRO A 185 -14.762 4.217 -8.228 1.00 0.00 H new ATOM 0 HD2 PRO A 185 -13.980 1.702 -7.092 1.00 0.00 H new ATOM 0 HD3 PRO A 185 -12.947 2.838 -7.936 1.00 0.00 H new ATOM 831 N TYR A 186 -14.655 2.104 -4.005 1.00 0.00 N ATOM 832 CA TYR A 186 -15.304 1.337 -2.955 1.00 0.00 C ATOM 833 C TYR A 186 -14.275 0.774 -1.972 1.00 0.00 C ATOM 834 O TYR A 186 -14.610 -0.051 -1.123 1.00 0.00 O ATOM 835 CB TYR A 186 -16.010 0.175 -3.657 1.00 0.00 C ATOM 836 CG TYR A 186 -17.451 -0.048 -3.195 1.00 0.00 C ATOM 837 CD1 TYR A 186 -18.465 0.746 -3.690 1.00 0.00 C ATOM 838 CD2 TYR A 186 -17.737 -1.043 -2.283 1.00 0.00 C ATOM 839 CE1 TYR A 186 -19.822 0.537 -3.256 1.00 0.00 C ATOM 840 CE2 TYR A 186 -19.094 -1.252 -1.848 1.00 0.00 C ATOM 841 CZ TYR A 186 -20.070 -0.452 -2.356 1.00 0.00 C ATOM 842 OH TYR A 186 -21.351 -0.650 -1.946 1.00 0.00 O ATOM 0 H TYR A 186 -14.307 1.548 -4.786 1.00 0.00 H new ATOM 0 HA TYR A 186 -15.993 1.965 -2.390 1.00 0.00 H new ATOM 0 HB2 TYR A 186 -16.008 0.358 -4.732 1.00 0.00 H new ATOM 0 HB3 TYR A 186 -15.440 -0.738 -3.488 1.00 0.00 H new ATOM 0 HD1 TYR A 186 -18.241 1.525 -4.404 1.00 0.00 H new ATOM 0 HD2 TYR A 186 -16.944 -1.665 -1.895 1.00 0.00 H new ATOM 0 HE1 TYR A 186 -20.624 1.152 -3.636 1.00 0.00 H new ATOM 0 HE2 TYR A 186 -19.332 -2.027 -1.134 1.00 0.00 H new ATOM 0 HH TYR A 186 -21.378 -1.390 -1.304 1.00 0.00 H new ATOM 852 N VAL A 187 -13.045 1.244 -2.118 1.00 0.00 N ATOM 853 CA VAL A 187 -11.966 0.798 -1.255 1.00 0.00 C ATOM 854 C VAL A 187 -11.126 2.004 -0.830 1.00 0.00 C ATOM 855 O VAL A 187 -11.416 3.135 -1.220 1.00 0.00 O ATOM 856 CB VAL A 187 -11.145 -0.285 -1.958 1.00 0.00 C ATOM 857 CG1 VAL A 187 -11.892 -1.621 -1.966 1.00 0.00 C ATOM 858 CG2 VAL A 187 -10.773 0.145 -3.378 1.00 0.00 C ATOM 0 H VAL A 187 -12.772 1.930 -2.822 1.00 0.00 H new ATOM 0 HA VAL A 187 -12.366 0.345 -0.348 1.00 0.00 H new ATOM 0 HB VAL A 187 -10.221 -0.422 -1.397 1.00 0.00 H new ATOM 0 HG11 VAL A 187 -11.287 -2.373 -2.472 1.00 0.00 H new ATOM 0 HG12 VAL A 187 -12.082 -1.938 -0.941 1.00 0.00 H new ATOM 0 HG13 VAL A 187 -12.840 -1.505 -2.492 1.00 0.00 H new ATOM 0 HG21 VAL A 187 -10.190 -0.642 -3.856 1.00 0.00 H new ATOM 0 HG22 VAL A 187 -11.681 0.324 -3.954 1.00 0.00 H new ATOM 0 HG23 VAL A 187 -10.183 1.060 -3.338 1.00 0.00 H new ATOM 868 N GLU A 188 -10.102 1.723 -0.038 1.00 0.00 N ATOM 869 CA GLU A 188 -9.217 2.772 0.442 1.00 0.00 C ATOM 870 C GLU A 188 -7.766 2.288 0.430 1.00 0.00 C ATOM 871 O GLU A 188 -7.507 1.091 0.319 1.00 0.00 O ATOM 872 CB GLU A 188 -9.629 3.237 1.840 1.00 0.00 C ATOM 873 CG GLU A 188 -9.207 2.221 2.903 1.00 0.00 C ATOM 874 CD GLU A 188 -9.540 2.728 4.308 1.00 0.00 C ATOM 875 OE1 GLU A 188 -10.472 3.554 4.407 1.00 0.00 O ATOM 876 OE2 GLU A 188 -8.853 2.277 5.250 1.00 0.00 O ATOM 0 H GLU A 188 -9.865 0.785 0.284 1.00 0.00 H new ATOM 0 HA GLU A 188 -9.299 3.627 -0.229 1.00 0.00 H new ATOM 0 HB2 GLU A 188 -9.173 4.204 2.055 1.00 0.00 H new ATOM 0 HB3 GLU A 188 -10.709 3.379 1.876 1.00 0.00 H new ATOM 0 HG2 GLU A 188 -9.713 1.272 2.725 1.00 0.00 H new ATOM 0 HG3 GLU A 188 -8.137 2.031 2.825 1.00 0.00 H new ATOM 883 N LYS A 189 -6.856 3.245 0.547 1.00 0.00 N ATOM 884 CA LYS A 189 -5.437 2.931 0.551 1.00 0.00 C ATOM 885 C LYS A 189 -4.990 2.633 1.984 1.00 0.00 C ATOM 886 O LYS A 189 -4.866 3.544 2.801 1.00 0.00 O ATOM 887 CB LYS A 189 -4.640 4.051 -0.122 1.00 0.00 C ATOM 888 CG LYS A 189 -4.709 3.933 -1.646 1.00 0.00 C ATOM 889 CD LYS A 189 -5.771 4.871 -2.221 1.00 0.00 C ATOM 890 CE LYS A 189 -5.234 6.300 -2.341 1.00 0.00 C ATOM 891 NZ LYS A 189 -5.866 6.997 -3.482 1.00 0.00 N ATOM 0 H LYS A 189 -7.074 4.237 0.640 1.00 0.00 H new ATOM 0 HA LYS A 189 -5.242 2.034 -0.037 1.00 0.00 H new ATOM 0 HB2 LYS A 189 -5.032 5.019 0.190 1.00 0.00 H new ATOM 0 HB3 LYS A 189 -3.600 4.009 0.203 1.00 0.00 H new ATOM 0 HG2 LYS A 189 -3.737 4.171 -2.077 1.00 0.00 H new ATOM 0 HG3 LYS A 189 -4.938 2.904 -1.925 1.00 0.00 H new ATOM 0 HD2 LYS A 189 -6.085 4.513 -3.202 1.00 0.00 H new ATOM 0 HD3 LYS A 189 -6.653 4.863 -1.581 1.00 0.00 H new ATOM 0 HE2 LYS A 189 -5.431 6.847 -1.419 1.00 0.00 H new ATOM 0 HE3 LYS A 189 -4.152 6.278 -2.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 -5.491 7.965 -3.549 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 -5.657 6.483 -4.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 -6.895 7.034 -3.339 1.00 0.00 H new ATOM 905 N TYR A 190 -4.759 1.355 2.243 1.00 0.00 N ATOM 906 CA TYR A 190 -4.326 0.925 3.563 1.00 0.00 C ATOM 907 C TYR A 190 -3.003 0.163 3.485 1.00 0.00 C ATOM 908 O TYR A 190 -1.980 0.639 3.976 1.00 0.00 O ATOM 909 CB TYR A 190 -5.416 -0.019 4.076 1.00 0.00 C ATOM 910 CG TYR A 190 -5.337 -0.303 5.577 1.00 0.00 C ATOM 911 CD1 TYR A 190 -5.546 0.717 6.484 1.00 0.00 C ATOM 912 CD2 TYR A 190 -5.056 -1.578 6.025 1.00 0.00 C ATOM 913 CE1 TYR A 190 -5.471 0.449 7.897 1.00 0.00 C ATOM 914 CE2 TYR A 190 -4.981 -1.845 7.437 1.00 0.00 C ATOM 915 CZ TYR A 190 -5.193 -0.818 8.304 1.00 0.00 C ATOM 916 OH TYR A 190 -5.123 -1.070 9.638 1.00 0.00 O ATOM 0 H TYR A 190 -4.863 0.603 1.562 1.00 0.00 H new ATOM 0 HA TYR A 190 -4.175 1.784 4.217 1.00 0.00 H new ATOM 0 HB2 TYR A 190 -6.391 0.411 3.849 1.00 0.00 H new ATOM 0 HB3 TYR A 190 -5.350 -0.962 3.534 1.00 0.00 H new ATOM 0 HD1 TYR A 190 -5.766 1.715 6.134 1.00 0.00 H new ATOM 0 HD2 TYR A 190 -4.892 -2.376 5.315 1.00 0.00 H new ATOM 0 HE1 TYR A 190 -5.632 1.237 8.618 1.00 0.00 H new ATOM 0 HE2 TYR A 190 -4.761 -2.838 7.800 1.00 0.00 H new ATOM 0 HH TYR A 190 -4.918 -2.018 9.782 1.00 0.00 H new