USER MOD reduce.3.24.130724 H: found=0, std=0, add=386, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 374 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 115 CYS SG : rot 114:sc= 0.805 USER MOD Set 1.2: A 117 HIS :FLIP no HD1:sc= -0.608 F(o=-25,f=-23) USER MOD Set 1.3: A 118 CYS SG : rot -57:sc= -4.77! USER MOD Set 1.4: A 140 HIS : no HE2:sc= -16.2! C(o=-23!,f=-29!) USER MOD Set 1.5: A 143 CYS SG : rot -98:sc= -1.79! USER MOD Set 2.1: A 107 HIS : no HE2:sc= 0.133 K(o=-5.4,f=-8.3!) USER MOD Set 2.2: A 109 TYR OH : rot 167:sc= -5.51! USER MOD Set 3.1: A 102 HIS : no HE2:sc= -3.12 K(o=-6.7,f=-11) USER MOD Set 3.2: A 132 CYS SG : rot 179:sc= 1.07! USER MOD Set 3.3: A 135 CYS SG : rot -54:sc= -4.68! USER MOD Set 3.4: A 137 MET CE :methyl -168:sc= -0.105 (180deg=-0.694) USER MOD Set 3.5: A 151 CYS SG : rot 57:sc= 0.0902 USER MOD Single : A 103 LYS NZ :NH3+ 143:sc= -1.12 (180deg=-1.75) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 110 SER OG : rot 180:sc= 0 USER MOD Single : A 111 SER OG : rot 36:sc= 0.926 USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 120 SER OG : rot 90:sc= 0.164 USER MOD Single : A 123 TYR OH : rot 180:sc= 0 USER MOD Single : A 127 HIS : no HD1:sc= -0.18 X(o=-0.18,f=-0.035) USER MOD Single : A 128 GLN : amide:sc= -4.82! C(o=-4.8!,f=-4.5!) USER MOD Single : A 130 MET CE :methyl -138:sc= -4.05! (180deg=-7.35!) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 133 SER OG : rot -39:sc= 0.827 USER MOD Single : A 134 CYS SG : rot 180:sc= 0 USER MOD Single : A 138 ASN : amide:sc= -1.61 K(o=-1.6,f=-2.6) USER MOD Single : A 146 SER OG : rot 180:sc= 0 USER MOD Single : A 149 SER OG : rot 180:sc= -0.444 USER MOD ----------------------------------------------------------------- ATOM 132 N HIS A 102 -5.684 2.502 -3.549 1.00 0.00 N ATOM 133 CA HIS A 102 -4.987 2.017 -2.323 1.00 0.00 C ATOM 134 C HIS A 102 -4.706 3.196 -1.393 1.00 0.00 C ATOM 135 O HIS A 102 -4.911 4.342 -1.741 1.00 0.00 O ATOM 136 CB HIS A 102 -3.658 1.366 -2.713 1.00 0.00 C ATOM 137 CG HIS A 102 -3.895 -0.039 -3.192 1.00 0.00 C ATOM 138 ND1 HIS A 102 -4.538 -0.992 -2.415 1.00 0.00 N ATOM 139 CD2 HIS A 102 -3.575 -0.668 -4.369 1.00 0.00 C ATOM 140 CE1 HIS A 102 -4.585 -2.131 -3.130 1.00 0.00 C ATOM 141 NE2 HIS A 102 -4.012 -1.990 -4.328 1.00 0.00 N ATOM 0 HA HIS A 102 -5.621 1.289 -1.816 1.00 0.00 H new ATOM 0 HB2 HIS A 102 -3.174 1.949 -3.496 1.00 0.00 H new ATOM 0 HB3 HIS A 102 -2.982 1.358 -1.858 1.00 0.00 H new ATOM 0 HD1 HIS A 102 -4.907 -0.854 -1.474 1.00 0.00 H new ATOM 0 HD2 HIS A 102 -3.062 -0.208 -5.201 1.00 0.00 H new ATOM 0 HE1 HIS A 102 -5.032 -3.049 -2.777 1.00 0.00 H new ATOM 148 N LYS A 103 -4.221 2.920 -0.215 1.00 0.00 N ATOM 149 CA LYS A 103 -3.905 4.010 0.744 1.00 0.00 C ATOM 150 C LYS A 103 -2.532 3.736 1.354 1.00 0.00 C ATOM 151 O LYS A 103 -2.326 3.882 2.543 1.00 0.00 O ATOM 152 CB LYS A 103 -4.962 4.045 1.851 1.00 0.00 C ATOM 153 CG LYS A 103 -5.134 5.481 2.349 1.00 0.00 C ATOM 154 CD LYS A 103 -6.332 5.554 3.299 1.00 0.00 C ATOM 155 CE LYS A 103 -6.032 6.546 4.425 1.00 0.00 C ATOM 156 NZ LYS A 103 -5.449 7.790 3.849 1.00 0.00 N ATOM 0 H LYS A 103 -4.029 1.978 0.125 1.00 0.00 H new ATOM 0 HA LYS A 103 -3.901 4.971 0.229 1.00 0.00 H new ATOM 0 HB2 LYS A 103 -5.911 3.664 1.474 1.00 0.00 H new ATOM 0 HB3 LYS A 103 -4.663 3.397 2.675 1.00 0.00 H new ATOM 0 HG2 LYS A 103 -4.230 5.810 2.861 1.00 0.00 H new ATOM 0 HG3 LYS A 103 -5.285 6.154 1.505 1.00 0.00 H new ATOM 0 HD2 LYS A 103 -7.223 5.865 2.754 1.00 0.00 H new ATOM 0 HD3 LYS A 103 -6.540 4.568 3.715 1.00 0.00 H new ATOM 0 HE2 LYS A 103 -6.946 6.779 4.972 1.00 0.00 H new ATOM 0 HE3 LYS A 103 -5.338 6.103 5.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 -5.800 8.615 4.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 -4.412 7.751 3.917 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 -5.727 7.874 2.850 1.00 0.00 H new ATOM 170 N PHE A 104 -1.591 3.329 0.545 1.00 0.00 N ATOM 171 CA PHE A 104 -0.229 3.035 1.083 1.00 0.00 C ATOM 172 C PHE A 104 0.518 4.341 1.339 1.00 0.00 C ATOM 173 O PHE A 104 0.607 5.201 0.486 1.00 0.00 O ATOM 174 CB PHE A 104 0.582 2.163 0.107 1.00 0.00 C ATOM 175 CG PHE A 104 0.044 2.276 -1.302 1.00 0.00 C ATOM 176 CD1 PHE A 104 0.011 3.521 -1.946 1.00 0.00 C ATOM 177 CD2 PHE A 104 -0.415 1.131 -1.968 1.00 0.00 C ATOM 178 CE1 PHE A 104 -0.484 3.618 -3.254 1.00 0.00 C ATOM 179 CE2 PHE A 104 -0.910 1.230 -3.275 1.00 0.00 C ATOM 180 CZ PHE A 104 -0.944 2.473 -3.918 1.00 0.00 C ATOM 0 H PHE A 104 -1.704 3.188 -0.459 1.00 0.00 H new ATOM 0 HA PHE A 104 -0.347 2.485 2.017 1.00 0.00 H new ATOM 0 HB2 PHE A 104 1.628 2.468 0.125 1.00 0.00 H new ATOM 0 HB3 PHE A 104 0.548 1.123 0.430 1.00 0.00 H new ATOM 0 HD1 PHE A 104 0.366 4.404 -1.435 1.00 0.00 H new ATOM 0 HD2 PHE A 104 -0.387 0.171 -1.473 1.00 0.00 H new ATOM 0 HE1 PHE A 104 -0.511 4.577 -3.751 1.00 0.00 H new ATOM 0 HE2 PHE A 104 -1.265 0.348 -3.786 1.00 0.00 H new ATOM 0 HZ PHE A 104 -1.325 2.549 -4.926 1.00 0.00 H new ATOM 190 N ARG A 105 1.060 4.491 2.517 1.00 0.00 N ATOM 191 CA ARG A 105 1.808 5.737 2.842 1.00 0.00 C ATOM 192 C ARG A 105 3.174 5.364 3.416 1.00 0.00 C ATOM 193 O ARG A 105 3.311 4.400 4.143 1.00 0.00 O ATOM 194 CB ARG A 105 1.023 6.551 3.873 1.00 0.00 C ATOM 195 CG ARG A 105 0.576 7.873 3.246 1.00 0.00 C ATOM 196 CD ARG A 105 -0.278 8.652 4.247 1.00 0.00 C ATOM 197 NE ARG A 105 -0.878 9.838 3.571 1.00 0.00 N ATOM 198 CZ ARG A 105 -2.176 9.961 3.501 1.00 0.00 C ATOM 199 NH1 ARG A 105 -2.882 9.073 2.858 1.00 0.00 N ATOM 200 NH2 ARG A 105 -2.765 10.975 4.074 1.00 0.00 N ATOM 0 H ARG A 105 1.017 3.803 3.269 1.00 0.00 H new ATOM 0 HA ARG A 105 1.940 6.333 1.939 1.00 0.00 H new ATOM 0 HB2 ARG A 105 0.155 5.986 4.214 1.00 0.00 H new ATOM 0 HB3 ARG A 105 1.643 6.743 4.749 1.00 0.00 H new ATOM 0 HG2 ARG A 105 1.446 8.463 2.958 1.00 0.00 H new ATOM 0 HG3 ARG A 105 0.006 7.682 2.337 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -1.064 8.011 4.647 1.00 0.00 H new ATOM 0 HD3 ARG A 105 0.333 8.972 5.091 1.00 0.00 H new ATOM 0 HE ARG A 105 -0.275 10.553 3.164 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -2.420 8.282 2.409 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -3.896 9.170 2.804 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -2.211 11.670 4.575 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -3.779 11.073 4.020 1.00 0.00 H new ATOM 214 N LEU A 106 4.191 6.114 3.092 1.00 0.00 N ATOM 215 CA LEU A 106 5.545 5.793 3.618 1.00 0.00 C ATOM 216 C LEU A 106 5.502 5.743 5.147 1.00 0.00 C ATOM 217 O LEU A 106 5.032 6.657 5.796 1.00 0.00 O ATOM 218 CB LEU A 106 6.538 6.866 3.163 1.00 0.00 C ATOM 219 CG LEU A 106 6.324 8.146 3.972 1.00 0.00 C ATOM 220 CD1 LEU A 106 7.300 9.223 3.494 1.00 0.00 C ATOM 221 CD2 LEU A 106 4.889 8.639 3.782 1.00 0.00 C ATOM 0 H LEU A 106 4.142 6.934 2.487 1.00 0.00 H new ATOM 0 HA LEU A 106 5.863 4.823 3.236 1.00 0.00 H new ATOM 0 HB2 LEU A 106 7.559 6.508 3.294 1.00 0.00 H new ATOM 0 HB3 LEU A 106 6.406 7.070 2.100 1.00 0.00 H new ATOM 0 HG LEU A 106 6.500 7.939 5.028 1.00 0.00 H new ATOM 0 HD11 LEU A 106 7.147 10.135 4.071 1.00 0.00 H new ATOM 0 HD12 LEU A 106 8.323 8.874 3.632 1.00 0.00 H new ATOM 0 HD13 LEU A 106 7.126 9.429 2.438 1.00 0.00 H new ATOM 0 HD21 LEU A 106 4.738 9.551 4.359 1.00 0.00 H new ATOM 0 HD22 LEU A 106 4.712 8.844 2.726 1.00 0.00 H new ATOM 0 HD23 LEU A 106 4.193 7.874 4.125 1.00 0.00 H new ATOM 233 N HIS A 107 5.990 4.682 5.724 1.00 0.00 N ATOM 234 CA HIS A 107 5.983 4.567 7.209 1.00 0.00 C ATOM 235 C HIS A 107 7.418 4.630 7.729 1.00 0.00 C ATOM 236 O HIS A 107 8.352 4.836 6.980 1.00 0.00 O ATOM 237 CB HIS A 107 5.350 3.237 7.616 1.00 0.00 C ATOM 238 CG HIS A 107 4.203 3.491 8.554 1.00 0.00 C ATOM 239 ND1 HIS A 107 3.977 2.708 9.675 1.00 0.00 N ATOM 240 CD2 HIS A 107 3.207 4.437 8.551 1.00 0.00 C ATOM 241 CE1 HIS A 107 2.885 3.192 10.295 1.00 0.00 C ATOM 242 NE2 HIS A 107 2.376 4.245 9.651 1.00 0.00 N ATOM 0 H HIS A 107 6.395 3.887 5.230 1.00 0.00 H new ATOM 0 HA HIS A 107 5.405 5.387 7.635 1.00 0.00 H new ATOM 0 HB2 HIS A 107 4.999 2.704 6.732 1.00 0.00 H new ATOM 0 HB3 HIS A 107 6.093 2.601 8.098 1.00 0.00 H new ATOM 0 HD1 HIS A 107 4.537 1.910 9.975 1.00 0.00 H new ATOM 0 HD2 HIS A 107 3.087 5.212 7.808 1.00 0.00 H new ATOM 0 HE1 HIS A 107 2.471 2.779 11.203 1.00 0.00 H new ATOM 250 N SER A 108 7.601 4.460 9.008 1.00 0.00 N ATOM 251 CA SER A 108 8.978 4.518 9.575 1.00 0.00 C ATOM 252 C SER A 108 9.291 3.220 10.325 1.00 0.00 C ATOM 253 O SER A 108 9.590 3.233 11.503 1.00 0.00 O ATOM 254 CB SER A 108 9.079 5.699 10.539 1.00 0.00 C ATOM 255 OG SER A 108 8.335 6.793 10.021 1.00 0.00 O ATOM 0 H SER A 108 6.859 4.284 9.685 1.00 0.00 H new ATOM 0 HA SER A 108 9.695 4.642 8.763 1.00 0.00 H new ATOM 0 HB2 SER A 108 8.697 5.416 11.520 1.00 0.00 H new ATOM 0 HB3 SER A 108 10.122 5.985 10.674 1.00 0.00 H new ATOM 0 HG SER A 108 8.396 7.552 10.638 1.00 0.00 H new ATOM 261 N TYR A 109 9.236 2.099 9.657 1.00 0.00 N ATOM 262 CA TYR A 109 9.546 0.813 10.345 1.00 0.00 C ATOM 263 C TYR A 109 11.048 0.746 10.627 1.00 0.00 C ATOM 264 O TYR A 109 11.796 1.631 10.264 1.00 0.00 O ATOM 265 CB TYR A 109 9.156 -0.369 9.451 1.00 0.00 C ATOM 266 CG TYR A 109 7.862 -0.074 8.733 1.00 0.00 C ATOM 267 CD1 TYR A 109 6.648 -0.105 9.432 1.00 0.00 C ATOM 268 CD2 TYR A 109 7.875 0.220 7.363 1.00 0.00 C ATOM 269 CE1 TYR A 109 5.447 0.159 8.761 1.00 0.00 C ATOM 270 CE2 TYR A 109 6.673 0.483 6.692 1.00 0.00 C ATOM 271 CZ TYR A 109 5.460 0.452 7.391 1.00 0.00 C ATOM 272 OH TYR A 109 4.276 0.710 6.730 1.00 0.00 O ATOM 0 H TYR A 109 8.991 2.018 8.670 1.00 0.00 H new ATOM 0 HA TYR A 109 8.983 0.762 11.277 1.00 0.00 H new ATOM 0 HB2 TYR A 109 9.947 -0.563 8.726 1.00 0.00 H new ATOM 0 HB3 TYR A 109 9.049 -1.271 10.054 1.00 0.00 H new ATOM 0 HD1 TYR A 109 6.638 -0.332 10.488 1.00 0.00 H new ATOM 0 HD2 TYR A 109 8.811 0.244 6.824 1.00 0.00 H new ATOM 0 HE1 TYR A 109 4.511 0.137 9.300 1.00 0.00 H new ATOM 0 HE2 TYR A 109 6.682 0.710 5.636 1.00 0.00 H new ATOM 0 HH TYR A 109 4.470 1.094 5.850 1.00 0.00 H new ATOM 282 N SER A 110 11.497 -0.301 11.262 1.00 0.00 N ATOM 283 CA SER A 110 12.953 -0.424 11.551 1.00 0.00 C ATOM 284 C SER A 110 13.697 -0.725 10.248 1.00 0.00 C ATOM 285 O SER A 110 14.905 -0.622 10.170 1.00 0.00 O ATOM 286 CB SER A 110 13.184 -1.562 12.547 1.00 0.00 C ATOM 287 OG SER A 110 13.472 -2.758 11.834 1.00 0.00 O ATOM 0 H SER A 110 10.920 -1.075 11.592 1.00 0.00 H new ATOM 0 HA SER A 110 13.323 0.508 11.979 1.00 0.00 H new ATOM 0 HB2 SER A 110 14.010 -1.315 13.214 1.00 0.00 H new ATOM 0 HB3 SER A 110 12.301 -1.700 13.170 1.00 0.00 H new ATOM 0 HG SER A 110 13.622 -3.489 12.469 1.00 0.00 H new ATOM 293 N SER A 111 12.977 -1.095 9.222 1.00 0.00 N ATOM 294 CA SER A 111 13.626 -1.403 7.918 1.00 0.00 C ATOM 295 C SER A 111 12.566 -1.375 6.814 1.00 0.00 C ATOM 296 O SER A 111 11.384 -1.378 7.096 1.00 0.00 O ATOM 297 CB SER A 111 14.262 -2.793 7.983 1.00 0.00 C ATOM 298 OG SER A 111 15.602 -2.675 8.441 1.00 0.00 O ATOM 0 H SER A 111 11.962 -1.197 9.233 1.00 0.00 H new ATOM 0 HA SER A 111 14.398 -0.663 7.705 1.00 0.00 H new ATOM 0 HB2 SER A 111 13.692 -3.436 8.654 1.00 0.00 H new ATOM 0 HB3 SER A 111 14.242 -3.261 6.999 1.00 0.00 H new ATOM 0 HG SER A 111 15.656 -1.965 9.114 1.00 0.00 H new ATOM 304 N PRO A 112 13.019 -1.345 5.588 1.00 0.00 N ATOM 305 CA PRO A 112 12.126 -1.313 4.418 1.00 0.00 C ATOM 306 C PRO A 112 11.537 -2.699 4.150 1.00 0.00 C ATOM 307 O PRO A 112 12.217 -3.702 4.229 1.00 0.00 O ATOM 308 CB PRO A 112 13.044 -0.868 3.276 1.00 0.00 C ATOM 309 CG PRO A 112 14.487 -1.209 3.716 1.00 0.00 C ATOM 310 CD PRO A 112 14.458 -1.342 5.252 1.00 0.00 C ATOM 0 HA PRO A 112 11.271 -0.650 4.549 1.00 0.00 H new ATOM 0 HB2 PRO A 112 12.789 -1.383 2.350 1.00 0.00 H new ATOM 0 HB3 PRO A 112 12.938 0.200 3.087 1.00 0.00 H new ATOM 0 HG2 PRO A 112 14.825 -2.136 3.253 1.00 0.00 H new ATOM 0 HG3 PRO A 112 15.181 -0.427 3.408 1.00 0.00 H new ATOM 0 HD2 PRO A 112 14.946 -2.259 5.582 1.00 0.00 H new ATOM 0 HD3 PRO A 112 14.978 -0.514 5.733 1.00 0.00 H new ATOM 318 N THR A 113 10.272 -2.758 3.834 1.00 0.00 N ATOM 319 CA THR A 113 9.628 -4.072 3.558 1.00 0.00 C ATOM 320 C THR A 113 9.770 -4.394 2.075 1.00 0.00 C ATOM 321 O THR A 113 10.304 -3.618 1.309 1.00 0.00 O ATOM 322 CB THR A 113 8.145 -4.001 3.927 1.00 0.00 C ATOM 323 OG1 THR A 113 7.969 -3.077 4.993 1.00 0.00 O ATOM 324 CG2 THR A 113 7.659 -5.384 4.363 1.00 0.00 C ATOM 0 H THR A 113 9.655 -1.949 3.755 1.00 0.00 H new ATOM 0 HA THR A 113 10.109 -4.850 4.151 1.00 0.00 H new ATOM 0 HB THR A 113 7.569 -3.673 3.061 1.00 0.00 H new ATOM 0 HG1 THR A 113 7.019 -3.028 5.230 1.00 0.00 H new ATOM 0 HG21 THR A 113 6.602 -5.332 4.626 1.00 0.00 H new ATOM 0 HG22 THR A 113 7.795 -6.092 3.546 1.00 0.00 H new ATOM 0 HG23 THR A 113 8.232 -5.715 5.229 1.00 0.00 H new ATOM 332 N PHE A 114 9.303 -5.535 1.662 1.00 0.00 N ATOM 333 CA PHE A 114 9.423 -5.905 0.225 1.00 0.00 C ATOM 334 C PHE A 114 8.344 -5.188 -0.586 1.00 0.00 C ATOM 335 O PHE A 114 7.413 -4.625 -0.045 1.00 0.00 O ATOM 336 CB PHE A 114 9.248 -7.418 0.067 1.00 0.00 C ATOM 337 CG PHE A 114 10.210 -8.140 0.978 1.00 0.00 C ATOM 338 CD1 PHE A 114 11.505 -7.641 1.165 1.00 0.00 C ATOM 339 CD2 PHE A 114 9.808 -9.310 1.636 1.00 0.00 C ATOM 340 CE1 PHE A 114 12.400 -8.313 2.009 1.00 0.00 C ATOM 341 CE2 PHE A 114 10.702 -9.981 2.480 1.00 0.00 C ATOM 342 CZ PHE A 114 11.997 -9.483 2.668 1.00 0.00 C ATOM 0 H PHE A 114 8.844 -6.227 2.254 1.00 0.00 H new ATOM 0 HA PHE A 114 10.408 -5.609 -0.137 1.00 0.00 H new ATOM 0 HB2 PHE A 114 8.223 -7.702 0.306 1.00 0.00 H new ATOM 0 HB3 PHE A 114 9.426 -7.708 -0.969 1.00 0.00 H new ATOM 0 HD1 PHE A 114 11.814 -6.738 0.659 1.00 0.00 H new ATOM 0 HD2 PHE A 114 8.809 -9.694 1.492 1.00 0.00 H new ATOM 0 HE1 PHE A 114 13.400 -7.930 2.152 1.00 0.00 H new ATOM 0 HE2 PHE A 114 10.392 -10.883 2.986 1.00 0.00 H new ATOM 0 HZ PHE A 114 12.685 -10.000 3.320 1.00 0.00 H new ATOM 352 N CYS A 115 8.468 -5.206 -1.884 1.00 0.00 N ATOM 353 CA CYS A 115 7.461 -4.529 -2.746 1.00 0.00 C ATOM 354 C CYS A 115 6.515 -5.580 -3.331 1.00 0.00 C ATOM 355 O CYS A 115 6.910 -6.688 -3.632 1.00 0.00 O ATOM 356 CB CYS A 115 8.192 -3.788 -3.866 1.00 0.00 C ATOM 357 SG CYS A 115 7.001 -3.012 -4.983 1.00 0.00 S ATOM 0 H CYS A 115 9.228 -5.663 -2.387 1.00 0.00 H new ATOM 0 HA CYS A 115 6.878 -3.815 -2.164 1.00 0.00 H new ATOM 0 HB2 CYS A 115 8.850 -3.030 -3.441 1.00 0.00 H new ATOM 0 HB3 CYS A 115 8.822 -4.483 -4.421 1.00 0.00 H new ATOM 0 HG CYS A 115 7.107 -1.719 -4.900 1.00 0.00 H new ATOM 362 N ASP A 116 5.264 -5.245 -3.481 1.00 0.00 N ATOM 363 CA ASP A 116 4.286 -6.233 -4.030 1.00 0.00 C ATOM 364 C ASP A 116 4.169 -6.063 -5.546 1.00 0.00 C ATOM 365 O ASP A 116 3.709 -6.945 -6.244 1.00 0.00 O ATOM 366 CB ASP A 116 2.917 -6.007 -3.383 1.00 0.00 C ATOM 367 CG ASP A 116 2.455 -4.572 -3.645 1.00 0.00 C ATOM 368 OD1 ASP A 116 2.765 -4.054 -4.705 1.00 0.00 O ATOM 369 OD2 ASP A 116 1.800 -4.015 -2.779 1.00 0.00 O ATOM 0 H ASP A 116 4.874 -4.332 -3.248 1.00 0.00 H new ATOM 0 HA ASP A 116 4.633 -7.242 -3.809 1.00 0.00 H new ATOM 0 HB2 ASP A 116 2.192 -6.713 -3.788 1.00 0.00 H new ATOM 0 HB3 ASP A 116 2.976 -6.190 -2.310 1.00 0.00 H new ATOM 374 N HIS A 117 4.575 -4.939 -6.059 1.00 0.00 N ATOM 375 CA HIS A 117 4.482 -4.710 -7.527 1.00 0.00 C ATOM 376 C HIS A 117 5.759 -5.208 -8.211 1.00 0.00 C ATOM 377 O HIS A 117 5.751 -5.544 -9.378 1.00 0.00 O ATOM 378 CB HIS A 117 4.309 -3.214 -7.798 1.00 0.00 C ATOM 379 CG HIS A 117 4.446 -2.953 -9.273 1.00 0.00 C ATOM 380 ND1 HIS A 117 5.542 -2.715 -10.065 1.00 0.00 N flip ATOM 381 CD2 HIS A 117 3.350 -2.914 -10.121 1.00 0.00 C flip ATOM 382 CE1 HIS A 117 5.136 -2.530 -11.383 1.00 0.00 C flip ATOM 383 NE2 HIS A 117 3.806 -2.660 -11.361 1.00 0.00 N flip ATOM 0 H HIS A 117 4.969 -4.165 -5.524 1.00 0.00 H new ATOM 0 HA HIS A 117 3.626 -5.255 -7.923 1.00 0.00 H new ATOM 0 HB2 HIS A 117 3.332 -2.881 -7.448 1.00 0.00 H new ATOM 0 HB3 HIS A 117 5.057 -2.645 -7.246 1.00 0.00 H new ATOM 0 HD2 HIS A 117 2.318 -3.061 -9.838 1.00 0.00 H new ATOM 0 HE1 HIS A 117 5.761 -2.325 -12.240 1.00 0.00 H new ATOM 0 HE2 HIS A 117 3.209 -2.577 -12.184 1.00 0.00 H new ATOM 391 N CYS A 118 6.856 -5.264 -7.502 1.00 0.00 N ATOM 392 CA CYS A 118 8.114 -5.748 -8.138 1.00 0.00 C ATOM 393 C CYS A 118 8.766 -6.813 -7.251 1.00 0.00 C ATOM 394 O CYS A 118 9.816 -7.338 -7.566 1.00 0.00 O ATOM 395 CB CYS A 118 9.078 -4.574 -8.334 1.00 0.00 C ATOM 396 SG CYS A 118 9.441 -3.812 -6.735 1.00 0.00 S ATOM 0 H CYS A 118 6.934 -4.998 -6.520 1.00 0.00 H new ATOM 0 HA CYS A 118 7.881 -6.186 -9.109 1.00 0.00 H new ATOM 0 HB2 CYS A 118 10.000 -4.922 -8.800 1.00 0.00 H new ATOM 0 HB3 CYS A 118 8.638 -3.838 -9.007 1.00 0.00 H new ATOM 0 HG CYS A 118 8.331 -3.439 -6.170 1.00 0.00 H new ATOM 401 N GLY A 119 8.151 -7.143 -6.147 1.00 0.00 N ATOM 402 CA GLY A 119 8.733 -8.181 -5.248 1.00 0.00 C ATOM 403 C GLY A 119 10.203 -7.866 -4.972 1.00 0.00 C ATOM 404 O GLY A 119 11.076 -8.677 -5.209 1.00 0.00 O ATOM 0 H GLY A 119 7.270 -6.738 -5.829 1.00 0.00 H new ATOM 0 HA2 GLY A 119 8.177 -8.216 -4.311 1.00 0.00 H new ATOM 0 HA3 GLY A 119 8.643 -9.165 -5.708 1.00 0.00 H new ATOM 408 N SER A 120 10.487 -6.697 -4.466 1.00 0.00 N ATOM 409 CA SER A 120 11.906 -6.342 -4.174 1.00 0.00 C ATOM 410 C SER A 120 11.972 -5.472 -2.916 1.00 0.00 C ATOM 411 O SER A 120 11.077 -4.702 -2.632 1.00 0.00 O ATOM 412 CB SER A 120 12.493 -5.571 -5.358 1.00 0.00 C ATOM 413 OG SER A 120 12.278 -6.312 -6.551 1.00 0.00 O ATOM 0 H SER A 120 9.802 -5.975 -4.243 1.00 0.00 H new ATOM 0 HA SER A 120 12.480 -7.255 -4.012 1.00 0.00 H new ATOM 0 HB2 SER A 120 12.025 -4.590 -5.436 1.00 0.00 H new ATOM 0 HB3 SER A 120 13.559 -5.405 -5.206 1.00 0.00 H new ATOM 0 HG SER A 120 11.419 -6.054 -6.946 1.00 0.00 H new ATOM 419 N LEU A 121 13.032 -5.589 -2.159 1.00 0.00 N ATOM 420 CA LEU A 121 13.158 -4.770 -0.921 1.00 0.00 C ATOM 421 C LEU A 121 13.129 -3.284 -1.269 1.00 0.00 C ATOM 422 O LEU A 121 13.738 -2.842 -2.224 1.00 0.00 O ATOM 423 CB LEU A 121 14.479 -5.091 -0.218 1.00 0.00 C ATOM 424 CG LEU A 121 14.257 -6.200 0.809 1.00 0.00 C ATOM 425 CD1 LEU A 121 15.605 -6.810 1.199 1.00 0.00 C ATOM 426 CD2 LEU A 121 13.585 -5.606 2.051 1.00 0.00 C ATOM 0 H LEU A 121 13.814 -6.216 -2.346 1.00 0.00 H new ATOM 0 HA LEU A 121 12.323 -5.005 -0.262 1.00 0.00 H new ATOM 0 HB2 LEU A 121 15.225 -5.403 -0.949 1.00 0.00 H new ATOM 0 HB3 LEU A 121 14.867 -4.199 0.273 1.00 0.00 H new ATOM 0 HG LEU A 121 13.620 -6.975 0.383 1.00 0.00 H new ATOM 0 HD11 LEU A 121 15.448 -7.601 1.932 1.00 0.00 H new ATOM 0 HD12 LEU A 121 16.086 -7.226 0.314 1.00 0.00 H new ATOM 0 HD13 LEU A 121 16.243 -6.038 1.630 1.00 0.00 H new ATOM 0 HD21 LEU A 121 13.423 -6.392 2.788 1.00 0.00 H new ATOM 0 HD22 LEU A 121 14.226 -4.834 2.478 1.00 0.00 H new ATOM 0 HD23 LEU A 121 12.627 -5.168 1.772 1.00 0.00 H new ATOM 438 N LEU A 122 12.429 -2.508 -0.491 1.00 0.00 N ATOM 439 CA LEU A 122 12.360 -1.046 -0.758 1.00 0.00 C ATOM 440 C LEU A 122 13.691 -0.402 -0.365 1.00 0.00 C ATOM 441 O LEU A 122 13.919 -0.071 0.782 1.00 0.00 O ATOM 442 CB LEU A 122 11.225 -0.432 0.065 1.00 0.00 C ATOM 443 CG LEU A 122 9.921 -1.173 -0.236 1.00 0.00 C ATOM 444 CD1 LEU A 122 9.014 -1.142 0.995 1.00 0.00 C ATOM 445 CD2 LEU A 122 9.209 -0.494 -1.407 1.00 0.00 C ATOM 0 H LEU A 122 11.900 -2.825 0.321 1.00 0.00 H new ATOM 0 HA LEU A 122 12.170 -0.871 -1.817 1.00 0.00 H new ATOM 0 HB2 LEU A 122 11.456 -0.497 1.128 1.00 0.00 H new ATOM 0 HB3 LEU A 122 11.119 0.626 -0.174 1.00 0.00 H new ATOM 0 HG LEU A 122 10.146 -2.208 -0.494 1.00 0.00 H new ATOM 0 HD11 LEU A 122 8.086 -1.671 0.777 1.00 0.00 H new ATOM 0 HD12 LEU A 122 9.519 -1.625 1.831 1.00 0.00 H new ATOM 0 HD13 LEU A 122 8.789 -0.108 1.256 1.00 0.00 H new ATOM 0 HD21 LEU A 122 8.280 -1.021 -1.623 1.00 0.00 H new ATOM 0 HD22 LEU A 122 8.987 0.541 -1.147 1.00 0.00 H new ATOM 0 HD23 LEU A 122 9.852 -0.518 -2.287 1.00 0.00 H new ATOM 457 N TYR A 123 14.574 -0.228 -1.311 1.00 0.00 N ATOM 458 CA TYR A 123 15.896 0.387 -0.999 1.00 0.00 C ATOM 459 C TYR A 123 15.688 1.742 -0.321 1.00 0.00 C ATOM 460 O TYR A 123 14.607 2.063 0.134 1.00 0.00 O ATOM 461 CB TYR A 123 16.684 0.584 -2.296 1.00 0.00 C ATOM 462 CG TYR A 123 16.873 -0.749 -2.979 1.00 0.00 C ATOM 463 CD1 TYR A 123 15.887 -1.237 -3.847 1.00 0.00 C ATOM 464 CD2 TYR A 123 18.034 -1.498 -2.744 1.00 0.00 C ATOM 465 CE1 TYR A 123 16.063 -2.474 -4.482 1.00 0.00 C ATOM 466 CE2 TYR A 123 18.208 -2.735 -3.378 1.00 0.00 C ATOM 467 CZ TYR A 123 17.223 -3.223 -4.247 1.00 0.00 C ATOM 468 OH TYR A 123 17.396 -4.441 -4.871 1.00 0.00 O ATOM 0 H TYR A 123 14.436 -0.486 -2.288 1.00 0.00 H new ATOM 0 HA TYR A 123 16.450 -0.271 -0.329 1.00 0.00 H new ATOM 0 HB2 TYR A 123 16.153 1.270 -2.956 1.00 0.00 H new ATOM 0 HB3 TYR A 123 17.653 1.035 -2.080 1.00 0.00 H new ATOM 0 HD1 TYR A 123 14.992 -0.660 -4.027 1.00 0.00 H new ATOM 0 HD2 TYR A 123 18.794 -1.122 -2.075 1.00 0.00 H new ATOM 0 HE1 TYR A 123 15.304 -2.850 -5.152 1.00 0.00 H new ATOM 0 HE2 TYR A 123 19.102 -3.313 -3.197 1.00 0.00 H new ATOM 0 HH TYR A 123 18.254 -4.829 -4.600 1.00 0.00 H new ATOM 478 N GLY A 124 16.717 2.542 -0.251 1.00 0.00 N ATOM 479 CA GLY A 124 16.583 3.878 0.395 1.00 0.00 C ATOM 480 C GLY A 124 15.584 4.729 -0.391 1.00 0.00 C ATOM 481 O GLY A 124 15.154 5.772 0.061 1.00 0.00 O ATOM 0 H GLY A 124 17.646 2.327 -0.614 1.00 0.00 H new ATOM 0 HA2 GLY A 124 16.247 3.763 1.425 1.00 0.00 H new ATOM 0 HA3 GLY A 124 17.552 4.376 0.430 1.00 0.00 H new ATOM 485 N LEU A 125 15.211 4.292 -1.564 1.00 0.00 N ATOM 486 CA LEU A 125 14.240 5.075 -2.379 1.00 0.00 C ATOM 487 C LEU A 125 13.112 5.586 -1.480 1.00 0.00 C ATOM 488 O LEU A 125 12.498 6.598 -1.756 1.00 0.00 O ATOM 489 CB LEU A 125 13.655 4.179 -3.472 1.00 0.00 C ATOM 490 CG LEU A 125 14.526 4.272 -4.726 1.00 0.00 C ATOM 491 CD1 LEU A 125 14.210 3.100 -5.656 1.00 0.00 C ATOM 492 CD2 LEU A 125 14.237 5.589 -5.449 1.00 0.00 C ATOM 0 H LEU A 125 15.538 3.426 -1.993 1.00 0.00 H new ATOM 0 HA LEU A 125 14.750 5.923 -2.837 1.00 0.00 H new ATOM 0 HB2 LEU A 125 13.607 3.147 -3.125 1.00 0.00 H new ATOM 0 HB3 LEU A 125 12.634 4.486 -3.701 1.00 0.00 H new ATOM 0 HG LEU A 125 15.578 4.235 -4.442 1.00 0.00 H new ATOM 0 HD11 LEU A 125 14.831 3.167 -6.549 1.00 0.00 H new ATOM 0 HD12 LEU A 125 14.415 2.161 -5.141 1.00 0.00 H new ATOM 0 HD13 LEU A 125 13.159 3.135 -5.941 1.00 0.00 H new ATOM 0 HD21 LEU A 125 14.857 5.657 -6.343 1.00 0.00 H new ATOM 0 HD22 LEU A 125 13.185 5.625 -5.733 1.00 0.00 H new ATOM 0 HD23 LEU A 125 14.463 6.425 -4.787 1.00 0.00 H new ATOM 504 N VAL A 126 12.834 4.897 -0.407 1.00 0.00 N ATOM 505 CA VAL A 126 11.745 5.349 0.504 1.00 0.00 C ATOM 506 C VAL A 126 12.207 5.218 1.956 1.00 0.00 C ATOM 507 O VAL A 126 12.900 4.286 2.313 1.00 0.00 O ATOM 508 CB VAL A 126 10.503 4.483 0.285 1.00 0.00 C ATOM 509 CG1 VAL A 126 9.945 4.736 -1.117 1.00 0.00 C ATOM 510 CG2 VAL A 126 10.882 3.007 0.423 1.00 0.00 C ATOM 0 H VAL A 126 13.313 4.043 -0.122 1.00 0.00 H new ATOM 0 HA VAL A 126 11.504 6.391 0.291 1.00 0.00 H new ATOM 0 HB VAL A 126 9.747 4.737 1.028 1.00 0.00 H new ATOM 0 HG11 VAL A 126 9.060 4.119 -1.273 1.00 0.00 H new ATOM 0 HG12 VAL A 126 9.677 5.788 -1.217 1.00 0.00 H new ATOM 0 HG13 VAL A 126 10.700 4.482 -1.861 1.00 0.00 H new ATOM 0 HG21 VAL A 126 9.998 2.388 0.267 1.00 0.00 H new ATOM 0 HG22 VAL A 126 11.638 2.754 -0.321 1.00 0.00 H new ATOM 0 HG23 VAL A 126 11.281 2.825 1.421 1.00 0.00 H new ATOM 520 N HIS A 127 11.827 6.142 2.796 1.00 0.00 N ATOM 521 CA HIS A 127 12.244 6.065 4.224 1.00 0.00 C ATOM 522 C HIS A 127 12.077 4.629 4.722 1.00 0.00 C ATOM 523 O HIS A 127 12.760 4.191 5.627 1.00 0.00 O ATOM 524 CB HIS A 127 11.371 7.001 5.062 1.00 0.00 C ATOM 525 CG HIS A 127 12.030 7.246 6.391 1.00 0.00 C ATOM 526 ND1 HIS A 127 11.309 7.601 7.520 1.00 0.00 N ATOM 527 CD2 HIS A 127 13.343 7.188 6.787 1.00 0.00 C ATOM 528 CE1 HIS A 127 12.185 7.743 8.532 1.00 0.00 C ATOM 529 NE2 HIS A 127 13.438 7.504 8.139 1.00 0.00 N ATOM 0 H HIS A 127 11.247 6.946 2.555 1.00 0.00 H new ATOM 0 HA HIS A 127 13.288 6.365 4.317 1.00 0.00 H new ATOM 0 HB2 HIS A 127 11.224 7.945 4.537 1.00 0.00 H new ATOM 0 HB3 HIS A 127 10.385 6.561 5.209 1.00 0.00 H new ATOM 0 HD2 HIS A 127 14.175 6.936 6.147 1.00 0.00 H new ATOM 0 HE1 HIS A 127 11.908 8.017 9.539 1.00 0.00 H new ATOM 0 HE2 HIS A 127 14.284 7.544 8.708 1.00 0.00 H new ATOM 537 N GLN A 128 11.174 3.892 4.135 1.00 0.00 N ATOM 538 CA GLN A 128 10.962 2.484 4.569 1.00 0.00 C ATOM 539 C GLN A 128 10.095 1.761 3.538 1.00 0.00 C ATOM 540 O GLN A 128 10.434 0.695 3.066 1.00 0.00 O ATOM 541 CB GLN A 128 10.262 2.468 5.930 1.00 0.00 C ATOM 542 CG GLN A 128 11.052 1.587 6.900 1.00 0.00 C ATOM 543 CD GLN A 128 12.319 2.323 7.340 1.00 0.00 C ATOM 544 OE1 GLN A 128 13.387 2.089 6.811 1.00 0.00 O ATOM 545 NE2 GLN A 128 12.244 3.211 8.295 1.00 0.00 N ATOM 0 H GLN A 128 10.573 4.206 3.372 1.00 0.00 H new ATOM 0 HA GLN A 128 11.924 1.979 4.653 1.00 0.00 H new ATOM 0 HB2 GLN A 128 10.185 3.482 6.323 1.00 0.00 H new ATOM 0 HB3 GLN A 128 9.245 2.089 5.824 1.00 0.00 H new ATOM 0 HG2 GLN A 128 10.440 1.344 7.768 1.00 0.00 H new ATOM 0 HG3 GLN A 128 11.314 0.644 6.421 1.00 0.00 H new ATOM 0 HE21 GLN A 128 11.347 3.408 8.739 1.00 0.00 H new ATOM 0 HE22 GLN A 128 13.082 3.708 8.596 1.00 0.00 H new ATOM 554 N GLY A 129 8.976 2.334 3.183 1.00 0.00 N ATOM 555 CA GLY A 129 8.089 1.680 2.180 1.00 0.00 C ATOM 556 C GLY A 129 6.654 2.176 2.367 1.00 0.00 C ATOM 557 O GLY A 129 6.266 2.593 3.440 1.00 0.00 O ATOM 0 H GLY A 129 8.639 3.226 3.544 1.00 0.00 H new ATOM 0 HA2 GLY A 129 8.435 1.906 1.171 1.00 0.00 H new ATOM 0 HA3 GLY A 129 8.129 0.597 2.295 1.00 0.00 H new ATOM 561 N MET A 130 5.859 2.132 1.332 1.00 0.00 N ATOM 562 CA MET A 130 4.450 2.599 1.457 1.00 0.00 C ATOM 563 C MET A 130 3.567 1.424 1.877 1.00 0.00 C ATOM 564 O MET A 130 3.512 0.408 1.211 1.00 0.00 O ATOM 565 CB MET A 130 3.969 3.145 0.110 1.00 0.00 C ATOM 566 CG MET A 130 5.133 3.830 -0.608 1.00 0.00 C ATOM 567 SD MET A 130 4.606 5.458 -1.195 1.00 0.00 S ATOM 568 CE MET A 130 5.460 6.439 0.063 1.00 0.00 C ATOM 0 H MET A 130 6.124 1.793 0.407 1.00 0.00 H new ATOM 0 HA MET A 130 4.391 3.388 2.206 1.00 0.00 H new ATOM 0 HB2 MET A 130 3.576 2.334 -0.504 1.00 0.00 H new ATOM 0 HB3 MET A 130 3.155 3.853 0.263 1.00 0.00 H new ATOM 0 HG2 MET A 130 5.982 3.933 0.068 1.00 0.00 H new ATOM 0 HG3 MET A 130 5.466 3.219 -1.447 1.00 0.00 H new ATOM 0 HE1 MET A 130 4.807 7.242 0.403 1.00 0.00 H new ATOM 0 HE2 MET A 130 5.720 5.801 0.907 1.00 0.00 H new ATOM 0 HE3 MET A 130 6.368 6.866 -0.363 1.00 0.00 H new ATOM 578 N LYS A 131 2.880 1.547 2.980 1.00 0.00 N ATOM 579 CA LYS A 131 2.009 0.427 3.439 1.00 0.00 C ATOM 580 C LYS A 131 0.542 0.852 3.388 1.00 0.00 C ATOM 581 O LYS A 131 0.157 1.859 3.950 1.00 0.00 O ATOM 582 CB LYS A 131 2.377 0.053 4.873 1.00 0.00 C ATOM 583 CG LYS A 131 1.628 -1.219 5.279 1.00 0.00 C ATOM 584 CD LYS A 131 1.980 -1.580 6.722 1.00 0.00 C ATOM 585 CE LYS A 131 1.599 -0.421 7.646 1.00 0.00 C ATOM 586 NZ LYS A 131 1.634 -0.883 9.062 1.00 0.00 N ATOM 0 H LYS A 131 2.884 2.371 3.581 1.00 0.00 H new ATOM 0 HA LYS A 131 2.157 -0.432 2.784 1.00 0.00 H new ATOM 0 HB2 LYS A 131 3.453 -0.104 4.954 1.00 0.00 H new ATOM 0 HB3 LYS A 131 2.122 0.869 5.549 1.00 0.00 H new ATOM 0 HG2 LYS A 131 0.553 -1.067 5.183 1.00 0.00 H new ATOM 0 HG3 LYS A 131 1.895 -2.039 4.612 1.00 0.00 H new ATOM 0 HD2 LYS A 131 1.452 -2.486 7.021 1.00 0.00 H new ATOM 0 HD3 LYS A 131 3.046 -1.790 6.806 1.00 0.00 H new ATOM 0 HE2 LYS A 131 2.289 0.411 7.507 1.00 0.00 H new ATOM 0 HE3 LYS A 131 0.603 -0.055 7.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 1.375 -0.096 9.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 0.959 -1.664 9.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 2.592 -1.212 9.296 1.00 0.00 H new ATOM 600 N CYS A 132 -0.280 0.089 2.723 1.00 0.00 N ATOM 601 CA CYS A 132 -1.725 0.446 2.639 1.00 0.00 C ATOM 602 C CYS A 132 -2.360 0.309 4.024 1.00 0.00 C ATOM 603 O CYS A 132 -2.384 -0.757 4.605 1.00 0.00 O ATOM 604 CB CYS A 132 -2.428 -0.488 1.652 1.00 0.00 C ATOM 605 SG CYS A 132 -4.172 -0.027 1.514 1.00 0.00 S ATOM 0 H CYS A 132 -0.015 -0.766 2.234 1.00 0.00 H new ATOM 0 HA CYS A 132 -1.829 1.474 2.293 1.00 0.00 H new ATOM 0 HB2 CYS A 132 -1.948 -0.429 0.675 1.00 0.00 H new ATOM 0 HB3 CYS A 132 -2.340 -1.521 1.988 1.00 0.00 H new ATOM 0 HG CYS A 132 -4.761 -0.808 0.658 1.00 0.00 H new ATOM 610 N SER A 133 -2.870 1.385 4.560 1.00 0.00 N ATOM 611 CA SER A 133 -3.494 1.322 5.913 1.00 0.00 C ATOM 612 C SER A 133 -4.961 0.904 5.786 1.00 0.00 C ATOM 613 O SER A 133 -5.745 1.072 6.701 1.00 0.00 O ATOM 614 CB SER A 133 -3.412 2.697 6.576 1.00 0.00 C ATOM 615 OG SER A 133 -3.902 2.608 7.907 1.00 0.00 O ATOM 0 H SER A 133 -2.881 2.305 4.119 1.00 0.00 H new ATOM 0 HA SER A 133 -2.962 0.591 6.522 1.00 0.00 H new ATOM 0 HB2 SER A 133 -2.381 3.051 6.579 1.00 0.00 H new ATOM 0 HB3 SER A 133 -3.996 3.422 6.009 1.00 0.00 H new ATOM 0 HG SER A 133 -4.676 2.007 7.931 1.00 0.00 H new ATOM 621 N CYS A 134 -5.341 0.369 4.661 1.00 0.00 N ATOM 622 CA CYS A 134 -6.759 -0.053 4.478 1.00 0.00 C ATOM 623 C CYS A 134 -6.819 -1.502 3.981 1.00 0.00 C ATOM 624 O CYS A 134 -7.848 -2.145 4.055 1.00 0.00 O ATOM 625 CB CYS A 134 -7.432 0.862 3.454 1.00 0.00 C ATOM 626 SG CYS A 134 -8.819 1.724 4.235 1.00 0.00 S ATOM 0 H CYS A 134 -4.732 0.205 3.859 1.00 0.00 H new ATOM 0 HA CYS A 134 -7.277 0.017 5.434 1.00 0.00 H new ATOM 0 HB2 CYS A 134 -6.713 1.584 3.067 1.00 0.00 H new ATOM 0 HB3 CYS A 134 -7.785 0.277 2.605 1.00 0.00 H new ATOM 0 HG CYS A 134 -9.390 2.504 3.366 1.00 0.00 H new ATOM 632 N CYS A 135 -5.735 -2.022 3.471 1.00 0.00 N ATOM 633 CA CYS A 135 -5.758 -3.425 2.969 1.00 0.00 C ATOM 634 C CYS A 135 -4.432 -4.125 3.292 1.00 0.00 C ATOM 635 O CYS A 135 -4.193 -5.238 2.867 1.00 0.00 O ATOM 636 CB CYS A 135 -5.972 -3.417 1.453 1.00 0.00 C ATOM 637 SG CYS A 135 -4.482 -2.794 0.633 1.00 0.00 S ATOM 0 H CYS A 135 -4.841 -1.540 3.381 1.00 0.00 H new ATOM 0 HA CYS A 135 -6.571 -3.964 3.455 1.00 0.00 H new ATOM 0 HB2 CYS A 135 -6.199 -4.424 1.102 1.00 0.00 H new ATOM 0 HB3 CYS A 135 -6.828 -2.791 1.200 1.00 0.00 H new ATOM 0 HG CYS A 135 -4.160 -1.640 1.137 1.00 0.00 H new ATOM 642 N GLU A 136 -3.566 -3.489 4.034 1.00 0.00 N ATOM 643 CA GLU A 136 -2.265 -4.135 4.364 1.00 0.00 C ATOM 644 C GLU A 136 -1.512 -4.423 3.065 1.00 0.00 C ATOM 645 O GLU A 136 -1.439 -5.548 2.613 1.00 0.00 O ATOM 646 CB GLU A 136 -2.519 -5.446 5.110 1.00 0.00 C ATOM 647 CG GLU A 136 -2.707 -5.159 6.601 1.00 0.00 C ATOM 648 CD GLU A 136 -2.523 -6.452 7.398 1.00 0.00 C ATOM 649 OE1 GLU A 136 -2.764 -7.509 6.838 1.00 0.00 O ATOM 650 OE2 GLU A 136 -2.144 -6.363 8.555 1.00 0.00 O ATOM 0 H GLU A 136 -3.702 -2.556 4.423 1.00 0.00 H new ATOM 0 HA GLU A 136 -1.673 -3.473 4.996 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -3.405 -5.938 4.709 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -1.681 -6.128 4.963 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -1.987 -4.410 6.931 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -3.700 -4.747 6.780 1.00 0.00 H new ATOM 657 N MET A 137 -0.960 -3.411 2.456 1.00 0.00 N ATOM 658 CA MET A 137 -0.222 -3.619 1.179 1.00 0.00 C ATOM 659 C MET A 137 1.168 -2.986 1.280 1.00 0.00 C ATOM 660 O MET A 137 1.497 -2.339 2.253 1.00 0.00 O ATOM 661 CB MET A 137 -1.000 -2.964 0.036 1.00 0.00 C ATOM 662 CG MET A 137 -0.494 -3.493 -1.306 1.00 0.00 C ATOM 663 SD MET A 137 -1.860 -3.522 -2.493 1.00 0.00 S ATOM 664 CE MET A 137 -0.875 -3.242 -3.985 1.00 0.00 C ATOM 0 H MET A 137 -0.988 -2.447 2.788 1.00 0.00 H new ATOM 0 HA MET A 137 -0.118 -4.687 0.987 1.00 0.00 H new ATOM 0 HB2 MET A 137 -2.064 -3.174 0.142 1.00 0.00 H new ATOM 0 HB3 MET A 137 -0.883 -1.881 0.078 1.00 0.00 H new ATOM 0 HG2 MET A 137 0.312 -2.861 -1.678 1.00 0.00 H new ATOM 0 HG3 MET A 137 -0.083 -4.495 -1.183 1.00 0.00 H new ATOM 0 HE1 MET A 137 -1.537 -3.011 -4.820 1.00 0.00 H new ATOM 0 HE2 MET A 137 -0.194 -2.407 -3.820 1.00 0.00 H new ATOM 0 HE3 MET A 137 -0.300 -4.139 -4.215 1.00 0.00 H new ATOM 674 N ASN A 138 1.983 -3.166 0.277 1.00 0.00 N ATOM 675 CA ASN A 138 3.350 -2.574 0.309 1.00 0.00 C ATOM 676 C ASN A 138 3.794 -2.259 -1.120 1.00 0.00 C ATOM 677 O ASN A 138 3.804 -3.118 -1.979 1.00 0.00 O ATOM 678 CB ASN A 138 4.326 -3.571 0.938 1.00 0.00 C ATOM 679 CG ASN A 138 3.912 -3.850 2.383 1.00 0.00 C ATOM 680 OD1 ASN A 138 3.818 -2.943 3.186 1.00 0.00 O ATOM 681 ND2 ASN A 138 3.659 -5.076 2.752 1.00 0.00 N ATOM 0 H ASN A 138 1.761 -3.698 -0.564 1.00 0.00 H new ATOM 0 HA ASN A 138 3.338 -1.659 0.901 1.00 0.00 H new ATOM 0 HB2 ASN A 138 4.334 -4.499 0.366 1.00 0.00 H new ATOM 0 HB3 ASN A 138 5.339 -3.171 0.910 1.00 0.00 H new ATOM 0 HD21 ASN A 138 3.383 -5.272 3.714 1.00 0.00 H new ATOM 0 HD22 ASN A 138 3.738 -5.838 2.078 1.00 0.00 H new ATOM 688 N VAL A 139 4.157 -1.035 -1.388 1.00 0.00 N ATOM 689 CA VAL A 139 4.591 -0.675 -2.767 1.00 0.00 C ATOM 690 C VAL A 139 5.748 0.326 -2.704 1.00 0.00 C ATOM 691 O VAL A 139 6.010 0.927 -1.680 1.00 0.00 O ATOM 692 CB VAL A 139 3.417 -0.048 -3.521 1.00 0.00 C ATOM 693 CG1 VAL A 139 2.347 -1.110 -3.777 1.00 0.00 C ATOM 694 CG2 VAL A 139 2.820 1.083 -2.682 1.00 0.00 C ATOM 0 H VAL A 139 4.172 -0.270 -0.713 1.00 0.00 H new ATOM 0 HA VAL A 139 4.923 -1.575 -3.286 1.00 0.00 H new ATOM 0 HB VAL A 139 3.768 0.350 -4.473 1.00 0.00 H new ATOM 0 HG11 VAL A 139 1.511 -0.662 -4.314 1.00 0.00 H new ATOM 0 HG12 VAL A 139 2.771 -1.917 -4.374 1.00 0.00 H new ATOM 0 HG13 VAL A 139 1.995 -1.509 -2.826 1.00 0.00 H new ATOM 0 HG21 VAL A 139 1.983 1.531 -3.218 1.00 0.00 H new ATOM 0 HG22 VAL A 139 2.469 0.684 -1.730 1.00 0.00 H new ATOM 0 HG23 VAL A 139 3.581 1.841 -2.499 1.00 0.00 H new ATOM 704 N HIS A 140 6.436 0.511 -3.798 1.00 0.00 N ATOM 705 CA HIS A 140 7.573 1.473 -3.818 1.00 0.00 C ATOM 706 C HIS A 140 7.029 2.896 -3.967 1.00 0.00 C ATOM 707 O HIS A 140 5.835 3.120 -3.934 1.00 0.00 O ATOM 708 CB HIS A 140 8.486 1.160 -5.007 1.00 0.00 C ATOM 709 CG HIS A 140 9.493 0.114 -4.614 1.00 0.00 C ATOM 710 ND1 HIS A 140 9.454 -1.177 -5.118 1.00 0.00 N ATOM 711 CD2 HIS A 140 10.576 0.155 -3.771 1.00 0.00 C ATOM 712 CE1 HIS A 140 10.486 -1.853 -4.578 1.00 0.00 C ATOM 713 NE2 HIS A 140 11.201 -1.088 -3.751 1.00 0.00 N ATOM 0 H HIS A 140 6.258 0.035 -4.682 1.00 0.00 H new ATOM 0 HA HIS A 140 8.137 1.387 -2.889 1.00 0.00 H new ATOM 0 HB2 HIS A 140 7.892 0.808 -5.850 1.00 0.00 H new ATOM 0 HB3 HIS A 140 8.997 2.066 -5.333 1.00 0.00 H new ATOM 0 HD1 HIS A 140 8.769 -1.547 -5.777 1.00 0.00 H new ATOM 0 HD2 HIS A 140 10.894 1.020 -3.209 1.00 0.00 H new ATOM 0 HE1 HIS A 140 10.708 -2.889 -4.789 1.00 0.00 H new ATOM 720 N ARG A 141 7.893 3.857 -4.139 1.00 0.00 N ATOM 721 CA ARG A 141 7.422 5.261 -4.301 1.00 0.00 C ATOM 722 C ARG A 141 7.159 5.531 -5.782 1.00 0.00 C ATOM 723 O ARG A 141 6.400 6.410 -6.140 1.00 0.00 O ATOM 724 CB ARG A 141 8.494 6.224 -3.786 1.00 0.00 C ATOM 725 CG ARG A 141 7.975 6.947 -2.543 1.00 0.00 C ATOM 726 CD ARG A 141 8.818 8.198 -2.289 1.00 0.00 C ATOM 727 NE ARG A 141 7.928 9.324 -1.888 1.00 0.00 N ATOM 728 CZ ARG A 141 7.939 9.757 -0.657 1.00 0.00 C ATOM 729 NH1 ARG A 141 8.927 10.496 -0.234 1.00 0.00 N ATOM 730 NH2 ARG A 141 6.960 9.452 0.151 1.00 0.00 N ATOM 0 H ARG A 141 8.905 3.731 -4.174 1.00 0.00 H new ATOM 0 HA ARG A 141 6.504 5.409 -3.732 1.00 0.00 H new ATOM 0 HB2 ARG A 141 9.406 5.676 -3.547 1.00 0.00 H new ATOM 0 HB3 ARG A 141 8.750 6.947 -4.560 1.00 0.00 H new ATOM 0 HG2 ARG A 141 6.929 7.222 -2.680 1.00 0.00 H new ATOM 0 HG3 ARG A 141 8.020 6.284 -1.679 1.00 0.00 H new ATOM 0 HD2 ARG A 141 9.551 8.003 -1.506 1.00 0.00 H new ATOM 0 HD3 ARG A 141 9.375 8.463 -3.188 1.00 0.00 H new ATOM 0 HE ARG A 141 7.311 9.756 -2.575 1.00 0.00 H new ATOM 0 HH11 ARG A 141 9.691 10.736 -0.865 1.00 0.00 H new ATOM 0 HH12 ARG A 141 8.935 10.834 0.728 1.00 0.00 H new ATOM 0 HH21 ARG A 141 6.187 8.875 -0.180 1.00 0.00 H new ATOM 0 HH22 ARG A 141 6.969 9.790 1.113 1.00 0.00 H new ATOM 744 N ARG A 142 7.781 4.776 -6.646 1.00 0.00 N ATOM 745 CA ARG A 142 7.568 4.977 -8.106 1.00 0.00 C ATOM 746 C ARG A 142 6.773 3.798 -8.670 1.00 0.00 C ATOM 747 O ARG A 142 6.455 3.755 -9.842 1.00 0.00 O ATOM 748 CB ARG A 142 8.923 5.065 -8.812 1.00 0.00 C ATOM 749 CG ARG A 142 9.822 3.923 -8.333 1.00 0.00 C ATOM 750 CD ARG A 142 10.474 3.247 -9.540 1.00 0.00 C ATOM 751 NE ARG A 142 11.066 1.945 -9.121 1.00 0.00 N ATOM 752 CZ ARG A 142 12.297 1.896 -8.694 1.00 0.00 C ATOM 753 NH1 ARG A 142 13.236 2.540 -9.332 1.00 0.00 N ATOM 754 NH2 ARG A 142 12.591 1.202 -7.628 1.00 0.00 N ATOM 0 H ARG A 142 8.429 4.027 -6.402 1.00 0.00 H new ATOM 0 HA ARG A 142 7.014 5.901 -8.270 1.00 0.00 H new ATOM 0 HB2 ARG A 142 8.787 5.007 -9.892 1.00 0.00 H new ATOM 0 HB3 ARG A 142 9.393 6.025 -8.601 1.00 0.00 H new ATOM 0 HG2 ARG A 142 10.588 4.307 -7.660 1.00 0.00 H new ATOM 0 HG3 ARG A 142 9.237 3.197 -7.768 1.00 0.00 H new ATOM 0 HD2 ARG A 142 9.734 3.087 -10.324 1.00 0.00 H new ATOM 0 HD3 ARG A 142 11.247 3.892 -9.958 1.00 0.00 H new ATOM 0 HE ARG A 142 10.508 1.092 -9.168 1.00 0.00 H new ATOM 0 HH11 ARG A 142 13.007 3.082 -10.165 1.00 0.00 H new ATOM 0 HH12 ARG A 142 14.199 2.501 -8.997 1.00 0.00 H new ATOM 0 HH21 ARG A 142 11.858 0.698 -7.129 1.00 0.00 H new ATOM 0 HH22 ARG A 142 13.554 1.164 -7.294 1.00 0.00 H new ATOM 768 N CYS A 143 6.447 2.839 -7.844 1.00 0.00 N ATOM 769 CA CYS A 143 5.672 1.664 -8.334 1.00 0.00 C ATOM 770 C CYS A 143 4.175 1.949 -8.196 1.00 0.00 C ATOM 771 O CYS A 143 3.345 1.221 -8.702 1.00 0.00 O ATOM 772 CB CYS A 143 6.031 0.431 -7.502 1.00 0.00 C ATOM 773 SG CYS A 143 7.596 -0.263 -8.089 1.00 0.00 S ATOM 0 H CYS A 143 6.684 2.820 -6.852 1.00 0.00 H new ATOM 0 HA CYS A 143 5.915 1.480 -9.381 1.00 0.00 H new ATOM 0 HB2 CYS A 143 6.114 0.702 -6.449 1.00 0.00 H new ATOM 0 HB3 CYS A 143 5.240 -0.315 -7.578 1.00 0.00 H new ATOM 0 HG CYS A 143 7.356 -1.255 -8.894 1.00 0.00 H new ATOM 778 N VAL A 144 3.824 3.004 -7.512 1.00 0.00 N ATOM 779 CA VAL A 144 2.380 3.333 -7.342 1.00 0.00 C ATOM 780 C VAL A 144 1.784 3.732 -8.694 1.00 0.00 C ATOM 781 O VAL A 144 0.598 3.598 -8.924 1.00 0.00 O ATOM 782 CB VAL A 144 2.234 4.496 -6.359 1.00 0.00 C ATOM 783 CG1 VAL A 144 0.792 5.003 -6.377 1.00 0.00 C ATOM 784 CG2 VAL A 144 2.588 4.017 -4.948 1.00 0.00 C ATOM 0 H VAL A 144 4.473 3.651 -7.064 1.00 0.00 H new ATOM 0 HA VAL A 144 1.853 2.461 -6.955 1.00 0.00 H new ATOM 0 HB VAL A 144 2.906 5.304 -6.650 1.00 0.00 H new ATOM 0 HG11 VAL A 144 0.689 5.832 -5.676 1.00 0.00 H new ATOM 0 HG12 VAL A 144 0.538 5.343 -7.381 1.00 0.00 H new ATOM 0 HG13 VAL A 144 0.119 4.196 -6.086 1.00 0.00 H new ATOM 0 HG21 VAL A 144 2.485 4.845 -4.246 1.00 0.00 H new ATOM 0 HG22 VAL A 144 1.916 3.209 -4.659 1.00 0.00 H new ATOM 0 HG23 VAL A 144 3.616 3.656 -4.934 1.00 0.00 H new ATOM 794 N ARG A 145 2.596 4.223 -9.589 1.00 0.00 N ATOM 795 CA ARG A 145 2.076 4.633 -10.924 1.00 0.00 C ATOM 796 C ARG A 145 1.840 3.393 -11.788 1.00 0.00 C ATOM 797 O ARG A 145 1.342 3.481 -12.893 1.00 0.00 O ATOM 798 CB ARG A 145 3.094 5.547 -11.609 1.00 0.00 C ATOM 799 CG ARG A 145 3.587 6.600 -10.615 1.00 0.00 C ATOM 800 CD ARG A 145 2.420 7.500 -10.203 1.00 0.00 C ATOM 801 NE ARG A 145 2.943 8.831 -9.783 1.00 0.00 N ATOM 802 CZ ARG A 145 3.883 9.411 -10.478 1.00 0.00 C ATOM 803 NH1 ARG A 145 3.621 9.877 -11.669 1.00 0.00 N ATOM 804 NH2 ARG A 145 5.084 9.526 -9.982 1.00 0.00 N ATOM 0 H ARG A 145 3.598 4.358 -9.454 1.00 0.00 H new ATOM 0 HA ARG A 145 1.135 5.168 -10.796 1.00 0.00 H new ATOM 0 HB2 ARG A 145 3.934 4.960 -11.979 1.00 0.00 H new ATOM 0 HB3 ARG A 145 2.639 6.032 -12.473 1.00 0.00 H new ATOM 0 HG2 ARG A 145 4.013 6.115 -9.737 1.00 0.00 H new ATOM 0 HG3 ARG A 145 4.379 7.198 -11.065 1.00 0.00 H new ATOM 0 HD2 ARG A 145 1.725 7.616 -11.035 1.00 0.00 H new ATOM 0 HD3 ARG A 145 1.864 7.041 -9.385 1.00 0.00 H new ATOM 0 HE ARG A 145 2.566 9.288 -8.953 1.00 0.00 H new ATOM 0 HH11 ARG A 145 2.682 9.788 -12.056 1.00 0.00 H new ATOM 0 HH12 ARG A 145 4.356 10.330 -12.212 1.00 0.00 H new ATOM 0 HH21 ARG A 145 5.288 9.163 -9.051 1.00 0.00 H new ATOM 0 HH22 ARG A 145 5.819 9.979 -10.525 1.00 0.00 H new ATOM 818 N SER A 146 2.196 2.237 -11.298 1.00 0.00 N ATOM 819 CA SER A 146 1.992 0.994 -12.096 1.00 0.00 C ATOM 820 C SER A 146 1.020 0.066 -11.364 1.00 0.00 C ATOM 821 O SER A 146 0.803 -1.059 -11.764 1.00 0.00 O ATOM 822 CB SER A 146 3.330 0.283 -12.281 1.00 0.00 C ATOM 823 OG SER A 146 4.286 1.203 -12.791 1.00 0.00 O ATOM 0 H SER A 146 2.619 2.099 -10.380 1.00 0.00 H new ATOM 0 HA SER A 146 1.579 1.255 -13.070 1.00 0.00 H new ATOM 0 HB2 SER A 146 3.672 -0.125 -11.330 1.00 0.00 H new ATOM 0 HB3 SER A 146 3.216 -0.558 -12.966 1.00 0.00 H new ATOM 0 HG SER A 146 5.146 0.749 -12.909 1.00 0.00 H new ATOM 829 N VAL A 147 0.433 0.530 -10.295 1.00 0.00 N ATOM 830 CA VAL A 147 -0.525 -0.328 -9.541 1.00 0.00 C ATOM 831 C VAL A 147 -1.933 -0.145 -10.119 1.00 0.00 C ATOM 832 O VAL A 147 -2.313 0.953 -10.476 1.00 0.00 O ATOM 833 CB VAL A 147 -0.520 0.081 -8.065 1.00 0.00 C ATOM 834 CG1 VAL A 147 -1.029 -1.080 -7.210 1.00 0.00 C ATOM 835 CG2 VAL A 147 0.907 0.436 -7.640 1.00 0.00 C ATOM 0 H VAL A 147 0.575 1.464 -9.911 1.00 0.00 H new ATOM 0 HA VAL A 147 -0.229 -1.373 -9.629 1.00 0.00 H new ATOM 0 HB VAL A 147 -1.169 0.946 -7.927 1.00 0.00 H new ATOM 0 HG11 VAL A 147 -1.025 -0.788 -6.160 1.00 0.00 H new ATOM 0 HG12 VAL A 147 -2.045 -1.336 -7.511 1.00 0.00 H new ATOM 0 HG13 VAL A 147 -0.381 -1.945 -7.348 1.00 0.00 H new ATOM 0 HG21 VAL A 147 0.912 0.727 -6.590 1.00 0.00 H new ATOM 0 HG22 VAL A 147 1.554 -0.430 -7.780 1.00 0.00 H new ATOM 0 HG23 VAL A 147 1.272 1.264 -8.248 1.00 0.00 H new ATOM 845 N PRO A 148 -2.667 -1.228 -10.197 1.00 0.00 N ATOM 846 CA PRO A 148 -4.040 -1.217 -10.731 1.00 0.00 C ATOM 847 C PRO A 148 -5.016 -0.667 -9.687 1.00 0.00 C ATOM 848 O PRO A 148 -6.142 -0.329 -9.994 1.00 0.00 O ATOM 849 CB PRO A 148 -4.323 -2.694 -11.024 1.00 0.00 C ATOM 850 CG PRO A 148 -3.352 -3.509 -10.136 1.00 0.00 C ATOM 851 CD PRO A 148 -2.199 -2.560 -9.761 1.00 0.00 C ATOM 0 HA PRO A 148 -4.153 -0.585 -11.612 1.00 0.00 H new ATOM 0 HB2 PRO A 148 -5.359 -2.943 -10.797 1.00 0.00 H new ATOM 0 HB3 PRO A 148 -4.165 -2.918 -12.079 1.00 0.00 H new ATOM 0 HG2 PRO A 148 -3.858 -3.876 -9.243 1.00 0.00 H new ATOM 0 HG3 PRO A 148 -2.977 -4.382 -10.671 1.00 0.00 H new ATOM 0 HD2 PRO A 148 -1.999 -2.581 -8.690 1.00 0.00 H new ATOM 0 HD3 PRO A 148 -1.273 -2.841 -10.263 1.00 0.00 H new ATOM 859 N SER A 149 -4.593 -0.573 -8.457 1.00 0.00 N ATOM 860 CA SER A 149 -5.496 -0.041 -7.396 1.00 0.00 C ATOM 861 C SER A 149 -6.595 -1.063 -7.100 1.00 0.00 C ATOM 862 O SER A 149 -7.770 -0.753 -7.133 1.00 0.00 O ATOM 863 CB SER A 149 -6.129 1.265 -7.874 1.00 0.00 C ATOM 864 OG SER A 149 -5.228 1.932 -8.749 1.00 0.00 O ATOM 0 H SER A 149 -3.661 -0.841 -8.140 1.00 0.00 H new ATOM 0 HA SER A 149 -4.920 0.145 -6.489 1.00 0.00 H new ATOM 0 HB2 SER A 149 -7.068 1.060 -8.388 1.00 0.00 H new ATOM 0 HB3 SER A 149 -6.364 1.902 -7.021 1.00 0.00 H new ATOM 0 HG SER A 149 -5.632 2.769 -9.059 1.00 0.00 H new ATOM 870 N LEU A 150 -6.226 -2.280 -6.809 1.00 0.00 N ATOM 871 CA LEU A 150 -7.251 -3.317 -6.510 1.00 0.00 C ATOM 872 C LEU A 150 -7.530 -3.338 -5.005 1.00 0.00 C ATOM 873 O LEU A 150 -7.553 -4.380 -4.382 1.00 0.00 O ATOM 874 CB LEU A 150 -6.736 -4.688 -6.952 1.00 0.00 C ATOM 875 CG LEU A 150 -7.519 -5.153 -8.180 1.00 0.00 C ATOM 876 CD1 LEU A 150 -7.564 -4.027 -9.214 1.00 0.00 C ATOM 877 CD2 LEU A 150 -6.829 -6.375 -8.789 1.00 0.00 C ATOM 0 H LEU A 150 -5.259 -2.600 -6.766 1.00 0.00 H new ATOM 0 HA LEU A 150 -8.170 -3.085 -7.048 1.00 0.00 H new ATOM 0 HB2 LEU A 150 -5.673 -4.631 -7.185 1.00 0.00 H new ATOM 0 HB3 LEU A 150 -6.847 -5.409 -6.142 1.00 0.00 H new ATOM 0 HG LEU A 150 -8.535 -5.416 -7.885 1.00 0.00 H new ATOM 0 HD11 LEU A 150 -8.122 -4.359 -10.089 1.00 0.00 H new ATOM 0 HD12 LEU A 150 -8.053 -3.155 -8.781 1.00 0.00 H new ATOM 0 HD13 LEU A 150 -6.548 -3.764 -9.510 1.00 0.00 H new ATOM 0 HD21 LEU A 150 -7.386 -6.708 -9.665 1.00 0.00 H new ATOM 0 HD22 LEU A 150 -5.813 -6.110 -9.084 1.00 0.00 H new ATOM 0 HD23 LEU A 150 -6.796 -7.178 -8.053 1.00 0.00 H new ATOM 889 N CYS A 151 -7.739 -2.191 -4.416 1.00 0.00 N ATOM 890 CA CYS A 151 -8.014 -2.144 -2.953 1.00 0.00 C ATOM 891 C CYS A 151 -9.491 -2.456 -2.700 1.00 0.00 C ATOM 892 O CYS A 151 -10.357 -1.637 -2.937 1.00 0.00 O ATOM 893 CB CYS A 151 -7.690 -0.748 -2.419 1.00 0.00 C ATOM 894 SG CYS A 151 -7.295 -0.853 -0.655 1.00 0.00 S ATOM 0 H CYS A 151 -7.731 -1.286 -4.886 1.00 0.00 H new ATOM 0 HA CYS A 151 -7.395 -2.882 -2.443 1.00 0.00 H new ATOM 0 HB2 CYS A 151 -6.848 -0.324 -2.966 1.00 0.00 H new ATOM 0 HB3 CYS A 151 -8.539 -0.082 -2.573 1.00 0.00 H new ATOM 0 HG CYS A 151 -6.304 -1.676 -0.480 1.00 0.00 H new