USER MOD reduce.3.24.130724 H: found=0, std=0, add=403, rem=0, adj=8 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+ -133:sc= -0.0548 (180deg=-0.373) USER MOD Single : A 168 GLN : amide:sc= -0.309 X(o=-0.31,f=-0.0041) USER MOD Single : A 171 ASN : amide:sc= -1.13! C(o=-1.1!,f=-8.1!) USER MOD Single : A 175 SER OG : rot -94:sc= 0.477 USER MOD Single : A 178 LYS NZ :NH3+ 150:sc= -0.982 (180deg=-1.47) USER MOD Single : A 181 MET CE :methyl -153:sc= -0.0295 (180deg=-1.24) USER MOD Single : A 186 TYR OH : rot 180:sc= -0.0105 USER MOD Single : A 189 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0574) USER MOD Single : A 190 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 19 N TYR A 136 -1.981 -2.345 0.714 1.00 0.00 N ATOM 20 CA TYR A 136 -2.983 -2.465 -0.330 1.00 0.00 C ATOM 21 C TYR A 136 -4.191 -1.572 -0.036 1.00 0.00 C ATOM 22 O TYR A 136 -4.059 -0.541 0.621 1.00 0.00 O ATOM 23 CB TYR A 136 -3.431 -3.927 -0.319 1.00 0.00 C ATOM 24 CG TYR A 136 -2.281 -4.929 -0.210 1.00 0.00 C ATOM 25 CD1 TYR A 136 -1.436 -5.130 -1.283 1.00 0.00 C ATOM 26 CD2 TYR A 136 -2.086 -5.633 0.961 1.00 0.00 C ATOM 27 CE1 TYR A 136 -0.354 -6.074 -1.181 1.00 0.00 C ATOM 28 CE2 TYR A 136 -1.004 -6.577 1.064 1.00 0.00 C ATOM 29 CZ TYR A 136 -0.190 -6.750 -0.012 1.00 0.00 C ATOM 30 OH TYR A 136 0.833 -7.641 0.085 1.00 0.00 O ATOM 0 HA TYR A 136 -2.572 -2.161 -1.293 1.00 0.00 H new ATOM 0 HB2 TYR A 136 -4.114 -4.081 0.517 1.00 0.00 H new ATOM 0 HB3 TYR A 136 -3.992 -4.131 -1.231 1.00 0.00 H new ATOM 0 HD1 TYR A 136 -1.587 -4.579 -2.199 1.00 0.00 H new ATOM 0 HD2 TYR A 136 -2.746 -5.475 1.801 1.00 0.00 H new ATOM 0 HE1 TYR A 136 0.313 -6.242 -2.014 1.00 0.00 H new ATOM 0 HE2 TYR A 136 -0.842 -7.135 1.974 1.00 0.00 H new ATOM 0 HH TYR A 136 0.829 -8.048 0.976 1.00 0.00 H new ATOM 40 N VAL A 137 -5.340 -2.000 -0.538 1.00 0.00 N ATOM 41 CA VAL A 137 -6.569 -1.253 -0.337 1.00 0.00 C ATOM 42 C VAL A 137 -7.488 -2.035 0.604 1.00 0.00 C ATOM 43 O VAL A 137 -7.221 -3.194 0.918 1.00 0.00 O ATOM 44 CB VAL A 137 -7.220 -0.943 -1.686 1.00 0.00 C ATOM 45 CG1 VAL A 137 -6.184 -0.430 -2.689 1.00 0.00 C ATOM 46 CG2 VAL A 137 -7.954 -2.167 -2.236 1.00 0.00 C ATOM 0 H VAL A 137 -5.445 -2.855 -1.084 1.00 0.00 H new ATOM 0 HA VAL A 137 -6.359 -0.294 0.136 1.00 0.00 H new ATOM 0 HB VAL A 137 -7.956 -0.154 -1.529 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -6.672 -0.217 -3.640 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -5.725 0.481 -2.305 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -5.415 -1.188 -2.838 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -8.407 -1.919 -3.196 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -7.247 -2.986 -2.370 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -8.732 -2.470 -1.535 1.00 0.00 H new ATOM 56 N ARG A 138 -8.552 -1.369 1.028 1.00 0.00 N ATOM 57 CA ARG A 138 -9.512 -1.987 1.927 1.00 0.00 C ATOM 58 C ARG A 138 -10.935 -1.559 1.559 1.00 0.00 C ATOM 59 O ARG A 138 -11.195 -0.378 1.336 1.00 0.00 O ATOM 60 CB ARG A 138 -9.232 -1.602 3.381 1.00 0.00 C ATOM 61 CG ARG A 138 -8.403 -2.680 4.083 1.00 0.00 C ATOM 62 CD ARG A 138 -9.153 -3.249 5.290 1.00 0.00 C ATOM 63 NE ARG A 138 -8.231 -3.389 6.438 1.00 0.00 N ATOM 64 CZ ARG A 138 -7.954 -2.404 7.304 1.00 0.00 C ATOM 65 NH1 ARG A 138 -8.528 -1.203 7.158 1.00 0.00 N ATOM 66 NH2 ARG A 138 -7.105 -2.622 8.317 1.00 0.00 N ATOM 0 H ARG A 138 -8.770 -0.408 0.766 1.00 0.00 H new ATOM 0 HA ARG A 138 -9.415 -3.068 1.824 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -8.701 -0.651 3.413 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -10.174 -1.459 3.911 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -8.174 -3.482 3.381 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -7.451 -2.259 4.407 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -9.981 -2.593 5.556 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -9.583 -4.218 5.038 1.00 0.00 H new ATOM 0 HE ARG A 138 -7.778 -4.292 6.580 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -9.176 -1.038 6.388 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -8.317 -0.454 7.817 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -6.669 -3.537 8.429 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -6.894 -1.873 8.976 1.00 0.00 H new ATOM 80 N ALA A 139 -11.820 -2.544 1.506 1.00 0.00 N ATOM 81 CA ALA A 139 -13.209 -2.285 1.170 1.00 0.00 C ATOM 82 C ALA A 139 -13.970 -1.884 2.435 1.00 0.00 C ATOM 83 O ALA A 139 -13.913 -2.583 3.445 1.00 0.00 O ATOM 84 CB ALA A 139 -13.810 -3.521 0.495 1.00 0.00 C ATOM 0 H ALA A 139 -11.601 -3.523 1.690 1.00 0.00 H new ATOM 0 HA ALA A 139 -13.285 -1.458 0.464 1.00 0.00 H new ATOM 0 HB1 ALA A 139 -14.853 -3.327 0.243 1.00 0.00 H new ATOM 0 HB2 ALA A 139 -13.252 -3.746 -0.414 1.00 0.00 H new ATOM 0 HB3 ALA A 139 -13.753 -4.371 1.175 1.00 0.00 H new ATOM 90 N LEU A 140 -14.664 -0.759 2.337 1.00 0.00 N ATOM 91 CA LEU A 140 -15.436 -0.257 3.462 1.00 0.00 C ATOM 92 C LEU A 140 -16.928 -0.405 3.157 1.00 0.00 C ATOM 93 O LEU A 140 -17.727 0.455 3.523 1.00 0.00 O ATOM 94 CB LEU A 140 -15.016 1.175 3.802 1.00 0.00 C ATOM 95 CG LEU A 140 -13.562 1.539 3.494 1.00 0.00 C ATOM 96 CD1 LEU A 140 -13.424 3.030 3.182 1.00 0.00 C ATOM 97 CD2 LEU A 140 -12.635 1.104 4.632 1.00 0.00 C ATOM 0 H LEU A 140 -14.708 -0.182 1.497 1.00 0.00 H new ATOM 0 HA LEU A 140 -15.234 -0.845 4.357 1.00 0.00 H new ATOM 0 HB2 LEU A 140 -15.665 1.862 3.258 1.00 0.00 H new ATOM 0 HB3 LEU A 140 -15.194 1.342 4.864 1.00 0.00 H new ATOM 0 HG LEU A 140 -13.255 0.993 2.602 1.00 0.00 H new ATOM 0 HD11 LEU A 140 -12.381 3.262 2.967 1.00 0.00 H new ATOM 0 HD12 LEU A 140 -14.037 3.279 2.316 1.00 0.00 H new ATOM 0 HD13 LEU A 140 -13.756 3.614 4.041 1.00 0.00 H new ATOM 0 HD21 LEU A 140 -11.608 1.374 4.388 1.00 0.00 H new ATOM 0 HD22 LEU A 140 -12.932 1.603 5.554 1.00 0.00 H new ATOM 0 HD23 LEU A 140 -12.704 0.024 4.765 1.00 0.00 H new ATOM 109 N PHE A 141 -17.258 -1.502 2.492 1.00 0.00 N ATOM 110 CA PHE A 141 -18.640 -1.773 2.135 1.00 0.00 C ATOM 111 C PHE A 141 -18.781 -3.162 1.508 1.00 0.00 C ATOM 112 O PHE A 141 -18.024 -3.520 0.607 1.00 0.00 O ATOM 113 CB PHE A 141 -19.052 -0.718 1.106 1.00 0.00 C ATOM 114 CG PHE A 141 -20.276 0.104 1.514 1.00 0.00 C ATOM 115 CD1 PHE A 141 -20.513 0.365 2.828 1.00 0.00 C ATOM 116 CD2 PHE A 141 -21.127 0.573 0.563 1.00 0.00 C ATOM 117 CE1 PHE A 141 -21.649 1.128 3.206 1.00 0.00 C ATOM 118 CE2 PHE A 141 -22.263 1.335 0.942 1.00 0.00 C ATOM 119 CZ PHE A 141 -22.500 1.597 2.256 1.00 0.00 C ATOM 0 H PHE A 141 -16.592 -2.214 2.191 1.00 0.00 H new ATOM 0 HA PHE A 141 -19.268 -1.739 3.025 1.00 0.00 H new ATOM 0 HB2 PHE A 141 -18.213 -0.043 0.937 1.00 0.00 H new ATOM 0 HB3 PHE A 141 -19.259 -1.212 0.157 1.00 0.00 H new ATOM 0 HD1 PHE A 141 -19.837 -0.008 3.583 1.00 0.00 H new ATOM 0 HD2 PHE A 141 -20.939 0.366 -0.480 1.00 0.00 H new ATOM 0 HE1 PHE A 141 -21.837 1.336 4.249 1.00 0.00 H new ATOM 0 HE2 PHE A 141 -22.940 1.707 0.187 1.00 0.00 H new ATOM 0 HZ PHE A 141 -23.364 2.177 2.544 1.00 0.00 H new ATOM 129 N ASP A 142 -19.755 -3.906 2.010 1.00 0.00 N ATOM 130 CA ASP A 142 -20.005 -5.248 1.510 1.00 0.00 C ATOM 131 C ASP A 142 -20.675 -5.159 0.137 1.00 0.00 C ATOM 132 O ASP A 142 -21.376 -4.191 -0.155 1.00 0.00 O ATOM 133 CB ASP A 142 -20.942 -6.017 2.444 1.00 0.00 C ATOM 134 CG ASP A 142 -21.074 -7.510 2.140 1.00 0.00 C ATOM 135 OD1 ASP A 142 -21.694 -7.826 1.101 1.00 0.00 O ATOM 136 OD2 ASP A 142 -20.552 -8.304 2.953 1.00 0.00 O ATOM 0 H ASP A 142 -20.381 -3.606 2.758 1.00 0.00 H new ATOM 0 HA ASP A 142 -19.050 -5.769 1.448 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -20.587 -5.900 3.468 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -21.932 -5.563 2.396 1.00 0.00 H new ATOM 141 N PHE A 143 -20.436 -6.183 -0.669 1.00 0.00 N ATOM 142 CA PHE A 143 -21.006 -6.232 -2.005 1.00 0.00 C ATOM 143 C PHE A 143 -21.182 -7.678 -2.472 1.00 0.00 C ATOM 144 O PHE A 143 -20.294 -8.508 -2.282 1.00 0.00 O ATOM 145 CB PHE A 143 -20.023 -5.523 -2.938 1.00 0.00 C ATOM 146 CG PHE A 143 -20.630 -5.103 -4.279 1.00 0.00 C ATOM 147 CD1 PHE A 143 -20.944 -6.044 -5.208 1.00 0.00 C ATOM 148 CD2 PHE A 143 -20.855 -3.788 -4.540 1.00 0.00 C ATOM 149 CE1 PHE A 143 -21.507 -5.655 -6.451 1.00 0.00 C ATOM 150 CE2 PHE A 143 -21.418 -3.398 -5.784 1.00 0.00 C ATOM 151 CZ PHE A 143 -21.732 -4.339 -6.714 1.00 0.00 C ATOM 0 H PHE A 143 -19.856 -6.985 -0.423 1.00 0.00 H new ATOM 0 HA PHE A 143 -21.986 -5.755 -2.009 1.00 0.00 H new ATOM 0 HB2 PHE A 143 -19.633 -4.638 -2.434 1.00 0.00 H new ATOM 0 HB3 PHE A 143 -19.175 -6.182 -3.125 1.00 0.00 H new ATOM 0 HD1 PHE A 143 -20.765 -7.089 -5.000 1.00 0.00 H new ATOM 0 HD2 PHE A 143 -20.606 -3.040 -3.802 1.00 0.00 H new ATOM 0 HE1 PHE A 143 -21.757 -6.403 -7.188 1.00 0.00 H new ATOM 0 HE2 PHE A 143 -21.597 -2.353 -5.992 1.00 0.00 H new ATOM 0 HZ PHE A 143 -22.160 -4.042 -7.660 1.00 0.00 H new ATOM 250 N LEU A 151 -15.708 -9.142 -8.991 1.00 0.00 N ATOM 251 CA LEU A 151 -15.745 -10.037 -7.846 1.00 0.00 C ATOM 252 C LEU A 151 -16.356 -9.302 -6.651 1.00 0.00 C ATOM 253 O LEU A 151 -16.111 -8.112 -6.457 1.00 0.00 O ATOM 254 CB LEU A 151 -14.355 -10.613 -7.569 1.00 0.00 C ATOM 255 CG LEU A 151 -14.132 -11.180 -6.166 1.00 0.00 C ATOM 256 CD1 LEU A 151 -14.007 -12.705 -6.205 1.00 0.00 C ATOM 257 CD2 LEU A 151 -12.924 -10.523 -5.495 1.00 0.00 C ATOM 0 HA LEU A 151 -16.383 -10.896 -8.054 1.00 0.00 H new ATOM 0 HB2 LEU A 151 -14.160 -11.403 -8.294 1.00 0.00 H new ATOM 0 HB3 LEU A 151 -13.617 -9.830 -7.744 1.00 0.00 H new ATOM 0 HG LEU A 151 -15.006 -10.944 -5.559 1.00 0.00 H new ATOM 0 HD11 LEU A 151 -13.849 -13.083 -5.195 1.00 0.00 H new ATOM 0 HD12 LEU A 151 -14.921 -13.135 -6.614 1.00 0.00 H new ATOM 0 HD13 LEU A 151 -13.162 -12.985 -6.833 1.00 0.00 H new ATOM 0 HD21 LEU A 151 -12.788 -10.944 -4.499 1.00 0.00 H new ATOM 0 HD22 LEU A 151 -12.031 -10.707 -6.092 1.00 0.00 H new ATOM 0 HD23 LEU A 151 -13.092 -9.449 -5.415 1.00 0.00 H new ATOM 269 N PRO A 152 -17.161 -10.062 -5.859 1.00 0.00 N ATOM 270 CA PRO A 152 -17.809 -9.496 -4.689 1.00 0.00 C ATOM 271 C PRO A 152 -16.807 -9.305 -3.547 1.00 0.00 C ATOM 272 O PRO A 152 -15.846 -10.062 -3.425 1.00 0.00 O ATOM 273 CB PRO A 152 -18.922 -10.471 -4.344 1.00 0.00 C ATOM 274 CG PRO A 152 -18.568 -11.773 -5.045 1.00 0.00 C ATOM 275 CD PRO A 152 -17.474 -11.474 -6.058 1.00 0.00 C ATOM 0 HA PRO A 152 -18.213 -8.500 -4.873 1.00 0.00 H new ATOM 0 HB2 PRO A 152 -18.995 -10.615 -3.266 1.00 0.00 H new ATOM 0 HB3 PRO A 152 -19.888 -10.096 -4.681 1.00 0.00 H new ATOM 0 HG2 PRO A 152 -18.227 -12.515 -4.323 1.00 0.00 H new ATOM 0 HG3 PRO A 152 -19.444 -12.190 -5.541 1.00 0.00 H new ATOM 0 HD2 PRO A 152 -16.598 -12.101 -5.892 1.00 0.00 H new ATOM 0 HD3 PRO A 152 -17.814 -11.665 -7.076 1.00 0.00 H new ATOM 283 N PHE A 153 -17.068 -8.288 -2.738 1.00 0.00 N ATOM 284 CA PHE A 153 -16.202 -7.987 -1.611 1.00 0.00 C ATOM 285 C PHE A 153 -16.990 -7.986 -0.299 1.00 0.00 C ATOM 286 O PHE A 153 -18.194 -8.234 -0.294 1.00 0.00 O ATOM 287 CB PHE A 153 -15.627 -6.590 -1.848 1.00 0.00 C ATOM 288 CG PHE A 153 -16.108 -5.930 -3.143 1.00 0.00 C ATOM 289 CD1 PHE A 153 -15.511 -6.237 -4.325 1.00 0.00 C ATOM 290 CD2 PHE A 153 -17.133 -5.037 -3.110 1.00 0.00 C ATOM 291 CE1 PHE A 153 -15.957 -5.626 -5.526 1.00 0.00 C ATOM 292 CE2 PHE A 153 -17.579 -4.425 -4.312 1.00 0.00 C ATOM 293 CZ PHE A 153 -16.981 -4.733 -5.495 1.00 0.00 C ATOM 0 H PHE A 153 -17.867 -7.662 -2.841 1.00 0.00 H new ATOM 0 HA PHE A 153 -15.419 -8.741 -1.533 1.00 0.00 H new ATOM 0 HB2 PHE A 153 -15.893 -5.951 -1.006 1.00 0.00 H new ATOM 0 HB3 PHE A 153 -14.539 -6.655 -1.868 1.00 0.00 H new ATOM 0 HD1 PHE A 153 -14.697 -6.946 -4.350 1.00 0.00 H new ATOM 0 HD2 PHE A 153 -17.608 -4.793 -2.171 1.00 0.00 H new ATOM 0 HE1 PHE A 153 -15.482 -5.871 -6.465 1.00 0.00 H new ATOM 0 HE2 PHE A 153 -18.393 -3.715 -4.287 1.00 0.00 H new ATOM 0 HZ PHE A 153 -17.320 -4.268 -6.409 1.00 0.00 H new ATOM 303 N LYS A 154 -16.278 -7.703 0.781 1.00 0.00 N ATOM 304 CA LYS A 154 -16.895 -7.667 2.096 1.00 0.00 C ATOM 305 C LYS A 154 -16.631 -6.305 2.741 1.00 0.00 C ATOM 306 O LYS A 154 -15.760 -5.560 2.292 1.00 0.00 O ATOM 307 CB LYS A 154 -16.423 -8.850 2.943 1.00 0.00 C ATOM 308 CG LYS A 154 -16.840 -10.179 2.310 1.00 0.00 C ATOM 309 CD LYS A 154 -17.513 -11.090 3.339 1.00 0.00 C ATOM 310 CE LYS A 154 -19.032 -11.096 3.156 1.00 0.00 C ATOM 311 NZ LYS A 154 -19.439 -12.185 2.242 1.00 0.00 N ATOM 0 H LYS A 154 -15.279 -7.496 0.773 1.00 0.00 H new ATOM 0 HA LYS A 154 -17.976 -7.777 2.012 1.00 0.00 H new ATOM 0 HB2 LYS A 154 -15.338 -8.817 3.047 1.00 0.00 H new ATOM 0 HB3 LYS A 154 -16.842 -8.774 3.946 1.00 0.00 H new ATOM 0 HG2 LYS A 154 -17.524 -9.993 1.482 1.00 0.00 H new ATOM 0 HG3 LYS A 154 -15.965 -10.678 1.894 1.00 0.00 H new ATOM 0 HD2 LYS A 154 -17.127 -12.105 3.239 1.00 0.00 H new ATOM 0 HD3 LYS A 154 -17.266 -10.753 4.346 1.00 0.00 H new ATOM 0 HE2 LYS A 154 -19.520 -11.223 4.122 1.00 0.00 H new ATOM 0 HE3 LYS A 154 -19.360 -10.136 2.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 154 -20.473 -12.175 2.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 154 -18.988 -12.047 1.315 1.00 0.00 H new ATOM 0 HZ3 LYS A 154 -19.143 -13.100 2.638 1.00 0.00 H new ATOM 325 N LYS A 155 -17.399 -6.020 3.782 1.00 0.00 N ATOM 326 CA LYS A 155 -17.258 -4.760 4.494 1.00 0.00 C ATOM 327 C LYS A 155 -15.974 -4.788 5.322 1.00 0.00 C ATOM 328 O LYS A 155 -15.734 -5.732 6.074 1.00 0.00 O ATOM 329 CB LYS A 155 -18.515 -4.467 5.315 1.00 0.00 C ATOM 330 CG LYS A 155 -18.481 -5.209 6.653 1.00 0.00 C ATOM 331 CD LYS A 155 -17.832 -4.351 7.741 1.00 0.00 C ATOM 332 CE LYS A 155 -18.720 -3.159 8.101 1.00 0.00 C ATOM 333 NZ LYS A 155 -19.528 -3.459 9.303 1.00 0.00 N ATOM 0 H LYS A 155 -18.121 -6.639 4.150 1.00 0.00 H new ATOM 0 HA LYS A 155 -17.164 -3.932 3.791 1.00 0.00 H new ATOM 0 HB2 LYS A 155 -18.597 -3.395 5.492 1.00 0.00 H new ATOM 0 HB3 LYS A 155 -19.399 -4.765 4.752 1.00 0.00 H new ATOM 0 HG2 LYS A 155 -19.495 -5.474 6.951 1.00 0.00 H new ATOM 0 HG3 LYS A 155 -17.927 -6.141 6.542 1.00 0.00 H new ATOM 0 HD2 LYS A 155 -17.653 -4.957 8.629 1.00 0.00 H new ATOM 0 HD3 LYS A 155 -16.861 -3.995 7.397 1.00 0.00 H new ATOM 0 HE2 LYS A 155 -18.102 -2.279 8.281 1.00 0.00 H new ATOM 0 HE3 LYS A 155 -19.377 -2.921 7.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -20.125 -2.639 9.533 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 -20.131 -4.286 9.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 -18.897 -3.663 10.104 1.00 0.00 H new ATOM 347 N GLY A 156 -15.178 -3.740 5.158 1.00 0.00 N ATOM 348 CA GLY A 156 -13.923 -3.632 5.882 1.00 0.00 C ATOM 349 C GLY A 156 -13.024 -4.837 5.602 1.00 0.00 C ATOM 350 O GLY A 156 -12.486 -5.444 6.527 1.00 0.00 O ATOM 0 H GLY A 156 -15.379 -2.959 4.534 1.00 0.00 H new ATOM 0 HA2 GLY A 156 -13.409 -2.715 5.592 1.00 0.00 H new ATOM 0 HA3 GLY A 156 -14.121 -3.562 6.952 1.00 0.00 H new ATOM 354 N ASP A 157 -12.887 -5.148 4.321 1.00 0.00 N ATOM 355 CA ASP A 157 -12.062 -6.270 3.907 1.00 0.00 C ATOM 356 C ASP A 157 -10.775 -5.743 3.270 1.00 0.00 C ATOM 357 O ASP A 157 -10.653 -4.548 3.003 1.00 0.00 O ATOM 358 CB ASP A 157 -12.784 -7.133 2.870 1.00 0.00 C ATOM 359 CG ASP A 157 -12.253 -8.561 2.735 1.00 0.00 C ATOM 360 OD1 ASP A 157 -11.223 -8.722 2.048 1.00 0.00 O ATOM 361 OD2 ASP A 157 -12.892 -9.461 3.323 1.00 0.00 O ATOM 0 H ASP A 157 -13.334 -4.642 3.556 1.00 0.00 H new ATOM 0 HA ASP A 157 -11.846 -6.873 4.789 1.00 0.00 H new ATOM 0 HB2 ASP A 157 -13.842 -7.178 3.130 1.00 0.00 H new ATOM 0 HB3 ASP A 157 -12.715 -6.642 1.899 1.00 0.00 H new ATOM 366 N ILE A 158 -9.844 -6.660 3.044 1.00 0.00 N ATOM 367 CA ILE A 158 -8.572 -6.303 2.443 1.00 0.00 C ATOM 368 C ILE A 158 -8.548 -6.774 0.988 1.00 0.00 C ATOM 369 O ILE A 158 -9.114 -7.816 0.661 1.00 0.00 O ATOM 370 CB ILE A 158 -7.411 -6.843 3.283 1.00 0.00 C ATOM 371 CG1 ILE A 158 -6.997 -5.836 4.357 1.00 0.00 C ATOM 372 CG2 ILE A 158 -6.235 -7.251 2.395 1.00 0.00 C ATOM 373 CD1 ILE A 158 -6.681 -6.541 5.678 1.00 0.00 C ATOM 0 H ILE A 158 -9.947 -7.650 3.267 1.00 0.00 H new ATOM 0 HA ILE A 158 -8.449 -5.220 2.429 1.00 0.00 H new ATOM 0 HB ILE A 158 -7.751 -7.741 3.798 1.00 0.00 H new ATOM 0 HG12 ILE A 158 -6.123 -5.279 4.020 1.00 0.00 H new ATOM 0 HG13 ILE A 158 -7.797 -5.112 4.510 1.00 0.00 H new ATOM 0 HG21 ILE A 158 -5.424 -7.631 3.017 1.00 0.00 H new ATOM 0 HG22 ILE A 158 -6.555 -8.028 1.701 1.00 0.00 H new ATOM 0 HG23 ILE A 158 -5.886 -6.385 1.833 1.00 0.00 H new ATOM 0 HD11 ILE A 158 -6.389 -5.802 6.424 1.00 0.00 H new ATOM 0 HD12 ILE A 158 -7.564 -7.077 6.024 1.00 0.00 H new ATOM 0 HD13 ILE A 158 -5.864 -7.246 5.528 1.00 0.00 H new ATOM 385 N LEU A 159 -7.889 -5.984 0.153 1.00 0.00 N ATOM 386 CA LEU A 159 -7.784 -6.308 -1.258 1.00 0.00 C ATOM 387 C LEU A 159 -6.413 -5.873 -1.778 1.00 0.00 C ATOM 388 O LEU A 159 -6.041 -4.706 -1.660 1.00 0.00 O ATOM 389 CB LEU A 159 -8.956 -5.703 -2.035 1.00 0.00 C ATOM 390 CG LEU A 159 -10.353 -6.127 -1.578 1.00 0.00 C ATOM 391 CD1 LEU A 159 -11.322 -4.944 -1.607 1.00 0.00 C ATOM 392 CD2 LEU A 159 -10.866 -7.308 -2.406 1.00 0.00 C ATOM 0 H LEU A 159 -7.422 -5.120 0.428 1.00 0.00 H new ATOM 0 HA LEU A 159 -7.854 -7.386 -1.407 1.00 0.00 H new ATOM 0 HB2 LEU A 159 -8.888 -4.617 -1.969 1.00 0.00 H new ATOM 0 HB3 LEU A 159 -8.844 -5.967 -3.087 1.00 0.00 H new ATOM 0 HG LEU A 159 -10.286 -6.463 -0.543 1.00 0.00 H new ATOM 0 HD11 LEU A 159 -12.308 -5.273 -1.278 1.00 0.00 H new ATOM 0 HD12 LEU A 159 -10.960 -4.161 -0.941 1.00 0.00 H new ATOM 0 HD13 LEU A 159 -11.390 -4.554 -2.623 1.00 0.00 H new ATOM 0 HD21 LEU A 159 -11.861 -7.590 -2.061 1.00 0.00 H new ATOM 0 HD22 LEU A 159 -10.914 -7.022 -3.457 1.00 0.00 H new ATOM 0 HD23 LEU A 159 -10.189 -8.154 -2.291 1.00 0.00 H new ATOM 404 N ARG A 160 -5.696 -6.834 -2.342 1.00 0.00 N ATOM 405 CA ARG A 160 -4.373 -6.565 -2.880 1.00 0.00 C ATOM 406 C ARG A 160 -4.468 -6.196 -4.361 1.00 0.00 C ATOM 407 O ARG A 160 -5.085 -6.916 -5.146 1.00 0.00 O ATOM 408 CB ARG A 160 -3.457 -7.780 -2.720 1.00 0.00 C ATOM 409 CG ARG A 160 -2.317 -7.744 -3.741 1.00 0.00 C ATOM 410 CD ARG A 160 -2.588 -8.707 -4.899 1.00 0.00 C ATOM 411 NE ARG A 160 -1.905 -9.997 -4.654 1.00 0.00 N ATOM 412 CZ ARG A 160 -0.630 -10.246 -4.983 1.00 0.00 C ATOM 413 NH1 ARG A 160 0.108 -9.296 -5.571 1.00 0.00 N ATOM 414 NH2 ARG A 160 -0.094 -11.447 -4.722 1.00 0.00 N ATOM 0 H ARG A 160 -6.007 -7.801 -2.438 1.00 0.00 H new ATOM 0 HA ARG A 160 -3.950 -5.730 -2.321 1.00 0.00 H new ATOM 0 HB2 ARG A 160 -3.046 -7.800 -1.711 1.00 0.00 H new ATOM 0 HB3 ARG A 160 -4.035 -8.695 -2.847 1.00 0.00 H new ATOM 0 HG2 ARG A 160 -2.200 -6.731 -4.126 1.00 0.00 H new ATOM 0 HG3 ARG A 160 -1.379 -8.010 -3.254 1.00 0.00 H new ATOM 0 HD2 ARG A 160 -3.661 -8.868 -5.005 1.00 0.00 H new ATOM 0 HD3 ARG A 160 -2.237 -8.272 -5.835 1.00 0.00 H new ATOM 0 HE ARG A 160 -2.438 -10.743 -4.207 1.00 0.00 H new ATOM 0 HH11 ARG A 160 -0.300 -8.382 -5.769 1.00 0.00 H new ATOM 0 HH12 ARG A 160 1.078 -9.486 -5.821 1.00 0.00 H new ATOM 0 HH21 ARG A 160 -0.657 -12.170 -4.273 1.00 0.00 H new ATOM 0 HH22 ARG A 160 0.876 -11.638 -4.972 1.00 0.00 H new ATOM 428 N ILE A 161 -3.847 -5.076 -4.701 1.00 0.00 N ATOM 429 CA ILE A 161 -3.853 -4.604 -6.075 1.00 0.00 C ATOM 430 C ILE A 161 -2.756 -5.324 -6.862 1.00 0.00 C ATOM 431 O ILE A 161 -1.603 -5.360 -6.435 1.00 0.00 O ATOM 432 CB ILE A 161 -3.740 -3.078 -6.117 1.00 0.00 C ATOM 433 CG1 ILE A 161 -4.987 -2.453 -6.746 1.00 0.00 C ATOM 434 CG2 ILE A 161 -2.459 -2.642 -6.830 1.00 0.00 C ATOM 435 CD1 ILE A 161 -6.073 -2.220 -5.694 1.00 0.00 C ATOM 0 H ILE A 161 -3.336 -4.482 -4.048 1.00 0.00 H new ATOM 0 HA ILE A 161 -4.801 -4.844 -6.557 1.00 0.00 H new ATOM 0 HB ILE A 161 -3.678 -2.712 -5.092 1.00 0.00 H new ATOM 0 HG12 ILE A 161 -4.725 -1.507 -7.219 1.00 0.00 H new ATOM 0 HG13 ILE A 161 -5.369 -3.106 -7.530 1.00 0.00 H new ATOM 0 HG21 ILE A 161 -2.404 -1.554 -6.846 1.00 0.00 H new ATOM 0 HG22 ILE A 161 -1.594 -3.042 -6.301 1.00 0.00 H new ATOM 0 HG23 ILE A 161 -2.465 -3.020 -7.852 1.00 0.00 H new ATOM 0 HD11 ILE A 161 -6.948 -1.775 -6.167 1.00 0.00 H new ATOM 0 HD12 ILE A 161 -6.350 -3.172 -5.240 1.00 0.00 H new ATOM 0 HD13 ILE A 161 -5.695 -1.547 -4.924 1.00 0.00 H new ATOM 447 N ARG A 162 -3.155 -5.878 -7.998 1.00 0.00 N ATOM 448 CA ARG A 162 -2.220 -6.595 -8.848 1.00 0.00 C ATOM 449 C ARG A 162 -2.149 -5.939 -10.229 1.00 0.00 C ATOM 450 O ARG A 162 -1.061 -5.672 -10.738 1.00 0.00 O ATOM 451 CB ARG A 162 -2.633 -8.060 -9.008 1.00 0.00 C ATOM 452 CG ARG A 162 -1.464 -8.906 -9.517 1.00 0.00 C ATOM 453 CD ARG A 162 -1.965 -10.201 -10.162 1.00 0.00 C ATOM 454 NE ARG A 162 -0.890 -10.805 -10.980 1.00 0.00 N ATOM 455 CZ ARG A 162 -1.053 -11.891 -11.749 1.00 0.00 C ATOM 456 NH1 ARG A 162 -2.246 -12.497 -11.808 1.00 0.00 N ATOM 457 NH2 ARG A 162 -0.022 -12.372 -12.457 1.00 0.00 N ATOM 0 H ARG A 162 -4.112 -5.845 -8.349 1.00 0.00 H new ATOM 0 HA ARG A 162 -1.240 -6.555 -8.371 1.00 0.00 H new ATOM 0 HB2 ARG A 162 -2.980 -8.450 -8.051 1.00 0.00 H new ATOM 0 HB3 ARG A 162 -3.469 -8.132 -9.704 1.00 0.00 H new ATOM 0 HG2 ARG A 162 -0.885 -8.334 -10.242 1.00 0.00 H new ATOM 0 HG3 ARG A 162 -0.794 -9.143 -8.690 1.00 0.00 H new ATOM 0 HD2 ARG A 162 -2.284 -10.902 -9.391 1.00 0.00 H new ATOM 0 HD3 ARG A 162 -2.835 -9.994 -10.785 1.00 0.00 H new ATOM 0 HE ARG A 162 0.032 -10.368 -10.957 1.00 0.00 H new ATOM 0 HH11 ARG A 162 -3.031 -12.132 -11.268 1.00 0.00 H new ATOM 0 HH12 ARG A 162 -2.370 -13.323 -12.393 1.00 0.00 H new ATOM 0 HH21 ARG A 162 0.887 -11.912 -12.411 1.00 0.00 H new ATOM 0 HH22 ARG A 162 -0.146 -13.198 -13.042 1.00 0.00 H new ATOM 471 N ASP A 163 -3.322 -5.697 -10.795 1.00 0.00 N ATOM 472 CA ASP A 163 -3.406 -5.078 -12.107 1.00 0.00 C ATOM 473 C ASP A 163 -4.489 -3.997 -12.087 1.00 0.00 C ATOM 474 O ASP A 163 -5.464 -4.103 -11.344 1.00 0.00 O ATOM 475 CB ASP A 163 -3.783 -6.104 -13.177 1.00 0.00 C ATOM 476 CG ASP A 163 -3.228 -5.815 -14.574 1.00 0.00 C ATOM 477 OD1 ASP A 163 -2.608 -4.740 -14.727 1.00 0.00 O ATOM 478 OD2 ASP A 163 -3.439 -6.674 -15.458 1.00 0.00 O ATOM 0 H ASP A 163 -4.222 -5.918 -10.369 1.00 0.00 H new ATOM 0 HA ASP A 163 -2.430 -4.653 -12.343 1.00 0.00 H new ATOM 0 HB2 ASP A 163 -3.431 -7.085 -12.858 1.00 0.00 H new ATOM 0 HB3 ASP A 163 -4.870 -6.160 -13.239 1.00 0.00 H new ATOM 483 N LYS A 164 -4.280 -2.981 -12.911 1.00 0.00 N ATOM 484 CA LYS A 164 -5.226 -1.881 -12.997 1.00 0.00 C ATOM 485 C LYS A 164 -5.078 -1.193 -14.355 1.00 0.00 C ATOM 486 O LYS A 164 -4.707 -0.021 -14.425 1.00 0.00 O ATOM 487 CB LYS A 164 -5.057 -0.935 -11.807 1.00 0.00 C ATOM 488 CG LYS A 164 -3.632 -0.381 -11.743 1.00 0.00 C ATOM 489 CD LYS A 164 -2.814 -1.094 -10.666 1.00 0.00 C ATOM 490 CE LYS A 164 -1.321 -1.062 -10.999 1.00 0.00 C ATOM 491 NZ LYS A 164 -1.026 -1.957 -12.140 1.00 0.00 N ATOM 0 H LYS A 164 -3.470 -2.896 -13.525 1.00 0.00 H new ATOM 0 HA LYS A 164 -6.249 -2.252 -12.937 1.00 0.00 H new ATOM 0 HB2 LYS A 164 -5.767 -0.112 -11.889 1.00 0.00 H new ATOM 0 HB3 LYS A 164 -5.287 -1.464 -10.882 1.00 0.00 H new ATOM 0 HG2 LYS A 164 -3.147 -0.502 -12.712 1.00 0.00 H new ATOM 0 HG3 LYS A 164 -3.663 0.688 -11.533 1.00 0.00 H new ATOM 0 HD2 LYS A 164 -2.985 -0.618 -9.700 1.00 0.00 H new ATOM 0 HD3 LYS A 164 -3.148 -2.128 -10.576 1.00 0.00 H new ATOM 0 HE2 LYS A 164 -1.018 -0.043 -11.240 1.00 0.00 H new ATOM 0 HE3 LYS A 164 -0.741 -1.369 -10.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 164 -0.197 -2.544 -11.916 1.00 0.00 H new ATOM 0 HZ2 LYS A 164 -1.846 -2.571 -12.321 1.00 0.00 H new ATOM 0 HZ3 LYS A 164 -0.827 -1.386 -12.986 1.00 0.00 H new ATOM 505 N PRO A 165 -5.384 -1.968 -15.429 1.00 0.00 N ATOM 506 CA PRO A 165 -5.289 -1.445 -16.782 1.00 0.00 C ATOM 507 C PRO A 165 -6.454 -0.501 -17.088 1.00 0.00 C ATOM 508 O PRO A 165 -6.712 -0.183 -18.248 1.00 0.00 O ATOM 509 CB PRO A 165 -5.268 -2.673 -17.678 1.00 0.00 C ATOM 510 CG PRO A 165 -5.817 -3.813 -16.836 1.00 0.00 C ATOM 511 CD PRO A 165 -5.826 -3.359 -15.386 1.00 0.00 C ATOM 0 HA PRO A 165 -4.396 -0.840 -16.937 1.00 0.00 H new ATOM 0 HB2 PRO A 165 -5.877 -2.517 -18.569 1.00 0.00 H new ATOM 0 HB3 PRO A 165 -4.256 -2.891 -18.018 1.00 0.00 H new ATOM 0 HG2 PRO A 165 -6.824 -4.076 -17.160 1.00 0.00 H new ATOM 0 HG3 PRO A 165 -5.201 -4.705 -16.953 1.00 0.00 H new ATOM 0 HD2 PRO A 165 -6.822 -3.445 -14.951 1.00 0.00 H new ATOM 0 HD3 PRO A 165 -5.158 -3.968 -14.777 1.00 0.00 H new ATOM 519 N GLU A 166 -7.128 -0.081 -16.028 1.00 0.00 N ATOM 520 CA GLU A 166 -8.259 0.820 -16.168 1.00 0.00 C ATOM 521 C GLU A 166 -8.310 1.796 -14.991 1.00 0.00 C ATOM 522 O GLU A 166 -7.452 1.757 -14.111 1.00 0.00 O ATOM 523 CB GLU A 166 -9.569 0.039 -16.290 1.00 0.00 C ATOM 524 CG GLU A 166 -9.952 -0.601 -14.954 1.00 0.00 C ATOM 525 CD GLU A 166 -11.383 -1.143 -14.996 1.00 0.00 C ATOM 526 OE1 GLU A 166 -12.309 -0.307 -14.908 1.00 0.00 O ATOM 527 OE2 GLU A 166 -11.518 -2.380 -15.114 1.00 0.00 O ATOM 0 H GLU A 166 -6.912 -0.348 -15.068 1.00 0.00 H new ATOM 0 HA GLU A 166 -8.129 1.395 -17.085 1.00 0.00 H new ATOM 0 HB2 GLU A 166 -10.365 0.707 -16.619 1.00 0.00 H new ATOM 0 HB3 GLU A 166 -9.466 -0.734 -17.051 1.00 0.00 H new ATOM 0 HG2 GLU A 166 -9.259 -1.410 -14.722 1.00 0.00 H new ATOM 0 HG3 GLU A 166 -9.861 0.135 -14.155 1.00 0.00 H new ATOM 534 N GLU A 167 -9.324 2.649 -15.015 1.00 0.00 N ATOM 535 CA GLU A 167 -9.497 3.633 -13.960 1.00 0.00 C ATOM 536 C GLU A 167 -10.870 3.472 -13.303 1.00 0.00 C ATOM 537 O GLU A 167 -11.762 4.292 -13.512 1.00 0.00 O ATOM 538 CB GLU A 167 -9.312 5.053 -14.500 1.00 0.00 C ATOM 539 CG GLU A 167 -9.314 6.077 -13.363 1.00 0.00 C ATOM 540 CD GLU A 167 -8.194 7.103 -13.548 1.00 0.00 C ATOM 541 OE1 GLU A 167 -7.903 7.421 -14.721 1.00 0.00 O ATOM 542 OE2 GLU A 167 -7.654 7.546 -12.510 1.00 0.00 O ATOM 0 H GLU A 167 -10.033 2.679 -15.748 1.00 0.00 H new ATOM 0 HA GLU A 167 -8.731 3.464 -13.203 1.00 0.00 H new ATOM 0 HB2 GLU A 167 -8.373 5.117 -15.050 1.00 0.00 H new ATOM 0 HB3 GLU A 167 -10.111 5.285 -15.204 1.00 0.00 H new ATOM 0 HG2 GLU A 167 -10.277 6.587 -13.329 1.00 0.00 H new ATOM 0 HG3 GLU A 167 -9.190 5.566 -12.408 1.00 0.00 H new ATOM 549 N GLN A 168 -10.995 2.408 -12.524 1.00 0.00 N ATOM 550 CA GLN A 168 -12.243 2.128 -11.836 1.00 0.00 C ATOM 551 C GLN A 168 -12.187 0.748 -11.176 1.00 0.00 C ATOM 552 O GLN A 168 -12.177 0.642 -9.950 1.00 0.00 O ATOM 553 CB GLN A 168 -13.432 2.230 -12.792 1.00 0.00 C ATOM 554 CG GLN A 168 -14.491 3.192 -12.249 1.00 0.00 C ATOM 555 CD GLN A 168 -14.856 4.251 -13.291 1.00 0.00 C ATOM 556 OE1 GLN A 168 -15.621 4.016 -14.212 1.00 0.00 O ATOM 557 NE2 GLN A 168 -14.265 5.427 -13.098 1.00 0.00 N ATOM 0 H GLN A 168 -10.253 1.730 -12.354 1.00 0.00 H new ATOM 0 HA GLN A 168 -12.381 2.877 -11.057 1.00 0.00 H new ATOM 0 HB2 GLN A 168 -13.090 2.573 -13.768 1.00 0.00 H new ATOM 0 HB3 GLN A 168 -13.872 1.243 -12.937 1.00 0.00 H new ATOM 0 HG2 GLN A 168 -15.383 2.634 -11.965 1.00 0.00 H new ATOM 0 HG3 GLN A 168 -14.118 3.677 -11.347 1.00 0.00 H new ATOM 0 HE21 GLN A 168 -13.635 5.557 -12.307 1.00 0.00 H new ATOM 0 HE22 GLN A 168 -14.442 6.198 -13.741 1.00 0.00 H new ATOM 566 N TRP A 169 -12.153 -0.274 -12.018 1.00 0.00 N ATOM 567 CA TRP A 169 -12.098 -1.642 -11.531 1.00 0.00 C ATOM 568 C TRP A 169 -10.699 -2.191 -11.817 1.00 0.00 C ATOM 569 O TRP A 169 -10.260 -2.216 -12.966 1.00 0.00 O ATOM 570 CB TRP A 169 -13.210 -2.490 -12.154 1.00 0.00 C ATOM 571 CG TRP A 169 -14.604 -1.872 -12.033 1.00 0.00 C ATOM 572 CD1 TRP A 169 -15.156 -0.923 -12.802 1.00 0.00 C ATOM 573 CD2 TRP A 169 -15.609 -2.201 -11.050 1.00 0.00 C ATOM 574 NE1 TRP A 169 -16.436 -0.618 -12.389 1.00 0.00 N ATOM 575 CE2 TRP A 169 -16.720 -1.420 -11.289 1.00 0.00 C ATOM 576 CE3 TRP A 169 -15.578 -3.129 -9.994 1.00 0.00 C ATOM 577 CZ2 TRP A 169 -17.885 -1.486 -10.515 1.00 0.00 C ATOM 578 CZ3 TRP A 169 -16.750 -3.183 -9.229 1.00 0.00 C ATOM 579 CH2 TRP A 169 -17.878 -2.403 -9.458 1.00 0.00 C ATOM 0 H TRP A 169 -12.162 -0.183 -13.034 1.00 0.00 H new ATOM 0 HA TRP A 169 -12.272 -1.675 -10.455 1.00 0.00 H new ATOM 0 HB2 TRP A 169 -12.984 -2.649 -13.208 1.00 0.00 H new ATOM 0 HB3 TRP A 169 -13.216 -3.470 -11.678 1.00 0.00 H new ATOM 0 HD1 TRP A 169 -14.660 -0.456 -13.640 1.00 0.00 H new ATOM 0 HE1 TRP A 169 -17.060 0.069 -12.812 1.00 0.00 H new ATOM 0 HE3 TRP A 169 -14.719 -3.751 -9.789 1.00 0.00 H new ATOM 0 HZ2 TRP A 169 -18.742 -0.863 -10.723 1.00 0.00 H new ATOM 0 HZ3 TRP A 169 -16.780 -3.879 -8.404 1.00 0.00 H new ATOM 0 HH2 TRP A 169 -18.745 -2.504 -8.823 1.00 0.00 H new ATOM 590 N TRP A 170 -10.035 -2.616 -10.752 1.00 0.00 N ATOM 591 CA TRP A 170 -8.694 -3.161 -10.873 1.00 0.00 C ATOM 592 C TRP A 170 -8.731 -4.615 -10.397 1.00 0.00 C ATOM 593 O TRP A 170 -9.590 -4.990 -9.602 1.00 0.00 O ATOM 594 CB TRP A 170 -7.683 -2.307 -10.107 1.00 0.00 C ATOM 595 CG TRP A 170 -7.634 -0.846 -10.559 1.00 0.00 C ATOM 596 CD1 TRP A 170 -8.086 -0.321 -11.707 1.00 0.00 C ATOM 597 CD2 TRP A 170 -7.079 0.264 -9.822 1.00 0.00 C ATOM 598 NE1 TRP A 170 -7.865 1.040 -11.763 1.00 0.00 N ATOM 599 CE2 TRP A 170 -7.234 1.407 -10.580 1.00 0.00 C ATOM 600 CE3 TRP A 170 -6.468 0.302 -8.557 1.00 0.00 C ATOM 601 CZ2 TRP A 170 -6.803 2.671 -10.158 1.00 0.00 C ATOM 602 CZ3 TRP A 170 -6.043 1.572 -8.150 1.00 0.00 C ATOM 603 CH2 TRP A 170 -6.191 2.732 -8.901 1.00 0.00 C ATOM 0 H TRP A 170 -10.402 -2.594 -9.800 1.00 0.00 H new ATOM 0 HA TRP A 170 -8.362 -3.142 -11.911 1.00 0.00 H new ATOM 0 HB2 TRP A 170 -7.926 -2.340 -9.045 1.00 0.00 H new ATOM 0 HB3 TRP A 170 -6.692 -2.746 -10.221 1.00 0.00 H new ATOM 0 HD1 TRP A 170 -8.563 -0.892 -12.490 1.00 0.00 H new ATOM 0 HE1 TRP A 170 -8.118 1.662 -12.531 1.00 0.00 H new ATOM 0 HE3 TRP A 170 -6.337 -0.579 -7.947 1.00 0.00 H new ATOM 0 HZ2 TRP A 170 -6.936 3.551 -10.770 1.00 0.00 H new ATOM 0 HZ3 TRP A 170 -5.567 1.656 -7.184 1.00 0.00 H new ATOM 0 HH2 TRP A 170 -5.835 3.676 -8.516 1.00 0.00 H new ATOM 614 N ASN A 171 -7.787 -5.394 -10.905 1.00 0.00 N ATOM 615 CA ASN A 171 -7.700 -6.798 -10.541 1.00 0.00 C ATOM 616 C ASN A 171 -6.889 -6.937 -9.252 1.00 0.00 C ATOM 617 O ASN A 171 -5.659 -6.919 -9.283 1.00 0.00 O ATOM 618 CB ASN A 171 -6.995 -7.607 -11.633 1.00 0.00 C ATOM 619 CG ASN A 171 -6.871 -9.077 -11.231 1.00 0.00 C ATOM 620 OD1 ASN A 171 -7.079 -9.456 -10.090 1.00 0.00 O ATOM 621 ND2 ASN A 171 -6.521 -9.884 -12.229 1.00 0.00 N ATOM 0 H ASN A 171 -7.076 -5.080 -11.565 1.00 0.00 H new ATOM 0 HA ASN A 171 -8.714 -7.176 -10.409 1.00 0.00 H new ATOM 0 HB2 ASN A 171 -7.552 -7.527 -12.567 1.00 0.00 H new ATOM 0 HB3 ASN A 171 -6.004 -7.191 -11.816 1.00 0.00 H new ATOM 0 HD21 ASN A 171 -6.412 -10.884 -12.062 1.00 0.00 H new ATOM 0 HD22 ASN A 171 -6.362 -9.502 -13.161 1.00 0.00 H new ATOM 628 N ALA A 172 -7.609 -7.074 -8.148 1.00 0.00 N ATOM 629 CA ALA A 172 -6.972 -7.216 -6.851 1.00 0.00 C ATOM 630 C ALA A 172 -7.283 -8.603 -6.284 1.00 0.00 C ATOM 631 O ALA A 172 -8.300 -9.204 -6.628 1.00 0.00 O ATOM 632 CB ALA A 172 -7.439 -6.090 -5.926 1.00 0.00 C ATOM 0 H ALA A 172 -8.629 -7.090 -8.126 1.00 0.00 H new ATOM 0 HA ALA A 172 -5.889 -7.133 -6.944 1.00 0.00 H new ATOM 0 HB1 ALA A 172 -6.961 -6.197 -4.952 1.00 0.00 H new ATOM 0 HB2 ALA A 172 -7.168 -5.127 -6.359 1.00 0.00 H new ATOM 0 HB3 ALA A 172 -8.521 -6.143 -5.806 1.00 0.00 H new ATOM 638 N GLU A 173 -6.390 -9.070 -5.425 1.00 0.00 N ATOM 639 CA GLU A 173 -6.557 -10.374 -4.807 1.00 0.00 C ATOM 640 C GLU A 173 -7.157 -10.226 -3.407 1.00 0.00 C ATOM 641 O GLU A 173 -6.493 -9.740 -2.491 1.00 0.00 O ATOM 642 CB GLU A 173 -5.228 -11.131 -4.757 1.00 0.00 C ATOM 643 CG GLU A 173 -5.432 -12.565 -4.262 1.00 0.00 C ATOM 644 CD GLU A 173 -4.653 -12.814 -2.969 1.00 0.00 C ATOM 645 OE1 GLU A 173 -3.409 -12.701 -3.025 1.00 0.00 O ATOM 646 OE2 GLU A 173 -5.317 -13.114 -1.955 1.00 0.00 O ATOM 0 H GLU A 173 -5.548 -8.569 -5.142 1.00 0.00 H new ATOM 0 HA GLU A 173 -7.247 -10.957 -5.416 1.00 0.00 H new ATOM 0 HB2 GLU A 173 -4.776 -11.146 -5.749 1.00 0.00 H new ATOM 0 HB3 GLU A 173 -4.533 -10.610 -4.098 1.00 0.00 H new ATOM 0 HG2 GLU A 173 -6.493 -12.748 -4.093 1.00 0.00 H new ATOM 0 HG3 GLU A 173 -5.106 -13.268 -5.028 1.00 0.00 H new ATOM 653 N ASP A 174 -8.404 -10.654 -3.284 1.00 0.00 N ATOM 654 CA ASP A 174 -9.100 -10.575 -2.011 1.00 0.00 C ATOM 655 C ASP A 174 -8.283 -11.301 -0.941 1.00 0.00 C ATOM 656 O ASP A 174 -7.261 -11.914 -1.246 1.00 0.00 O ATOM 657 CB ASP A 174 -10.473 -11.245 -2.092 1.00 0.00 C ATOM 658 CG ASP A 174 -11.638 -10.394 -1.580 1.00 0.00 C ATOM 659 OD1 ASP A 174 -11.613 -10.064 -0.375 1.00 0.00 O ATOM 660 OD2 ASP A 174 -12.528 -10.096 -2.406 1.00 0.00 O ATOM 0 H ASP A 174 -8.951 -11.057 -4.045 1.00 0.00 H new ATOM 0 HA ASP A 174 -9.226 -9.522 -1.761 1.00 0.00 H new ATOM 0 HB2 ASP A 174 -10.668 -11.515 -3.130 1.00 0.00 H new ATOM 0 HB3 ASP A 174 -10.442 -12.173 -1.521 1.00 0.00 H new ATOM 665 N SER A 175 -8.763 -11.208 0.290 1.00 0.00 N ATOM 666 CA SER A 175 -8.089 -11.848 1.407 1.00 0.00 C ATOM 667 C SER A 175 -8.455 -13.332 1.458 1.00 0.00 C ATOM 668 O SER A 175 -8.485 -13.931 2.532 1.00 0.00 O ATOM 669 CB SER A 175 -8.445 -11.167 2.729 1.00 0.00 C ATOM 670 OG SER A 175 -9.845 -11.215 2.994 1.00 0.00 O ATOM 0 H SER A 175 -9.611 -10.699 0.539 1.00 0.00 H new ATOM 0 HA SER A 175 -7.014 -11.751 1.259 1.00 0.00 H new ATOM 0 HB2 SER A 175 -7.905 -11.651 3.543 1.00 0.00 H new ATOM 0 HB3 SER A 175 -8.117 -10.128 2.702 1.00 0.00 H new ATOM 0 HG SER A 175 -10.269 -10.396 2.662 1.00 0.00 H new ATOM 676 N GLU A 176 -8.726 -13.883 0.283 1.00 0.00 N ATOM 677 CA GLU A 176 -9.089 -15.286 0.181 1.00 0.00 C ATOM 678 C GLU A 176 -8.286 -15.963 -0.931 1.00 0.00 C ATOM 679 O GLU A 176 -8.353 -17.179 -1.098 1.00 0.00 O ATOM 680 CB GLU A 176 -10.592 -15.447 -0.053 1.00 0.00 C ATOM 681 CG GLU A 176 -11.362 -15.398 1.269 1.00 0.00 C ATOM 682 CD GLU A 176 -12.850 -15.138 1.028 1.00 0.00 C ATOM 683 OE1 GLU A 176 -13.361 -15.663 0.015 1.00 0.00 O ATOM 684 OE2 GLU A 176 -13.443 -14.420 1.862 1.00 0.00 O ATOM 0 H GLU A 176 -8.701 -13.383 -0.606 1.00 0.00 H new ATOM 0 HA GLU A 176 -8.847 -15.773 1.125 1.00 0.00 H new ATOM 0 HB2 GLU A 176 -10.947 -14.657 -0.714 1.00 0.00 H new ATOM 0 HB3 GLU A 176 -10.786 -16.394 -0.556 1.00 0.00 H new ATOM 0 HG2 GLU A 176 -11.236 -16.340 1.803 1.00 0.00 H new ATOM 0 HG3 GLU A 176 -10.951 -14.614 1.905 1.00 0.00 H new ATOM 691 N GLY A 177 -7.544 -15.144 -1.663 1.00 0.00 N ATOM 692 CA GLY A 177 -6.728 -15.649 -2.755 1.00 0.00 C ATOM 693 C GLY A 177 -7.458 -15.513 -4.093 1.00 0.00 C ATOM 694 O GLY A 177 -6.905 -15.841 -5.141 1.00 0.00 O ATOM 0 H GLY A 177 -7.491 -14.135 -1.521 1.00 0.00 H new ATOM 0 HA2 GLY A 177 -5.786 -15.102 -2.793 1.00 0.00 H new ATOM 0 HA3 GLY A 177 -6.482 -16.696 -2.576 1.00 0.00 H new ATOM 698 N LYS A 178 -8.688 -15.028 -4.012 1.00 0.00 N ATOM 699 CA LYS A 178 -9.500 -14.844 -5.204 1.00 0.00 C ATOM 700 C LYS A 178 -9.121 -13.522 -5.874 1.00 0.00 C ATOM 701 O LYS A 178 -9.315 -12.452 -5.300 1.00 0.00 O ATOM 702 CB LYS A 178 -10.987 -14.957 -4.863 1.00 0.00 C ATOM 703 CG LYS A 178 -11.396 -13.898 -3.837 1.00 0.00 C ATOM 704 CD LYS A 178 -12.299 -14.499 -2.758 1.00 0.00 C ATOM 705 CE LYS A 178 -13.720 -14.705 -3.286 1.00 0.00 C ATOM 706 NZ LYS A 178 -14.559 -13.522 -2.990 1.00 0.00 N ATOM 0 H LYS A 178 -9.143 -14.757 -3.140 1.00 0.00 H new ATOM 0 HA LYS A 178 -9.302 -15.636 -5.926 1.00 0.00 H new ATOM 0 HB2 LYS A 178 -11.582 -14.840 -5.769 1.00 0.00 H new ATOM 0 HB3 LYS A 178 -11.199 -15.951 -4.469 1.00 0.00 H new ATOM 0 HG2 LYS A 178 -10.506 -13.471 -3.375 1.00 0.00 H new ATOM 0 HG3 LYS A 178 -11.917 -13.082 -4.339 1.00 0.00 H new ATOM 0 HD2 LYS A 178 -11.889 -15.452 -2.425 1.00 0.00 H new ATOM 0 HD3 LYS A 178 -12.322 -13.841 -1.889 1.00 0.00 H new ATOM 0 HE2 LYS A 178 -13.693 -14.879 -4.362 1.00 0.00 H new ATOM 0 HE3 LYS A 178 -14.159 -15.593 -2.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 178 -15.288 -13.420 -3.725 1.00 0.00 H new ATOM 0 HZ2 LYS A 178 -15.016 -13.644 -2.064 1.00 0.00 H new ATOM 0 HZ3 LYS A 178 -13.963 -12.670 -2.973 1.00 0.00 H new ATOM 720 N ARG A 179 -8.587 -13.640 -7.082 1.00 0.00 N ATOM 721 CA ARG A 179 -8.181 -12.467 -7.837 1.00 0.00 C ATOM 722 C ARG A 179 -9.270 -12.075 -8.838 1.00 0.00 C ATOM 723 O ARG A 179 -9.597 -12.846 -9.738 1.00 0.00 O ATOM 724 CB ARG A 179 -6.874 -12.724 -8.591 1.00 0.00 C ATOM 725 CG ARG A 179 -5.747 -13.095 -7.624 1.00 0.00 C ATOM 726 CD ARG A 179 -4.378 -12.788 -8.234 1.00 0.00 C ATOM 727 NE ARG A 179 -3.666 -14.049 -8.539 1.00 0.00 N ATOM 728 CZ ARG A 179 -2.878 -14.696 -7.670 1.00 0.00 C ATOM 729 NH1 ARG A 179 -2.697 -14.206 -6.435 1.00 0.00 N ATOM 730 NH2 ARG A 179 -2.271 -15.834 -8.033 1.00 0.00 N ATOM 0 H ARG A 179 -8.427 -14.529 -7.555 1.00 0.00 H new ATOM 0 HA ARG A 179 -8.026 -11.654 -7.128 1.00 0.00 H new ATOM 0 HB2 ARG A 179 -7.018 -13.528 -9.313 1.00 0.00 H new ATOM 0 HB3 ARG A 179 -6.595 -11.835 -9.156 1.00 0.00 H new ATOM 0 HG2 ARG A 179 -5.866 -12.542 -6.692 1.00 0.00 H new ATOM 0 HG3 ARG A 179 -5.809 -14.155 -7.376 1.00 0.00 H new ATOM 0 HD2 ARG A 179 -4.500 -12.200 -9.144 1.00 0.00 H new ATOM 0 HD3 ARG A 179 -3.789 -12.186 -7.542 1.00 0.00 H new ATOM 0 HE ARG A 179 -3.783 -14.451 -9.469 1.00 0.00 H new ATOM 0 HH11 ARG A 179 -3.159 -13.340 -6.157 1.00 0.00 H new ATOM 0 HH12 ARG A 179 -2.097 -14.699 -5.774 1.00 0.00 H new ATOM 0 HH21 ARG A 179 -2.409 -16.208 -8.972 1.00 0.00 H new ATOM 0 HH22 ARG A 179 -1.671 -16.326 -7.371 1.00 0.00 H new ATOM 744 N GLY A 180 -9.800 -10.876 -8.646 1.00 0.00 N ATOM 745 CA GLY A 180 -10.845 -10.372 -9.521 1.00 0.00 C ATOM 746 C GLY A 180 -10.833 -8.843 -9.566 1.00 0.00 C ATOM 747 O GLY A 180 -9.923 -8.210 -9.031 1.00 0.00 O ATOM 0 H GLY A 180 -9.526 -10.239 -7.898 1.00 0.00 H new ATOM 0 HA2 GLY A 180 -10.706 -10.770 -10.526 1.00 0.00 H new ATOM 0 HA3 GLY A 180 -11.817 -10.721 -9.172 1.00 0.00 H new ATOM 751 N MET A 181 -11.852 -8.293 -10.210 1.00 0.00 N ATOM 752 CA MET A 181 -11.970 -6.850 -10.332 1.00 0.00 C ATOM 753 C MET A 181 -12.645 -6.249 -9.099 1.00 0.00 C ATOM 754 O MET A 181 -13.704 -6.713 -8.678 1.00 0.00 O ATOM 755 CB MET A 181 -12.787 -6.508 -11.580 1.00 0.00 C ATOM 756 CG MET A 181 -11.881 -6.352 -12.803 1.00 0.00 C ATOM 757 SD MET A 181 -12.870 -6.257 -14.286 1.00 0.00 S ATOM 758 CE MET A 181 -11.679 -5.539 -15.406 1.00 0.00 C ATOM 0 H MET A 181 -12.604 -8.821 -10.653 1.00 0.00 H new ATOM 0 HA MET A 181 -10.968 -6.428 -10.416 1.00 0.00 H new ATOM 0 HB2 MET A 181 -13.521 -7.292 -11.765 1.00 0.00 H new ATOM 0 HB3 MET A 181 -13.342 -5.585 -11.414 1.00 0.00 H new ATOM 0 HG2 MET A 181 -11.273 -5.453 -12.703 1.00 0.00 H new ATOM 0 HG3 MET A 181 -11.194 -7.196 -12.867 1.00 0.00 H new ATOM 0 HE1 MET A 181 -12.201 -4.981 -16.183 1.00 0.00 H new ATOM 0 HE2 MET A 181 -11.021 -4.866 -14.855 1.00 0.00 H new ATOM 0 HE3 MET A 181 -11.087 -6.331 -15.864 1.00 0.00 H new ATOM 768 N ILE A 182 -12.005 -5.225 -8.553 1.00 0.00 N ATOM 769 CA ILE A 182 -12.531 -4.555 -7.376 1.00 0.00 C ATOM 770 C ILE A 182 -12.569 -3.046 -7.627 1.00 0.00 C ATOM 771 O ILE A 182 -11.694 -2.503 -8.299 1.00 0.00 O ATOM 772 CB ILE A 182 -11.732 -4.951 -6.133 1.00 0.00 C ATOM 773 CG1 ILE A 182 -11.925 -6.433 -5.805 1.00 0.00 C ATOM 774 CG2 ILE A 182 -12.083 -4.051 -4.945 1.00 0.00 C ATOM 775 CD1 ILE A 182 -10.578 -7.150 -5.696 1.00 0.00 C ATOM 0 H ILE A 182 -11.127 -4.843 -8.904 1.00 0.00 H new ATOM 0 HA ILE A 182 -13.556 -4.872 -7.183 1.00 0.00 H new ATOM 0 HB ILE A 182 -10.673 -4.804 -6.347 1.00 0.00 H new ATOM 0 HG12 ILE A 182 -12.471 -6.533 -4.867 1.00 0.00 H new ATOM 0 HG13 ILE A 182 -12.531 -6.905 -6.579 1.00 0.00 H new ATOM 0 HG21 ILE A 182 -11.501 -4.354 -4.075 1.00 0.00 H new ATOM 0 HG22 ILE A 182 -11.852 -3.015 -5.193 1.00 0.00 H new ATOM 0 HG23 ILE A 182 -13.146 -4.143 -4.721 1.00 0.00 H new ATOM 0 HD11 ILE A 182 -10.743 -8.202 -5.462 1.00 0.00 H new ATOM 0 HD12 ILE A 182 -10.045 -7.068 -6.643 1.00 0.00 H new ATOM 0 HD13 ILE A 182 -9.985 -6.691 -4.905 1.00 0.00 H new ATOM 787 N PRO A 183 -13.621 -2.396 -7.061 1.00 0.00 N ATOM 788 CA PRO A 183 -13.785 -0.960 -7.216 1.00 0.00 C ATOM 789 C PRO A 183 -12.793 -0.196 -6.337 1.00 0.00 C ATOM 790 O PRO A 183 -12.649 -0.495 -5.152 1.00 0.00 O ATOM 791 CB PRO A 183 -15.235 -0.688 -6.850 1.00 0.00 C ATOM 792 CG PRO A 183 -15.700 -1.901 -6.060 1.00 0.00 C ATOM 793 CD PRO A 183 -14.676 -3.007 -6.258 1.00 0.00 C ATOM 0 HA PRO A 183 -13.573 -0.620 -8.230 1.00 0.00 H new ATOM 0 HB2 PRO A 183 -15.324 0.222 -6.257 1.00 0.00 H new ATOM 0 HB3 PRO A 183 -15.843 -0.547 -7.743 1.00 0.00 H new ATOM 0 HG2 PRO A 183 -15.796 -1.654 -5.003 1.00 0.00 H new ATOM 0 HG3 PRO A 183 -16.683 -2.225 -6.402 1.00 0.00 H new ATOM 0 HD2 PRO A 183 -14.290 -3.365 -5.303 1.00 0.00 H new ATOM 0 HD3 PRO A 183 -15.114 -3.866 -6.767 1.00 0.00 H new ATOM 801 N VAL A 184 -12.134 0.776 -6.951 1.00 0.00 N ATOM 802 CA VAL A 184 -11.160 1.585 -6.239 1.00 0.00 C ATOM 803 C VAL A 184 -11.892 2.615 -5.376 1.00 0.00 C ATOM 804 O VAL A 184 -11.379 3.039 -4.341 1.00 0.00 O ATOM 805 CB VAL A 184 -10.184 2.223 -7.230 1.00 0.00 C ATOM 806 CG1 VAL A 184 -9.276 3.236 -6.531 1.00 0.00 C ATOM 807 CG2 VAL A 184 -9.360 1.154 -7.953 1.00 0.00 C ATOM 0 H VAL A 184 -12.256 1.021 -7.934 1.00 0.00 H new ATOM 0 HA VAL A 184 -10.564 0.964 -5.570 1.00 0.00 H new ATOM 0 HB VAL A 184 -10.768 2.759 -7.978 1.00 0.00 H new ATOM 0 HG11 VAL A 184 -8.592 3.674 -7.258 1.00 0.00 H new ATOM 0 HG12 VAL A 184 -9.884 4.023 -6.085 1.00 0.00 H new ATOM 0 HG13 VAL A 184 -8.703 2.734 -5.751 1.00 0.00 H new ATOM 0 HG21 VAL A 184 -8.674 1.634 -8.651 1.00 0.00 H new ATOM 0 HG22 VAL A 184 -8.791 0.578 -7.223 1.00 0.00 H new ATOM 0 HG23 VAL A 184 -10.028 0.488 -8.500 1.00 0.00 H new ATOM 817 N PRO A 185 -13.110 2.996 -5.844 1.00 0.00 N ATOM 818 CA PRO A 185 -13.918 3.966 -5.125 1.00 0.00 C ATOM 819 C PRO A 185 -14.553 3.339 -3.883 1.00 0.00 C ATOM 820 O PRO A 185 -14.879 4.042 -2.927 1.00 0.00 O ATOM 821 CB PRO A 185 -14.944 4.450 -6.138 1.00 0.00 C ATOM 822 CG PRO A 185 -14.971 3.401 -7.237 1.00 0.00 C ATOM 823 CD PRO A 185 -13.749 2.514 -7.065 1.00 0.00 C ATOM 0 HA PRO A 185 -13.331 4.801 -4.742 1.00 0.00 H new ATOM 0 HB2 PRO A 185 -15.926 4.559 -5.678 1.00 0.00 H new ATOM 0 HB3 PRO A 185 -14.669 5.426 -6.537 1.00 0.00 H new ATOM 0 HG2 PRO A 185 -15.884 2.809 -7.177 1.00 0.00 H new ATOM 0 HG3 PRO A 185 -14.963 3.876 -8.218 1.00 0.00 H new ATOM 0 HD2 PRO A 185 -14.031 1.465 -6.977 1.00 0.00 H new ATOM 0 HD3 PRO A 185 -13.078 2.593 -7.921 1.00 0.00 H new ATOM 831 N TYR A 186 -14.711 2.025 -3.937 1.00 0.00 N ATOM 832 CA TYR A 186 -15.301 1.296 -2.828 1.00 0.00 C ATOM 833 C TYR A 186 -14.273 1.053 -1.721 1.00 0.00 C ATOM 834 O TYR A 186 -14.587 1.174 -0.538 1.00 0.00 O ATOM 835 CB TYR A 186 -15.747 -0.052 -3.399 1.00 0.00 C ATOM 836 CG TYR A 186 -17.193 -0.422 -3.064 1.00 0.00 C ATOM 837 CD1 TYR A 186 -18.230 0.377 -3.503 1.00 0.00 C ATOM 838 CD2 TYR A 186 -17.461 -1.554 -2.322 1.00 0.00 C ATOM 839 CE1 TYR A 186 -19.591 0.029 -3.189 1.00 0.00 C ATOM 840 CE2 TYR A 186 -18.824 -1.902 -2.008 1.00 0.00 C ATOM 841 CZ TYR A 186 -19.820 -1.093 -2.456 1.00 0.00 C ATOM 842 OH TYR A 186 -21.107 -1.422 -2.159 1.00 0.00 O ATOM 0 H TYR A 186 -14.440 1.446 -4.732 1.00 0.00 H new ATOM 0 HA TYR A 186 -16.127 1.860 -2.394 1.00 0.00 H new ATOM 0 HB2 TYR A 186 -15.629 -0.033 -4.482 1.00 0.00 H new ATOM 0 HB3 TYR A 186 -15.086 -0.832 -3.020 1.00 0.00 H new ATOM 0 HD1 TYR A 186 -18.020 1.264 -4.082 1.00 0.00 H new ATOM 0 HD2 TYR A 186 -16.650 -2.179 -1.977 1.00 0.00 H new ATOM 0 HE1 TYR A 186 -20.411 0.645 -3.528 1.00 0.00 H new ATOM 0 HE2 TYR A 186 -19.049 -2.786 -1.430 1.00 0.00 H new ATOM 0 HH TYR A 186 -21.120 -2.248 -1.631 1.00 0.00 H new ATOM 852 N VAL A 187 -13.064 0.715 -2.146 1.00 0.00 N ATOM 853 CA VAL A 187 -11.986 0.454 -1.206 1.00 0.00 C ATOM 854 C VAL A 187 -11.247 1.761 -0.909 1.00 0.00 C ATOM 855 O VAL A 187 -11.617 2.817 -1.419 1.00 0.00 O ATOM 856 CB VAL A 187 -11.069 -0.642 -1.753 1.00 0.00 C ATOM 857 CG1 VAL A 187 -11.869 -1.896 -2.112 1.00 0.00 C ATOM 858 CG2 VAL A 187 -10.269 -0.138 -2.955 1.00 0.00 C ATOM 0 H VAL A 187 -12.807 0.616 -3.128 1.00 0.00 H new ATOM 0 HA VAL A 187 -12.383 0.084 -0.261 1.00 0.00 H new ATOM 0 HB VAL A 187 -10.361 -0.910 -0.969 1.00 0.00 H new ATOM 0 HG11 VAL A 187 -11.194 -2.660 -2.498 1.00 0.00 H new ATOM 0 HG12 VAL A 187 -12.373 -2.273 -1.222 1.00 0.00 H new ATOM 0 HG13 VAL A 187 -12.611 -1.649 -2.872 1.00 0.00 H new ATOM 0 HG21 VAL A 187 -9.625 -0.936 -3.324 1.00 0.00 H new ATOM 0 HG22 VAL A 187 -10.954 0.170 -3.745 1.00 0.00 H new ATOM 0 HG23 VAL A 187 -9.656 0.712 -2.654 1.00 0.00 H new ATOM 868 N GLU A 188 -10.214 1.644 -0.086 1.00 0.00 N ATOM 869 CA GLU A 188 -9.419 2.803 0.284 1.00 0.00 C ATOM 870 C GLU A 188 -7.928 2.478 0.181 1.00 0.00 C ATOM 871 O GLU A 188 -7.539 1.312 0.214 1.00 0.00 O ATOM 872 CB GLU A 188 -9.779 3.287 1.690 1.00 0.00 C ATOM 873 CG GLU A 188 -9.341 2.273 2.748 1.00 0.00 C ATOM 874 CD GLU A 188 -9.688 2.764 4.155 1.00 0.00 C ATOM 875 OE1 GLU A 188 -10.697 3.494 4.269 1.00 0.00 O ATOM 876 OE2 GLU A 188 -8.936 2.399 5.084 1.00 0.00 O ATOM 0 H GLU A 188 -9.910 0.766 0.334 1.00 0.00 H new ATOM 0 HA GLU A 188 -9.643 3.611 -0.412 1.00 0.00 H new ATOM 0 HB2 GLU A 188 -9.300 4.247 1.881 1.00 0.00 H new ATOM 0 HB3 GLU A 188 -10.855 3.448 1.759 1.00 0.00 H new ATOM 0 HG2 GLU A 188 -9.828 1.316 2.563 1.00 0.00 H new ATOM 0 HG3 GLU A 188 -8.267 2.104 2.672 1.00 0.00 H new ATOM 883 N LYS A 189 -7.133 3.531 0.056 1.00 0.00 N ATOM 884 CA LYS A 189 -5.692 3.372 -0.053 1.00 0.00 C ATOM 885 C LYS A 189 -5.081 3.335 1.349 1.00 0.00 C ATOM 886 O LYS A 189 -5.097 4.335 2.064 1.00 0.00 O ATOM 887 CB LYS A 189 -5.100 4.458 -0.953 1.00 0.00 C ATOM 888 CG LYS A 189 -5.297 5.846 -0.340 1.00 0.00 C ATOM 889 CD LYS A 189 -6.011 6.781 -1.318 1.00 0.00 C ATOM 890 CE LYS A 189 -6.921 7.760 -0.573 1.00 0.00 C ATOM 891 NZ LYS A 189 -8.200 7.107 -0.214 1.00 0.00 N ATOM 0 H LYS A 189 -7.459 4.497 0.028 1.00 0.00 H new ATOM 0 HA LYS A 189 -5.448 2.424 -0.533 1.00 0.00 H new ATOM 0 HB2 LYS A 189 -4.037 4.271 -1.104 1.00 0.00 H new ATOM 0 HB3 LYS A 189 -5.573 4.420 -1.934 1.00 0.00 H new ATOM 0 HG2 LYS A 189 -5.878 5.763 0.579 1.00 0.00 H new ATOM 0 HG3 LYS A 189 -4.329 6.268 -0.068 1.00 0.00 H new ATOM 0 HD2 LYS A 189 -5.275 7.334 -1.901 1.00 0.00 H new ATOM 0 HD3 LYS A 189 -6.601 6.195 -2.023 1.00 0.00 H new ATOM 0 HE2 LYS A 189 -6.422 8.116 0.328 1.00 0.00 H new ATOM 0 HE3 LYS A 189 -7.114 8.633 -1.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 189 -8.851 7.814 0.184 1.00 0.00 H new ATOM 0 HZ2 LYS A 189 -8.625 6.685 -1.064 1.00 0.00 H new ATOM 0 HZ3 LYS A 189 -8.024 6.363 0.491 1.00 0.00 H new ATOM 905 N TYR A 190 -4.556 2.170 1.700 1.00 0.00 N ATOM 906 CA TYR A 190 -3.940 1.989 3.004 1.00 0.00 C ATOM 907 C TYR A 190 -2.466 1.601 2.865 1.00 0.00 C ATOM 908 O TYR A 190 -2.145 0.425 2.691 1.00 0.00 O ATOM 909 CB TYR A 190 -4.697 0.840 3.672 1.00 0.00 C ATOM 910 CG TYR A 190 -5.062 1.103 5.135 1.00 0.00 C ATOM 911 CD1 TYR A 190 -6.175 1.859 5.444 1.00 0.00 C ATOM 912 CD2 TYR A 190 -4.279 0.585 6.146 1.00 0.00 C ATOM 913 CE1 TYR A 190 -6.518 2.107 6.820 1.00 0.00 C ATOM 914 CE2 TYR A 190 -4.622 0.833 7.522 1.00 0.00 C ATOM 915 CZ TYR A 190 -5.725 1.581 7.791 1.00 0.00 C ATOM 916 OH TYR A 190 -6.050 1.815 9.091 1.00 0.00 O ATOM 0 H TYR A 190 -4.544 1.342 1.104 1.00 0.00 H new ATOM 0 HA TYR A 190 -3.986 2.912 3.582 1.00 0.00 H new ATOM 0 HB2 TYR A 190 -5.610 0.645 3.110 1.00 0.00 H new ATOM 0 HB3 TYR A 190 -4.089 -0.063 3.616 1.00 0.00 H new ATOM 0 HD1 TYR A 190 -6.789 2.265 4.653 1.00 0.00 H new ATOM 0 HD2 TYR A 190 -3.408 -0.007 5.905 1.00 0.00 H new ATOM 0 HE1 TYR A 190 -7.386 2.697 7.075 1.00 0.00 H new ATOM 0 HE2 TYR A 190 -4.017 0.434 8.323 1.00 0.00 H new ATOM 0 HH TYR A 190 -5.396 1.378 9.675 1.00 0.00 H new