USER MOD reduce.3.24.130724 H: found=0, std=0, add=403, rem=0, adj=5 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=-0.000808 K(o=-0.00081,f=-0.84) USER MOD Single : A 171 ASN : amide:sc= 0 K(o=0,f=-2.1!) USER MOD Single : A 175 SER OG : rot -9:sc= 0.174 USER MOD Single : A 178 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 181 MET CE :methyl -138:sc= 0 (180deg=-0.142) 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 -15:sc= -2.89! USER MOD ----------------------------------------------------------------- ATOM 19 N TYR A 136 -2.040 -2.093 -1.832 1.00 0.00 N ATOM 20 CA TYR A 136 -3.079 -2.715 -1.029 1.00 0.00 C ATOM 21 C TYR A 136 -4.237 -1.746 -0.784 1.00 0.00 C ATOM 22 O TYR A 136 -4.019 -0.553 -0.575 1.00 0.00 O ATOM 23 CB TYR A 136 -2.426 -3.060 0.311 1.00 0.00 C ATOM 24 CG TYR A 136 -1.144 -3.886 0.185 1.00 0.00 C ATOM 25 CD1 TYR A 136 0.075 -3.253 0.056 1.00 0.00 C ATOM 26 CD2 TYR A 136 -1.208 -5.264 0.199 1.00 0.00 C ATOM 27 CE1 TYR A 136 1.281 -4.030 -0.063 1.00 0.00 C ATOM 28 CE2 TYR A 136 -0.002 -6.042 0.080 1.00 0.00 C ATOM 29 CZ TYR A 136 1.183 -5.387 -0.045 1.00 0.00 C ATOM 30 OH TYR A 136 2.323 -6.121 -0.158 1.00 0.00 O ATOM 0 HA TYR A 136 -3.483 -3.592 -1.536 1.00 0.00 H new ATOM 0 HB2 TYR A 136 -2.199 -2.135 0.842 1.00 0.00 H new ATOM 0 HB3 TYR A 136 -3.142 -3.610 0.921 1.00 0.00 H new ATOM 0 HD1 TYR A 136 0.125 -2.174 0.044 1.00 0.00 H new ATOM 0 HD2 TYR A 136 -2.162 -5.759 0.299 1.00 0.00 H new ATOM 0 HE1 TYR A 136 2.242 -3.547 -0.164 1.00 0.00 H new ATOM 0 HE2 TYR A 136 -0.038 -7.121 0.090 1.00 0.00 H new ATOM 0 HH TYR A 136 2.102 -7.075 -0.129 1.00 0.00 H new ATOM 40 N VAL A 137 -5.443 -2.294 -0.818 1.00 0.00 N ATOM 41 CA VAL A 137 -6.635 -1.492 -0.603 1.00 0.00 C ATOM 42 C VAL A 137 -7.537 -2.192 0.416 1.00 0.00 C ATOM 43 O VAL A 137 -7.256 -3.315 0.831 1.00 0.00 O ATOM 44 CB VAL A 137 -7.335 -1.226 -1.937 1.00 0.00 C ATOM 45 CG1 VAL A 137 -6.408 -0.488 -2.904 1.00 0.00 C ATOM 46 CG2 VAL A 137 -7.849 -2.527 -2.556 1.00 0.00 C ATOM 0 H VAL A 137 -5.620 -3.283 -0.991 1.00 0.00 H new ATOM 0 HA VAL A 137 -6.371 -0.518 -0.190 1.00 0.00 H new ATOM 0 HB VAL A 137 -8.195 -0.586 -1.742 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -6.930 -0.311 -3.845 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -6.113 0.466 -2.468 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -5.520 -1.092 -3.090 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -8.342 -2.309 -3.503 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -7.012 -3.203 -2.730 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -8.560 -2.997 -1.877 1.00 0.00 H new ATOM 56 N ARG A 138 -8.603 -1.499 0.790 1.00 0.00 N ATOM 57 CA ARG A 138 -9.548 -2.040 1.752 1.00 0.00 C ATOM 58 C ARG A 138 -10.962 -1.545 1.443 1.00 0.00 C ATOM 59 O ARG A 138 -11.169 -0.358 1.197 1.00 0.00 O ATOM 60 CB ARG A 138 -9.174 -1.634 3.179 1.00 0.00 C ATOM 61 CG ARG A 138 -8.853 -2.862 4.033 1.00 0.00 C ATOM 62 CD ARG A 138 -9.861 -3.015 5.174 1.00 0.00 C ATOM 63 NE ARG A 138 -9.154 -3.039 6.474 1.00 0.00 N ATOM 64 CZ ARG A 138 -9.734 -2.763 7.650 1.00 0.00 C ATOM 65 NH1 ARG A 138 -11.034 -2.442 7.696 1.00 0.00 N ATOM 66 NH2 ARG A 138 -9.014 -2.810 8.779 1.00 0.00 N ATOM 0 H ARG A 138 -8.833 -0.567 0.444 1.00 0.00 H new ATOM 0 HA ARG A 138 -9.515 -3.127 1.674 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -8.312 -0.967 3.157 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -9.996 -1.078 3.630 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -8.865 -3.756 3.410 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -7.847 -2.772 4.442 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -10.574 -2.191 5.154 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -10.433 -3.934 5.045 1.00 0.00 H new ATOM 0 HE ARG A 138 -8.163 -3.281 6.475 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -11.582 -2.408 6.836 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -11.476 -2.232 8.591 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -8.025 -3.056 8.743 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -9.455 -2.600 9.674 1.00 0.00 H new ATOM 80 N ALA A 139 -11.900 -2.481 1.465 1.00 0.00 N ATOM 81 CA ALA A 139 -13.289 -2.156 1.190 1.00 0.00 C ATOM 82 C ALA A 139 -13.970 -1.711 2.486 1.00 0.00 C ATOM 83 O ALA A 139 -13.998 -2.457 3.464 1.00 0.00 O ATOM 84 CB ALA A 139 -13.980 -3.362 0.552 1.00 0.00 C ATOM 0 H ALA A 139 -11.725 -3.465 1.669 1.00 0.00 H new ATOM 0 HA ALA A 139 -13.357 -1.330 0.482 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -15.022 -3.117 0.346 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -13.476 -3.619 -0.380 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -13.935 -4.211 1.235 1.00 0.00 H new ATOM 90 N LEU A 140 -14.503 -0.499 2.451 1.00 0.00 N ATOM 91 CA LEU A 140 -15.183 0.054 3.610 1.00 0.00 C ATOM 92 C LEU A 140 -16.691 0.064 3.355 1.00 0.00 C ATOM 93 O LEU A 140 -17.384 1.004 3.742 1.00 0.00 O ATOM 94 CB LEU A 140 -14.609 1.427 3.963 1.00 0.00 C ATOM 95 CG LEU A 140 -13.195 1.714 3.456 1.00 0.00 C ATOM 96 CD1 LEU A 140 -12.987 3.213 3.229 1.00 0.00 C ATOM 97 CD2 LEU A 140 -12.144 1.126 4.399 1.00 0.00 C ATOM 0 H LEU A 140 -14.478 0.116 1.638 1.00 0.00 H new ATOM 0 HA LEU A 140 -15.013 -0.572 4.486 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -15.278 2.191 3.566 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -14.613 1.532 5.048 1.00 0.00 H new ATOM 0 HG LEU A 140 -13.072 1.222 2.491 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -11.973 3.389 2.869 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -13.703 3.572 2.489 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -13.137 3.747 4.167 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -11.148 1.345 4.015 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -12.256 1.567 5.389 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -12.278 0.046 4.466 1.00 0.00 H new ATOM 109 N PHE A 141 -17.157 -0.993 2.705 1.00 0.00 N ATOM 110 CA PHE A 141 -18.570 -1.117 2.393 1.00 0.00 C ATOM 111 C PHE A 141 -18.895 -2.517 1.868 1.00 0.00 C ATOM 112 O PHE A 141 -18.184 -3.043 1.013 1.00 0.00 O ATOM 113 CB PHE A 141 -18.880 -0.091 1.301 1.00 0.00 C ATOM 114 CG PHE A 141 -20.061 0.826 1.625 1.00 0.00 C ATOM 115 CD1 PHE A 141 -20.252 1.265 2.898 1.00 0.00 C ATOM 116 CD2 PHE A 141 -20.920 1.201 0.640 1.00 0.00 C ATOM 117 CE1 PHE A 141 -21.348 2.116 3.198 1.00 0.00 C ATOM 118 CE2 PHE A 141 -22.017 2.052 0.941 1.00 0.00 C ATOM 119 CZ PHE A 141 -22.208 2.491 2.213 1.00 0.00 C ATOM 0 H PHE A 141 -16.580 -1.771 2.386 1.00 0.00 H new ATOM 0 HA PHE A 141 -19.165 -0.947 3.291 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -17.994 0.521 1.130 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -19.088 -0.618 0.370 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -19.570 0.966 3.680 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -20.768 0.852 -0.371 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -21.499 2.466 4.209 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -22.699 2.350 0.159 1.00 0.00 H new ATOM 0 HZ PHE A 141 -23.042 3.137 2.442 1.00 0.00 H new ATOM 129 N ASP A 142 -19.969 -3.080 2.402 1.00 0.00 N ATOM 130 CA ASP A 142 -20.397 -4.408 1.997 1.00 0.00 C ATOM 131 C ASP A 142 -21.335 -4.293 0.795 1.00 0.00 C ATOM 132 O ASP A 142 -22.359 -3.614 0.864 1.00 0.00 O ATOM 133 CB ASP A 142 -21.157 -5.109 3.125 1.00 0.00 C ATOM 134 CG ASP A 142 -22.080 -6.244 2.675 1.00 0.00 C ATOM 135 OD1 ASP A 142 -23.230 -5.926 2.303 1.00 0.00 O ATOM 136 OD2 ASP A 142 -21.614 -7.403 2.714 1.00 0.00 O ATOM 0 H ASP A 142 -20.555 -2.641 3.112 1.00 0.00 H new ATOM 0 HA ASP A 142 -19.508 -4.987 1.747 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -20.434 -5.509 3.836 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -21.752 -4.367 3.658 1.00 0.00 H new ATOM 141 N PHE A 143 -20.954 -4.967 -0.280 1.00 0.00 N ATOM 142 CA PHE A 143 -21.749 -4.949 -1.496 1.00 0.00 C ATOM 143 C PHE A 143 -22.717 -6.133 -1.535 1.00 0.00 C ATOM 144 O PHE A 143 -22.494 -7.145 -0.874 1.00 0.00 O ATOM 145 CB PHE A 143 -20.774 -5.065 -2.670 1.00 0.00 C ATOM 146 CG PHE A 143 -21.441 -4.984 -4.044 1.00 0.00 C ATOM 147 CD1 PHE A 143 -22.429 -4.076 -4.268 1.00 0.00 C ATOM 148 CD2 PHE A 143 -21.048 -5.821 -5.041 1.00 0.00 C ATOM 149 CE1 PHE A 143 -23.049 -4.002 -5.543 1.00 0.00 C ATOM 150 CE2 PHE A 143 -21.668 -5.746 -6.317 1.00 0.00 C ATOM 151 CZ PHE A 143 -22.655 -4.838 -6.541 1.00 0.00 C ATOM 0 H PHE A 143 -20.105 -5.529 -0.334 1.00 0.00 H new ATOM 0 HA PHE A 143 -22.336 -4.032 -1.543 1.00 0.00 H new ATOM 0 HB2 PHE A 143 -20.031 -4.272 -2.591 1.00 0.00 H new ATOM 0 HB3 PHE A 143 -20.239 -6.012 -2.592 1.00 0.00 H new ATOM 0 HD1 PHE A 143 -22.742 -3.412 -3.476 1.00 0.00 H new ATOM 0 HD2 PHE A 143 -20.265 -6.543 -4.863 1.00 0.00 H new ATOM 0 HE1 PHE A 143 -23.834 -3.282 -5.721 1.00 0.00 H new ATOM 0 HE2 PHE A 143 -21.355 -6.410 -7.109 1.00 0.00 H new ATOM 0 HZ PHE A 143 -23.126 -4.781 -7.511 1.00 0.00 H new ATOM 250 N LEU A 151 -15.161 -10.356 -8.012 1.00 0.00 N ATOM 251 CA LEU A 151 -15.089 -10.845 -6.646 1.00 0.00 C ATOM 252 C LEU A 151 -15.967 -9.970 -5.749 1.00 0.00 C ATOM 253 O LEU A 151 -15.988 -8.749 -5.896 1.00 0.00 O ATOM 254 CB LEU A 151 -13.633 -10.933 -6.184 1.00 0.00 C ATOM 255 CG LEU A 151 -13.403 -10.868 -4.673 1.00 0.00 C ATOM 256 CD1 LEU A 151 -13.122 -12.259 -4.101 1.00 0.00 C ATOM 257 CD2 LEU A 151 -12.294 -9.872 -4.329 1.00 0.00 C ATOM 0 HA LEU A 151 -15.481 -11.860 -6.584 1.00 0.00 H new ATOM 0 HB2 LEU A 151 -13.211 -11.866 -6.556 1.00 0.00 H new ATOM 0 HB3 LEU A 151 -13.075 -10.122 -6.652 1.00 0.00 H new ATOM 0 HG LEU A 151 -14.318 -10.505 -4.204 1.00 0.00 H new ATOM 0 HD11 LEU A 151 -12.962 -12.185 -3.025 1.00 0.00 H new ATOM 0 HD12 LEU A 151 -13.973 -12.912 -4.297 1.00 0.00 H new ATOM 0 HD13 LEU A 151 -12.231 -12.673 -4.572 1.00 0.00 H new ATOM 0 HD21 LEU A 151 -12.151 -9.845 -3.249 1.00 0.00 H new ATOM 0 HD22 LEU A 151 -11.366 -10.180 -4.810 1.00 0.00 H new ATOM 0 HD23 LEU A 151 -12.574 -8.880 -4.682 1.00 0.00 H new ATOM 269 N PRO A 152 -16.688 -10.646 -4.815 1.00 0.00 N ATOM 270 CA PRO A 152 -17.566 -9.943 -3.894 1.00 0.00 C ATOM 271 C PRO A 152 -16.760 -9.230 -2.806 1.00 0.00 C ATOM 272 O PRO A 152 -15.721 -9.724 -2.373 1.00 0.00 O ATOM 273 CB PRO A 152 -18.494 -11.012 -3.341 1.00 0.00 C ATOM 274 CG PRO A 152 -17.808 -12.341 -3.615 1.00 0.00 C ATOM 275 CD PRO A 152 -16.688 -12.091 -4.611 1.00 0.00 C ATOM 0 HA PRO A 152 -18.137 -9.151 -4.379 1.00 0.00 H new ATOM 0 HB2 PRO A 152 -18.660 -10.871 -2.273 1.00 0.00 H new ATOM 0 HB3 PRO A 152 -19.470 -10.970 -3.824 1.00 0.00 H new ATOM 0 HG2 PRO A 152 -17.411 -12.763 -2.692 1.00 0.00 H new ATOM 0 HG3 PRO A 152 -18.520 -13.063 -4.015 1.00 0.00 H new ATOM 0 HD2 PRO A 152 -15.729 -12.436 -4.223 1.00 0.00 H new ATOM 0 HD3 PRO A 152 -16.864 -12.623 -5.546 1.00 0.00 H new ATOM 283 N PHE A 153 -17.271 -8.078 -2.395 1.00 0.00 N ATOM 284 CA PHE A 153 -16.613 -7.292 -1.366 1.00 0.00 C ATOM 285 C PHE A 153 -17.453 -7.247 -0.088 1.00 0.00 C ATOM 286 O PHE A 153 -18.658 -7.494 -0.124 1.00 0.00 O ATOM 287 CB PHE A 153 -16.465 -5.871 -1.915 1.00 0.00 C ATOM 288 CG PHE A 153 -16.479 -5.790 -3.442 1.00 0.00 C ATOM 289 CD1 PHE A 153 -15.367 -6.118 -4.152 1.00 0.00 C ATOM 290 CD2 PHE A 153 -17.605 -5.388 -4.091 1.00 0.00 C ATOM 291 CE1 PHE A 153 -15.380 -6.042 -5.570 1.00 0.00 C ATOM 292 CE2 PHE A 153 -17.619 -5.312 -5.509 1.00 0.00 C ATOM 293 CZ PHE A 153 -16.506 -5.641 -6.218 1.00 0.00 C ATOM 0 H PHE A 153 -18.133 -7.671 -2.757 1.00 0.00 H new ATOM 0 HA PHE A 153 -15.649 -7.736 -1.119 1.00 0.00 H new ATOM 0 HB2 PHE A 153 -17.273 -5.254 -1.521 1.00 0.00 H new ATOM 0 HB3 PHE A 153 -15.531 -5.446 -1.547 1.00 0.00 H new ATOM 0 HD1 PHE A 153 -14.473 -6.437 -3.637 1.00 0.00 H new ATOM 0 HD2 PHE A 153 -18.489 -5.127 -3.528 1.00 0.00 H new ATOM 0 HE1 PHE A 153 -14.496 -6.303 -6.133 1.00 0.00 H new ATOM 0 HE2 PHE A 153 -18.513 -4.993 -6.024 1.00 0.00 H new ATOM 0 HZ PHE A 153 -16.517 -5.584 -7.296 1.00 0.00 H new ATOM 303 N LYS A 154 -16.784 -6.931 1.011 1.00 0.00 N ATOM 304 CA LYS A 154 -17.455 -6.851 2.298 1.00 0.00 C ATOM 305 C LYS A 154 -16.951 -5.620 3.054 1.00 0.00 C ATOM 306 O LYS A 154 -15.906 -5.065 2.718 1.00 0.00 O ATOM 307 CB LYS A 154 -17.287 -8.160 3.072 1.00 0.00 C ATOM 308 CG LYS A 154 -17.915 -9.330 2.312 1.00 0.00 C ATOM 309 CD LYS A 154 -18.781 -10.184 3.240 1.00 0.00 C ATOM 310 CE LYS A 154 -18.016 -11.418 3.723 1.00 0.00 C ATOM 311 NZ LYS A 154 -17.736 -11.320 5.173 1.00 0.00 N ATOM 0 H LYS A 154 -15.785 -6.727 1.037 1.00 0.00 H new ATOM 0 HA LYS A 154 -18.529 -6.725 2.161 1.00 0.00 H new ATOM 0 HB2 LYS A 154 -16.228 -8.356 3.237 1.00 0.00 H new ATOM 0 HB3 LYS A 154 -17.751 -8.068 4.054 1.00 0.00 H new ATOM 0 HG2 LYS A 154 -18.521 -8.951 1.490 1.00 0.00 H new ATOM 0 HG3 LYS A 154 -17.130 -9.946 1.872 1.00 0.00 H new ATOM 0 HD2 LYS A 154 -19.097 -9.589 4.097 1.00 0.00 H new ATOM 0 HD3 LYS A 154 -19.685 -10.494 2.716 1.00 0.00 H new ATOM 0 HE2 LYS A 154 -18.598 -12.317 3.519 1.00 0.00 H new ATOM 0 HE3 LYS A 154 -17.080 -11.512 3.172 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 -17.216 -12.165 5.484 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 -17.162 -10.473 5.359 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 -18.632 -11.253 5.696 1.00 0.00 H new ATOM 325 N LYS A 155 -17.718 -5.229 4.062 1.00 0.00 N ATOM 326 CA LYS A 155 -17.363 -4.074 4.869 1.00 0.00 C ATOM 327 C LYS A 155 -16.071 -4.370 5.634 1.00 0.00 C ATOM 328 O LYS A 155 -16.012 -5.318 6.415 1.00 0.00 O ATOM 329 CB LYS A 155 -18.532 -3.670 5.769 1.00 0.00 C ATOM 330 CG LYS A 155 -18.894 -4.797 6.738 1.00 0.00 C ATOM 331 CD LYS A 155 -18.879 -4.302 8.186 1.00 0.00 C ATOM 332 CE LYS A 155 -17.545 -4.625 8.862 1.00 0.00 C ATOM 333 NZ LYS A 155 -17.736 -4.819 10.317 1.00 0.00 N ATOM 0 H LYS A 155 -18.584 -5.692 4.338 1.00 0.00 H new ATOM 0 HA LYS A 155 -17.167 -3.210 4.234 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -18.270 -2.773 6.330 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -19.398 -3.421 5.156 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -19.882 -5.188 6.494 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -18.188 -5.620 6.624 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -19.051 -3.226 8.208 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -19.694 -4.766 8.741 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -17.116 -5.525 8.422 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -16.836 -3.816 8.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -16.821 -5.037 10.761 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -18.125 -3.950 10.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -18.396 -5.606 10.479 1.00 0.00 H new ATOM 347 N GLY A 156 -15.069 -3.541 5.382 1.00 0.00 N ATOM 348 CA GLY A 156 -13.782 -3.702 6.037 1.00 0.00 C ATOM 349 C GLY A 156 -13.050 -4.938 5.511 1.00 0.00 C ATOM 350 O GLY A 156 -12.465 -5.694 6.286 1.00 0.00 O ATOM 0 H GLY A 156 -15.122 -2.756 4.733 1.00 0.00 H new ATOM 0 HA2 GLY A 156 -13.171 -2.815 5.870 1.00 0.00 H new ATOM 0 HA3 GLY A 156 -13.927 -3.791 7.114 1.00 0.00 H new ATOM 354 N ASP A 157 -13.105 -5.105 4.198 1.00 0.00 N ATOM 355 CA ASP A 157 -12.454 -6.236 3.560 1.00 0.00 C ATOM 356 C ASP A 157 -11.068 -5.812 3.071 1.00 0.00 C ATOM 357 O ASP A 157 -10.813 -4.626 2.869 1.00 0.00 O ATOM 358 CB ASP A 157 -13.254 -6.721 2.349 1.00 0.00 C ATOM 359 CG ASP A 157 -13.037 -8.188 1.975 1.00 0.00 C ATOM 360 OD1 ASP A 157 -11.913 -8.676 2.222 1.00 0.00 O ATOM 361 OD2 ASP A 157 -13.999 -8.789 1.450 1.00 0.00 O ATOM 0 H ASP A 157 -13.590 -4.476 3.559 1.00 0.00 H new ATOM 0 HA ASP A 157 -12.383 -7.041 4.292 1.00 0.00 H new ATOM 0 HB2 ASP A 157 -14.314 -6.566 2.547 1.00 0.00 H new ATOM 0 HB3 ASP A 157 -12.996 -6.101 1.490 1.00 0.00 H new ATOM 366 N ILE A 158 -10.208 -6.805 2.896 1.00 0.00 N ATOM 367 CA ILE A 158 -8.854 -6.550 2.435 1.00 0.00 C ATOM 368 C ILE A 158 -8.720 -7.007 0.981 1.00 0.00 C ATOM 369 O ILE A 158 -9.120 -8.118 0.637 1.00 0.00 O ATOM 370 CB ILE A 158 -7.836 -7.195 3.379 1.00 0.00 C ATOM 371 CG1 ILE A 158 -7.534 -6.280 4.568 1.00 0.00 C ATOM 372 CG2 ILE A 158 -6.566 -7.594 2.625 1.00 0.00 C ATOM 373 CD1 ILE A 158 -6.559 -5.170 4.171 1.00 0.00 C ATOM 0 H ILE A 158 -10.423 -7.788 3.065 1.00 0.00 H new ATOM 0 HA ILE A 158 -8.640 -5.481 2.455 1.00 0.00 H new ATOM 0 HB ILE A 158 -8.273 -8.109 3.780 1.00 0.00 H new ATOM 0 HG12 ILE A 158 -8.460 -5.840 4.938 1.00 0.00 H new ATOM 0 HG13 ILE A 158 -7.111 -6.866 5.384 1.00 0.00 H new ATOM 0 HG21 ILE A 158 -5.859 -8.050 3.318 1.00 0.00 H new ATOM 0 HG22 ILE A 158 -6.817 -8.309 1.841 1.00 0.00 H new ATOM 0 HG23 ILE A 158 -6.115 -6.708 2.177 1.00 0.00 H new ATOM 0 HD11 ILE A 158 -6.361 -4.534 5.034 1.00 0.00 H new ATOM 0 HD12 ILE A 158 -5.625 -5.613 3.825 1.00 0.00 H new ATOM 0 HD13 ILE A 158 -6.995 -4.571 3.371 1.00 0.00 H new ATOM 385 N LEU A 159 -8.155 -6.127 0.168 1.00 0.00 N ATOM 386 CA LEU A 159 -7.964 -6.425 -1.241 1.00 0.00 C ATOM 387 C LEU A 159 -6.651 -5.800 -1.717 1.00 0.00 C ATOM 388 O LEU A 159 -6.458 -4.591 -1.604 1.00 0.00 O ATOM 389 CB LEU A 159 -9.184 -5.986 -2.053 1.00 0.00 C ATOM 390 CG LEU A 159 -10.546 -6.220 -1.398 1.00 0.00 C ATOM 391 CD1 LEU A 159 -11.016 -4.973 -0.647 1.00 0.00 C ATOM 392 CD2 LEU A 159 -11.575 -6.693 -2.426 1.00 0.00 C ATOM 0 H LEU A 159 -7.823 -5.207 0.458 1.00 0.00 H new ATOM 0 HA LEU A 159 -7.879 -7.501 -1.394 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -9.086 -4.923 -2.272 1.00 0.00 H new ATOM 0 HB3 LEU A 159 -9.168 -6.511 -3.008 1.00 0.00 H new ATOM 0 HG LEU A 159 -10.438 -7.016 -0.662 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -11.987 -5.167 -0.191 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -10.294 -4.722 0.130 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -11.103 -4.140 -1.344 1.00 0.00 H new ATOM 0 HD21 LEU A 159 -12.534 -6.852 -1.934 1.00 0.00 H new ATOM 0 HD22 LEU A 159 -11.687 -5.937 -3.203 1.00 0.00 H new ATOM 0 HD23 LEU A 159 -11.238 -7.628 -2.874 1.00 0.00 H new ATOM 404 N ARG A 160 -5.781 -6.653 -2.238 1.00 0.00 N ATOM 405 CA ARG A 160 -4.492 -6.200 -2.731 1.00 0.00 C ATOM 406 C ARG A 160 -4.585 -5.848 -4.217 1.00 0.00 C ATOM 407 O ARG A 160 -5.356 -6.459 -4.956 1.00 0.00 O ATOM 408 CB ARG A 160 -3.418 -7.272 -2.535 1.00 0.00 C ATOM 409 CG ARG A 160 -2.408 -7.254 -3.683 1.00 0.00 C ATOM 410 CD ARG A 160 -1.319 -8.308 -3.472 1.00 0.00 C ATOM 411 NE ARG A 160 -1.710 -9.577 -4.126 1.00 0.00 N ATOM 412 CZ ARG A 160 -1.089 -10.747 -3.926 1.00 0.00 C ATOM 413 NH1 ARG A 160 -0.044 -10.817 -3.090 1.00 0.00 N ATOM 414 NH2 ARG A 160 -1.513 -11.848 -4.561 1.00 0.00 N ATOM 0 H ARG A 160 -5.944 -7.656 -2.329 1.00 0.00 H new ATOM 0 HA ARG A 160 -4.213 -5.314 -2.161 1.00 0.00 H new ATOM 0 HB2 ARG A 160 -2.902 -7.106 -1.589 1.00 0.00 H new ATOM 0 HB3 ARG A 160 -3.887 -8.254 -2.474 1.00 0.00 H new ATOM 0 HG2 ARG A 160 -2.921 -7.440 -4.626 1.00 0.00 H new ATOM 0 HG3 ARG A 160 -1.953 -6.266 -3.757 1.00 0.00 H new ATOM 0 HD2 ARG A 160 -0.374 -7.954 -3.883 1.00 0.00 H new ATOM 0 HD3 ARG A 160 -1.162 -8.472 -2.406 1.00 0.00 H new ATOM 0 HE ARG A 160 -2.502 -9.560 -4.769 1.00 0.00 H new ATOM 0 HH11 ARG A 160 0.279 -9.979 -2.606 1.00 0.00 H new ATOM 0 HH12 ARG A 160 0.429 -11.708 -2.938 1.00 0.00 H new ATOM 0 HH21 ARG A 160 -2.309 -11.795 -5.197 1.00 0.00 H new ATOM 0 HH22 ARG A 160 -1.040 -12.739 -4.409 1.00 0.00 H new ATOM 428 N ILE A 161 -3.789 -4.865 -4.611 1.00 0.00 N ATOM 429 CA ILE A 161 -3.773 -4.425 -5.996 1.00 0.00 C ATOM 430 C ILE A 161 -2.786 -5.285 -6.788 1.00 0.00 C ATOM 431 O ILE A 161 -1.659 -5.506 -6.349 1.00 0.00 O ATOM 432 CB ILE A 161 -3.485 -2.925 -6.078 1.00 0.00 C ATOM 433 CG1 ILE A 161 -4.617 -2.113 -5.444 1.00 0.00 C ATOM 434 CG2 ILE A 161 -3.211 -2.497 -7.521 1.00 0.00 C ATOM 435 CD1 ILE A 161 -4.240 -0.634 -5.341 1.00 0.00 C ATOM 0 H ILE A 161 -3.151 -4.361 -3.996 1.00 0.00 H new ATOM 0 HA ILE A 161 -4.754 -4.563 -6.451 1.00 0.00 H new ATOM 0 HB ILE A 161 -2.581 -2.719 -5.504 1.00 0.00 H new ATOM 0 HG12 ILE A 161 -5.524 -2.220 -6.039 1.00 0.00 H new ATOM 0 HG13 ILE A 161 -4.839 -2.505 -4.452 1.00 0.00 H new ATOM 0 HG21 ILE A 161 -3.009 -1.426 -7.551 1.00 0.00 H new ATOM 0 HG22 ILE A 161 -2.347 -3.040 -7.904 1.00 0.00 H new ATOM 0 HG23 ILE A 161 -4.082 -2.720 -8.138 1.00 0.00 H new ATOM 0 HD11 ILE A 161 -5.062 -0.080 -4.887 1.00 0.00 H new ATOM 0 HD12 ILE A 161 -3.347 -0.528 -4.725 1.00 0.00 H new ATOM 0 HD13 ILE A 161 -4.042 -0.239 -6.337 1.00 0.00 H new ATOM 447 N ARG A 162 -3.246 -5.746 -7.942 1.00 0.00 N ATOM 448 CA ARG A 162 -2.418 -6.577 -8.799 1.00 0.00 C ATOM 449 C ARG A 162 -2.227 -5.908 -10.162 1.00 0.00 C ATOM 450 O ARG A 162 -1.098 -5.670 -10.588 1.00 0.00 O ATOM 451 CB ARG A 162 -3.045 -7.958 -9.000 1.00 0.00 C ATOM 452 CG ARG A 162 -1.982 -8.995 -9.366 1.00 0.00 C ATOM 453 CD ARG A 162 -2.253 -10.329 -8.668 1.00 0.00 C ATOM 454 NE ARG A 162 -1.418 -11.393 -9.267 1.00 0.00 N ATOM 455 CZ ARG A 162 -1.604 -11.892 -10.497 1.00 0.00 C ATOM 456 NH1 ARG A 162 -2.598 -11.426 -11.265 1.00 0.00 N ATOM 457 NH2 ARG A 162 -0.797 -12.857 -10.958 1.00 0.00 N ATOM 0 H ARG A 162 -4.181 -5.560 -8.303 1.00 0.00 H new ATOM 0 HA ARG A 162 -1.451 -6.697 -8.310 1.00 0.00 H new ATOM 0 HB2 ARG A 162 -3.558 -8.264 -8.089 1.00 0.00 H new ATOM 0 HB3 ARG A 162 -3.797 -7.909 -9.788 1.00 0.00 H new ATOM 0 HG2 ARG A 162 -1.969 -9.142 -10.446 1.00 0.00 H new ATOM 0 HG3 ARG A 162 -0.996 -8.626 -9.083 1.00 0.00 H new ATOM 0 HD2 ARG A 162 -2.037 -10.242 -7.603 1.00 0.00 H new ATOM 0 HD3 ARG A 162 -3.308 -10.589 -8.759 1.00 0.00 H new ATOM 0 HE ARG A 162 -0.652 -11.771 -8.709 1.00 0.00 H new ATOM 0 HH11 ARG A 162 -3.213 -10.692 -10.914 1.00 0.00 H new ATOM 0 HH12 ARG A 162 -2.740 -11.805 -12.201 1.00 0.00 H new ATOM 0 HH21 ARG A 162 -0.041 -13.212 -10.373 1.00 0.00 H new ATOM 0 HH22 ARG A 162 -0.939 -13.237 -11.894 1.00 0.00 H new ATOM 471 N ASP A 163 -3.348 -5.624 -10.809 1.00 0.00 N ATOM 472 CA ASP A 163 -3.318 -4.987 -12.114 1.00 0.00 C ATOM 473 C ASP A 163 -4.456 -3.969 -12.207 1.00 0.00 C ATOM 474 O ASP A 163 -5.570 -4.234 -11.757 1.00 0.00 O ATOM 475 CB ASP A 163 -3.510 -6.013 -13.232 1.00 0.00 C ATOM 476 CG ASP A 163 -2.313 -6.934 -13.478 1.00 0.00 C ATOM 477 OD1 ASP A 163 -1.451 -6.996 -12.576 1.00 0.00 O ATOM 478 OD2 ASP A 163 -2.288 -7.554 -14.563 1.00 0.00 O ATOM 0 H ASP A 163 -4.283 -5.824 -10.453 1.00 0.00 H new ATOM 0 HA ASP A 163 -2.348 -4.503 -12.230 1.00 0.00 H new ATOM 0 HB2 ASP A 163 -4.379 -6.627 -12.996 1.00 0.00 H new ATOM 0 HB3 ASP A 163 -3.737 -5.482 -14.157 1.00 0.00 H new ATOM 483 N LYS A 164 -4.137 -2.824 -12.793 1.00 0.00 N ATOM 484 CA LYS A 164 -5.119 -1.765 -12.950 1.00 0.00 C ATOM 485 C LYS A 164 -5.255 -1.417 -14.434 1.00 0.00 C ATOM 486 O LYS A 164 -4.726 -0.403 -14.888 1.00 0.00 O ATOM 487 CB LYS A 164 -4.761 -0.567 -12.068 1.00 0.00 C ATOM 488 CG LYS A 164 -4.359 -1.021 -10.663 1.00 0.00 C ATOM 489 CD LYS A 164 -3.226 -0.155 -10.110 1.00 0.00 C ATOM 490 CE LYS A 164 -3.780 1.069 -9.376 1.00 0.00 C ATOM 491 NZ LYS A 164 -2.718 2.081 -9.181 1.00 0.00 N ATOM 0 H LYS A 164 -3.212 -2.607 -13.165 1.00 0.00 H new ATOM 0 HA LYS A 164 -6.099 -2.101 -12.610 1.00 0.00 H new ATOM 0 HB2 LYS A 164 -3.942 -0.009 -12.522 1.00 0.00 H new ATOM 0 HB3 LYS A 164 -5.613 0.110 -12.005 1.00 0.00 H new ATOM 0 HG2 LYS A 164 -5.221 -0.966 -9.999 1.00 0.00 H new ATOM 0 HG3 LYS A 164 -4.044 -2.064 -10.690 1.00 0.00 H new ATOM 0 HD2 LYS A 164 -2.612 -0.745 -9.429 1.00 0.00 H new ATOM 0 HD3 LYS A 164 -2.579 0.168 -10.925 1.00 0.00 H new ATOM 0 HE2 LYS A 164 -4.602 1.501 -9.947 1.00 0.00 H new ATOM 0 HE3 LYS A 164 -4.186 0.768 -8.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 -3.111 2.905 -8.682 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 -1.946 1.670 -8.618 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 -2.350 2.380 -10.106 1.00 0.00 H new ATOM 505 N PRO A 165 -5.985 -2.299 -15.167 1.00 0.00 N ATOM 506 CA PRO A 165 -6.197 -2.095 -16.590 1.00 0.00 C ATOM 507 C PRO A 165 -7.223 -0.987 -16.838 1.00 0.00 C ATOM 508 O PRO A 165 -7.025 -0.138 -17.705 1.00 0.00 O ATOM 509 CB PRO A 165 -6.645 -3.448 -17.118 1.00 0.00 C ATOM 510 CG PRO A 165 -7.114 -4.236 -15.905 1.00 0.00 C ATOM 511 CD PRO A 165 -6.626 -3.510 -14.662 1.00 0.00 C ATOM 0 HA PRO A 165 -5.298 -1.759 -17.106 1.00 0.00 H new ATOM 0 HB2 PRO A 165 -7.449 -3.336 -17.846 1.00 0.00 H new ATOM 0 HB3 PRO A 165 -5.826 -3.960 -17.624 1.00 0.00 H new ATOM 0 HG2 PRO A 165 -8.201 -4.316 -15.899 1.00 0.00 H new ATOM 0 HG3 PRO A 165 -6.720 -5.252 -15.934 1.00 0.00 H new ATOM 0 HD2 PRO A 165 -7.453 -3.271 -13.993 1.00 0.00 H new ATOM 0 HD3 PRO A 165 -5.925 -4.122 -14.096 1.00 0.00 H new ATOM 519 N GLU A 166 -8.295 -1.032 -16.061 1.00 0.00 N ATOM 520 CA GLU A 166 -9.352 -0.043 -16.186 1.00 0.00 C ATOM 521 C GLU A 166 -9.041 1.177 -15.317 1.00 0.00 C ATOM 522 O GLU A 166 -8.005 1.227 -14.657 1.00 0.00 O ATOM 523 CB GLU A 166 -10.711 -0.644 -15.823 1.00 0.00 C ATOM 524 CG GLU A 166 -11.040 -1.839 -16.720 1.00 0.00 C ATOM 525 CD GLU A 166 -11.814 -1.395 -17.963 1.00 0.00 C ATOM 526 OE1 GLU A 166 -11.153 -0.867 -18.884 1.00 0.00 O ATOM 527 OE2 GLU A 166 -13.048 -1.593 -17.965 1.00 0.00 O ATOM 0 H GLU A 166 -8.454 -1.738 -15.342 1.00 0.00 H new ATOM 0 HA GLU A 166 -9.401 0.279 -17.226 1.00 0.00 H new ATOM 0 HB2 GLU A 166 -10.706 -0.959 -14.779 1.00 0.00 H new ATOM 0 HB3 GLU A 166 -11.487 0.115 -15.924 1.00 0.00 H new ATOM 0 HG2 GLU A 166 -10.118 -2.338 -17.020 1.00 0.00 H new ATOM 0 HG3 GLU A 166 -11.629 -2.567 -16.161 1.00 0.00 H new ATOM 534 N GLU A 167 -9.959 2.133 -15.345 1.00 0.00 N ATOM 535 CA GLU A 167 -9.797 3.349 -14.568 1.00 0.00 C ATOM 536 C GLU A 167 -10.886 3.446 -13.498 1.00 0.00 C ATOM 537 O GLU A 167 -11.288 4.542 -13.113 1.00 0.00 O ATOM 538 CB GLU A 167 -9.807 4.583 -15.473 1.00 0.00 C ATOM 539 CG GLU A 167 -8.843 5.652 -14.953 1.00 0.00 C ATOM 540 CD GLU A 167 -9.053 6.981 -15.682 1.00 0.00 C ATOM 541 OE1 GLU A 167 -10.216 7.246 -16.054 1.00 0.00 O ATOM 542 OE2 GLU A 167 -8.045 7.700 -15.852 1.00 0.00 O ATOM 0 H GLU A 167 -10.817 2.089 -15.894 1.00 0.00 H new ATOM 0 HA GLU A 167 -8.828 3.311 -14.070 1.00 0.00 H new ATOM 0 HB2 GLU A 167 -9.526 4.297 -16.487 1.00 0.00 H new ATOM 0 HB3 GLU A 167 -10.816 4.992 -15.525 1.00 0.00 H new ATOM 0 HG2 GLU A 167 -8.993 5.793 -13.883 1.00 0.00 H new ATOM 0 HG3 GLU A 167 -7.815 5.317 -15.089 1.00 0.00 H new ATOM 549 N GLN A 168 -11.334 2.282 -13.048 1.00 0.00 N ATOM 550 CA GLN A 168 -12.369 2.221 -12.031 1.00 0.00 C ATOM 551 C GLN A 168 -12.284 0.899 -11.266 1.00 0.00 C ATOM 552 O GLN A 168 -12.277 0.888 -10.036 1.00 0.00 O ATOM 553 CB GLN A 168 -13.756 2.410 -12.647 1.00 0.00 C ATOM 554 CG GLN A 168 -13.940 1.508 -13.870 1.00 0.00 C ATOM 555 CD GLN A 168 -15.216 1.872 -14.632 1.00 0.00 C ATOM 556 OE1 GLN A 168 -15.614 3.022 -14.715 1.00 0.00 O ATOM 557 NE2 GLN A 168 -15.833 0.829 -15.182 1.00 0.00 N ATOM 0 H GLN A 168 -10.998 1.374 -13.370 1.00 0.00 H new ATOM 0 HA GLN A 168 -12.207 3.037 -11.327 1.00 0.00 H new ATOM 0 HB2 GLN A 168 -14.521 2.183 -11.905 1.00 0.00 H new ATOM 0 HB3 GLN A 168 -13.891 3.452 -12.936 1.00 0.00 H new ATOM 0 HG2 GLN A 168 -13.078 1.604 -14.530 1.00 0.00 H new ATOM 0 HG3 GLN A 168 -13.985 0.466 -13.554 1.00 0.00 H new ATOM 0 HE21 GLN A 168 -15.445 -0.108 -15.074 1.00 0.00 H new ATOM 0 HE22 GLN A 168 -16.694 0.967 -15.712 1.00 0.00 H new ATOM 566 N TRP A 169 -12.222 -0.185 -12.026 1.00 0.00 N ATOM 567 CA TRP A 169 -12.138 -1.509 -11.435 1.00 0.00 C ATOM 568 C TRP A 169 -10.798 -2.126 -11.845 1.00 0.00 C ATOM 569 O TRP A 169 -10.483 -2.202 -13.031 1.00 0.00 O ATOM 570 CB TRP A 169 -13.339 -2.367 -11.839 1.00 0.00 C ATOM 571 CG TRP A 169 -14.681 -1.836 -11.332 1.00 0.00 C ATOM 572 CD1 TRP A 169 -15.115 -0.569 -11.319 1.00 0.00 C ATOM 573 CD2 TRP A 169 -15.753 -2.615 -10.762 1.00 0.00 C ATOM 574 NE1 TRP A 169 -16.384 -0.474 -10.784 1.00 0.00 N ATOM 575 CE2 TRP A 169 -16.784 -1.758 -10.434 1.00 0.00 C ATOM 576 CE3 TRP A 169 -15.850 -3.999 -10.530 1.00 0.00 C ATOM 577 CZ2 TRP A 169 -17.985 -2.188 -9.856 1.00 0.00 C ATOM 578 CZ3 TRP A 169 -17.056 -4.413 -9.952 1.00 0.00 C ATOM 579 CH2 TRP A 169 -18.103 -3.563 -9.616 1.00 0.00 C ATOM 0 H TRP A 169 -12.228 -0.173 -13.046 1.00 0.00 H new ATOM 0 HA TRP A 169 -12.176 -1.449 -10.347 1.00 0.00 H new ATOM 0 HB2 TRP A 169 -13.374 -2.436 -12.926 1.00 0.00 H new ATOM 0 HB3 TRP A 169 -13.194 -3.379 -11.460 1.00 0.00 H new ATOM 0 HD1 TRP A 169 -14.544 0.273 -11.682 1.00 0.00 H new ATOM 0 HE1 TRP A 169 -16.928 0.381 -10.667 1.00 0.00 H new ATOM 0 HE3 TRP A 169 -15.056 -4.688 -10.778 1.00 0.00 H new ATOM 0 HZ2 TRP A 169 -18.777 -1.497 -9.609 1.00 0.00 H new ATOM 0 HZ3 TRP A 169 -17.182 -5.467 -9.753 1.00 0.00 H new ATOM 0 HH2 TRP A 169 -19.003 -3.961 -9.172 1.00 0.00 H new ATOM 590 N TRP A 170 -10.046 -2.549 -10.839 1.00 0.00 N ATOM 591 CA TRP A 170 -8.748 -3.156 -11.080 1.00 0.00 C ATOM 592 C TRP A 170 -8.776 -4.575 -10.508 1.00 0.00 C ATOM 593 O TRP A 170 -9.643 -4.905 -9.700 1.00 0.00 O ATOM 594 CB TRP A 170 -7.625 -2.298 -10.495 1.00 0.00 C ATOM 595 CG TRP A 170 -7.680 -0.828 -10.917 1.00 0.00 C ATOM 596 CD1 TRP A 170 -8.099 -0.320 -12.084 1.00 0.00 C ATOM 597 CD2 TRP A 170 -7.284 0.310 -10.123 1.00 0.00 C ATOM 598 NE1 TRP A 170 -8.002 1.056 -12.100 1.00 0.00 N ATOM 599 CE2 TRP A 170 -7.491 1.452 -10.870 1.00 0.00 C ATOM 600 CE3 TRP A 170 -6.768 0.372 -8.816 1.00 0.00 C ATOM 601 CZ2 TRP A 170 -7.209 2.739 -10.396 1.00 0.00 C ATOM 602 CZ3 TRP A 170 -6.492 1.666 -8.358 1.00 0.00 C ATOM 603 CH2 TRP A 170 -6.695 2.826 -9.097 1.00 0.00 C ATOM 0 H TRP A 170 -10.311 -2.483 -9.856 1.00 0.00 H new ATOM 0 HA TRP A 170 -8.542 -3.216 -12.149 1.00 0.00 H new ATOM 0 HB2 TRP A 170 -7.667 -2.355 -9.407 1.00 0.00 H new ATOM 0 HB3 TRP A 170 -6.666 -2.717 -10.799 1.00 0.00 H new ATOM 0 HD1 TRP A 170 -8.466 -0.913 -12.908 1.00 0.00 H new ATOM 0 HE1 TRP A 170 -8.258 1.670 -12.873 1.00 0.00 H new ATOM 0 HE3 TRP A 170 -6.598 -0.508 -8.214 1.00 0.00 H new ATOM 0 HZ2 TRP A 170 -7.379 3.618 -11.000 1.00 0.00 H new ATOM 0 HZ3 TRP A 170 -6.093 1.770 -7.360 1.00 0.00 H new ATOM 0 HH2 TRP A 170 -6.457 3.789 -8.671 1.00 0.00 H new ATOM 614 N ASN A 171 -7.818 -5.376 -10.949 1.00 0.00 N ATOM 615 CA ASN A 171 -7.722 -6.751 -10.491 1.00 0.00 C ATOM 616 C ASN A 171 -6.932 -6.794 -9.181 1.00 0.00 C ATOM 617 O ASN A 171 -5.715 -6.620 -9.180 1.00 0.00 O ATOM 618 CB ASN A 171 -6.989 -7.622 -11.514 1.00 0.00 C ATOM 619 CG ASN A 171 -7.021 -9.096 -11.102 1.00 0.00 C ATOM 620 OD1 ASN A 171 -6.141 -9.596 -10.421 1.00 0.00 O ATOM 621 ND2 ASN A 171 -8.082 -9.760 -11.552 1.00 0.00 N ATOM 0 H ASN A 171 -7.101 -5.099 -11.619 1.00 0.00 H new ATOM 0 HA ASN A 171 -8.734 -7.132 -10.352 1.00 0.00 H new ATOM 0 HB2 ASN A 171 -7.451 -7.505 -12.494 1.00 0.00 H new ATOM 0 HB3 ASN A 171 -5.955 -7.289 -11.607 1.00 0.00 H new ATOM 0 HD21 ASN A 171 -8.196 -10.749 -11.331 1.00 0.00 H new ATOM 0 HD22 ASN A 171 -8.782 -9.280 -12.118 1.00 0.00 H new ATOM 628 N ALA A 172 -7.658 -7.027 -8.098 1.00 0.00 N ATOM 629 CA ALA A 172 -7.041 -7.095 -6.784 1.00 0.00 C ATOM 630 C ALA A 172 -7.223 -8.503 -6.212 1.00 0.00 C ATOM 631 O ALA A 172 -8.185 -9.193 -6.547 1.00 0.00 O ATOM 632 CB ALA A 172 -7.643 -6.017 -5.881 1.00 0.00 C ATOM 0 H ALA A 172 -8.668 -7.171 -8.103 1.00 0.00 H new ATOM 0 HA ALA A 172 -5.970 -6.903 -6.852 1.00 0.00 H new ATOM 0 HB1 ALA A 172 -7.180 -6.068 -4.895 1.00 0.00 H new ATOM 0 HB2 ALA A 172 -7.462 -5.034 -6.317 1.00 0.00 H new ATOM 0 HB3 ALA A 172 -8.717 -6.179 -5.787 1.00 0.00 H new ATOM 638 N GLU A 173 -6.285 -8.887 -5.359 1.00 0.00 N ATOM 639 CA GLU A 173 -6.329 -10.199 -4.738 1.00 0.00 C ATOM 640 C GLU A 173 -6.934 -10.102 -3.336 1.00 0.00 C ATOM 641 O GLU A 173 -6.303 -9.579 -2.419 1.00 0.00 O ATOM 642 CB GLU A 173 -4.937 -10.832 -4.692 1.00 0.00 C ATOM 643 CG GLU A 173 -5.009 -12.280 -4.204 1.00 0.00 C ATOM 644 CD GLU A 173 -4.317 -12.437 -2.848 1.00 0.00 C ATOM 645 OE1 GLU A 173 -3.336 -11.695 -2.622 1.00 0.00 O ATOM 646 OE2 GLU A 173 -4.785 -13.294 -2.068 1.00 0.00 O ATOM 0 H GLU A 173 -5.489 -8.312 -5.083 1.00 0.00 H new ATOM 0 HA GLU A 173 -6.965 -10.845 -5.344 1.00 0.00 H new ATOM 0 HB2 GLU A 173 -4.486 -10.801 -5.684 1.00 0.00 H new ATOM 0 HB3 GLU A 173 -4.292 -10.253 -4.031 1.00 0.00 H new ATOM 0 HG2 GLU A 173 -6.051 -12.589 -4.122 1.00 0.00 H new ATOM 0 HG3 GLU A 173 -4.538 -12.938 -4.935 1.00 0.00 H new ATOM 653 N ASP A 174 -8.150 -10.615 -3.214 1.00 0.00 N ATOM 654 CA ASP A 174 -8.847 -10.593 -1.939 1.00 0.00 C ATOM 655 C ASP A 174 -7.997 -11.307 -0.886 1.00 0.00 C ATOM 656 O ASP A 174 -6.935 -11.841 -1.198 1.00 0.00 O ATOM 657 CB ASP A 174 -10.191 -11.318 -2.033 1.00 0.00 C ATOM 658 CG ASP A 174 -11.410 -10.471 -1.662 1.00 0.00 C ATOM 659 OD1 ASP A 174 -11.189 -9.333 -1.196 1.00 0.00 O ATOM 660 OD2 ASP A 174 -12.535 -10.981 -1.853 1.00 0.00 O ATOM 0 H ASP A 174 -8.670 -11.048 -3.977 1.00 0.00 H new ATOM 0 HA ASP A 174 -9.018 -9.552 -1.666 1.00 0.00 H new ATOM 0 HB2 ASP A 174 -10.319 -11.685 -3.052 1.00 0.00 H new ATOM 0 HB3 ASP A 174 -10.162 -12.191 -1.381 1.00 0.00 H new ATOM 665 N SER A 175 -8.498 -11.293 0.341 1.00 0.00 N ATOM 666 CA SER A 175 -7.798 -11.932 1.442 1.00 0.00 C ATOM 667 C SER A 175 -8.155 -13.419 1.496 1.00 0.00 C ATOM 668 O SER A 175 -8.127 -14.029 2.564 1.00 0.00 O ATOM 669 CB SER A 175 -8.133 -11.257 2.774 1.00 0.00 C ATOM 670 OG SER A 175 -9.499 -11.439 3.136 1.00 0.00 O ATOM 0 H SER A 175 -9.380 -10.849 0.596 1.00 0.00 H new ATOM 0 HA SER A 175 -6.726 -11.828 1.272 1.00 0.00 H new ATOM 0 HB2 SER A 175 -7.493 -11.663 3.557 1.00 0.00 H new ATOM 0 HB3 SER A 175 -7.915 -10.191 2.705 1.00 0.00 H new ATOM 0 HG SER A 175 -9.987 -11.835 2.384 1.00 0.00 H new ATOM 676 N GLU A 176 -8.484 -13.959 0.332 1.00 0.00 N ATOM 677 CA GLU A 176 -8.846 -15.362 0.233 1.00 0.00 C ATOM 678 C GLU A 176 -8.086 -16.027 -0.917 1.00 0.00 C ATOM 679 O GLU A 176 -8.181 -17.238 -1.110 1.00 0.00 O ATOM 680 CB GLU A 176 -10.357 -15.527 0.060 1.00 0.00 C ATOM 681 CG GLU A 176 -11.109 -15.015 1.290 1.00 0.00 C ATOM 682 CD GLU A 176 -11.829 -13.700 0.984 1.00 0.00 C ATOM 683 OE1 GLU A 176 -12.388 -13.605 -0.130 1.00 0.00 O ATOM 684 OE2 GLU A 176 -11.805 -12.820 1.871 1.00 0.00 O ATOM 0 H GLU A 176 -8.507 -13.449 -0.551 1.00 0.00 H new ATOM 0 HA GLU A 176 -8.564 -15.856 1.162 1.00 0.00 H new ATOM 0 HB2 GLU A 176 -10.687 -14.983 -0.825 1.00 0.00 H new ATOM 0 HB3 GLU A 176 -10.595 -16.578 -0.105 1.00 0.00 H new ATOM 0 HG2 GLU A 176 -11.832 -15.763 1.616 1.00 0.00 H new ATOM 0 HG3 GLU A 176 -10.410 -14.868 2.113 1.00 0.00 H new ATOM 691 N GLY A 177 -7.350 -15.205 -1.650 1.00 0.00 N ATOM 692 CA GLY A 177 -6.574 -15.698 -2.776 1.00 0.00 C ATOM 693 C GLY A 177 -7.351 -15.547 -4.085 1.00 0.00 C ATOM 694 O GLY A 177 -6.857 -15.913 -5.151 1.00 0.00 O ATOM 0 H GLY A 177 -7.274 -14.201 -1.487 1.00 0.00 H new ATOM 0 HA2 GLY A 177 -5.634 -15.151 -2.842 1.00 0.00 H new ATOM 0 HA3 GLY A 177 -6.322 -16.747 -2.617 1.00 0.00 H new ATOM 698 N LYS A 178 -8.555 -15.007 -3.963 1.00 0.00 N ATOM 699 CA LYS A 178 -9.405 -14.803 -5.124 1.00 0.00 C ATOM 700 C LYS A 178 -9.032 -13.481 -5.798 1.00 0.00 C ATOM 701 O LYS A 178 -9.267 -12.409 -5.242 1.00 0.00 O ATOM 702 CB LYS A 178 -10.881 -14.897 -4.730 1.00 0.00 C ATOM 703 CG LYS A 178 -11.781 -14.859 -5.966 1.00 0.00 C ATOM 704 CD LYS A 178 -13.110 -15.568 -5.699 1.00 0.00 C ATOM 705 CE LYS A 178 -14.143 -15.219 -6.772 1.00 0.00 C ATOM 706 NZ LYS A 178 -14.773 -16.449 -7.304 1.00 0.00 N ATOM 0 H LYS A 178 -8.962 -14.705 -3.078 1.00 0.00 H new ATOM 0 HA LYS A 178 -9.243 -15.592 -5.858 1.00 0.00 H new ATOM 0 HB2 LYS A 178 -11.055 -15.820 -4.177 1.00 0.00 H new ATOM 0 HB3 LYS A 178 -11.137 -14.073 -4.064 1.00 0.00 H new ATOM 0 HG2 LYS A 178 -11.968 -13.824 -6.252 1.00 0.00 H new ATOM 0 HG3 LYS A 178 -11.273 -15.335 -6.805 1.00 0.00 H new ATOM 0 HD2 LYS A 178 -12.953 -16.646 -5.677 1.00 0.00 H new ATOM 0 HD3 LYS A 178 -13.488 -15.281 -4.718 1.00 0.00 H new ATOM 0 HE2 LYS A 178 -14.907 -14.565 -6.351 1.00 0.00 H new ATOM 0 HE3 LYS A 178 -13.663 -14.669 -7.582 1.00 0.00 H new ATOM 0 HZ1 LYS A 178 -15.472 -16.195 -8.031 1.00 0.00 H new ATOM 0 HZ2 LYS A 178 -14.043 -17.059 -7.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 178 -15.248 -16.958 -6.531 1.00 0.00 H new ATOM 720 N ARG A 179 -8.456 -13.601 -6.985 1.00 0.00 N ATOM 721 CA ARG A 179 -8.048 -12.429 -7.740 1.00 0.00 C ATOM 722 C ARG A 179 -9.121 -12.057 -8.765 1.00 0.00 C ATOM 723 O ARG A 179 -9.408 -12.831 -9.677 1.00 0.00 O ATOM 724 CB ARG A 179 -6.723 -12.675 -8.466 1.00 0.00 C ATOM 725 CG ARG A 179 -5.626 -13.084 -7.481 1.00 0.00 C ATOM 726 CD ARG A 179 -4.721 -14.159 -8.085 1.00 0.00 C ATOM 727 NE ARG A 179 -4.837 -15.414 -7.309 1.00 0.00 N ATOM 728 CZ ARG A 179 -5.752 -16.363 -7.549 1.00 0.00 C ATOM 729 NH1 ARG A 179 -6.636 -16.206 -8.544 1.00 0.00 N ATOM 730 NH2 ARG A 179 -5.784 -17.469 -6.793 1.00 0.00 N ATOM 0 H ARG A 179 -8.262 -14.492 -7.442 1.00 0.00 H new ATOM 0 HA ARG A 179 -7.916 -11.610 -7.033 1.00 0.00 H new ATOM 0 HB2 ARG A 179 -6.854 -13.456 -9.215 1.00 0.00 H new ATOM 0 HB3 ARG A 179 -6.422 -11.772 -8.997 1.00 0.00 H new ATOM 0 HG2 ARG A 179 -5.031 -12.212 -7.211 1.00 0.00 H new ATOM 0 HG3 ARG A 179 -6.078 -13.458 -6.562 1.00 0.00 H new ATOM 0 HD2 ARG A 179 -4.998 -14.337 -9.124 1.00 0.00 H new ATOM 0 HD3 ARG A 179 -3.686 -13.817 -8.085 1.00 0.00 H new ATOM 0 HE ARG A 179 -4.180 -15.566 -6.544 1.00 0.00 H new ATOM 0 HH11 ARG A 179 -6.612 -15.364 -9.119 1.00 0.00 H new ATOM 0 HH12 ARG A 179 -7.332 -16.929 -8.726 1.00 0.00 H new ATOM 0 HH21 ARG A 179 -5.112 -17.588 -6.035 1.00 0.00 H new ATOM 0 HH22 ARG A 179 -6.480 -18.192 -6.976 1.00 0.00 H new ATOM 744 N GLY A 180 -9.686 -10.873 -8.581 1.00 0.00 N ATOM 745 CA GLY A 180 -10.722 -10.389 -9.478 1.00 0.00 C ATOM 746 C GLY A 180 -10.740 -8.860 -9.520 1.00 0.00 C ATOM 747 O GLY A 180 -9.840 -8.210 -8.991 1.00 0.00 O ATOM 0 H GLY A 180 -9.446 -10.234 -7.823 1.00 0.00 H new ATOM 0 HA2 GLY A 180 -10.553 -10.782 -10.481 1.00 0.00 H new ATOM 0 HA3 GLY A 180 -11.694 -10.759 -9.150 1.00 0.00 H new ATOM 751 N MET A 181 -11.776 -8.330 -10.154 1.00 0.00 N ATOM 752 CA MET A 181 -11.924 -6.890 -10.272 1.00 0.00 C ATOM 753 C MET A 181 -12.548 -6.297 -9.007 1.00 0.00 C ATOM 754 O MET A 181 -13.559 -6.797 -8.516 1.00 0.00 O ATOM 755 CB MET A 181 -12.808 -6.564 -11.478 1.00 0.00 C ATOM 756 CG MET A 181 -11.967 -6.063 -12.654 1.00 0.00 C ATOM 757 SD MET A 181 -12.771 -6.467 -14.195 1.00 0.00 S ATOM 758 CE MET A 181 -14.028 -5.199 -14.231 1.00 0.00 C ATOM 0 H MET A 181 -12.521 -8.873 -10.591 1.00 0.00 H new ATOM 0 HA MET A 181 -10.935 -6.452 -10.406 1.00 0.00 H new ATOM 0 HB2 MET A 181 -13.364 -7.453 -11.776 1.00 0.00 H new ATOM 0 HB3 MET A 181 -13.541 -5.806 -11.202 1.00 0.00 H new ATOM 0 HG2 MET A 181 -11.828 -4.985 -12.579 1.00 0.00 H new ATOM 0 HG3 MET A 181 -10.976 -6.515 -12.622 1.00 0.00 H new ATOM 0 HE1 MET A 181 -14.970 -5.630 -14.571 1.00 0.00 H new ATOM 0 HE2 MET A 181 -14.157 -4.786 -13.230 1.00 0.00 H new ATOM 0 HE3 MET A 181 -13.725 -4.406 -14.914 1.00 0.00 H new ATOM 768 N ILE A 182 -11.919 -5.239 -8.515 1.00 0.00 N ATOM 769 CA ILE A 182 -12.400 -4.573 -7.316 1.00 0.00 C ATOM 770 C ILE A 182 -12.481 -3.067 -7.573 1.00 0.00 C ATOM 771 O ILE A 182 -11.657 -2.512 -8.298 1.00 0.00 O ATOM 772 CB ILE A 182 -11.533 -4.946 -6.112 1.00 0.00 C ATOM 773 CG1 ILE A 182 -11.684 -6.428 -5.765 1.00 0.00 C ATOM 774 CG2 ILE A 182 -11.839 -4.043 -4.916 1.00 0.00 C ATOM 775 CD1 ILE A 182 -10.353 -7.021 -5.301 1.00 0.00 C ATOM 0 H ILE A 182 -11.081 -4.827 -8.925 1.00 0.00 H new ATOM 0 HA ILE A 182 -13.407 -4.910 -7.070 1.00 0.00 H new ATOM 0 HB ILE A 182 -10.489 -4.783 -6.380 1.00 0.00 H new ATOM 0 HG12 ILE A 182 -12.432 -6.547 -4.981 1.00 0.00 H new ATOM 0 HG13 ILE A 182 -12.045 -6.974 -6.636 1.00 0.00 H new ATOM 0 HG21 ILE A 182 -11.209 -4.329 -4.074 1.00 0.00 H new ATOM 0 HG22 ILE A 182 -11.639 -3.005 -5.183 1.00 0.00 H new ATOM 0 HG23 ILE A 182 -12.888 -4.150 -4.638 1.00 0.00 H new ATOM 0 HD11 ILE A 182 -10.489 -8.075 -5.061 1.00 0.00 H new ATOM 0 HD12 ILE A 182 -9.614 -6.922 -6.096 1.00 0.00 H new ATOM 0 HD13 ILE A 182 -10.007 -6.489 -4.415 1.00 0.00 H new ATOM 787 N PRO A 183 -13.510 -2.433 -6.949 1.00 0.00 N ATOM 788 CA PRO A 183 -13.709 -1.002 -7.102 1.00 0.00 C ATOM 789 C PRO A 183 -12.682 -0.214 -6.287 1.00 0.00 C ATOM 790 O PRO A 183 -12.385 -0.569 -5.147 1.00 0.00 O ATOM 791 CB PRO A 183 -15.140 -0.754 -6.654 1.00 0.00 C ATOM 792 CG PRO A 183 -15.536 -1.970 -5.831 1.00 0.00 C ATOM 793 CD PRO A 183 -14.505 -3.058 -6.083 1.00 0.00 C ATOM 0 HA PRO A 183 -13.563 -0.665 -8.128 1.00 0.00 H new ATOM 0 HB2 PRO A 183 -15.211 0.158 -6.062 1.00 0.00 H new ATOM 0 HB3 PRO A 183 -15.802 -0.630 -7.511 1.00 0.00 H new ATOM 0 HG2 PRO A 183 -15.574 -1.718 -4.771 1.00 0.00 H new ATOM 0 HG3 PRO A 183 -16.531 -2.314 -6.113 1.00 0.00 H new ATOM 0 HD2 PRO A 183 -14.058 -3.403 -5.151 1.00 0.00 H new ATOM 0 HD3 PRO A 183 -14.956 -3.928 -6.561 1.00 0.00 H new ATOM 801 N VAL A 184 -12.168 0.841 -6.902 1.00 0.00 N ATOM 802 CA VAL A 184 -11.181 1.682 -6.248 1.00 0.00 C ATOM 803 C VAL A 184 -11.891 2.656 -5.305 1.00 0.00 C ATOM 804 O VAL A 184 -11.328 3.065 -4.291 1.00 0.00 O ATOM 805 CB VAL A 184 -10.317 2.387 -7.295 1.00 0.00 C ATOM 806 CG1 VAL A 184 -9.404 3.427 -6.643 1.00 0.00 C ATOM 807 CG2 VAL A 184 -9.504 1.376 -8.107 1.00 0.00 C ATOM 0 H VAL A 184 -12.417 1.132 -7.847 1.00 0.00 H new ATOM 0 HA VAL A 184 -10.506 1.077 -5.643 1.00 0.00 H new ATOM 0 HB VAL A 184 -10.983 2.910 -7.981 1.00 0.00 H new ATOM 0 HG11 VAL A 184 -8.801 3.913 -7.410 1.00 0.00 H new ATOM 0 HG12 VAL A 184 -10.011 4.174 -6.131 1.00 0.00 H new ATOM 0 HG13 VAL A 184 -8.749 2.936 -5.923 1.00 0.00 H new ATOM 0 HG21 VAL A 184 -8.899 1.904 -8.844 1.00 0.00 H new ATOM 0 HG22 VAL A 184 -8.853 0.812 -7.439 1.00 0.00 H new ATOM 0 HG23 VAL A 184 -10.181 0.691 -8.617 1.00 0.00 H new ATOM 817 N PRO A 185 -13.149 3.008 -5.683 1.00 0.00 N ATOM 818 CA PRO A 185 -13.942 3.926 -4.883 1.00 0.00 C ATOM 819 C PRO A 185 -14.475 3.236 -3.626 1.00 0.00 C ATOM 820 O PRO A 185 -14.402 3.792 -2.531 1.00 0.00 O ATOM 821 CB PRO A 185 -15.045 4.405 -5.812 1.00 0.00 C ATOM 822 CG PRO A 185 -15.106 3.392 -6.944 1.00 0.00 C ATOM 823 CD PRO A 185 -13.847 2.543 -6.878 1.00 0.00 C ATOM 0 HA PRO A 185 -13.361 4.769 -4.509 1.00 0.00 H new ATOM 0 HB2 PRO A 185 -15.999 4.463 -5.288 1.00 0.00 H new ATOM 0 HB3 PRO A 185 -14.829 5.403 -6.193 1.00 0.00 H new ATOM 0 HG2 PRO A 185 -15.994 2.767 -6.849 1.00 0.00 H new ATOM 0 HG3 PRO A 185 -15.175 3.899 -7.907 1.00 0.00 H new ATOM 0 HD2 PRO A 185 -14.088 1.482 -6.808 1.00 0.00 H new ATOM 0 HD3 PRO A 185 -13.234 2.673 -7.770 1.00 0.00 H new ATOM 831 N TYR A 186 -15.001 2.037 -3.825 1.00 0.00 N ATOM 832 CA TYR A 186 -15.547 1.266 -2.721 1.00 0.00 C ATOM 833 C TYR A 186 -14.450 0.881 -1.726 1.00 0.00 C ATOM 834 O TYR A 186 -14.731 0.624 -0.556 1.00 0.00 O ATOM 835 CB TYR A 186 -16.126 -0.007 -3.341 1.00 0.00 C ATOM 836 CG TYR A 186 -17.583 -0.277 -2.963 1.00 0.00 C ATOM 837 CD1 TYR A 186 -18.590 0.505 -3.494 1.00 0.00 C ATOM 838 CD2 TYR A 186 -17.892 -1.300 -2.091 1.00 0.00 C ATOM 839 CE1 TYR A 186 -19.962 0.251 -3.138 1.00 0.00 C ATOM 840 CE2 TYR A 186 -19.264 -1.554 -1.735 1.00 0.00 C ATOM 841 CZ TYR A 186 -20.231 -0.765 -2.276 1.00 0.00 C ATOM 842 OH TYR A 186 -21.527 -1.005 -1.940 1.00 0.00 O ATOM 0 H TYR A 186 -15.061 1.580 -4.735 1.00 0.00 H new ATOM 0 HA TYR A 186 -16.296 1.846 -2.181 1.00 0.00 H new ATOM 0 HB2 TYR A 186 -16.050 0.063 -4.426 1.00 0.00 H new ATOM 0 HB3 TYR A 186 -15.518 -0.858 -3.033 1.00 0.00 H new ATOM 0 HD1 TYR A 186 -18.349 1.307 -4.176 1.00 0.00 H new ATOM 0 HD2 TYR A 186 -17.105 -1.911 -1.675 1.00 0.00 H new ATOM 0 HE1 TYR A 186 -20.759 0.854 -3.547 1.00 0.00 H new ATOM 0 HE2 TYR A 186 -19.519 -2.353 -1.054 1.00 0.00 H new ATOM 0 HH TYR A 186 -21.569 -1.761 -1.317 1.00 0.00 H new ATOM 852 N VAL A 187 -13.224 0.854 -2.227 1.00 0.00 N ATOM 853 CA VAL A 187 -12.084 0.505 -1.396 1.00 0.00 C ATOM 854 C VAL A 187 -11.270 1.766 -1.098 1.00 0.00 C ATOM 855 O VAL A 187 -11.633 2.859 -1.531 1.00 0.00 O ATOM 856 CB VAL A 187 -11.259 -0.592 -2.073 1.00 0.00 C ATOM 857 CG1 VAL A 187 -12.142 -1.777 -2.467 1.00 0.00 C ATOM 858 CG2 VAL A 187 -10.507 -0.042 -3.287 1.00 0.00 C ATOM 0 H VAL A 187 -12.995 1.068 -3.198 1.00 0.00 H new ATOM 0 HA VAL A 187 -12.418 0.100 -0.441 1.00 0.00 H new ATOM 0 HB VAL A 187 -10.521 -0.948 -1.354 1.00 0.00 H new ATOM 0 HG11 VAL A 187 -11.531 -2.542 -2.946 1.00 0.00 H new ATOM 0 HG12 VAL A 187 -12.612 -2.193 -1.576 1.00 0.00 H new ATOM 0 HG13 VAL A 187 -12.913 -1.441 -3.161 1.00 0.00 H new ATOM 0 HG21 VAL A 187 -9.929 -0.842 -3.750 1.00 0.00 H new ATOM 0 HG22 VAL A 187 -11.221 0.354 -4.009 1.00 0.00 H new ATOM 0 HG23 VAL A 187 -9.834 0.754 -2.968 1.00 0.00 H new ATOM 868 N GLU A 188 -10.187 1.573 -0.361 1.00 0.00 N ATOM 869 CA GLU A 188 -9.319 2.681 0.000 1.00 0.00 C ATOM 870 C GLU A 188 -7.852 2.251 -0.070 1.00 0.00 C ATOM 871 O GLU A 188 -7.553 1.060 -0.134 1.00 0.00 O ATOM 872 CB GLU A 188 -9.667 3.219 1.389 1.00 0.00 C ATOM 873 CG GLU A 188 -8.998 4.573 1.636 1.00 0.00 C ATOM 874 CD GLU A 188 -9.865 5.458 2.533 1.00 0.00 C ATOM 875 OE1 GLU A 188 -10.410 4.909 3.515 1.00 0.00 O ATOM 876 OE2 GLU A 188 -9.963 6.663 2.217 1.00 0.00 O ATOM 0 H GLU A 188 -9.890 0.665 -0.003 1.00 0.00 H new ATOM 0 HA GLU A 188 -9.475 3.488 -0.716 1.00 0.00 H new ATOM 0 HB2 GLU A 188 -10.748 3.321 1.483 1.00 0.00 H new ATOM 0 HB3 GLU A 188 -9.347 2.507 2.150 1.00 0.00 H new ATOM 0 HG2 GLU A 188 -8.024 4.422 2.101 1.00 0.00 H new ATOM 0 HG3 GLU A 188 -8.823 5.075 0.684 1.00 0.00 H new ATOM 883 N LYS A 189 -6.977 3.246 -0.056 1.00 0.00 N ATOM 884 CA LYS A 189 -5.548 2.986 -0.117 1.00 0.00 C ATOM 885 C LYS A 189 -5.017 2.747 1.298 1.00 0.00 C ATOM 886 O LYS A 189 -4.967 3.669 2.110 1.00 0.00 O ATOM 887 CB LYS A 189 -4.830 4.113 -0.862 1.00 0.00 C ATOM 888 CG LYS A 189 -3.574 3.593 -1.564 1.00 0.00 C ATOM 889 CD LYS A 189 -2.833 4.727 -2.274 1.00 0.00 C ATOM 890 CE LYS A 189 -1.962 5.512 -1.291 1.00 0.00 C ATOM 891 NZ LYS A 189 -0.871 6.210 -2.008 1.00 0.00 N ATOM 0 H LYS A 189 -7.229 4.233 -0.003 1.00 0.00 H new ATOM 0 HA LYS A 189 -5.349 2.080 -0.689 1.00 0.00 H new ATOM 0 HB2 LYS A 189 -5.504 4.556 -1.595 1.00 0.00 H new ATOM 0 HB3 LYS A 189 -4.559 4.902 -0.161 1.00 0.00 H new ATOM 0 HG2 LYS A 189 -2.914 3.123 -0.835 1.00 0.00 H new ATOM 0 HG3 LYS A 189 -3.849 2.825 -2.287 1.00 0.00 H new ATOM 0 HD2 LYS A 189 -2.211 4.318 -3.070 1.00 0.00 H new ATOM 0 HD3 LYS A 189 -3.552 5.398 -2.744 1.00 0.00 H new ATOM 0 HE2 LYS A 189 -2.573 6.236 -0.753 1.00 0.00 H new ATOM 0 HE3 LYS A 189 -1.542 4.835 -0.548 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 -0.290 6.738 -1.326 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 -0.278 5.513 -2.502 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 -1.278 6.871 -2.701 1.00 0.00 H new ATOM 905 N TYR A 190 -4.633 1.504 1.549 1.00 0.00 N ATOM 906 CA TYR A 190 -4.107 1.132 2.851 1.00 0.00 C ATOM 907 C TYR A 190 -2.578 1.176 2.858 1.00 0.00 C ATOM 908 O TYR A 190 -1.971 1.652 3.816 1.00 0.00 O ATOM 909 CB TYR A 190 -4.565 -0.307 3.096 1.00 0.00 C ATOM 910 CG TYR A 190 -5.388 -0.490 4.372 1.00 0.00 C ATOM 911 CD1 TYR A 190 -6.653 0.055 4.462 1.00 0.00 C ATOM 912 CD2 TYR A 190 -4.867 -1.200 5.435 1.00 0.00 C ATOM 913 CE1 TYR A 190 -7.428 -0.116 5.663 1.00 0.00 C ATOM 914 CE2 TYR A 190 -5.642 -1.372 6.636 1.00 0.00 C ATOM 915 CZ TYR A 190 -6.884 -0.822 6.691 1.00 0.00 C ATOM 916 OH TYR A 190 -7.617 -0.984 7.825 1.00 0.00 O ATOM 0 H TYR A 190 -4.676 0.742 0.873 1.00 0.00 H new ATOM 0 HA TYR A 190 -4.462 1.820 3.618 1.00 0.00 H new ATOM 0 HB2 TYR A 190 -5.157 -0.639 2.243 1.00 0.00 H new ATOM 0 HB3 TYR A 190 -3.688 -0.953 3.146 1.00 0.00 H new ATOM 0 HD1 TYR A 190 -7.062 0.610 3.631 1.00 0.00 H new ATOM 0 HD2 TYR A 190 -3.877 -1.627 5.366 1.00 0.00 H new ATOM 0 HE1 TYR A 190 -8.418 0.306 5.746 1.00 0.00 H new ATOM 0 HE2 TYR A 190 -5.246 -1.926 7.474 1.00 0.00 H new ATOM 0 HH TYR A 190 -8.366 -0.352 7.824 1.00 0.00 H new