USER MOD reduce.3.24.130724 H: found=0, std=0, add=614, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 617 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 212 SER OG : rot 180:sc= 0 USER MOD Single : A 217 TYR OH : rot 180:sc= 0 USER MOD Single : A 219 THR OG1 : rot -59:sc= 0.373 USER MOD Single : A 232 CYS SG : rot 180:sc= 0 USER MOD Single : A 233 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 234 SER OG : rot -34:sc= 0.945 USER MOD Single : B 212 SER OG : rot -31:sc= 0.0304 USER MOD Single : B 217 TYR OH : rot 180:sc= 0 USER MOD Single : B 219 THR OG1 : rot -52:sc= 0.214 USER MOD Single : B 232 CYS SG : rot 180:sc= 0 USER MOD Single : B 233 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.168) USER MOD Single : B 234 SER OG : rot -54:sc= 1.23 USER MOD Single : C 212 SER OG : rot 180:sc= -0.0082 USER MOD Single : C 217 TYR OH : rot 180:sc= 0 USER MOD Single : C 219 THR OG1 : rot -64:sc= 0.424 USER MOD Single : C 232 CYS SG : rot 86:sc= 1.1 USER MOD Single : C 233 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.149) USER MOD ----------------------------------------------------------------- ATOM 71 N SER A 212 86.493 20.736 0.149 1.00 0.00 N ATOM 72 CA SER A 212 85.757 19.501 0.674 1.00 0.00 C ATOM 73 C SER A 212 85.749 18.371 -0.391 1.00 0.00 C ATOM 74 O SER A 212 85.538 17.208 -0.080 1.00 0.00 O ATOM 75 CB SER A 212 84.300 19.893 1.068 1.00 0.00 C ATOM 76 OG SER A 212 83.642 18.758 1.617 1.00 0.00 O ATOM 0 HA SER A 212 86.278 19.126 1.555 1.00 0.00 H new ATOM 0 HB2 SER A 212 84.313 20.707 1.793 1.00 0.00 H new ATOM 0 HB3 SER A 212 83.759 20.254 0.193 1.00 0.00 H new ATOM 0 HG SER A 212 82.726 19.000 1.868 1.00 0.00 H new ATOM 82 N GLY A 213 85.969 18.786 -1.657 1.00 0.00 N ATOM 83 CA GLY A 213 85.987 17.878 -2.861 1.00 0.00 C ATOM 84 C GLY A 213 87.079 16.783 -2.799 1.00 0.00 C ATOM 85 O GLY A 213 86.838 15.658 -3.224 1.00 0.00 O ATOM 0 H GLY A 213 86.142 19.764 -1.891 1.00 0.00 H new ATOM 0 HA2 GLY A 213 85.012 17.401 -2.960 1.00 0.00 H new ATOM 0 HA3 GLY A 213 86.139 18.480 -3.757 1.00 0.00 H new ATOM 89 N ILE A 214 88.312 17.132 -2.301 1.00 0.00 N ATOM 90 CA ILE A 214 89.480 16.128 -2.237 1.00 0.00 C ATOM 91 C ILE A 214 89.127 14.890 -1.361 1.00 0.00 C ATOM 92 O ILE A 214 89.556 13.780 -1.634 1.00 0.00 O ATOM 93 CB ILE A 214 90.855 16.825 -1.758 1.00 0.00 C ATOM 94 CG1 ILE A 214 92.128 15.866 -2.076 1.00 0.00 C ATOM 95 CG2 ILE A 214 90.822 17.217 -0.202 1.00 0.00 C ATOM 96 CD1 ILE A 214 93.500 16.538 -1.792 1.00 0.00 C ATOM 0 H ILE A 214 88.538 18.061 -1.945 1.00 0.00 H new ATOM 0 HA ILE A 214 89.645 15.770 -3.253 1.00 0.00 H new ATOM 0 HB ILE A 214 90.961 17.750 -2.325 1.00 0.00 H new ATOM 0 HG12 ILE A 214 92.047 14.958 -1.478 1.00 0.00 H new ATOM 0 HG13 ILE A 214 92.091 15.563 -3.122 1.00 0.00 H new ATOM 0 HG21 ILE A 214 91.767 17.683 0.076 1.00 0.00 H new ATOM 0 HG22 ILE A 214 90.006 17.916 -0.020 1.00 0.00 H new ATOM 0 HG23 ILE A 214 90.670 16.319 0.396 1.00 0.00 H new ATOM 0 HD11 ILE A 214 94.303 15.839 -2.027 1.00 0.00 H new ATOM 0 HD12 ILE A 214 93.603 17.430 -2.410 1.00 0.00 H new ATOM 0 HD13 ILE A 214 93.558 16.817 -0.740 1.00 0.00 H new ATOM 108 N ILE A 215 88.354 15.132 -0.267 1.00 0.00 N ATOM 109 CA ILE A 215 87.930 14.040 0.718 1.00 0.00 C ATOM 110 C ILE A 215 86.987 13.024 0.003 1.00 0.00 C ATOM 111 O ILE A 215 87.048 11.837 0.261 1.00 0.00 O ATOM 112 CB ILE A 215 87.241 14.711 2.014 1.00 0.00 C ATOM 113 CG1 ILE A 215 88.241 15.816 2.657 1.00 0.00 C ATOM 114 CG2 ILE A 215 86.847 13.598 3.108 1.00 0.00 C ATOM 115 CD1 ILE A 215 87.607 16.626 3.828 1.00 0.00 C ATOM 0 H ILE A 215 88.003 16.059 -0.027 1.00 0.00 H new ATOM 0 HA ILE A 215 88.803 13.487 1.064 1.00 0.00 H new ATOM 0 HB ILE A 215 86.320 15.203 1.699 1.00 0.00 H new ATOM 0 HG12 ILE A 215 89.139 15.315 3.018 1.00 0.00 H new ATOM 0 HG13 ILE A 215 88.555 16.508 1.876 1.00 0.00 H new ATOM 0 HG21 ILE A 215 86.385 14.081 3.969 1.00 0.00 H new ATOM 0 HG22 ILE A 215 86.144 12.889 2.669 1.00 0.00 H new ATOM 0 HG23 ILE A 215 87.744 13.068 3.428 1.00 0.00 H new ATOM 0 HD11 ILE A 215 88.333 17.345 4.208 1.00 0.00 H new ATOM 0 HD12 ILE A 215 86.725 17.156 3.468 1.00 0.00 H new ATOM 0 HD13 ILE A 215 87.319 15.944 4.628 1.00 0.00 H new ATOM 127 N ILE A 216 86.106 13.531 -0.894 1.00 0.00 N ATOM 128 CA ILE A 216 85.131 12.664 -1.691 1.00 0.00 C ATOM 129 C ILE A 216 85.933 11.826 -2.736 1.00 0.00 C ATOM 130 O ILE A 216 85.624 10.674 -2.997 1.00 0.00 O ATOM 131 CB ILE A 216 84.018 13.595 -2.394 1.00 0.00 C ATOM 132 CG1 ILE A 216 83.279 14.502 -1.271 1.00 0.00 C ATOM 133 CG2 ILE A 216 82.947 12.707 -3.212 1.00 0.00 C ATOM 134 CD1 ILE A 216 82.265 15.526 -1.863 1.00 0.00 C ATOM 0 H ILE A 216 86.031 14.527 -1.101 1.00 0.00 H new ATOM 0 HA ILE A 216 84.608 11.975 -1.028 1.00 0.00 H new ATOM 0 HB ILE A 216 84.513 14.250 -3.111 1.00 0.00 H new ATOM 0 HG12 ILE A 216 82.756 13.847 -0.574 1.00 0.00 H new ATOM 0 HG13 ILE A 216 84.033 15.041 -0.697 1.00 0.00 H new ATOM 0 HG21 ILE A 216 82.209 13.362 -3.675 1.00 0.00 H new ATOM 0 HG22 ILE A 216 83.462 12.137 -3.985 1.00 0.00 H new ATOM 0 HG23 ILE A 216 82.446 12.021 -2.529 1.00 0.00 H new ATOM 0 HD11 ILE A 216 81.810 16.097 -1.054 1.00 0.00 H new ATOM 0 HD12 ILE A 216 82.786 16.205 -2.538 1.00 0.00 H new ATOM 0 HD13 ILE A 216 81.489 14.993 -2.412 1.00 0.00 H new ATOM 146 N TYR A 217 86.929 12.497 -3.361 1.00 0.00 N ATOM 147 CA TYR A 217 87.796 11.917 -4.470 1.00 0.00 C ATOM 148 C TYR A 217 88.598 10.644 -4.050 1.00 0.00 C ATOM 149 O TYR A 217 88.632 9.674 -4.794 1.00 0.00 O ATOM 150 CB TYR A 217 88.769 13.060 -4.982 1.00 0.00 C ATOM 151 CG TYR A 217 89.656 12.612 -6.225 1.00 0.00 C ATOM 152 CD1 TYR A 217 89.035 12.350 -7.489 1.00 0.00 C ATOM 153 CD2 TYR A 217 91.084 12.452 -6.124 1.00 0.00 C ATOM 154 CE1 TYR A 217 89.817 11.946 -8.597 1.00 0.00 C ATOM 155 CE2 TYR A 217 91.836 12.048 -7.250 1.00 0.00 C ATOM 156 CZ TYR A 217 91.202 11.799 -8.472 1.00 0.00 C ATOM 157 OH TYR A 217 91.953 11.401 -9.564 1.00 0.00 O ATOM 0 H TYR A 217 87.172 13.459 -3.126 1.00 0.00 H new ATOM 0 HA TYR A 217 87.136 11.578 -5.268 1.00 0.00 H new ATOM 0 HB2 TYR A 217 88.179 13.934 -5.260 1.00 0.00 H new ATOM 0 HB3 TYR A 217 89.424 13.364 -4.166 1.00 0.00 H new ATOM 0 HD1 TYR A 217 87.966 12.461 -7.597 1.00 0.00 H new ATOM 0 HD2 TYR A 217 91.582 12.641 -5.184 1.00 0.00 H new ATOM 0 HE1 TYR A 217 89.341 11.750 -9.546 1.00 0.00 H new ATOM 0 HE2 TYR A 217 92.906 11.931 -7.167 1.00 0.00 H new ATOM 0 HH TYR A 217 92.898 11.348 -9.309 1.00 0.00 H new ATOM 167 N VAL A 218 89.298 10.682 -2.884 1.00 0.00 N ATOM 168 CA VAL A 218 90.180 9.508 -2.429 1.00 0.00 C ATOM 169 C VAL A 218 89.375 8.173 -2.249 1.00 0.00 C ATOM 170 O VAL A 218 89.927 7.095 -2.449 1.00 0.00 O ATOM 171 CB VAL A 218 90.990 9.908 -1.099 1.00 0.00 C ATOM 172 CG1 VAL A 218 92.046 11.085 -1.403 1.00 0.00 C ATOM 173 CG2 VAL A 218 89.981 10.366 0.051 1.00 0.00 C ATOM 0 H VAL A 218 89.289 11.474 -2.241 1.00 0.00 H new ATOM 0 HA VAL A 218 90.898 9.309 -3.225 1.00 0.00 H new ATOM 0 HB VAL A 218 91.539 9.029 -0.761 1.00 0.00 H new ATOM 0 HG11 VAL A 218 92.582 11.338 -0.488 1.00 0.00 H new ATOM 0 HG12 VAL A 218 92.756 10.750 -2.159 1.00 0.00 H new ATOM 0 HG13 VAL A 218 91.516 11.964 -1.768 1.00 0.00 H new ATOM 0 HG21 VAL A 218 90.545 10.633 0.945 1.00 0.00 H new ATOM 0 HG22 VAL A 218 89.409 11.229 -0.289 1.00 0.00 H new ATOM 0 HG23 VAL A 218 89.299 9.548 0.284 1.00 0.00 H new ATOM 183 N THR A 219 88.084 8.265 -1.839 1.00 0.00 N ATOM 184 CA THR A 219 87.204 7.033 -1.598 1.00 0.00 C ATOM 185 C THR A 219 86.797 6.346 -2.926 1.00 0.00 C ATOM 186 O THR A 219 86.916 5.132 -3.061 1.00 0.00 O ATOM 187 CB THR A 219 85.892 7.442 -0.790 1.00 0.00 C ATOM 188 OG1 THR A 219 85.021 8.181 -1.650 1.00 0.00 O ATOM 189 CG2 THR A 219 86.223 8.349 0.448 1.00 0.00 C ATOM 0 H THR A 219 87.612 9.152 -1.664 1.00 0.00 H new ATOM 0 HA THR A 219 87.792 6.324 -1.015 1.00 0.00 H new ATOM 0 HB THR A 219 85.426 6.522 -0.439 1.00 0.00 H new ATOM 0 HG1 THR A 219 85.486 8.978 -1.980 1.00 0.00 H new ATOM 0 HG21 THR A 219 85.300 8.604 0.969 1.00 0.00 H new ATOM 0 HG22 THR A 219 86.886 7.812 1.126 1.00 0.00 H new ATOM 0 HG23 THR A 219 86.713 9.262 0.110 1.00 0.00 H new ATOM 197 N VAL A 220 86.296 7.148 -3.904 1.00 0.00 N ATOM 198 CA VAL A 220 85.841 6.610 -5.261 1.00 0.00 C ATOM 199 C VAL A 220 87.074 6.182 -6.105 1.00 0.00 C ATOM 200 O VAL A 220 86.998 5.249 -6.891 1.00 0.00 O ATOM 201 CB VAL A 220 84.923 7.708 -5.995 1.00 0.00 C ATOM 202 CG1 VAL A 220 83.597 7.995 -5.132 1.00 0.00 C ATOM 203 CG2 VAL A 220 85.734 9.065 -6.218 1.00 0.00 C ATOM 0 H VAL A 220 86.189 8.157 -3.803 1.00 0.00 H new ATOM 0 HA VAL A 220 85.229 5.717 -5.129 1.00 0.00 H new ATOM 0 HB VAL A 220 84.633 7.313 -6.969 1.00 0.00 H new ATOM 0 HG11 VAL A 220 82.986 8.740 -5.641 1.00 0.00 H new ATOM 0 HG12 VAL A 220 83.028 7.072 -5.022 1.00 0.00 H new ATOM 0 HG13 VAL A 220 83.878 8.368 -4.147 1.00 0.00 H new ATOM 0 HG21 VAL A 220 85.094 9.794 -6.716 1.00 0.00 H new ATOM 0 HG22 VAL A 220 86.053 9.461 -5.254 1.00 0.00 H new ATOM 0 HG23 VAL A 220 86.609 8.868 -6.837 1.00 0.00 H new ATOM 213 N ALA A 221 88.216 6.903 -5.914 1.00 0.00 N ATOM 214 CA ALA A 221 89.517 6.622 -6.660 1.00 0.00 C ATOM 215 C ALA A 221 90.042 5.184 -6.363 1.00 0.00 C ATOM 216 O ALA A 221 90.674 4.565 -7.205 1.00 0.00 O ATOM 217 CB ALA A 221 90.598 7.701 -6.283 1.00 0.00 C ATOM 0 H ALA A 221 88.280 7.682 -5.258 1.00 0.00 H new ATOM 0 HA ALA A 221 89.318 6.683 -7.730 1.00 0.00 H new ATOM 0 HB1 ALA A 221 91.523 7.492 -6.820 1.00 0.00 H new ATOM 0 HB2 ALA A 221 90.235 8.691 -6.557 1.00 0.00 H new ATOM 0 HB3 ALA A 221 90.786 7.668 -5.210 1.00 0.00 H new ATOM 223 N ALA A 222 89.813 4.696 -5.119 1.00 0.00 N ATOM 224 CA ALA A 222 90.298 3.321 -4.680 1.00 0.00 C ATOM 225 C ALA A 222 89.520 2.183 -5.401 1.00 0.00 C ATOM 226 O ALA A 222 90.088 1.149 -5.726 1.00 0.00 O ATOM 227 CB ALA A 222 90.145 3.219 -3.117 1.00 0.00 C ATOM 0 H ALA A 222 89.306 5.208 -4.397 1.00 0.00 H new ATOM 0 HA ALA A 222 91.345 3.199 -4.956 1.00 0.00 H new ATOM 0 HB1 ALA A 222 90.487 2.240 -2.781 1.00 0.00 H new ATOM 0 HB2 ALA A 222 90.744 3.996 -2.641 1.00 0.00 H new ATOM 0 HB3 ALA A 222 89.098 3.350 -2.845 1.00 0.00 H new ATOM 233 N VAL A 223 88.201 2.390 -5.591 1.00 0.00 N ATOM 234 CA VAL A 223 87.272 1.365 -6.230 1.00 0.00 C ATOM 235 C VAL A 223 87.554 1.188 -7.759 1.00 0.00 C ATOM 236 O VAL A 223 87.536 0.062 -8.248 1.00 0.00 O ATOM 237 CB VAL A 223 85.748 1.788 -5.935 1.00 0.00 C ATOM 238 CG1 VAL A 223 84.700 0.713 -6.510 1.00 0.00 C ATOM 239 CG2 VAL A 223 85.518 1.980 -4.353 1.00 0.00 C ATOM 0 H VAL A 223 87.730 3.253 -5.319 1.00 0.00 H new ATOM 0 HA VAL A 223 87.459 0.388 -5.785 1.00 0.00 H new ATOM 0 HB VAL A 223 85.571 2.733 -6.449 1.00 0.00 H new ATOM 0 HG11 VAL A 223 83.684 1.040 -6.288 1.00 0.00 H new ATOM 0 HG12 VAL A 223 84.825 0.625 -7.589 1.00 0.00 H new ATOM 0 HG13 VAL A 223 84.880 -0.256 -6.044 1.00 0.00 H new ATOM 0 HG21 VAL A 223 84.483 2.266 -4.168 1.00 0.00 H new ATOM 0 HG22 VAL A 223 85.733 1.044 -3.838 1.00 0.00 H new ATOM 0 HG23 VAL A 223 86.182 2.760 -3.981 1.00 0.00 H new ATOM 249 N VAL A 224 87.764 2.305 -8.529 1.00 0.00 N ATOM 250 CA VAL A 224 87.989 2.207 -10.048 1.00 0.00 C ATOM 251 C VAL A 224 89.299 1.436 -10.394 1.00 0.00 C ATOM 252 O VAL A 224 89.357 0.768 -11.417 1.00 0.00 O ATOM 253 CB VAL A 224 87.939 3.662 -10.738 1.00 0.00 C ATOM 254 CG1 VAL A 224 86.537 4.379 -10.421 1.00 0.00 C ATOM 255 CG2 VAL A 224 89.148 4.580 -10.245 1.00 0.00 C ATOM 0 H VAL A 224 87.786 3.256 -8.160 1.00 0.00 H new ATOM 0 HA VAL A 224 87.169 1.623 -10.465 1.00 0.00 H new ATOM 0 HB VAL A 224 88.036 3.526 -11.815 1.00 0.00 H new ATOM 0 HG11 VAL A 224 86.516 5.361 -10.893 1.00 0.00 H new ATOM 0 HG12 VAL A 224 85.721 3.771 -10.812 1.00 0.00 H new ATOM 0 HG13 VAL A 224 86.422 4.492 -9.343 1.00 0.00 H new ATOM 0 HG21 VAL A 224 89.086 5.555 -10.729 1.00 0.00 H new ATOM 0 HG22 VAL A 224 89.091 4.707 -9.164 1.00 0.00 H new ATOM 0 HG23 VAL A 224 90.094 4.106 -10.505 1.00 0.00 H new ATOM 265 N LEU A 225 90.360 1.550 -9.531 1.00 0.00 N ATOM 266 CA LEU A 225 91.701 0.844 -9.787 1.00 0.00 C ATOM 267 C LEU A 225 91.510 -0.707 -9.843 1.00 0.00 C ATOM 268 O LEU A 225 92.167 -1.381 -10.629 1.00 0.00 O ATOM 269 CB LEU A 225 92.764 1.251 -8.671 1.00 0.00 C ATOM 270 CG LEU A 225 93.271 2.796 -8.748 1.00 0.00 C ATOM 271 CD1 LEU A 225 94.008 3.226 -7.399 1.00 0.00 C ATOM 272 CD2 LEU A 225 94.249 3.049 -9.990 1.00 0.00 C ATOM 0 H LEU A 225 90.335 2.101 -8.673 1.00 0.00 H new ATOM 0 HA LEU A 225 92.083 1.167 -10.755 1.00 0.00 H new ATOM 0 HB2 LEU A 225 92.325 1.075 -7.689 1.00 0.00 H new ATOM 0 HB3 LEU A 225 93.630 0.594 -8.756 1.00 0.00 H new ATOM 0 HG LEU A 225 92.379 3.407 -8.885 1.00 0.00 H new ATOM 0 HD11 LEU A 225 94.336 4.262 -7.478 1.00 0.00 H new ATOM 0 HD12 LEU A 225 93.319 3.127 -6.560 1.00 0.00 H new ATOM 0 HD13 LEU A 225 94.873 2.583 -7.236 1.00 0.00 H new ATOM 0 HD21 LEU A 225 94.561 4.093 -10.000 1.00 0.00 H new ATOM 0 HD22 LEU A 225 95.126 2.409 -9.899 1.00 0.00 H new ATOM 0 HD23 LEU A 225 93.726 2.817 -10.918 1.00 0.00 H new ATOM 284 N ILE A 226 90.601 -1.255 -8.989 1.00 0.00 N ATOM 285 CA ILE A 226 90.317 -2.761 -8.945 1.00 0.00 C ATOM 286 C ILE A 226 89.567 -3.184 -10.248 1.00 0.00 C ATOM 287 O ILE A 226 89.903 -4.162 -10.884 1.00 0.00 O ATOM 288 CB ILE A 226 89.473 -3.126 -7.628 1.00 0.00 C ATOM 289 CG1 ILE A 226 90.144 -2.469 -6.308 1.00 0.00 C ATOM 290 CG2 ILE A 226 89.322 -4.714 -7.446 1.00 0.00 C ATOM 291 CD1 ILE A 226 91.621 -2.894 -6.050 1.00 0.00 C ATOM 0 H ILE A 226 90.051 -0.709 -8.326 1.00 0.00 H new ATOM 0 HA ILE A 226 91.255 -3.314 -8.896 1.00 0.00 H new ATOM 0 HB ILE A 226 88.475 -2.706 -7.756 1.00 0.00 H new ATOM 0 HG12 ILE A 226 90.103 -1.383 -6.398 1.00 0.00 H new ATOM 0 HG13 ILE A 226 89.545 -2.740 -5.439 1.00 0.00 H new ATOM 0 HG21 ILE A 226 88.746 -4.924 -6.545 1.00 0.00 H new ATOM 0 HG22 ILE A 226 88.808 -5.132 -8.311 1.00 0.00 H new ATOM 0 HG23 ILE A 226 90.310 -5.166 -7.358 1.00 0.00 H new ATOM 0 HD11 ILE A 226 91.987 -2.406 -5.147 1.00 0.00 H new ATOM 0 HD12 ILE A 226 91.672 -3.976 -5.924 1.00 0.00 H new ATOM 0 HD13 ILE A 226 92.238 -2.598 -6.898 1.00 0.00 H new ATOM 303 N VAL A 227 88.522 -2.407 -10.595 1.00 0.00 N ATOM 304 CA VAL A 227 87.649 -2.643 -11.822 1.00 0.00 C ATOM 305 C VAL A 227 88.445 -2.417 -13.146 1.00 0.00 C ATOM 306 O VAL A 227 88.208 -3.099 -14.125 1.00 0.00 O ATOM 307 CB VAL A 227 86.356 -1.698 -11.719 1.00 0.00 C ATOM 308 CG1 VAL A 227 85.366 -1.874 -12.973 1.00 0.00 C ATOM 309 CG2 VAL A 227 85.562 -2.003 -10.353 1.00 0.00 C ATOM 0 H VAL A 227 88.238 -1.593 -10.051 1.00 0.00 H new ATOM 0 HA VAL A 227 87.325 -3.683 -11.847 1.00 0.00 H new ATOM 0 HB VAL A 227 86.709 -0.667 -11.724 1.00 0.00 H new ATOM 0 HG11 VAL A 227 84.508 -1.213 -12.854 1.00 0.00 H new ATOM 0 HG12 VAL A 227 85.895 -1.621 -13.892 1.00 0.00 H new ATOM 0 HG13 VAL A 227 85.024 -2.908 -13.024 1.00 0.00 H new ATOM 0 HG21 VAL A 227 84.686 -1.358 -10.290 1.00 0.00 H new ATOM 0 HG22 VAL A 227 85.246 -3.046 -10.341 1.00 0.00 H new ATOM 0 HG23 VAL A 227 86.215 -1.812 -9.502 1.00 0.00 H new ATOM 319 N ALA A 228 89.346 -1.405 -13.171 1.00 0.00 N ATOM 320 CA ALA A 228 90.128 -1.018 -14.431 1.00 0.00 C ATOM 321 C ALA A 228 90.980 -2.199 -14.990 1.00 0.00 C ATOM 322 O ALA A 228 90.976 -2.451 -16.191 1.00 0.00 O ATOM 323 CB ALA A 228 91.045 0.222 -14.097 1.00 0.00 C ATOM 0 H ALA A 228 89.567 -0.832 -12.357 1.00 0.00 H new ATOM 0 HA ALA A 228 89.414 -0.759 -15.213 1.00 0.00 H new ATOM 0 HB1 ALA A 228 91.608 0.508 -14.986 1.00 0.00 H new ATOM 0 HB2 ALA A 228 90.424 1.058 -13.776 1.00 0.00 H new ATOM 0 HB3 ALA A 228 91.738 -0.043 -13.298 1.00 0.00 H new ATOM 329 N VAL A 229 91.697 -2.917 -14.095 1.00 0.00 N ATOM 330 CA VAL A 229 92.565 -4.109 -14.496 1.00 0.00 C ATOM 331 C VAL A 229 91.660 -5.274 -15.032 1.00 0.00 C ATOM 332 O VAL A 229 92.065 -5.978 -15.944 1.00 0.00 O ATOM 333 CB VAL A 229 93.528 -4.537 -13.283 1.00 0.00 C ATOM 334 CG1 VAL A 229 92.702 -4.759 -11.946 1.00 0.00 C ATOM 335 CG2 VAL A 229 94.404 -5.833 -13.647 1.00 0.00 C ATOM 0 H VAL A 229 91.709 -2.715 -13.095 1.00 0.00 H new ATOM 0 HA VAL A 229 93.227 -3.832 -15.316 1.00 0.00 H new ATOM 0 HB VAL A 229 94.223 -3.714 -13.115 1.00 0.00 H new ATOM 0 HG11 VAL A 229 93.380 -5.048 -11.143 1.00 0.00 H new ATOM 0 HG12 VAL A 229 92.192 -3.834 -11.675 1.00 0.00 H new ATOM 0 HG13 VAL A 229 91.966 -5.548 -12.100 1.00 0.00 H new ATOM 0 HG21 VAL A 229 95.042 -6.090 -12.801 1.00 0.00 H new ATOM 0 HG22 VAL A 229 93.741 -6.669 -13.869 1.00 0.00 H new ATOM 0 HG23 VAL A 229 95.024 -5.620 -14.518 1.00 0.00 H new ATOM 345 N PHE A 230 90.419 -5.461 -14.473 1.00 0.00 N ATOM 346 CA PHE A 230 89.458 -6.565 -14.966 1.00 0.00 C ATOM 347 C PHE A 230 88.930 -6.201 -16.396 1.00 0.00 C ATOM 348 O PHE A 230 88.854 -7.061 -17.267 1.00 0.00 O ATOM 349 CB PHE A 230 88.237 -6.777 -13.945 1.00 0.00 C ATOM 350 CG PHE A 230 88.605 -7.758 -12.737 1.00 0.00 C ATOM 351 CD1 PHE A 230 88.678 -7.307 -11.378 1.00 0.00 C ATOM 352 CD2 PHE A 230 88.867 -9.145 -13.002 1.00 0.00 C ATOM 353 CE1 PHE A 230 89.005 -8.210 -10.336 1.00 0.00 C ATOM 354 CE2 PHE A 230 89.190 -10.033 -11.950 1.00 0.00 C ATOM 355 CZ PHE A 230 89.260 -9.566 -10.621 1.00 0.00 C ATOM 0 H PHE A 230 90.051 -4.896 -13.708 1.00 0.00 H new ATOM 0 HA PHE A 230 90.006 -7.506 -15.015 1.00 0.00 H new ATOM 0 HB2 PHE A 230 87.933 -5.811 -13.543 1.00 0.00 H new ATOM 0 HB3 PHE A 230 87.381 -7.180 -14.487 1.00 0.00 H new ATOM 0 HD1 PHE A 230 88.482 -6.270 -11.147 1.00 0.00 H new ATOM 0 HD2 PHE A 230 88.817 -9.514 -14.016 1.00 0.00 H new ATOM 0 HE1 PHE A 230 89.059 -7.857 -9.317 1.00 0.00 H new ATOM 0 HE2 PHE A 230 89.384 -11.073 -12.165 1.00 0.00 H new ATOM 0 HZ PHE A 230 89.509 -10.248 -9.822 1.00 0.00 H new ATOM 365 N VAL A 231 88.573 -4.903 -16.616 1.00 0.00 N ATOM 366 CA VAL A 231 88.051 -4.403 -17.973 1.00 0.00 C ATOM 367 C VAL A 231 89.201 -4.452 -19.029 1.00 0.00 C ATOM 368 O VAL A 231 88.948 -4.642 -20.213 1.00 0.00 O ATOM 369 CB VAL A 231 87.432 -2.933 -17.793 1.00 0.00 C ATOM 370 CG1 VAL A 231 86.990 -2.275 -19.192 1.00 0.00 C ATOM 371 CG2 VAL A 231 86.164 -2.987 -16.802 1.00 0.00 C ATOM 0 H VAL A 231 88.627 -4.177 -15.901 1.00 0.00 H new ATOM 0 HA VAL A 231 87.254 -5.049 -18.341 1.00 0.00 H new ATOM 0 HB VAL A 231 88.216 -2.307 -17.368 1.00 0.00 H new ATOM 0 HG11 VAL A 231 86.578 -1.282 -19.013 1.00 0.00 H new ATOM 0 HG12 VAL A 231 87.858 -2.195 -19.847 1.00 0.00 H new ATOM 0 HG13 VAL A 231 86.234 -2.901 -19.666 1.00 0.00 H new ATOM 0 HG21 VAL A 231 85.750 -1.985 -16.686 1.00 0.00 H new ATOM 0 HG22 VAL A 231 85.404 -3.647 -17.219 1.00 0.00 H new ATOM 0 HG23 VAL A 231 86.478 -3.365 -15.829 1.00 0.00 H new ATOM 381 N CYS A 232 90.462 -4.245 -18.570 1.00 0.00 N ATOM 382 CA CYS A 232 91.695 -4.237 -19.476 1.00 0.00 C ATOM 383 C CYS A 232 91.931 -5.636 -20.134 1.00 0.00 C ATOM 384 O CYS A 232 92.195 -5.730 -21.327 1.00 0.00 O ATOM 385 CB CYS A 232 92.942 -3.796 -18.623 1.00 0.00 C ATOM 386 SG CYS A 232 94.426 -3.579 -19.661 1.00 0.00 S ATOM 0 H CYS A 232 90.676 -4.080 -17.587 1.00 0.00 H new ATOM 0 HA CYS A 232 91.538 -3.530 -20.290 1.00 0.00 H new ATOM 0 HB2 CYS A 232 92.719 -2.862 -18.108 1.00 0.00 H new ATOM 0 HB3 CYS A 232 93.141 -4.544 -17.855 1.00 0.00 H new ATOM 0 HG CYS A 232 95.427 -3.214 -18.916 1.00 0.00 H new ATOM 392 N LYS A 233 91.846 -6.713 -19.310 1.00 0.00 N ATOM 393 CA LYS A 233 92.063 -8.152 -19.780 1.00 0.00 C ATOM 394 C LYS A 233 90.903 -8.609 -20.714 1.00 0.00 C ATOM 395 O LYS A 233 91.128 -9.326 -21.680 1.00 0.00 O ATOM 396 CB LYS A 233 92.184 -9.098 -18.502 1.00 0.00 C ATOM 397 CG LYS A 233 93.493 -8.778 -17.634 1.00 0.00 C ATOM 398 CD LYS A 233 93.677 -9.774 -16.388 1.00 0.00 C ATOM 399 CE LYS A 233 92.541 -9.635 -15.297 1.00 0.00 C ATOM 400 NZ LYS A 233 92.917 -10.439 -14.095 1.00 0.00 N ATOM 0 H LYS A 233 91.631 -6.637 -18.316 1.00 0.00 H new ATOM 0 HA LYS A 233 92.985 -8.214 -20.359 1.00 0.00 H new ATOM 0 HB2 LYS A 233 91.298 -8.978 -17.878 1.00 0.00 H new ATOM 0 HB3 LYS A 233 92.209 -10.139 -18.824 1.00 0.00 H new ATOM 0 HG2 LYS A 233 94.372 -8.841 -18.275 1.00 0.00 H new ATOM 0 HG3 LYS A 233 93.438 -7.753 -17.268 1.00 0.00 H new ATOM 0 HD2 LYS A 233 93.695 -10.801 -16.753 1.00 0.00 H new ATOM 0 HD3 LYS A 233 94.644 -9.584 -15.921 1.00 0.00 H new ATOM 0 HE2 LYS A 233 92.409 -8.588 -15.023 1.00 0.00 H new ATOM 0 HE3 LYS A 233 91.589 -9.982 -15.699 1.00 0.00 H new ATOM 0 HZ1 LYS A 233 92.174 -10.352 -13.373 1.00 0.00 H new ATOM 0 HZ2 LYS A 233 93.023 -11.438 -14.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 233 93.817 -10.087 -13.710 1.00 0.00 H new ATOM 414 N SER A 234 89.656 -8.186 -20.390 1.00 0.00 N ATOM 415 CA SER A 234 88.411 -8.559 -21.193 1.00 0.00 C ATOM 416 C SER A 234 88.492 -7.979 -22.630 1.00 0.00 C ATOM 417 O SER A 234 88.030 -8.588 -23.583 1.00 0.00 O ATOM 418 CB SER A 234 87.141 -8.011 -20.454 1.00 0.00 C ATOM 419 OG SER A 234 87.157 -6.588 -20.473 1.00 0.00 O ATOM 0 H SER A 234 89.461 -7.588 -19.587 1.00 0.00 H new ATOM 0 HA SER A 234 88.347 -9.644 -21.272 1.00 0.00 H new ATOM 0 HB2 SER A 234 86.237 -8.381 -20.938 1.00 0.00 H new ATOM 0 HB3 SER A 234 87.122 -8.371 -19.425 1.00 0.00 H new ATOM 0 HG SER A 234 88.083 -6.271 -20.425 1.00 0.00 H new ATOM 425 N LEU A 235 89.099 -6.774 -22.738 1.00 0.00 N ATOM 426 CA LEU A 235 89.288 -6.027 -24.054 1.00 0.00 C ATOM 427 C LEU A 235 90.363 -6.740 -24.910 1.00 0.00 C ATOM 428 O LEU A 235 90.249 -6.816 -26.127 1.00 0.00 O ATOM 429 CB LEU A 235 89.700 -4.533 -23.694 1.00 0.00 C ATOM 430 CG LEU A 235 89.973 -3.532 -24.951 1.00 0.00 C ATOM 431 CD1 LEU A 235 91.395 -3.709 -25.652 1.00 0.00 C ATOM 432 CD2 LEU A 235 88.795 -3.559 -26.014 1.00 0.00 C ATOM 0 H LEU A 235 89.478 -6.274 -21.934 1.00 0.00 H new ATOM 0 HA LEU A 235 88.373 -6.014 -24.646 1.00 0.00 H new ATOM 0 HB2 LEU A 235 88.911 -4.100 -23.078 1.00 0.00 H new ATOM 0 HB3 LEU A 235 90.601 -4.566 -23.082 1.00 0.00 H new ATOM 0 HG LEU A 235 89.998 -2.540 -24.499 1.00 0.00 H new ATOM 0 HD11 LEU A 235 91.485 -3.001 -26.476 1.00 0.00 H new ATOM 0 HD12 LEU A 235 92.185 -3.522 -24.925 1.00 0.00 H new ATOM 0 HD13 LEU A 235 91.488 -4.725 -26.035 1.00 0.00 H new ATOM 0 HD21 LEU A 235 89.026 -2.875 -26.831 1.00 0.00 H new ATOM 0 HD22 LEU A 235 88.683 -4.569 -26.407 1.00 0.00 H new ATOM 0 HD23 LEU A 235 87.866 -3.251 -25.535 1.00 0.00 H new ATOM 444 N LEU A 236 91.412 -7.263 -24.229 1.00 0.00 N ATOM 445 CA LEU A 236 92.581 -7.990 -24.891 1.00 0.00 C ATOM 446 C LEU A 236 92.190 -9.456 -25.220 1.00 0.00 C ATOM 447 O LEU A 236 92.745 -10.045 -26.138 1.00 0.00 O ATOM 448 CB LEU A 236 93.816 -7.920 -23.893 1.00 0.00 C ATOM 449 CG LEU A 236 95.158 -8.674 -24.399 1.00 0.00 C ATOM 450 CD1 LEU A 236 95.693 -8.097 -25.775 1.00 0.00 C ATOM 451 CD2 LEU A 236 96.296 -8.600 -23.279 1.00 0.00 C ATOM 0 H LEU A 236 91.494 -7.207 -23.214 1.00 0.00 H new ATOM 0 HA LEU A 236 92.848 -7.518 -25.836 1.00 0.00 H new ATOM 0 HB2 LEU A 236 94.055 -6.872 -23.709 1.00 0.00 H new ATOM 0 HB3 LEU A 236 93.515 -8.351 -22.938 1.00 0.00 H new ATOM 0 HG LEU A 236 94.894 -9.717 -24.572 1.00 0.00 H new ATOM 0 HD11 LEU A 236 96.593 -8.636 -26.070 1.00 0.00 H new ATOM 0 HD12 LEU A 236 94.929 -8.219 -26.543 1.00 0.00 H new ATOM 0 HD13 LEU A 236 95.925 -7.038 -25.660 1.00 0.00 H new ATOM 0 HD21 LEU A 236 97.191 -9.111 -23.635 1.00 0.00 H new ATOM 0 HD22 LEU A 236 96.533 -7.557 -23.070 1.00 0.00 H new ATOM 0 HD23 LEU A 236 95.941 -9.081 -22.368 1.00 0.00 H new ATOM 652 N SER B 212 73.391 9.305 4.808 1.00 0.00 N ATOM 653 CA SER B 212 74.555 9.464 5.781 1.00 0.00 C ATOM 654 C SER B 212 75.306 8.118 5.927 1.00 0.00 C ATOM 655 O SER B 212 76.516 8.081 6.085 1.00 0.00 O ATOM 656 CB SER B 212 73.995 9.934 7.166 1.00 0.00 C ATOM 657 OG SER B 212 73.157 8.916 7.707 1.00 0.00 O ATOM 0 HA SER B 212 75.257 10.208 5.405 1.00 0.00 H new ATOM 0 HB2 SER B 212 74.817 10.146 7.850 1.00 0.00 H new ATOM 0 HB3 SER B 212 73.432 10.860 7.048 1.00 0.00 H new ATOM 0 HG SER B 212 72.722 8.428 6.977 1.00 0.00 H new ATOM 663 N GLY B 213 74.526 7.022 5.863 1.00 0.00 N ATOM 664 CA GLY B 213 75.052 5.606 5.976 1.00 0.00 C ATOM 665 C GLY B 213 75.796 5.185 4.699 1.00 0.00 C ATOM 666 O GLY B 213 76.706 4.369 4.747 1.00 0.00 O ATOM 0 H GLY B 213 73.515 7.069 5.733 1.00 0.00 H new ATOM 0 HA2 GLY B 213 75.723 5.532 6.832 1.00 0.00 H new ATOM 0 HA3 GLY B 213 74.224 4.921 6.160 1.00 0.00 H new ATOM 670 N ILE B 214 75.365 5.752 3.539 1.00 0.00 N ATOM 671 CA ILE B 214 75.965 5.440 2.171 1.00 0.00 C ATOM 672 C ILE B 214 77.452 5.920 2.098 1.00 0.00 C ATOM 673 O ILE B 214 78.281 5.275 1.465 1.00 0.00 O ATOM 674 CB ILE B 214 75.053 6.099 1.026 1.00 0.00 C ATOM 675 CG1 ILE B 214 73.492 5.688 1.215 1.00 0.00 C ATOM 676 CG2 ILE B 214 75.556 5.708 -0.446 1.00 0.00 C ATOM 677 CD1 ILE B 214 73.212 4.152 1.177 1.00 0.00 C ATOM 0 H ILE B 214 74.604 6.431 3.503 1.00 0.00 H new ATOM 0 HA ILE B 214 75.977 4.362 2.011 1.00 0.00 H new ATOM 0 HB ILE B 214 75.147 7.180 1.131 1.00 0.00 H new ATOM 0 HG12 ILE B 214 73.139 6.084 2.167 1.00 0.00 H new ATOM 0 HG13 ILE B 214 72.906 6.170 0.432 1.00 0.00 H new ATOM 0 HG21 ILE B 214 74.909 6.176 -1.188 1.00 0.00 H new ATOM 0 HG22 ILE B 214 76.579 6.056 -0.585 1.00 0.00 H new ATOM 0 HG23 ILE B 214 75.522 4.625 -0.567 1.00 0.00 H new ATOM 0 HD11 ILE B 214 72.145 3.973 1.311 1.00 0.00 H new ATOM 0 HD12 ILE B 214 73.530 3.748 0.216 1.00 0.00 H new ATOM 0 HD13 ILE B 214 73.766 3.661 1.978 1.00 0.00 H new ATOM 689 N ILE B 215 77.758 7.081 2.737 1.00 0.00 N ATOM 690 CA ILE B 215 79.165 7.688 2.740 1.00 0.00 C ATOM 691 C ILE B 215 80.114 6.804 3.604 1.00 0.00 C ATOM 692 O ILE B 215 81.272 6.633 3.272 1.00 0.00 O ATOM 693 CB ILE B 215 79.095 9.212 3.257 1.00 0.00 C ATOM 694 CG1 ILE B 215 78.064 10.059 2.333 1.00 0.00 C ATOM 695 CG2 ILE B 215 80.550 9.903 3.255 1.00 0.00 C ATOM 696 CD1 ILE B 215 77.790 11.498 2.867 1.00 0.00 C ATOM 0 H ILE B 215 77.074 7.629 3.259 1.00 0.00 H new ATOM 0 HA ILE B 215 79.573 7.708 1.729 1.00 0.00 H new ATOM 0 HB ILE B 215 78.735 9.206 4.286 1.00 0.00 H new ATOM 0 HG12 ILE B 215 78.465 10.125 1.322 1.00 0.00 H new ATOM 0 HG13 ILE B 215 77.120 9.519 2.267 1.00 0.00 H new ATOM 0 HG21 ILE B 215 80.465 10.930 3.609 1.00 0.00 H new ATOM 0 HG22 ILE B 215 81.218 9.346 3.912 1.00 0.00 H new ATOM 0 HG23 ILE B 215 80.952 9.901 2.242 1.00 0.00 H new ATOM 0 HD11 ILE B 215 77.093 12.007 2.201 1.00 0.00 H new ATOM 0 HD12 ILE B 215 77.360 11.439 3.867 1.00 0.00 H new ATOM 0 HD13 ILE B 215 78.726 12.056 2.907 1.00 0.00 H new ATOM 708 N ILE B 216 79.595 6.261 4.728 1.00 0.00 N ATOM 709 CA ILE B 216 80.397 5.360 5.666 1.00 0.00 C ATOM 710 C ILE B 216 80.668 3.994 4.955 1.00 0.00 C ATOM 711 O ILE B 216 81.704 3.379 5.148 1.00 0.00 O ATOM 712 CB ILE B 216 79.593 5.178 7.052 1.00 0.00 C ATOM 713 CG1 ILE B 216 79.315 6.630 7.723 1.00 0.00 C ATOM 714 CG2 ILE B 216 80.393 4.226 8.078 1.00 0.00 C ATOM 715 CD1 ILE B 216 78.392 6.566 8.980 1.00 0.00 C ATOM 0 H ILE B 216 78.633 6.414 5.029 1.00 0.00 H new ATOM 0 HA ILE B 216 81.361 5.810 5.903 1.00 0.00 H new ATOM 0 HB ILE B 216 78.640 4.696 6.832 1.00 0.00 H new ATOM 0 HG12 ILE B 216 80.267 7.081 8.003 1.00 0.00 H new ATOM 0 HG13 ILE B 216 78.859 7.284 6.980 1.00 0.00 H new ATOM 0 HG21 ILE B 216 79.822 4.125 9.001 1.00 0.00 H new ATOM 0 HG22 ILE B 216 80.533 3.243 7.629 1.00 0.00 H new ATOM 0 HG23 ILE B 216 81.366 4.665 8.299 1.00 0.00 H new ATOM 0 HD11 ILE B 216 78.248 7.571 9.377 1.00 0.00 H new ATOM 0 HD12 ILE B 216 77.426 6.144 8.701 1.00 0.00 H new ATOM 0 HD13 ILE B 216 78.856 5.938 9.741 1.00 0.00 H new ATOM 727 N TYR B 217 79.650 3.528 4.198 1.00 0.00 N ATOM 728 CA TYR B 217 79.653 2.184 3.482 1.00 0.00 C ATOM 729 C TYR B 217 80.760 2.030 2.388 1.00 0.00 C ATOM 730 O TYR B 217 81.388 0.979 2.305 1.00 0.00 O ATOM 731 CB TYR B 217 78.211 1.963 2.862 1.00 0.00 C ATOM 732 CG TYR B 217 78.048 0.528 2.190 1.00 0.00 C ATOM 733 CD1 TYR B 217 77.794 -0.623 3.002 1.00 0.00 C ATOM 734 CD2 TYR B 217 78.164 0.346 0.771 1.00 0.00 C ATOM 735 CE1 TYR B 217 77.657 -1.900 2.408 1.00 0.00 C ATOM 736 CE2 TYR B 217 78.021 -0.942 0.205 1.00 0.00 C ATOM 737 CZ TYR B 217 77.770 -2.050 1.022 1.00 0.00 C ATOM 738 OH TYR B 217 77.634 -3.304 0.455 1.00 0.00 O ATOM 0 H TYR B 217 78.790 4.057 4.051 1.00 0.00 H new ATOM 0 HA TYR B 217 79.895 1.418 4.219 1.00 0.00 H new ATOM 0 HB2 TYR B 217 77.461 2.081 3.644 1.00 0.00 H new ATOM 0 HB3 TYR B 217 78.018 2.734 2.116 1.00 0.00 H new ATOM 0 HD1 TYR B 217 77.706 -0.516 4.073 1.00 0.00 H new ATOM 0 HD2 TYR B 217 78.361 1.195 0.134 1.00 0.00 H new ATOM 0 HE1 TYR B 217 77.464 -2.763 3.028 1.00 0.00 H new ATOM 0 HE2 TYR B 217 78.106 -1.071 -0.864 1.00 0.00 H new ATOM 0 HH TYR B 217 77.739 -3.237 -0.517 1.00 0.00 H new ATOM 748 N VAL B 218 80.943 3.045 1.499 1.00 0.00 N ATOM 749 CA VAL B 218 81.954 2.936 0.344 1.00 0.00 C ATOM 750 C VAL B 218 83.421 2.786 0.860 1.00 0.00 C ATOM 751 O VAL B 218 84.208 2.053 0.271 1.00 0.00 O ATOM 752 CB VAL B 218 81.764 4.178 -0.655 1.00 0.00 C ATOM 753 CG1 VAL B 218 82.022 5.564 0.087 1.00 0.00 C ATOM 754 CG2 VAL B 218 82.694 4.046 -1.960 1.00 0.00 C ATOM 0 H VAL B 218 80.436 3.929 1.533 1.00 0.00 H new ATOM 0 HA VAL B 218 81.754 2.022 -0.216 1.00 0.00 H new ATOM 0 HB VAL B 218 80.727 4.161 -0.989 1.00 0.00 H new ATOM 0 HG11 VAL B 218 81.885 6.385 -0.617 1.00 0.00 H new ATOM 0 HG12 VAL B 218 81.317 5.672 0.911 1.00 0.00 H new ATOM 0 HG13 VAL B 218 83.040 5.585 0.475 1.00 0.00 H new ATOM 0 HG21 VAL B 218 82.534 4.907 -2.609 1.00 0.00 H new ATOM 0 HG22 VAL B 218 83.741 4.008 -1.658 1.00 0.00 H new ATOM 0 HG23 VAL B 218 82.438 3.133 -2.498 1.00 0.00 H new ATOM 764 N THR B 219 83.776 3.513 1.948 1.00 0.00 N ATOM 765 CA THR B 219 85.186 3.486 2.541 1.00 0.00 C ATOM 766 C THR B 219 85.567 2.090 3.104 1.00 0.00 C ATOM 767 O THR B 219 86.645 1.577 2.813 1.00 0.00 O ATOM 768 CB THR B 219 85.294 4.565 3.702 1.00 0.00 C ATOM 769 OG1 THR B 219 84.461 4.154 4.786 1.00 0.00 O ATOM 770 CG2 THR B 219 84.812 5.987 3.235 1.00 0.00 C ATOM 0 H THR B 219 83.131 4.127 2.446 1.00 0.00 H new ATOM 0 HA THR B 219 85.881 3.717 1.734 1.00 0.00 H new ATOM 0 HB THR B 219 86.341 4.634 3.996 1.00 0.00 H new ATOM 0 HG1 THR B 219 83.559 3.967 4.453 1.00 0.00 H new ATOM 0 HG21 THR B 219 84.904 6.692 4.061 1.00 0.00 H new ATOM 0 HG22 THR B 219 85.427 6.324 2.401 1.00 0.00 H new ATOM 0 HG23 THR B 219 83.770 5.932 2.919 1.00 0.00 H new ATOM 778 N VAL B 220 84.667 1.487 3.931 1.00 0.00 N ATOM 779 CA VAL B 220 84.926 0.122 4.564 1.00 0.00 C ATOM 780 C VAL B 220 84.834 -0.986 3.486 1.00 0.00 C ATOM 781 O VAL B 220 85.581 -1.944 3.512 1.00 0.00 O ATOM 782 CB VAL B 220 83.919 -0.109 5.791 1.00 0.00 C ATOM 783 CG1 VAL B 220 82.401 -0.081 5.308 1.00 0.00 C ATOM 784 CG2 VAL B 220 84.241 -1.471 6.580 1.00 0.00 C ATOM 0 H VAL B 220 83.768 1.899 4.183 1.00 0.00 H new ATOM 0 HA VAL B 220 85.936 0.081 4.972 1.00 0.00 H new ATOM 0 HB VAL B 220 84.069 0.717 6.486 1.00 0.00 H new ATOM 0 HG11 VAL B 220 81.744 -0.241 6.163 1.00 0.00 H new ATOM 0 HG12 VAL B 220 82.181 0.886 4.857 1.00 0.00 H new ATOM 0 HG13 VAL B 220 82.238 -0.870 4.573 1.00 0.00 H new ATOM 0 HG21 VAL B 220 83.537 -1.590 7.403 1.00 0.00 H new ATOM 0 HG22 VAL B 220 84.149 -2.317 5.899 1.00 0.00 H new ATOM 0 HG23 VAL B 220 85.256 -1.432 6.974 1.00 0.00 H new ATOM 794 N ALA B 221 83.880 -0.832 2.532 1.00 0.00 N ATOM 795 CA ALA B 221 83.668 -1.843 1.415 1.00 0.00 C ATOM 796 C ALA B 221 84.902 -1.897 0.466 1.00 0.00 C ATOM 797 O ALA B 221 85.229 -2.952 -0.059 1.00 0.00 O ATOM 798 CB ALA B 221 82.360 -1.463 0.630 1.00 0.00 C ATOM 0 H ALA B 221 83.244 -0.036 2.496 1.00 0.00 H new ATOM 0 HA ALA B 221 83.554 -2.839 1.843 1.00 0.00 H new ATOM 0 HB1 ALA B 221 82.197 -2.181 -0.174 1.00 0.00 H new ATOM 0 HB2 ALA B 221 81.509 -1.481 1.311 1.00 0.00 H new ATOM 0 HB3 ALA B 221 82.466 -0.464 0.208 1.00 0.00 H new ATOM 804 N ALA B 222 85.557 -0.722 0.237 1.00 0.00 N ATOM 805 CA ALA B 222 86.755 -0.618 -0.694 1.00 0.00 C ATOM 806 C ALA B 222 87.983 -1.429 -0.176 1.00 0.00 C ATOM 807 O ALA B 222 88.589 -2.181 -0.932 1.00 0.00 O ATOM 808 CB ALA B 222 87.116 0.904 -0.874 1.00 0.00 C ATOM 0 H ALA B 222 85.292 0.163 0.670 1.00 0.00 H new ATOM 0 HA ALA B 222 86.490 -1.057 -1.656 1.00 0.00 H new ATOM 0 HB1 ALA B 222 87.974 0.998 -1.539 1.00 0.00 H new ATOM 0 HB2 ALA B 222 86.264 1.432 -1.303 1.00 0.00 H new ATOM 0 HB3 ALA B 222 87.360 1.337 0.096 1.00 0.00 H new ATOM 814 N VAL B 223 88.359 -1.248 1.119 1.00 0.00 N ATOM 815 CA VAL B 223 89.559 -1.979 1.731 1.00 0.00 C ATOM 816 C VAL B 223 89.237 -3.495 1.915 1.00 0.00 C ATOM 817 O VAL B 223 90.085 -4.345 1.692 1.00 0.00 O ATOM 818 CB VAL B 223 90.023 -1.247 3.084 1.00 0.00 C ATOM 819 CG1 VAL B 223 88.942 -1.402 4.246 1.00 0.00 C ATOM 820 CG2 VAL B 223 91.460 -1.765 3.574 1.00 0.00 C ATOM 0 H VAL B 223 87.877 -0.623 1.765 1.00 0.00 H new ATOM 0 HA VAL B 223 90.409 -1.932 1.051 1.00 0.00 H new ATOM 0 HB VAL B 223 90.109 -0.186 2.851 1.00 0.00 H new ATOM 0 HG11 VAL B 223 89.296 -0.893 5.142 1.00 0.00 H new ATOM 0 HG12 VAL B 223 87.998 -0.960 3.926 1.00 0.00 H new ATOM 0 HG13 VAL B 223 88.792 -2.459 4.465 1.00 0.00 H new ATOM 0 HG21 VAL B 223 91.740 -1.247 4.491 1.00 0.00 H new ATOM 0 HG22 VAL B 223 91.415 -2.838 3.762 1.00 0.00 H new ATOM 0 HG23 VAL B 223 92.202 -1.562 2.802 1.00 0.00 H new ATOM 830 N VAL B 224 87.966 -3.804 2.322 1.00 0.00 N ATOM 831 CA VAL B 224 87.473 -5.241 2.543 1.00 0.00 C ATOM 832 C VAL B 224 87.472 -6.019 1.191 1.00 0.00 C ATOM 833 O VAL B 224 87.691 -7.227 1.182 1.00 0.00 O ATOM 834 CB VAL B 224 86.017 -5.201 3.249 1.00 0.00 C ATOM 835 CG1 VAL B 224 85.229 -6.603 3.179 1.00 0.00 C ATOM 836 CG2 VAL B 224 86.155 -4.745 4.789 1.00 0.00 C ATOM 0 H VAL B 224 87.255 -3.097 2.508 1.00 0.00 H new ATOM 0 HA VAL B 224 88.146 -5.778 3.211 1.00 0.00 H new ATOM 0 HB VAL B 224 85.430 -4.475 2.686 1.00 0.00 H new ATOM 0 HG11 VAL B 224 84.262 -6.502 3.672 1.00 0.00 H new ATOM 0 HG12 VAL B 224 85.078 -6.884 2.137 1.00 0.00 H new ATOM 0 HG13 VAL B 224 85.813 -7.374 3.681 1.00 0.00 H new ATOM 0 HG21 VAL B 224 85.168 -4.722 5.252 1.00 0.00 H new ATOM 0 HG22 VAL B 224 86.790 -5.453 5.322 1.00 0.00 H new ATOM 0 HG23 VAL B 224 86.600 -3.751 4.836 1.00 0.00 H new ATOM 846 N LEU B 225 87.204 -5.316 0.050 1.00 0.00 N ATOM 847 CA LEU B 225 87.158 -5.974 -1.335 1.00 0.00 C ATOM 848 C LEU B 225 88.529 -6.636 -1.664 1.00 0.00 C ATOM 849 O LEU B 225 88.577 -7.695 -2.273 1.00 0.00 O ATOM 850 CB LEU B 225 86.747 -4.878 -2.404 1.00 0.00 C ATOM 851 CG LEU B 225 86.660 -5.402 -3.937 1.00 0.00 C ATOM 852 CD1 LEU B 225 85.636 -6.601 -4.109 1.00 0.00 C ATOM 853 CD2 LEU B 225 86.279 -4.193 -4.913 1.00 0.00 C ATOM 0 H LEU B 225 87.017 -4.313 0.038 1.00 0.00 H new ATOM 0 HA LEU B 225 86.413 -6.770 -1.355 1.00 0.00 H new ATOM 0 HB2 LEU B 225 85.778 -4.466 -2.123 1.00 0.00 H new ATOM 0 HB3 LEU B 225 87.467 -4.061 -2.357 1.00 0.00 H new ATOM 0 HG LEU B 225 87.645 -5.785 -4.206 1.00 0.00 H new ATOM 0 HD11 LEU B 225 85.615 -6.915 -5.153 1.00 0.00 H new ATOM 0 HD12 LEU B 225 85.948 -7.438 -3.485 1.00 0.00 H new ATOM 0 HD13 LEU B 225 84.640 -6.275 -3.808 1.00 0.00 H new ATOM 0 HD21 LEU B 225 86.224 -4.557 -5.939 1.00 0.00 H new ATOM 0 HD22 LEU B 225 85.313 -3.781 -4.622 1.00 0.00 H new ATOM 0 HD23 LEU B 225 87.041 -3.416 -4.844 1.00 0.00 H new ATOM 865 N ILE B 226 89.635 -5.973 -1.233 1.00 0.00 N ATOM 866 CA ILE B 226 91.058 -6.481 -1.456 1.00 0.00 C ATOM 867 C ILE B 226 91.307 -7.738 -0.563 1.00 0.00 C ATOM 868 O ILE B 226 91.792 -8.753 -1.024 1.00 0.00 O ATOM 869 CB ILE B 226 92.121 -5.313 -1.117 1.00 0.00 C ATOM 870 CG1 ILE B 226 91.755 -3.980 -1.959 1.00 0.00 C ATOM 871 CG2 ILE B 226 93.632 -5.792 -1.431 1.00 0.00 C ATOM 872 CD1 ILE B 226 92.648 -2.753 -1.602 1.00 0.00 C ATOM 0 H ILE B 226 89.592 -5.087 -0.729 1.00 0.00 H new ATOM 0 HA ILE B 226 91.187 -6.764 -2.501 1.00 0.00 H new ATOM 0 HB ILE B 226 92.062 -5.087 -0.052 1.00 0.00 H new ATOM 0 HG12 ILE B 226 91.854 -4.194 -3.023 1.00 0.00 H new ATOM 0 HG13 ILE B 226 90.711 -3.723 -1.781 1.00 0.00 H new ATOM 0 HG21 ILE B 226 94.326 -4.986 -1.193 1.00 0.00 H new ATOM 0 HG22 ILE B 226 93.870 -6.666 -0.825 1.00 0.00 H new ATOM 0 HG23 ILE B 226 93.721 -6.048 -2.487 1.00 0.00 H new ATOM 0 HD11 ILE B 226 92.346 -1.896 -2.204 1.00 0.00 H new ATOM 0 HD12 ILE B 226 92.531 -2.513 -0.545 1.00 0.00 H new ATOM 0 HD13 ILE B 226 93.692 -2.991 -1.807 1.00 0.00 H new ATOM 884 N VAL B 227 91.017 -7.578 0.746 1.00 0.00 N ATOM 885 CA VAL B 227 91.245 -8.641 1.812 1.00 0.00 C ATOM 886 C VAL B 227 90.334 -9.894 1.623 1.00 0.00 C ATOM 887 O VAL B 227 90.759 -10.993 1.917 1.00 0.00 O ATOM 888 CB VAL B 227 91.051 -7.965 3.258 1.00 0.00 C ATOM 889 CG1 VAL B 227 91.272 -9.009 4.462 1.00 0.00 C ATOM 890 CG2 VAL B 227 92.062 -6.725 3.425 1.00 0.00 C ATOM 0 H VAL B 227 90.617 -6.717 1.118 1.00 0.00 H new ATOM 0 HA VAL B 227 92.264 -9.018 1.719 1.00 0.00 H new ATOM 0 HB VAL B 227 90.019 -7.618 3.313 1.00 0.00 H new ATOM 0 HG11 VAL B 227 91.129 -8.500 5.415 1.00 0.00 H new ATOM 0 HG12 VAL B 227 90.553 -9.823 4.374 1.00 0.00 H new ATOM 0 HG13 VAL B 227 92.284 -9.411 4.414 1.00 0.00 H new ATOM 0 HG21 VAL B 227 91.924 -6.273 4.407 1.00 0.00 H new ATOM 0 HG22 VAL B 227 93.089 -7.077 3.329 1.00 0.00 H new ATOM 0 HG23 VAL B 227 91.859 -5.983 2.652 1.00 0.00 H new ATOM 900 N ALA B 228 89.061 -9.712 1.199 1.00 0.00 N ATOM 901 CA ALA B 228 88.062 -10.874 1.076 1.00 0.00 C ATOM 902 C ALA B 228 88.564 -11.988 0.103 1.00 0.00 C ATOM 903 O ALA B 228 88.552 -13.168 0.443 1.00 0.00 O ATOM 904 CB ALA B 228 86.677 -10.290 0.608 1.00 0.00 C ATOM 0 H ALA B 228 88.678 -8.804 0.934 1.00 0.00 H new ATOM 0 HA ALA B 228 87.956 -11.353 2.049 1.00 0.00 H new ATOM 0 HB1 ALA B 228 85.953 -11.100 0.515 1.00 0.00 H new ATOM 0 HB2 ALA B 228 86.320 -9.567 1.342 1.00 0.00 H new ATOM 0 HB3 ALA B 228 86.797 -9.798 -0.357 1.00 0.00 H new ATOM 910 N VAL B 229 89.034 -11.578 -1.090 1.00 0.00 N ATOM 911 CA VAL B 229 89.600 -12.526 -2.143 1.00 0.00 C ATOM 912 C VAL B 229 90.958 -13.102 -1.634 1.00 0.00 C ATOM 913 O VAL B 229 91.313 -14.230 -1.940 1.00 0.00 O ATOM 914 CB VAL B 229 89.715 -11.765 -3.550 1.00 0.00 C ATOM 915 CG1 VAL B 229 90.588 -10.438 -3.422 1.00 0.00 C ATOM 916 CG2 VAL B 229 90.297 -12.726 -4.697 1.00 0.00 C ATOM 0 H VAL B 229 89.045 -10.599 -1.376 1.00 0.00 H new ATOM 0 HA VAL B 229 88.934 -13.374 -2.305 1.00 0.00 H new ATOM 0 HB VAL B 229 88.706 -11.476 -3.843 1.00 0.00 H new ATOM 0 HG11 VAL B 229 90.647 -9.946 -4.393 1.00 0.00 H new ATOM 0 HG12 VAL B 229 90.123 -9.765 -2.701 1.00 0.00 H new ATOM 0 HG13 VAL B 229 91.592 -10.694 -3.084 1.00 0.00 H new ATOM 0 HG21 VAL B 229 90.360 -12.175 -5.636 1.00 0.00 H new ATOM 0 HG22 VAL B 229 91.290 -13.073 -4.412 1.00 0.00 H new ATOM 0 HG23 VAL B 229 89.636 -13.583 -4.823 1.00 0.00 H new ATOM 926 N PHE B 230 91.721 -12.272 -0.873 1.00 0.00 N ATOM 927 CA PHE B 230 93.095 -12.664 -0.307 1.00 0.00 C ATOM 928 C PHE B 230 92.983 -13.885 0.664 1.00 0.00 C ATOM 929 O PHE B 230 93.804 -14.793 0.622 1.00 0.00 O ATOM 930 CB PHE B 230 93.725 -11.403 0.440 1.00 0.00 C ATOM 931 CG PHE B 230 95.314 -11.454 0.519 1.00 0.00 C ATOM 932 CD1 PHE B 230 96.132 -10.611 -0.313 1.00 0.00 C ATOM 933 CD2 PHE B 230 95.964 -12.337 1.436 1.00 0.00 C ATOM 934 CE1 PHE B 230 97.538 -10.657 -0.219 1.00 0.00 C ATOM 935 CE2 PHE B 230 97.378 -12.373 1.516 1.00 0.00 C ATOM 936 CZ PHE B 230 98.161 -11.535 0.691 1.00 0.00 C ATOM 0 H PHE B 230 91.433 -11.326 -0.623 1.00 0.00 H new ATOM 0 HA PHE B 230 93.745 -12.966 -1.128 1.00 0.00 H new ATOM 0 HB2 PHE B 230 93.422 -10.493 -0.078 1.00 0.00 H new ATOM 0 HB3 PHE B 230 93.319 -11.346 1.450 1.00 0.00 H new ATOM 0 HD1 PHE B 230 95.664 -9.937 -1.016 1.00 0.00 H new ATOM 0 HD2 PHE B 230 95.374 -12.980 2.072 1.00 0.00 H new ATOM 0 HE1 PHE B 230 98.140 -10.017 -0.847 1.00 0.00 H new ATOM 0 HE2 PHE B 230 97.860 -13.044 2.211 1.00 0.00 H new ATOM 0 HZ PHE B 230 99.238 -11.567 0.758 1.00 0.00 H new ATOM 946 N VAL B 231 91.935 -13.871 1.543 1.00 0.00 N ATOM 947 CA VAL B 231 91.682 -14.993 2.561 1.00 0.00 C ATOM 948 C VAL B 231 91.312 -16.316 1.821 1.00 0.00 C ATOM 949 O VAL B 231 91.599 -17.393 2.316 1.00 0.00 O ATOM 950 CB VAL B 231 90.550 -14.528 3.601 1.00 0.00 C ATOM 951 CG1 VAL B 231 90.103 -15.706 4.603 1.00 0.00 C ATOM 952 CG2 VAL B 231 91.072 -13.270 4.459 1.00 0.00 C ATOM 0 H VAL B 231 91.250 -13.117 1.584 1.00 0.00 H new ATOM 0 HA VAL B 231 92.589 -15.194 3.132 1.00 0.00 H new ATOM 0 HB VAL B 231 89.677 -14.249 3.011 1.00 0.00 H new ATOM 0 HG11 VAL B 231 89.336 -15.334 5.283 1.00 0.00 H new ATOM 0 HG12 VAL B 231 89.704 -16.541 4.028 1.00 0.00 H new ATOM 0 HG13 VAL B 231 90.966 -16.041 5.178 1.00 0.00 H new ATOM 0 HG21 VAL B 231 90.297 -12.962 5.161 1.00 0.00 H new ATOM 0 HG22 VAL B 231 91.969 -13.552 5.009 1.00 0.00 H new ATOM 0 HG23 VAL B 231 91.303 -12.443 3.788 1.00 0.00 H new ATOM 962 N CYS B 232 90.640 -16.215 0.644 1.00 0.00 N ATOM 963 CA CYS B 232 90.203 -17.440 -0.160 1.00 0.00 C ATOM 964 C CYS B 232 91.441 -18.235 -0.687 1.00 0.00 C ATOM 965 O CYS B 232 91.491 -19.453 -0.588 1.00 0.00 O ATOM 966 CB CYS B 232 89.278 -16.979 -1.349 1.00 0.00 C ATOM 967 SG CYS B 232 88.559 -18.409 -2.226 1.00 0.00 S ATOM 0 H CYS B 232 90.382 -15.325 0.217 1.00 0.00 H new ATOM 0 HA CYS B 232 89.640 -18.111 0.489 1.00 0.00 H new ATOM 0 HB2 CYS B 232 88.478 -16.346 -0.965 1.00 0.00 H new ATOM 0 HB3 CYS B 232 89.856 -16.374 -2.048 1.00 0.00 H new ATOM 0 HG CYS B 232 87.803 -17.988 -3.196 1.00 0.00 H new ATOM 973 N LYS B 233 92.423 -17.497 -1.263 1.00 0.00 N ATOM 974 CA LYS B 233 93.695 -18.099 -1.851 1.00 0.00 C ATOM 975 C LYS B 233 94.670 -18.543 -0.730 1.00 0.00 C ATOM 976 O LYS B 233 95.498 -19.416 -0.948 1.00 0.00 O ATOM 977 CB LYS B 233 94.360 -17.019 -2.811 1.00 0.00 C ATOM 978 CG LYS B 233 93.422 -16.679 -4.066 1.00 0.00 C ATOM 979 CD LYS B 233 94.067 -15.560 -5.013 1.00 0.00 C ATOM 980 CE LYS B 233 93.163 -15.269 -6.279 1.00 0.00 C ATOM 981 NZ LYS B 233 93.093 -16.499 -7.118 1.00 0.00 N ATOM 0 H LYS B 233 92.379 -16.481 -1.344 1.00 0.00 H new ATOM 0 HA LYS B 233 93.453 -18.994 -2.425 1.00 0.00 H new ATOM 0 HB2 LYS B 233 94.559 -16.107 -2.249 1.00 0.00 H new ATOM 0 HB3 LYS B 233 95.321 -17.391 -3.166 1.00 0.00 H new ATOM 0 HG2 LYS B 233 93.248 -17.586 -4.644 1.00 0.00 H new ATOM 0 HG3 LYS B 233 92.451 -16.336 -3.710 1.00 0.00 H new ATOM 0 HD2 LYS B 233 94.205 -14.640 -4.446 1.00 0.00 H new ATOM 0 HD3 LYS B 233 95.055 -15.885 -5.339 1.00 0.00 H new ATOM 0 HE2 LYS B 233 92.163 -14.969 -5.967 1.00 0.00 H new ATOM 0 HE3 LYS B 233 93.578 -14.443 -6.856 1.00 0.00 H new ATOM 0 HZ1 LYS B 233 92.662 -16.269 -8.036 1.00 0.00 H new ATOM 0 HZ2 LYS B 233 94.052 -16.871 -7.269 1.00 0.00 H new ATOM 0 HZ3 LYS B 233 92.516 -17.216 -6.635 1.00 0.00 H new ATOM 995 N SER B 234 94.568 -17.915 0.468 1.00 0.00 N ATOM 996 CA SER B 234 95.478 -18.243 1.651 1.00 0.00 C ATOM 997 C SER B 234 95.241 -19.693 2.152 1.00 0.00 C ATOM 998 O SER B 234 96.162 -20.346 2.619 1.00 0.00 O ATOM 999 CB SER B 234 95.234 -17.215 2.814 1.00 0.00 C ATOM 1000 OG SER B 234 93.968 -17.453 3.420 1.00 0.00 O ATOM 0 H SER B 234 93.883 -17.185 0.663 1.00 0.00 H new ATOM 0 HA SER B 234 96.514 -18.168 1.320 1.00 0.00 H new ATOM 0 HB2 SER B 234 96.025 -17.303 3.559 1.00 0.00 H new ATOM 0 HB3 SER B 234 95.274 -16.198 2.425 1.00 0.00 H new ATOM 0 HG SER B 234 93.270 -17.451 2.732 1.00 0.00 H new ATOM 1006 N LEU B 235 93.967 -20.160 2.054 1.00 0.00 N ATOM 1007 CA LEU B 235 93.526 -21.554 2.508 1.00 0.00 C ATOM 1008 C LEU B 235 93.641 -22.585 1.341 1.00 0.00 C ATOM 1009 O LEU B 235 93.683 -23.783 1.585 1.00 0.00 O ATOM 1010 CB LEU B 235 92.030 -21.471 3.049 1.00 0.00 C ATOM 1011 CG LEU B 235 91.836 -20.387 4.236 1.00 0.00 C ATOM 1012 CD1 LEU B 235 90.297 -20.242 4.627 1.00 0.00 C ATOM 1013 CD2 LEU B 235 92.705 -20.743 5.526 1.00 0.00 C ATOM 0 H LEU B 235 93.205 -19.604 1.665 1.00 0.00 H new ATOM 0 HA LEU B 235 94.182 -21.897 3.308 1.00 0.00 H new ATOM 0 HB2 LEU B 235 91.366 -21.217 2.223 1.00 0.00 H new ATOM 0 HB3 LEU B 235 91.727 -22.454 3.411 1.00 0.00 H new ATOM 0 HG LEU B 235 92.195 -19.431 3.854 1.00 0.00 H new ATOM 0 HD11 LEU B 235 90.192 -19.508 5.426 1.00 0.00 H new ATOM 0 HD12 LEU B 235 89.730 -19.913 3.756 1.00 0.00 H new ATOM 0 HD13 LEU B 235 89.915 -21.205 4.966 1.00 0.00 H new ATOM 0 HD21 LEU B 235 92.542 -19.988 6.295 1.00 0.00 H new ATOM 0 HD22 LEU B 235 92.406 -21.719 5.908 1.00 0.00 H new ATOM 0 HD23 LEU B 235 93.761 -20.766 5.258 1.00 0.00 H new ATOM 1025 N LEU B 236 93.658 -22.090 0.076 1.00 0.00 N ATOM 1026 CA LEU B 236 93.737 -22.979 -1.183 1.00 0.00 C ATOM 1027 C LEU B 236 95.226 -23.406 -1.414 1.00 0.00 C ATOM 1028 O LEU B 236 95.494 -24.407 -2.054 1.00 0.00 O ATOM 1029 CB LEU B 236 93.120 -22.176 -2.443 1.00 0.00 C ATOM 1030 CG LEU B 236 92.251 -23.081 -3.471 1.00 0.00 C ATOM 1031 CD1 LEU B 236 91.603 -22.189 -4.620 1.00 0.00 C ATOM 1032 CD2 LEU B 236 93.123 -24.252 -4.094 1.00 0.00 C ATOM 0 H LEU B 236 93.620 -21.092 -0.131 1.00 0.00 H new ATOM 0 HA LEU B 236 93.149 -23.888 -1.057 1.00 0.00 H new ATOM 0 HB2 LEU B 236 92.488 -21.371 -2.068 1.00 0.00 H new ATOM 0 HB3 LEU B 236 93.937 -21.710 -2.994 1.00 0.00 H new ATOM 0 HG LEU B 236 91.442 -23.535 -2.898 1.00 0.00 H new ATOM 0 HD11 LEU B 236 91.027 -22.824 -5.293 1.00 0.00 H new ATOM 0 HD12 LEU B 236 90.946 -21.443 -4.174 1.00 0.00 H new ATOM 0 HD13 LEU B 236 92.392 -21.688 -5.181 1.00 0.00 H new ATOM 0 HD21 LEU B 236 92.509 -24.838 -4.778 1.00 0.00 H new ATOM 0 HD22 LEU B 236 93.967 -23.828 -4.637 1.00 0.00 H new ATOM 0 HD23 LEU B 236 93.492 -24.895 -3.295 1.00 0.00 H new ATOM 1214 N LEU C 211 88.381 8.984 17.423 1.00 0.00 N ATOM 1215 CA LEU C 211 87.549 8.027 16.567 1.00 0.00 C ATOM 1216 C LEU C 211 87.302 8.661 15.166 1.00 0.00 C ATOM 1217 O LEU C 211 87.250 7.973 14.168 1.00 0.00 O ATOM 1218 CB LEU C 211 86.175 7.590 17.307 1.00 0.00 C ATOM 1219 CG LEU C 211 85.698 6.072 17.007 1.00 0.00 C ATOM 1220 CD1 LEU C 211 84.357 5.725 17.793 1.00 0.00 C ATOM 1221 CD2 LEU C 211 85.535 5.803 15.449 1.00 0.00 C ATOM 0 HA LEU C 211 88.109 7.103 16.426 1.00 0.00 H new ATOM 0 HB2 LEU C 211 86.304 7.710 18.383 1.00 0.00 H new ATOM 0 HB3 LEU C 211 85.382 8.273 17.003 1.00 0.00 H new ATOM 0 HG LEU C 211 86.482 5.408 17.371 1.00 0.00 H new ATOM 0 HD11 LEU C 211 84.061 4.700 17.572 1.00 0.00 H new ATOM 0 HD12 LEU C 211 84.525 5.831 18.865 1.00 0.00 H new ATOM 0 HD13 LEU C 211 83.566 6.406 17.481 1.00 0.00 H new ATOM 0 HD21 LEU C 211 85.214 4.774 15.289 1.00 0.00 H new ATOM 0 HD22 LEU C 211 84.789 6.484 15.038 1.00 0.00 H new ATOM 0 HD23 LEU C 211 86.490 5.967 14.950 1.00 0.00 H new ATOM 1233 N SER C 212 87.169 10.008 15.119 1.00 0.00 N ATOM 1234 CA SER C 212 86.937 10.783 13.823 1.00 0.00 C ATOM 1235 C SER C 212 88.186 10.681 12.917 1.00 0.00 C ATOM 1236 O SER C 212 88.077 10.548 11.710 1.00 0.00 O ATOM 1237 CB SER C 212 86.643 12.285 14.160 1.00 0.00 C ATOM 1238 OG SER C 212 87.774 12.847 14.818 1.00 0.00 O ATOM 0 H SER C 212 87.214 10.601 15.947 1.00 0.00 H new ATOM 0 HA SER C 212 86.084 10.357 13.295 1.00 0.00 H new ATOM 0 HB2 SER C 212 86.426 12.839 13.247 1.00 0.00 H new ATOM 0 HB3 SER C 212 85.762 12.362 14.797 1.00 0.00 H new ATOM 0 HG SER C 212 87.596 13.787 15.029 1.00 0.00 H new ATOM 1244 N GLY C 213 89.367 10.753 13.563 1.00 0.00 N ATOM 1245 CA GLY C 213 90.719 10.684 12.874 1.00 0.00 C ATOM 1246 C GLY C 213 90.934 9.348 12.137 1.00 0.00 C ATOM 1247 O GLY C 213 91.600 9.292 11.113 1.00 0.00 O ATOM 0 H GLY C 213 89.436 10.860 14.575 1.00 0.00 H new ATOM 0 HA2 GLY C 213 90.804 11.506 12.163 1.00 0.00 H new ATOM 0 HA3 GLY C 213 91.508 10.819 13.614 1.00 0.00 H new ATOM 1251 N ILE C 214 90.351 8.263 12.707 1.00 0.00 N ATOM 1252 CA ILE C 214 90.450 6.849 12.145 1.00 0.00 C ATOM 1253 C ILE C 214 89.722 6.771 10.762 1.00 0.00 C ATOM 1254 O ILE C 214 90.167 6.072 9.859 1.00 0.00 O ATOM 1255 CB ILE C 214 89.852 5.826 13.224 1.00 0.00 C ATOM 1256 CG1 ILE C 214 90.566 6.029 14.673 1.00 0.00 C ATOM 1257 CG2 ILE C 214 89.975 4.303 12.754 1.00 0.00 C ATOM 1258 CD1 ILE C 214 92.113 5.810 14.679 1.00 0.00 C ATOM 0 H ILE C 214 89.799 8.319 13.563 1.00 0.00 H new ATOM 0 HA ILE C 214 91.489 6.574 11.963 1.00 0.00 H new ATOM 0 HB ILE C 214 88.790 6.053 13.316 1.00 0.00 H new ATOM 0 HG12 ILE C 214 90.355 7.038 15.028 1.00 0.00 H new ATOM 0 HG13 ILE C 214 90.113 5.339 15.385 1.00 0.00 H new ATOM 0 HG21 ILE C 214 89.556 3.651 13.520 1.00 0.00 H new ATOM 0 HG22 ILE C 214 89.429 4.165 11.821 1.00 0.00 H new ATOM 0 HG23 ILE C 214 91.025 4.053 12.600 1.00 0.00 H new ATOM 0 HD11 ILE C 214 92.499 5.967 15.686 1.00 0.00 H new ATOM 0 HD12 ILE C 214 92.338 4.793 14.359 1.00 0.00 H new ATOM 0 HD13 ILE C 214 92.583 6.518 13.996 1.00 0.00 H new ATOM 1270 N ILE C 215 88.589 7.511 10.632 1.00 0.00 N ATOM 1271 CA ILE C 215 87.748 7.561 9.352 1.00 0.00 C ATOM 1272 C ILE C 215 88.576 8.184 8.187 1.00 0.00 C ATOM 1273 O ILE C 215 88.397 7.831 7.035 1.00 0.00 O ATOM 1274 CB ILE C 215 86.380 8.366 9.604 1.00 0.00 C ATOM 1275 CG1 ILE C 215 85.617 7.811 10.921 1.00 0.00 C ATOM 1276 CG2 ILE C 215 85.404 8.304 8.331 1.00 0.00 C ATOM 1277 CD1 ILE C 215 85.257 6.292 10.879 1.00 0.00 C ATOM 0 H ILE C 215 88.216 8.090 11.385 1.00 0.00 H new ATOM 0 HA ILE C 215 87.480 6.544 9.065 1.00 0.00 H new ATOM 0 HB ILE C 215 86.649 9.410 9.766 1.00 0.00 H new ATOM 0 HG12 ILE C 215 86.245 7.997 11.793 1.00 0.00 H new ATOM 0 HG13 ILE C 215 84.700 8.383 11.060 1.00 0.00 H new ATOM 0 HG21 ILE C 215 84.492 8.861 8.545 1.00 0.00 H new ATOM 0 HG22 ILE C 215 85.904 8.744 7.468 1.00 0.00 H new ATOM 0 HG23 ILE C 215 85.153 7.265 8.115 1.00 0.00 H new ATOM 0 HD11 ILE C 215 84.750 6.013 11.802 1.00 0.00 H new ATOM 0 HD12 ILE C 215 84.601 6.097 10.031 1.00 0.00 H new ATOM 0 HD13 ILE C 215 86.169 5.705 10.774 1.00 0.00 H new ATOM 1289 N ILE C 216 89.454 9.158 8.521 1.00 0.00 N ATOM 1290 CA ILE C 216 90.331 9.874 7.496 1.00 0.00 C ATOM 1291 C ILE C 216 91.409 8.878 6.950 1.00 0.00 C ATOM 1292 O ILE C 216 91.726 8.857 5.773 1.00 0.00 O ATOM 1293 CB ILE C 216 91.035 11.159 8.168 1.00 0.00 C ATOM 1294 CG1 ILE C 216 89.977 12.031 9.028 1.00 0.00 C ATOM 1295 CG2 ILE C 216 91.753 12.079 7.068 1.00 0.00 C ATOM 1296 CD1 ILE C 216 88.740 12.528 8.230 1.00 0.00 C ATOM 0 H ILE C 216 89.592 9.482 9.478 1.00 0.00 H new ATOM 0 HA ILE C 216 89.713 10.219 6.667 1.00 0.00 H new ATOM 0 HB ILE C 216 91.800 10.784 8.848 1.00 0.00 H new ATOM 0 HG12 ILE C 216 89.631 11.430 9.869 1.00 0.00 H new ATOM 0 HG13 ILE C 216 90.494 12.895 9.445 1.00 0.00 H new ATOM 0 HG21 ILE C 216 92.217 12.936 7.557 1.00 0.00 H new ATOM 0 HG22 ILE C 216 92.517 11.499 6.551 1.00 0.00 H new ATOM 0 HG23 ILE C 216 91.014 12.429 6.348 1.00 0.00 H new ATOM 0 HD11 ILE C 216 88.089 13.102 8.889 1.00 0.00 H new ATOM 0 HD12 ILE C 216 89.069 13.159 7.405 1.00 0.00 H new ATOM 0 HD13 ILE C 216 88.193 11.671 7.836 1.00 0.00 H new ATOM 1308 N TYR C 217 91.999 8.117 7.901 1.00 0.00 N ATOM 1309 CA TYR C 217 93.135 7.130 7.648 1.00 0.00 C ATOM 1310 C TYR C 217 92.752 5.879 6.785 1.00 0.00 C ATOM 1311 O TYR C 217 93.546 5.463 5.946 1.00 0.00 O ATOM 1312 CB TYR C 217 93.704 6.685 9.060 1.00 0.00 C ATOM 1313 CG TYR C 217 95.012 5.789 8.926 1.00 0.00 C ATOM 1314 CD1 TYR C 217 96.251 6.391 8.537 1.00 0.00 C ATOM 1315 CD2 TYR C 217 94.993 4.373 9.168 1.00 0.00 C ATOM 1316 CE1 TYR C 217 97.417 5.603 8.401 1.00 0.00 C ATOM 1317 CE2 TYR C 217 96.176 3.611 9.024 1.00 0.00 C ATOM 1318 CZ TYR C 217 97.373 4.227 8.644 1.00 0.00 C ATOM 1319 OH TYR C 217 98.522 3.469 8.506 1.00 0.00 O ATOM 0 H TYR C 217 91.716 8.153 8.880 1.00 0.00 H new ATOM 0 HA TYR C 217 93.885 7.644 7.047 1.00 0.00 H new ATOM 0 HB2 TYR C 217 93.932 7.570 9.653 1.00 0.00 H new ATOM 0 HB3 TYR C 217 92.938 6.128 9.599 1.00 0.00 H new ATOM 0 HD1 TYR C 217 96.295 7.453 8.346 1.00 0.00 H new ATOM 0 HD2 TYR C 217 94.073 3.889 9.461 1.00 0.00 H new ATOM 0 HE1 TYR C 217 98.347 6.067 8.108 1.00 0.00 H new ATOM 0 HE2 TYR C 217 96.155 2.547 9.209 1.00 0.00 H new ATOM 0 HH TYR C 217 98.322 2.532 8.712 1.00 0.00 H new ATOM 1329 N VAL C 218 91.572 5.235 7.040 1.00 0.00 N ATOM 1330 CA VAL C 218 91.166 3.947 6.290 1.00 0.00 C ATOM 1331 C VAL C 218 91.124 4.174 4.746 1.00 0.00 C ATOM 1332 O VAL C 218 91.481 3.290 3.975 1.00 0.00 O ATOM 1333 CB VAL C 218 89.777 3.394 6.877 1.00 0.00 C ATOM 1334 CG1 VAL C 218 88.609 4.458 6.695 1.00 0.00 C ATOM 1335 CG2 VAL C 218 89.370 1.984 6.225 1.00 0.00 C ATOM 0 H VAL C 218 90.890 5.552 7.729 1.00 0.00 H new ATOM 0 HA VAL C 218 91.924 3.182 6.456 1.00 0.00 H new ATOM 0 HB VAL C 218 89.925 3.231 7.944 1.00 0.00 H new ATOM 0 HG11 VAL C 218 87.682 4.054 7.102 1.00 0.00 H new ATOM 0 HG12 VAL C 218 88.868 5.376 7.223 1.00 0.00 H new ATOM 0 HG13 VAL C 218 88.476 4.674 5.635 1.00 0.00 H new ATOM 0 HG21 VAL C 218 88.425 1.646 6.650 1.00 0.00 H new ATOM 0 HG22 VAL C 218 89.263 2.099 5.146 1.00 0.00 H new ATOM 0 HG23 VAL C 218 90.146 1.248 6.436 1.00 0.00 H new ATOM 1345 N THR C 219 90.676 5.381 4.326 1.00 0.00 N ATOM 1346 CA THR C 219 90.572 5.774 2.855 1.00 0.00 C ATOM 1347 C THR C 219 91.975 5.860 2.198 1.00 0.00 C ATOM 1348 O THR C 219 92.194 5.327 1.122 1.00 0.00 O ATOM 1349 CB THR C 219 89.851 7.187 2.737 1.00 0.00 C ATOM 1350 OG1 THR C 219 90.693 8.184 3.309 1.00 0.00 O ATOM 1351 CG2 THR C 219 88.486 7.230 3.510 1.00 0.00 C ATOM 0 H THR C 219 90.375 6.116 4.966 1.00 0.00 H new ATOM 0 HA THR C 219 89.994 5.010 2.336 1.00 0.00 H new ATOM 0 HB THR C 219 89.660 7.363 1.678 1.00 0.00 H new ATOM 0 HG1 THR C 219 90.801 8.010 4.267 1.00 0.00 H new ATOM 0 HG21 THR C 219 88.035 8.216 3.398 1.00 0.00 H new ATOM 0 HG22 THR C 219 87.813 6.475 3.103 1.00 0.00 H new ATOM 0 HG23 THR C 219 88.660 7.029 4.567 1.00 0.00 H new ATOM 1359 N VAL C 220 92.909 6.567 2.879 1.00 0.00 N ATOM 1360 CA VAL C 220 94.335 6.777 2.381 1.00 0.00 C ATOM 1361 C VAL C 220 95.118 5.438 2.446 1.00 0.00 C ATOM 1362 O VAL C 220 95.972 5.174 1.610 1.00 0.00 O ATOM 1363 CB VAL C 220 95.032 7.932 3.257 1.00 0.00 C ATOM 1364 CG1 VAL C 220 96.532 8.237 2.768 1.00 0.00 C ATOM 1365 CG2 VAL C 220 94.154 9.278 3.195 1.00 0.00 C ATOM 0 H VAL C 220 92.723 7.011 3.778 1.00 0.00 H new ATOM 0 HA VAL C 220 94.332 7.099 1.340 1.00 0.00 H new ATOM 0 HB VAL C 220 95.085 7.574 4.285 1.00 0.00 H new ATOM 0 HG11 VAL C 220 96.964 9.023 3.387 1.00 0.00 H new ATOM 0 HG12 VAL C 220 97.134 7.333 2.857 1.00 0.00 H new ATOM 0 HG13 VAL C 220 96.517 8.562 1.728 1.00 0.00 H new ATOM 0 HG21 VAL C 220 94.635 10.054 3.791 1.00 0.00 H new ATOM 0 HG22 VAL C 220 94.074 9.613 2.161 1.00 0.00 H new ATOM 0 HG23 VAL C 220 93.158 9.081 3.591 1.00 0.00 H new ATOM 1375 N ALA C 221 94.814 4.611 3.479 1.00 0.00 N ATOM 1376 CA ALA C 221 95.504 3.272 3.704 1.00 0.00 C ATOM 1377 C ALA C 221 95.284 2.298 2.506 1.00 0.00 C ATOM 1378 O ALA C 221 96.153 1.494 2.189 1.00 0.00 O ATOM 1379 CB ALA C 221 94.971 2.647 5.045 1.00 0.00 C ATOM 0 H ALA C 221 94.102 4.828 4.177 1.00 0.00 H new ATOM 0 HA ALA C 221 96.579 3.437 3.777 1.00 0.00 H new ATOM 0 HB1 ALA C 221 95.458 1.687 5.218 1.00 0.00 H new ATOM 0 HB2 ALA C 221 95.192 3.320 5.873 1.00 0.00 H new ATOM 0 HB3 ALA C 221 93.893 2.500 4.975 1.00 0.00 H new ATOM 1385 N ALA C 222 94.085 2.363 1.874 1.00 0.00 N ATOM 1386 CA ALA C 222 93.730 1.464 0.702 1.00 0.00 C ATOM 1387 C ALA C 222 94.541 1.840 -0.574 1.00 0.00 C ATOM 1388 O ALA C 222 94.944 0.973 -1.327 1.00 0.00 O ATOM 1389 CB ALA C 222 92.182 1.577 0.442 1.00 0.00 C ATOM 0 H ALA C 222 93.344 3.013 2.137 1.00 0.00 H new ATOM 0 HA ALA C 222 93.991 0.434 0.944 1.00 0.00 H new ATOM 0 HB1 ALA C 222 91.906 0.938 -0.397 1.00 0.00 H new ATOM 0 HB2 ALA C 222 91.639 1.260 1.333 1.00 0.00 H new ATOM 0 HB3 ALA C 222 91.927 2.611 0.210 1.00 0.00 H new ATOM 1395 N VAL C 223 94.720 3.161 -0.815 1.00 0.00 N ATOM 1396 CA VAL C 223 95.444 3.695 -2.051 1.00 0.00 C ATOM 1397 C VAL C 223 96.962 3.330 -2.041 1.00 0.00 C ATOM 1398 O VAL C 223 97.495 2.933 -3.073 1.00 0.00 O ATOM 1399 CB VAL C 223 95.200 5.281 -2.157 1.00 0.00 C ATOM 1400 CG1 VAL C 223 95.900 5.920 -3.457 1.00 0.00 C ATOM 1401 CG2 VAL C 223 93.624 5.598 -2.181 1.00 0.00 C ATOM 0 H VAL C 223 94.384 3.893 -0.189 1.00 0.00 H new ATOM 0 HA VAL C 223 95.032 3.217 -2.940 1.00 0.00 H new ATOM 0 HB VAL C 223 95.657 5.736 -1.278 1.00 0.00 H new ATOM 0 HG11 VAL C 223 95.707 6.992 -3.484 1.00 0.00 H new ATOM 0 HG12 VAL C 223 96.975 5.746 -3.414 1.00 0.00 H new ATOM 0 HG13 VAL C 223 95.493 5.455 -4.355 1.00 0.00 H new ATOM 0 HG21 VAL C 223 93.471 6.675 -2.253 1.00 0.00 H new ATOM 0 HG22 VAL C 223 93.167 5.108 -3.041 1.00 0.00 H new ATOM 0 HG23 VAL C 223 93.164 5.226 -1.265 1.00 0.00 H new ATOM 1411 N VAL C 224 97.669 3.497 -0.882 1.00 0.00 N ATOM 1412 CA VAL C 224 99.171 3.197 -0.805 1.00 0.00 C ATOM 1413 C VAL C 224 99.443 1.677 -1.004 1.00 0.00 C ATOM 1414 O VAL C 224 100.467 1.296 -1.543 1.00 0.00 O ATOM 1415 CB VAL C 224 99.781 3.752 0.579 1.00 0.00 C ATOM 1416 CG1 VAL C 224 99.505 5.329 0.709 1.00 0.00 C ATOM 1417 CG2 VAL C 224 99.158 2.987 1.837 1.00 0.00 C ATOM 0 H VAL C 224 97.259 3.825 -0.007 1.00 0.00 H new ATOM 0 HA VAL C 224 99.679 3.717 -1.617 1.00 0.00 H new ATOM 0 HB VAL C 224 100.856 3.570 0.569 1.00 0.00 H new ATOM 0 HG11 VAL C 224 99.921 5.695 1.648 1.00 0.00 H new ATOM 0 HG12 VAL C 224 99.976 5.851 -0.124 1.00 0.00 H new ATOM 0 HG13 VAL C 224 98.431 5.513 0.692 1.00 0.00 H new ATOM 0 HG21 VAL C 224 99.590 3.385 2.755 1.00 0.00 H new ATOM 0 HG22 VAL C 224 98.078 3.131 1.852 1.00 0.00 H new ATOM 0 HG23 VAL C 224 99.381 1.923 1.762 1.00 0.00 H new ATOM 1427 N LEU C 225 98.493 0.819 -0.535 1.00 0.00 N ATOM 1428 CA LEU C 225 98.620 -0.702 -0.631 1.00 0.00 C ATOM 1429 C LEU C 225 98.715 -1.167 -2.117 1.00 0.00 C ATOM 1430 O LEU C 225 99.516 -2.033 -2.451 1.00 0.00 O ATOM 1431 CB LEU C 225 97.376 -1.339 0.118 1.00 0.00 C ATOM 1432 CG LEU C 225 97.317 -2.959 0.111 1.00 0.00 C ATOM 1433 CD1 LEU C 225 98.619 -3.614 0.737 1.00 0.00 C ATOM 1434 CD2 LEU C 225 96.007 -3.470 0.869 1.00 0.00 C ATOM 0 H LEU C 225 97.631 1.131 -0.087 1.00 0.00 H new ATOM 0 HA LEU C 225 99.541 -1.038 -0.154 1.00 0.00 H new ATOM 0 HB2 LEU C 225 97.382 -0.997 1.153 1.00 0.00 H new ATOM 0 HB3 LEU C 225 96.463 -0.957 -0.339 1.00 0.00 H new ATOM 0 HG LEU C 225 97.273 -3.277 -0.931 1.00 0.00 H new ATOM 0 HD11 LEU C 225 98.530 -4.700 0.709 1.00 0.00 H new ATOM 0 HD12 LEU C 225 99.493 -3.307 0.163 1.00 0.00 H new ATOM 0 HD13 LEU C 225 98.730 -3.286 1.770 1.00 0.00 H new ATOM 0 HD21 LEU C 225 95.981 -4.560 0.856 1.00 0.00 H new ATOM 0 HD22 LEU C 225 96.024 -3.119 1.901 1.00 0.00 H new ATOM 0 HD23 LEU C 225 95.121 -3.080 0.368 1.00 0.00 H new ATOM 1446 N ILE C 226 97.865 -0.571 -2.991 1.00 0.00 N ATOM 1447 CA ILE C 226 97.818 -0.913 -4.479 1.00 0.00 C ATOM 1448 C ILE C 226 99.107 -0.390 -5.193 1.00 0.00 C ATOM 1449 O ILE C 226 99.744 -1.103 -5.930 1.00 0.00 O ATOM 1450 CB ILE C 226 96.489 -0.273 -5.124 1.00 0.00 C ATOM 1451 CG1 ILE C 226 95.174 -0.809 -4.340 1.00 0.00 C ATOM 1452 CG2 ILE C 226 96.376 -0.606 -6.697 1.00 0.00 C ATOM 1453 CD1 ILE C 226 93.862 -0.079 -4.768 1.00 0.00 C ATOM 0 H ILE C 226 97.197 0.148 -2.715 1.00 0.00 H new ATOM 0 HA ILE C 226 97.784 -1.994 -4.611 1.00 0.00 H new ATOM 0 HB ILE C 226 96.553 0.810 -5.017 1.00 0.00 H new ATOM 0 HG12 ILE C 226 95.062 -1.878 -4.520 1.00 0.00 H new ATOM 0 HG13 ILE C 226 95.321 -0.680 -3.268 1.00 0.00 H new ATOM 0 HG21 ILE C 226 95.467 -0.158 -7.099 1.00 0.00 H new ATOM 0 HG22 ILE C 226 97.242 -0.199 -7.218 1.00 0.00 H new ATOM 0 HG23 ILE C 226 96.342 -1.686 -6.839 1.00 0.00 H new ATOM 0 HD11 ILE C 226 93.020 -0.484 -4.207 1.00 0.00 H new ATOM 0 HD12 ILE C 226 93.955 0.987 -4.562 1.00 0.00 H new ATOM 0 HD13 ILE C 226 93.693 -0.230 -5.834 1.00 0.00 H new ATOM 1465 N VAL C 227 99.391 0.907 -5.004 1.00 0.00 N ATOM 1466 CA VAL C 227 100.548 1.648 -5.663 1.00 0.00 C ATOM 1467 C VAL C 227 101.954 1.158 -5.197 1.00 0.00 C ATOM 1468 O VAL C 227 102.889 1.190 -5.982 1.00 0.00 O ATOM 1469 CB VAL C 227 100.323 3.219 -5.413 1.00 0.00 C ATOM 1470 CG1 VAL C 227 101.508 4.121 -6.015 1.00 0.00 C ATOM 1471 CG2 VAL C 227 98.915 3.682 -6.048 1.00 0.00 C ATOM 0 H VAL C 227 98.837 1.503 -4.389 1.00 0.00 H new ATOM 0 HA VAL C 227 100.546 1.434 -6.732 1.00 0.00 H new ATOM 0 HB VAL C 227 100.318 3.370 -4.334 1.00 0.00 H new ATOM 0 HG11 VAL C 227 101.302 5.173 -5.816 1.00 0.00 H new ATOM 0 HG12 VAL C 227 102.452 3.841 -5.547 1.00 0.00 H new ATOM 0 HG13 VAL C 227 101.576 3.962 -7.091 1.00 0.00 H new ATOM 0 HG21 VAL C 227 98.770 4.748 -5.874 1.00 0.00 H new ATOM 0 HG22 VAL C 227 98.918 3.486 -7.120 1.00 0.00 H new ATOM 0 HG23 VAL C 227 98.104 3.125 -5.580 1.00 0.00 H new ATOM 1481 N ALA C 228 102.124 0.803 -3.901 1.00 0.00 N ATOM 1482 CA ALA C 228 103.501 0.438 -3.325 1.00 0.00 C ATOM 1483 C ALA C 228 104.199 -0.755 -4.057 1.00 0.00 C ATOM 1484 O ALA C 228 105.417 -0.739 -4.191 1.00 0.00 O ATOM 1485 CB ALA C 228 103.352 0.126 -1.786 1.00 0.00 C ATOM 0 H ALA C 228 101.362 0.753 -3.224 1.00 0.00 H new ATOM 0 HA ALA C 228 104.150 1.300 -3.483 1.00 0.00 H new ATOM 0 HB1 ALA C 228 104.326 -0.134 -1.371 1.00 0.00 H new ATOM 0 HB2 ALA C 228 102.962 1.005 -1.273 1.00 0.00 H new ATOM 0 HB3 ALA C 228 102.665 -0.709 -1.649 1.00 0.00 H new ATOM 1491 N VAL C 229 103.437 -1.779 -4.520 1.00 0.00 N ATOM 1492 CA VAL C 229 104.059 -2.981 -5.244 1.00 0.00 C ATOM 1493 C VAL C 229 104.573 -2.562 -6.661 1.00 0.00 C ATOM 1494 O VAL C 229 105.586 -3.071 -7.123 1.00 0.00 O ATOM 1495 CB VAL C 229 103.037 -4.223 -5.285 1.00 0.00 C ATOM 1496 CG1 VAL C 229 102.595 -4.618 -3.791 1.00 0.00 C ATOM 1497 CG2 VAL C 229 101.746 -3.900 -6.169 1.00 0.00 C ATOM 0 H VAL C 229 102.423 -1.824 -4.423 1.00 0.00 H new ATOM 0 HA VAL C 229 104.929 -3.322 -4.683 1.00 0.00 H new ATOM 0 HB VAL C 229 103.554 -5.063 -5.748 1.00 0.00 H new ATOM 0 HG11 VAL C 229 101.903 -5.460 -3.827 1.00 0.00 H new ATOM 0 HG12 VAL C 229 103.476 -4.897 -3.213 1.00 0.00 H new ATOM 0 HG13 VAL C 229 102.106 -3.766 -3.319 1.00 0.00 H new ATOM 0 HG21 VAL C 229 101.081 -4.764 -6.171 1.00 0.00 H new ATOM 0 HG22 VAL C 229 101.223 -3.041 -5.749 1.00 0.00 H new ATOM 0 HG23 VAL C 229 102.052 -3.675 -7.191 1.00 0.00 H new ATOM 1507 N PHE C 230 103.850 -1.615 -7.341 1.00 0.00 N ATOM 1508 CA PHE C 230 104.255 -1.113 -8.733 1.00 0.00 C ATOM 1509 C PHE C 230 105.561 -0.262 -8.636 1.00 0.00 C ATOM 1510 O PHE C 230 106.447 -0.396 -9.472 1.00 0.00 O ATOM 1511 CB PHE C 230 103.073 -0.275 -9.388 1.00 0.00 C ATOM 1512 CG PHE C 230 101.880 -1.219 -9.867 1.00 0.00 C ATOM 1513 CD1 PHE C 230 102.070 -2.091 -10.991 1.00 0.00 C ATOM 1514 CD2 PHE C 230 100.611 -1.240 -9.205 1.00 0.00 C ATOM 1515 CE1 PHE C 230 101.028 -2.943 -11.427 1.00 0.00 C ATOM 1516 CE2 PHE C 230 99.577 -2.097 -9.654 1.00 0.00 C ATOM 1517 CZ PHE C 230 99.786 -2.947 -10.760 1.00 0.00 C ATOM 0 H PHE C 230 103.002 -1.183 -6.974 1.00 0.00 H new ATOM 0 HA PHE C 230 104.452 -1.971 -9.375 1.00 0.00 H new ATOM 0 HB2 PHE C 230 102.697 0.450 -8.666 1.00 0.00 H new ATOM 0 HB3 PHE C 230 103.455 0.290 -10.238 1.00 0.00 H new ATOM 0 HD1 PHE C 230 103.018 -2.097 -11.509 1.00 0.00 H new ATOM 0 HD2 PHE C 230 100.441 -0.596 -8.355 1.00 0.00 H new ATOM 0 HE1 PHE C 230 101.185 -3.593 -12.275 1.00 0.00 H new ATOM 0 HE2 PHE C 230 98.623 -2.100 -9.147 1.00 0.00 H new ATOM 0 HZ PHE C 230 98.995 -3.601 -11.096 1.00 0.00 H new ATOM 1527 N VAL C 231 105.662 0.620 -7.598 1.00 0.00 N ATOM 1528 CA VAL C 231 106.898 1.510 -7.390 1.00 0.00 C ATOM 1529 C VAL C 231 108.152 0.620 -7.091 1.00 0.00 C ATOM 1530 O VAL C 231 109.231 0.880 -7.610 1.00 0.00 O ATOM 1531 CB VAL C 231 106.600 2.575 -6.226 1.00 0.00 C ATOM 1532 CG1 VAL C 231 107.885 3.481 -5.883 1.00 0.00 C ATOM 1533 CG2 VAL C 231 105.372 3.525 -6.650 1.00 0.00 C ATOM 0 H VAL C 231 104.934 0.750 -6.896 1.00 0.00 H new ATOM 0 HA VAL C 231 107.118 2.072 -8.297 1.00 0.00 H new ATOM 0 HB VAL C 231 106.345 2.009 -5.330 1.00 0.00 H new ATOM 0 HG11 VAL C 231 107.633 4.185 -5.090 1.00 0.00 H new ATOM 0 HG12 VAL C 231 108.704 2.841 -5.553 1.00 0.00 H new ATOM 0 HG13 VAL C 231 108.190 4.031 -6.773 1.00 0.00 H new ATOM 0 HG21 VAL C 231 105.177 4.244 -5.855 1.00 0.00 H new ATOM 0 HG22 VAL C 231 105.624 4.058 -7.567 1.00 0.00 H new ATOM 0 HG23 VAL C 231 104.482 2.917 -6.816 1.00 0.00 H new ATOM 1543 N CYS C 232 107.978 -0.426 -6.240 1.00 0.00 N ATOM 1544 CA CYS C 232 109.105 -1.383 -5.854 1.00 0.00 C ATOM 1545 C CYS C 232 109.550 -2.231 -7.087 1.00 0.00 C ATOM 1546 O CYS C 232 110.732 -2.379 -7.367 1.00 0.00 O ATOM 1547 CB CYS C 232 108.596 -2.311 -4.687 1.00 0.00 C ATOM 1548 SG CYS C 232 108.211 -1.319 -3.212 1.00 0.00 S ATOM 0 H CYS C 232 107.084 -0.645 -5.800 1.00 0.00 H new ATOM 0 HA CYS C 232 109.973 -0.817 -5.516 1.00 0.00 H new ATOM 0 HB2 CYS C 232 107.709 -2.857 -5.008 1.00 0.00 H new ATOM 0 HB3 CYS C 232 109.357 -3.053 -4.446 1.00 0.00 H new ATOM 0 HG CYS C 232 106.994 -0.870 -3.297 1.00 0.00 H new ATOM 1554 N LYS C 233 108.543 -2.800 -7.789 1.00 0.00 N ATOM 1555 CA LYS C 233 108.744 -3.687 -9.011 1.00 0.00 C ATOM 1556 C LYS C 233 109.306 -2.874 -10.211 1.00 0.00 C ATOM 1557 O LYS C 233 110.220 -3.321 -10.890 1.00 0.00 O ATOM 1558 CB LYS C 233 107.351 -4.379 -9.332 1.00 0.00 C ATOM 1559 CG LYS C 233 107.426 -5.451 -10.515 1.00 0.00 C ATOM 1560 CD LYS C 233 106.025 -6.197 -10.735 1.00 0.00 C ATOM 1561 CE LYS C 233 106.086 -7.216 -11.944 1.00 0.00 C ATOM 1562 NZ LYS C 233 107.127 -8.247 -11.666 1.00 0.00 N ATOM 0 H LYS C 233 107.561 -2.672 -7.544 1.00 0.00 H new ATOM 0 HA LYS C 233 109.489 -4.458 -8.813 1.00 0.00 H new ATOM 0 HB2 LYS C 233 106.983 -4.870 -8.431 1.00 0.00 H new ATOM 0 HB3 LYS C 233 106.625 -3.610 -9.596 1.00 0.00 H new ATOM 0 HG2 LYS C 233 107.721 -4.953 -11.438 1.00 0.00 H new ATOM 0 HG3 LYS C 233 108.198 -6.187 -10.290 1.00 0.00 H new ATOM 0 HD2 LYS C 233 105.750 -6.729 -9.825 1.00 0.00 H new ATOM 0 HD3 LYS C 233 105.245 -5.459 -10.921 1.00 0.00 H new ATOM 0 HE2 LYS C 233 105.115 -7.691 -12.084 1.00 0.00 H new ATOM 0 HE3 LYS C 233 106.318 -6.688 -12.869 1.00 0.00 H new ATOM 0 HZ1 LYS C 233 107.057 -9.010 -12.369 1.00 0.00 H new ATOM 0 HZ2 LYS C 233 108.070 -7.812 -11.721 1.00 0.00 H new ATOM 0 HZ3 LYS C 233 106.982 -8.639 -10.714 1.00 0.00 H new