USER MOD reduce.3.24.130724 H: found=0, std=0, add=673, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 676 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 169 THR OG1 : rot -50:sc= 0.971 USER MOD Set 1.2: A 172 GLN :FLIP amide:sc= 0.587 F(o=-2.3,f=1.6) USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 94 TYR OH : rot 180:sc= 0 USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 CYS SG : rot -44:sc= 0.585 USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 102 GLN : amide:sc= -0.533 X(o=-0.53,f=-0.5) USER MOD Single : A 111 CYS SG : rot -6:sc= -0.0493 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 115 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 SER OG : rot -74:sc= 1.03 USER MOD Single : A 122 TYR OH : rot 180:sc= 0 USER MOD Single : A 123 THR OG1 : rot 78:sc= 1.14 USER MOD Single : A 125 GLN : amide:sc= -1.82 K(o=-1.8,f=-4.3!) USER MOD Single : A 126 SER OG : rot 180:sc= -1.51 USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD Single : A 145 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 149 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 150 GLN :FLIP amide:sc= -1.7 F(o=-3!,f=-1.7) USER MOD Single : A 151 THR OG1 : rot 180:sc= -0.307 USER MOD Single : A 152 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 157 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 159 MET CE :methyl -105:sc= -1.61 (180deg=-2.01) USER MOD Single : A 162 HIS : no HD1:sc= -2.79 K(o=-2.8,f=-5.4!) USER MOD Single : A 163 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 164 SER OG : rot 180:sc= 0 USER MOD Single : A 180 ASN : amide:sc= -0.604 K(o=-0.6,f=-1.6!) USER MOD Single : A 182 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 183 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 185 SER OG : rot 180:sc= 0 USER MOD Single : A 186 MET CE :methyl 164:sc= -0.0215 (180deg=-0.445) USER MOD Single : A 187 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 142 N GLU A 89 14.758 6.500 -8.757 1.00 0.00 N ATOM 143 CA GLU A 89 14.208 5.757 -7.628 1.00 0.00 C ATOM 144 C GLU A 89 12.716 6.034 -7.477 1.00 0.00 C ATOM 145 O GLU A 89 11.954 5.173 -7.035 1.00 0.00 O ATOM 146 CB GLU A 89 14.948 6.123 -6.341 1.00 0.00 C ATOM 147 CG GLU A 89 14.393 5.439 -5.101 1.00 0.00 C ATOM 148 CD GLU A 89 15.431 4.601 -4.381 1.00 0.00 C ATOM 149 OE1 GLU A 89 16.591 5.054 -4.276 1.00 0.00 O ATOM 150 OE2 GLU A 89 15.085 3.492 -3.922 1.00 0.00 O ATOM 0 HA GLU A 89 14.342 4.692 -7.819 1.00 0.00 H new ATOM 0 HB2 GLU A 89 16.000 5.860 -6.450 1.00 0.00 H new ATOM 0 HB3 GLU A 89 14.902 7.203 -6.201 1.00 0.00 H new ATOM 0 HG2 GLU A 89 14.004 6.194 -4.418 1.00 0.00 H new ATOM 0 HG3 GLU A 89 13.554 4.805 -5.386 1.00 0.00 H new ATOM 157 N ASP A 90 12.302 7.235 -7.865 1.00 0.00 N ATOM 158 CA ASP A 90 10.897 7.610 -7.790 1.00 0.00 C ATOM 159 C ASP A 90 10.125 6.914 -8.903 1.00 0.00 C ATOM 160 O ASP A 90 9.073 6.317 -8.672 1.00 0.00 O ATOM 161 CB ASP A 90 10.739 9.127 -7.906 1.00 0.00 C ATOM 162 CG ASP A 90 9.565 9.650 -7.101 1.00 0.00 C ATOM 163 OD1 ASP A 90 9.744 9.912 -5.893 1.00 0.00 O ATOM 164 OD2 ASP A 90 8.468 9.796 -7.678 1.00 0.00 O ATOM 0 H ASP A 90 12.916 7.961 -8.233 1.00 0.00 H new ATOM 0 HA ASP A 90 10.498 7.298 -6.825 1.00 0.00 H new ATOM 0 HB2 ASP A 90 11.654 9.612 -7.566 1.00 0.00 H new ATOM 0 HB3 ASP A 90 10.606 9.397 -8.954 1.00 0.00 H new ATOM 169 N ILE A 91 10.668 6.991 -10.113 1.00 0.00 N ATOM 170 CA ILE A 91 10.053 6.367 -11.276 1.00 0.00 C ATOM 171 C ILE A 91 9.956 4.856 -11.095 1.00 0.00 C ATOM 172 O ILE A 91 8.908 4.256 -11.338 1.00 0.00 O ATOM 173 CB ILE A 91 10.856 6.666 -12.557 1.00 0.00 C ATOM 174 CG1 ILE A 91 10.998 8.175 -12.761 1.00 0.00 C ATOM 175 CG2 ILE A 91 10.194 6.020 -13.765 1.00 0.00 C ATOM 176 CD1 ILE A 91 9.675 8.907 -12.802 1.00 0.00 C ATOM 0 H ILE A 91 11.539 7.483 -10.313 1.00 0.00 H new ATOM 0 HA ILE A 91 9.052 6.786 -11.374 1.00 0.00 H new ATOM 0 HB ILE A 91 11.853 6.241 -12.446 1.00 0.00 H new ATOM 0 HG12 ILE A 91 11.607 8.586 -11.956 1.00 0.00 H new ATOM 0 HG13 ILE A 91 11.534 8.359 -13.692 1.00 0.00 H new ATOM 0 HG21 ILE A 91 10.775 6.242 -14.660 1.00 0.00 H new ATOM 0 HG22 ILE A 91 10.148 4.941 -13.621 1.00 0.00 H new ATOM 0 HG23 ILE A 91 9.184 6.414 -13.881 1.00 0.00 H new ATOM 0 HD11 ILE A 91 9.853 9.972 -12.949 1.00 0.00 H new ATOM 0 HD12 ILE A 91 9.072 8.523 -13.625 1.00 0.00 H new ATOM 0 HD13 ILE A 91 9.145 8.754 -11.862 1.00 0.00 H new ATOM 188 N THR A 92 11.057 4.247 -10.667 1.00 0.00 N ATOM 189 CA THR A 92 11.094 2.807 -10.457 1.00 0.00 C ATOM 190 C THR A 92 10.091 2.391 -9.381 1.00 0.00 C ATOM 191 O THR A 92 9.300 1.473 -9.585 1.00 0.00 O ATOM 192 CB THR A 92 12.510 2.348 -10.083 1.00 0.00 C ATOM 193 OG1 THR A 92 12.620 0.939 -10.175 1.00 0.00 O ATOM 194 CG2 THR A 92 12.926 2.748 -8.686 1.00 0.00 C ATOM 0 H THR A 92 11.932 4.728 -10.460 1.00 0.00 H new ATOM 0 HA THR A 92 10.814 2.321 -11.391 1.00 0.00 H new ATOM 0 HB THR A 92 13.168 2.846 -10.794 1.00 0.00 H new ATOM 0 HG1 THR A 92 13.530 0.666 -9.935 1.00 0.00 H new ATOM 0 HG21 THR A 92 13.937 2.390 -8.491 1.00 0.00 H new ATOM 0 HG22 THR A 92 12.902 3.834 -8.596 1.00 0.00 H new ATOM 0 HG23 THR A 92 12.240 2.308 -7.962 1.00 0.00 H new ATOM 202 N ARG A 93 10.134 3.064 -8.230 1.00 0.00 N ATOM 203 CA ARG A 93 9.236 2.751 -7.125 1.00 0.00 C ATOM 204 C ARG A 93 7.776 2.797 -7.565 1.00 0.00 C ATOM 205 O ARG A 93 7.020 1.855 -7.327 1.00 0.00 O ATOM 206 CB ARG A 93 9.465 3.729 -5.972 1.00 0.00 C ATOM 207 CG ARG A 93 8.942 3.228 -4.636 1.00 0.00 C ATOM 208 CD ARG A 93 9.441 4.088 -3.486 1.00 0.00 C ATOM 209 NE ARG A 93 10.816 3.763 -3.115 1.00 0.00 N ATOM 210 CZ ARG A 93 11.421 4.231 -2.025 1.00 0.00 C ATOM 211 NH1 ARG A 93 10.776 5.045 -1.198 1.00 0.00 N ATOM 212 NH2 ARG A 93 12.673 3.885 -1.762 1.00 0.00 N ATOM 0 H ARG A 93 10.782 3.829 -8.042 1.00 0.00 H new ATOM 0 HA ARG A 93 9.455 1.737 -6.790 1.00 0.00 H new ATOM 0 HB2 ARG A 93 10.533 3.929 -5.883 1.00 0.00 H new ATOM 0 HB3 ARG A 93 8.982 4.677 -6.209 1.00 0.00 H new ATOM 0 HG2 ARG A 93 7.852 3.229 -4.647 1.00 0.00 H new ATOM 0 HG3 ARG A 93 9.258 2.196 -4.484 1.00 0.00 H new ATOM 0 HD2 ARG A 93 9.380 5.139 -3.767 1.00 0.00 H new ATOM 0 HD3 ARG A 93 8.791 3.951 -2.622 1.00 0.00 H new ATOM 0 HE ARG A 93 11.344 3.141 -3.727 1.00 0.00 H new ATOM 0 HH11 ARG A 93 9.812 5.315 -1.396 1.00 0.00 H new ATOM 0 HH12 ARG A 93 11.244 5.401 -0.364 1.00 0.00 H new ATOM 0 HH21 ARG A 93 13.173 3.260 -2.395 1.00 0.00 H new ATOM 0 HH22 ARG A 93 13.137 4.243 -0.927 1.00 0.00 H new ATOM 226 N TYR A 94 7.382 3.894 -8.206 1.00 0.00 N ATOM 227 CA TYR A 94 6.008 4.050 -8.674 1.00 0.00 C ATOM 228 C TYR A 94 5.573 2.845 -9.503 1.00 0.00 C ATOM 229 O TYR A 94 4.545 2.226 -9.226 1.00 0.00 O ATOM 230 CB TYR A 94 5.870 5.328 -9.503 1.00 0.00 C ATOM 231 CG TYR A 94 4.458 5.589 -9.976 1.00 0.00 C ATOM 232 CD1 TYR A 94 3.378 5.433 -9.116 1.00 0.00 C ATOM 233 CD2 TYR A 94 4.205 5.989 -11.282 1.00 0.00 C ATOM 234 CE1 TYR A 94 2.086 5.669 -9.544 1.00 0.00 C ATOM 235 CE2 TYR A 94 2.915 6.227 -11.718 1.00 0.00 C ATOM 236 CZ TYR A 94 1.859 6.066 -10.845 1.00 0.00 C ATOM 237 OH TYR A 94 0.574 6.301 -11.275 1.00 0.00 O ATOM 0 H TYR A 94 7.992 4.685 -8.413 1.00 0.00 H new ATOM 0 HA TYR A 94 5.361 4.120 -7.800 1.00 0.00 H new ATOM 0 HB2 TYR A 94 6.208 6.176 -8.908 1.00 0.00 H new ATOM 0 HB3 TYR A 94 6.529 5.263 -10.369 1.00 0.00 H new ATOM 0 HD1 TYR A 94 3.551 5.122 -8.096 1.00 0.00 H new ATOM 0 HD2 TYR A 94 5.030 6.116 -11.968 1.00 0.00 H new ATOM 0 HE1 TYR A 94 1.257 5.543 -8.863 1.00 0.00 H new ATOM 0 HE2 TYR A 94 2.735 6.537 -12.737 1.00 0.00 H new ATOM 0 HH TYR A 94 0.589 6.574 -12.216 1.00 0.00 H new ATOM 247 N TYR A 95 6.365 2.514 -10.518 1.00 0.00 N ATOM 248 CA TYR A 95 6.062 1.380 -11.382 1.00 0.00 C ATOM 249 C TYR A 95 6.084 0.076 -10.590 1.00 0.00 C ATOM 250 O TYR A 95 5.235 -0.794 -10.783 1.00 0.00 O ATOM 251 CB TYR A 95 7.064 1.309 -12.536 1.00 0.00 C ATOM 252 CG TYR A 95 6.877 2.397 -13.569 1.00 0.00 C ATOM 253 CD1 TYR A 95 5.610 2.727 -14.036 1.00 0.00 C ATOM 254 CD2 TYR A 95 7.966 3.093 -14.078 1.00 0.00 C ATOM 255 CE1 TYR A 95 5.435 3.720 -14.980 1.00 0.00 C ATOM 256 CE2 TYR A 95 7.798 4.088 -15.023 1.00 0.00 C ATOM 257 CZ TYR A 95 6.531 4.397 -15.470 1.00 0.00 C ATOM 258 OH TYR A 95 6.361 5.387 -16.411 1.00 0.00 O ATOM 0 H TYR A 95 7.220 3.014 -10.762 1.00 0.00 H new ATOM 0 HA TYR A 95 5.061 1.520 -11.790 1.00 0.00 H new ATOM 0 HB2 TYR A 95 8.075 1.373 -12.133 1.00 0.00 H new ATOM 0 HB3 TYR A 95 6.976 0.338 -13.023 1.00 0.00 H new ATOM 0 HD1 TYR A 95 4.749 2.199 -13.655 1.00 0.00 H new ATOM 0 HD2 TYR A 95 8.960 2.853 -13.730 1.00 0.00 H new ATOM 0 HE1 TYR A 95 4.444 3.965 -15.333 1.00 0.00 H new ATOM 0 HE2 TYR A 95 8.655 4.620 -15.409 1.00 0.00 H new ATOM 0 HH TYR A 95 7.233 5.765 -16.650 1.00 0.00 H new ATOM 268 N LEU A 96 7.063 -0.051 -9.700 1.00 0.00 N ATOM 269 CA LEU A 96 7.205 -1.247 -8.876 1.00 0.00 C ATOM 270 C LEU A 96 5.934 -1.518 -8.078 1.00 0.00 C ATOM 271 O LEU A 96 5.357 -2.603 -8.158 1.00 0.00 O ATOM 272 CB LEU A 96 8.391 -1.085 -7.922 1.00 0.00 C ATOM 273 CG LEU A 96 9.257 -2.331 -7.743 1.00 0.00 C ATOM 274 CD1 LEU A 96 9.826 -2.780 -9.080 1.00 0.00 C ATOM 275 CD2 LEU A 96 10.376 -2.060 -6.749 1.00 0.00 C ATOM 0 H LEU A 96 7.772 0.662 -9.530 1.00 0.00 H new ATOM 0 HA LEU A 96 7.382 -2.096 -9.537 1.00 0.00 H new ATOM 0 HB2 LEU A 96 9.021 -0.273 -8.286 1.00 0.00 H new ATOM 0 HB3 LEU A 96 8.013 -0.782 -6.946 1.00 0.00 H new ATOM 0 HG LEU A 96 8.633 -3.133 -7.349 1.00 0.00 H new ATOM 0 HD11 LEU A 96 10.440 -3.669 -8.934 1.00 0.00 H new ATOM 0 HD12 LEU A 96 9.009 -3.012 -9.764 1.00 0.00 H new ATOM 0 HD13 LEU A 96 10.437 -1.982 -9.502 1.00 0.00 H new ATOM 0 HD21 LEU A 96 10.984 -2.957 -6.632 1.00 0.00 H new ATOM 0 HD22 LEU A 96 10.999 -1.244 -7.116 1.00 0.00 H new ATOM 0 HD23 LEU A 96 9.948 -1.784 -5.785 1.00 0.00 H new ATOM 287 N CYS A 97 5.504 -0.525 -7.308 1.00 0.00 N ATOM 288 CA CYS A 97 4.302 -0.652 -6.492 1.00 0.00 C ATOM 289 C CYS A 97 3.098 -1.034 -7.348 1.00 0.00 C ATOM 290 O CYS A 97 2.296 -1.884 -6.963 1.00 0.00 O ATOM 291 CB CYS A 97 4.022 0.658 -5.751 1.00 0.00 C ATOM 292 SG CYS A 97 4.641 0.692 -4.053 1.00 0.00 S ATOM 0 H CYS A 97 5.971 0.379 -7.232 1.00 0.00 H new ATOM 0 HA CYS A 97 4.471 -1.445 -5.763 1.00 0.00 H new ATOM 0 HB2 CYS A 97 4.472 1.481 -6.307 1.00 0.00 H new ATOM 0 HB3 CYS A 97 2.946 0.833 -5.738 1.00 0.00 H new ATOM 0 HG CYS A 97 4.354 -0.431 -3.464 1.00 0.00 H new ATOM 298 N LEU A 98 2.980 -0.402 -8.511 1.00 0.00 N ATOM 299 CA LEU A 98 1.875 -0.679 -9.422 1.00 0.00 C ATOM 300 C LEU A 98 1.871 -2.144 -9.845 1.00 0.00 C ATOM 301 O LEU A 98 0.814 -2.757 -9.986 1.00 0.00 O ATOM 302 CB LEU A 98 1.966 0.220 -10.657 1.00 0.00 C ATOM 303 CG LEU A 98 1.654 1.696 -10.409 1.00 0.00 C ATOM 304 CD1 LEU A 98 1.922 2.515 -11.662 1.00 0.00 C ATOM 305 CD2 LEU A 98 0.211 1.867 -9.957 1.00 0.00 C ATOM 0 H LEU A 98 3.635 0.305 -8.845 1.00 0.00 H new ATOM 0 HA LEU A 98 0.944 -0.469 -8.896 1.00 0.00 H new ATOM 0 HB2 LEU A 98 2.971 0.142 -11.071 1.00 0.00 H new ATOM 0 HB3 LEU A 98 1.279 -0.158 -11.414 1.00 0.00 H new ATOM 0 HG LEU A 98 2.308 2.058 -9.616 1.00 0.00 H new ATOM 0 HD11 LEU A 98 1.695 3.563 -11.467 1.00 0.00 H new ATOM 0 HD12 LEU A 98 2.971 2.417 -11.943 1.00 0.00 H new ATOM 0 HD13 LEU A 98 1.293 2.152 -12.475 1.00 0.00 H new ATOM 0 HD21 LEU A 98 0.006 2.924 -9.785 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -0.459 1.488 -10.729 1.00 0.00 H new ATOM 0 HD23 LEU A 98 0.051 1.311 -9.033 1.00 0.00 H new ATOM 317 N GLN A 99 3.063 -2.699 -10.048 1.00 0.00 N ATOM 318 CA GLN A 99 3.200 -4.092 -10.457 1.00 0.00 C ATOM 319 C GLN A 99 2.864 -5.036 -9.306 1.00 0.00 C ATOM 320 O GLN A 99 2.212 -6.063 -9.499 1.00 0.00 O ATOM 321 CB GLN A 99 4.622 -4.359 -10.952 1.00 0.00 C ATOM 322 CG GLN A 99 4.912 -3.756 -12.317 1.00 0.00 C ATOM 323 CD GLN A 99 6.302 -4.094 -12.821 1.00 0.00 C ATOM 324 OE1 GLN A 99 7.163 -3.221 -12.931 1.00 0.00 O ATOM 325 NE2 GLN A 99 6.527 -5.365 -13.131 1.00 0.00 N ATOM 0 H GLN A 99 3.948 -2.204 -9.936 1.00 0.00 H new ATOM 0 HA GLN A 99 2.497 -4.277 -11.269 1.00 0.00 H new ATOM 0 HB2 GLN A 99 5.331 -3.958 -10.228 1.00 0.00 H new ATOM 0 HB3 GLN A 99 4.787 -5.436 -10.997 1.00 0.00 H new ATOM 0 HG2 GLN A 99 4.173 -4.115 -13.033 1.00 0.00 H new ATOM 0 HG3 GLN A 99 4.803 -2.673 -12.262 1.00 0.00 H new ATOM 0 HE21 GLN A 99 5.784 -6.055 -13.024 1.00 0.00 H new ATOM 0 HE22 GLN A 99 7.443 -5.651 -13.476 1.00 0.00 H new ATOM 334 N LEU A 100 3.317 -4.683 -8.109 1.00 0.00 N ATOM 335 CA LEU A 100 3.070 -5.498 -6.926 1.00 0.00 C ATOM 336 C LEU A 100 1.600 -5.449 -6.517 1.00 0.00 C ATOM 337 O LEU A 100 1.027 -6.457 -6.106 1.00 0.00 O ATOM 338 CB LEU A 100 3.947 -5.021 -5.765 1.00 0.00 C ATOM 339 CG LEU A 100 5.279 -5.759 -5.611 1.00 0.00 C ATOM 340 CD1 LEU A 100 6.234 -4.958 -4.739 1.00 0.00 C ATOM 341 CD2 LEU A 100 5.055 -7.148 -5.028 1.00 0.00 C ATOM 0 H LEU A 100 3.858 -3.837 -7.932 1.00 0.00 H new ATOM 0 HA LEU A 100 3.322 -6.530 -7.171 1.00 0.00 H new ATOM 0 HB2 LEU A 100 4.151 -3.959 -5.897 1.00 0.00 H new ATOM 0 HB3 LEU A 100 3.383 -5.124 -4.838 1.00 0.00 H new ATOM 0 HG LEU A 100 5.728 -5.871 -6.598 1.00 0.00 H new ATOM 0 HD11 LEU A 100 7.176 -5.498 -4.640 1.00 0.00 H new ATOM 0 HD12 LEU A 100 6.419 -3.987 -5.198 1.00 0.00 H new ATOM 0 HD13 LEU A 100 5.793 -4.815 -3.753 1.00 0.00 H new ATOM 0 HD21 LEU A 100 6.013 -7.658 -4.925 1.00 0.00 H new ATOM 0 HD22 LEU A 100 4.584 -7.060 -4.049 1.00 0.00 H new ATOM 0 HD23 LEU A 100 4.408 -7.721 -5.692 1.00 0.00 H new ATOM 353 N ARG A 101 0.998 -4.269 -6.621 1.00 0.00 N ATOM 354 CA ARG A 101 -0.402 -4.087 -6.248 1.00 0.00 C ATOM 355 C ARG A 101 -1.344 -4.754 -7.248 1.00 0.00 C ATOM 356 O ARG A 101 -2.392 -5.276 -6.869 1.00 0.00 O ATOM 357 CB ARG A 101 -0.729 -2.596 -6.136 1.00 0.00 C ATOM 358 CG ARG A 101 -1.255 -2.190 -4.768 1.00 0.00 C ATOM 359 CD ARG A 101 -2.728 -2.534 -4.608 1.00 0.00 C ATOM 360 NE ARG A 101 -3.529 -1.364 -4.254 1.00 0.00 N ATOM 361 CZ ARG A 101 -4.009 -0.494 -5.141 1.00 0.00 C ATOM 362 NH1 ARG A 101 -3.772 -0.656 -6.437 1.00 0.00 N ATOM 363 NH2 ARG A 101 -4.728 0.541 -4.731 1.00 0.00 N ATOM 0 H ARG A 101 1.457 -3.424 -6.960 1.00 0.00 H new ATOM 0 HA ARG A 101 -0.550 -4.565 -5.280 1.00 0.00 H new ATOM 0 HB2 ARG A 101 0.168 -2.018 -6.357 1.00 0.00 H new ATOM 0 HB3 ARG A 101 -1.470 -2.337 -6.893 1.00 0.00 H new ATOM 0 HG2 ARG A 101 -0.677 -2.692 -3.992 1.00 0.00 H new ATOM 0 HG3 ARG A 101 -1.114 -1.118 -4.627 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -3.103 -2.962 -5.538 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -2.840 -3.297 -3.837 1.00 0.00 H new ATOM 0 HE ARG A 101 -3.733 -1.204 -3.267 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -3.219 -1.451 -6.759 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -4.143 0.014 -7.111 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -4.914 0.671 -3.737 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -5.096 1.207 -5.410 1.00 0.00 H new ATOM 377 N GLN A 102 -0.967 -4.742 -8.522 1.00 0.00 N ATOM 378 CA GLN A 102 -1.787 -5.355 -9.562 1.00 0.00 C ATOM 379 C GLN A 102 -1.745 -6.876 -9.461 1.00 0.00 C ATOM 380 O GLN A 102 -2.755 -7.551 -9.665 1.00 0.00 O ATOM 381 CB GLN A 102 -1.323 -4.906 -10.950 1.00 0.00 C ATOM 382 CG GLN A 102 0.079 -5.370 -11.304 1.00 0.00 C ATOM 383 CD GLN A 102 0.454 -5.049 -12.737 1.00 0.00 C ATOM 384 OE1 GLN A 102 0.609 -5.945 -13.566 1.00 0.00 O ATOM 385 NE2 GLN A 102 0.602 -3.763 -13.036 1.00 0.00 N ATOM 0 H GLN A 102 -0.103 -4.317 -8.859 1.00 0.00 H new ATOM 0 HA GLN A 102 -2.816 -5.027 -9.415 1.00 0.00 H new ATOM 0 HB2 GLN A 102 -2.021 -5.284 -11.697 1.00 0.00 H new ATOM 0 HB3 GLN A 102 -1.360 -3.818 -11.002 1.00 0.00 H new ATOM 0 HG2 GLN A 102 0.795 -4.899 -10.631 1.00 0.00 H new ATOM 0 HG3 GLN A 102 0.153 -6.446 -11.145 1.00 0.00 H new ATOM 0 HE21 GLN A 102 0.464 -3.053 -12.317 1.00 0.00 H new ATOM 0 HE22 GLN A 102 0.854 -3.486 -13.985 1.00 0.00 H new ATOM 394 N ASP A 103 -0.569 -7.410 -9.148 1.00 0.00 N ATOM 395 CA ASP A 103 -0.392 -8.852 -9.022 1.00 0.00 C ATOM 396 C ASP A 103 -1.157 -9.395 -7.820 1.00 0.00 C ATOM 397 O ASP A 103 -1.784 -10.451 -7.897 1.00 0.00 O ATOM 398 CB ASP A 103 1.094 -9.193 -8.894 1.00 0.00 C ATOM 399 CG ASP A 103 1.752 -9.428 -10.239 1.00 0.00 C ATOM 400 OD1 ASP A 103 1.133 -10.096 -11.094 1.00 0.00 O ATOM 401 OD2 ASP A 103 2.886 -8.944 -10.438 1.00 0.00 O ATOM 0 H ASP A 103 0.276 -6.865 -8.977 1.00 0.00 H new ATOM 0 HA ASP A 103 -0.791 -9.321 -9.921 1.00 0.00 H new ATOM 0 HB2 ASP A 103 1.607 -8.381 -8.379 1.00 0.00 H new ATOM 0 HB3 ASP A 103 1.207 -10.084 -8.277 1.00 0.00 H new ATOM 406 N ILE A 104 -1.099 -8.668 -6.708 1.00 0.00 N ATOM 407 CA ILE A 104 -1.786 -9.081 -5.490 1.00 0.00 C ATOM 408 C ILE A 104 -3.299 -9.114 -5.694 1.00 0.00 C ATOM 409 O ILE A 104 -3.955 -10.103 -5.368 1.00 0.00 O ATOM 410 CB ILE A 104 -1.450 -8.147 -4.308 1.00 0.00 C ATOM 411 CG1 ILE A 104 0.058 -8.143 -4.048 1.00 0.00 C ATOM 412 CG2 ILE A 104 -2.203 -8.574 -3.055 1.00 0.00 C ATOM 413 CD1 ILE A 104 0.565 -6.848 -3.452 1.00 0.00 C ATOM 0 H ILE A 104 -0.584 -7.791 -6.626 1.00 0.00 H new ATOM 0 HA ILE A 104 -1.436 -10.086 -5.254 1.00 0.00 H new ATOM 0 HB ILE A 104 -1.763 -7.136 -4.568 1.00 0.00 H new ATOM 0 HG12 ILE A 104 0.305 -8.964 -3.375 1.00 0.00 H new ATOM 0 HG13 ILE A 104 0.581 -8.331 -4.986 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -1.952 -7.903 -2.233 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -3.276 -8.532 -3.243 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -1.921 -9.593 -2.790 1.00 0.00 H new ATOM 0 HD11 ILE A 104 1.641 -6.917 -3.295 1.00 0.00 H new ATOM 0 HD12 ILE A 104 0.350 -6.025 -4.134 1.00 0.00 H new ATOM 0 HD13 ILE A 104 0.070 -6.668 -2.498 1.00 0.00 H new ATOM 425 N VAL A 105 -3.850 -8.028 -6.229 1.00 0.00 N ATOM 426 CA VAL A 105 -5.286 -7.940 -6.467 1.00 0.00 C ATOM 427 C VAL A 105 -5.769 -9.055 -7.388 1.00 0.00 C ATOM 428 O VAL A 105 -6.898 -9.529 -7.263 1.00 0.00 O ATOM 429 CB VAL A 105 -5.672 -6.583 -7.086 1.00 0.00 C ATOM 430 CG1 VAL A 105 -5.409 -5.451 -6.105 1.00 0.00 C ATOM 431 CG2 VAL A 105 -4.919 -6.359 -8.389 1.00 0.00 C ATOM 0 H VAL A 105 -3.324 -7.199 -6.505 1.00 0.00 H new ATOM 0 HA VAL A 105 -5.768 -8.043 -5.495 1.00 0.00 H new ATOM 0 HB VAL A 105 -6.739 -6.595 -7.307 1.00 0.00 H new ATOM 0 HG11 VAL A 105 -5.688 -4.502 -6.562 1.00 0.00 H new ATOM 0 HG12 VAL A 105 -6.000 -5.607 -5.202 1.00 0.00 H new ATOM 0 HG13 VAL A 105 -4.350 -5.432 -5.847 1.00 0.00 H new ATOM 0 HG21 VAL A 105 -5.204 -5.396 -8.813 1.00 0.00 H new ATOM 0 HG22 VAL A 105 -3.846 -6.368 -8.195 1.00 0.00 H new ATOM 0 HG23 VAL A 105 -5.167 -7.153 -9.094 1.00 0.00 H new ATOM 441 N ALA A 106 -4.912 -9.468 -8.316 1.00 0.00 N ATOM 442 CA ALA A 106 -5.259 -10.525 -9.258 1.00 0.00 C ATOM 443 C ALA A 106 -5.062 -11.912 -8.647 1.00 0.00 C ATOM 444 O ALA A 106 -5.355 -12.924 -9.284 1.00 0.00 O ATOM 445 CB ALA A 106 -4.434 -10.387 -10.529 1.00 0.00 C ATOM 0 H ALA A 106 -3.973 -9.087 -8.436 1.00 0.00 H new ATOM 0 HA ALA A 106 -6.316 -10.418 -9.503 1.00 0.00 H new ATOM 0 HB1 ALA A 106 -4.702 -11.182 -11.225 1.00 0.00 H new ATOM 0 HB2 ALA A 106 -4.634 -9.419 -10.989 1.00 0.00 H new ATOM 0 HB3 ALA A 106 -3.374 -10.461 -10.285 1.00 0.00 H new ATOM 451 N GLY A 107 -4.564 -11.957 -7.414 1.00 0.00 N ATOM 452 CA GLY A 107 -4.341 -13.229 -6.754 1.00 0.00 C ATOM 453 C GLY A 107 -3.229 -14.029 -7.403 1.00 0.00 C ATOM 454 O GLY A 107 -3.278 -15.258 -7.440 1.00 0.00 O ATOM 0 H GLY A 107 -4.312 -11.137 -6.863 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -4.095 -13.054 -5.707 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -5.262 -13.811 -6.772 1.00 0.00 H new ATOM 458 N ARG A 108 -2.223 -13.328 -7.917 1.00 0.00 N ATOM 459 CA ARG A 108 -1.092 -13.978 -8.569 1.00 0.00 C ATOM 460 C ARG A 108 -0.048 -14.437 -7.551 1.00 0.00 C ATOM 461 O ARG A 108 0.997 -14.970 -7.924 1.00 0.00 O ATOM 462 CB ARG A 108 -0.447 -13.028 -9.581 1.00 0.00 C ATOM 463 CG ARG A 108 -1.434 -12.437 -10.575 1.00 0.00 C ATOM 464 CD ARG A 108 -1.106 -12.849 -12.002 1.00 0.00 C ATOM 465 NE ARG A 108 -1.608 -14.184 -12.316 1.00 0.00 N ATOM 466 CZ ARG A 108 -1.377 -14.812 -13.466 1.00 0.00 C ATOM 467 NH1 ARG A 108 -0.653 -14.231 -14.414 1.00 0.00 N ATOM 468 NH2 ARG A 108 -1.872 -16.026 -13.670 1.00 0.00 N ATOM 0 H ARG A 108 -2.168 -12.310 -7.894 1.00 0.00 H new ATOM 0 HA ARG A 108 -1.470 -14.859 -9.088 1.00 0.00 H new ATOM 0 HB2 ARG A 108 0.044 -12.217 -9.044 1.00 0.00 H new ATOM 0 HB3 ARG A 108 0.329 -13.564 -10.127 1.00 0.00 H new ATOM 0 HG2 ARG A 108 -2.443 -12.763 -10.324 1.00 0.00 H new ATOM 0 HG3 ARG A 108 -1.422 -11.350 -10.498 1.00 0.00 H new ATOM 0 HD2 ARG A 108 -1.537 -12.127 -12.696 1.00 0.00 H new ATOM 0 HD3 ARG A 108 -0.026 -12.825 -12.147 1.00 0.00 H new ATOM 0 HE ARG A 108 -2.169 -14.663 -11.612 1.00 0.00 H new ATOM 0 HH11 ARG A 108 -0.270 -13.298 -14.263 1.00 0.00 H new ATOM 0 HH12 ARG A 108 -0.479 -14.718 -15.293 1.00 0.00 H new ATOM 0 HH21 ARG A 108 -2.430 -16.478 -12.945 1.00 0.00 H new ATOM 0 HH22 ARG A 108 -1.695 -16.507 -14.552 1.00 0.00 H new ATOM 482 N LEU A 109 -0.332 -14.230 -6.266 1.00 0.00 N ATOM 483 CA LEU A 109 0.589 -14.628 -5.209 1.00 0.00 C ATOM 484 C LEU A 109 -0.171 -14.934 -3.918 1.00 0.00 C ATOM 485 O LEU A 109 -1.057 -14.177 -3.519 1.00 0.00 O ATOM 486 CB LEU A 109 1.620 -13.523 -4.961 1.00 0.00 C ATOM 487 CG LEU A 109 3.071 -13.999 -4.865 1.00 0.00 C ATOM 488 CD1 LEU A 109 4.020 -12.925 -5.374 1.00 0.00 C ATOM 489 CD2 LEU A 109 3.411 -14.379 -3.432 1.00 0.00 C ATOM 0 H LEU A 109 -1.191 -13.790 -5.935 1.00 0.00 H new ATOM 0 HA LEU A 109 1.108 -15.532 -5.529 1.00 0.00 H new ATOM 0 HB2 LEU A 109 1.546 -12.792 -5.766 1.00 0.00 H new ATOM 0 HB3 LEU A 109 1.361 -13.007 -4.036 1.00 0.00 H new ATOM 0 HG LEU A 109 3.187 -14.883 -5.492 1.00 0.00 H new ATOM 0 HD11 LEU A 109 5.047 -13.281 -5.298 1.00 0.00 H new ATOM 0 HD12 LEU A 109 3.790 -12.700 -6.415 1.00 0.00 H new ATOM 0 HD13 LEU A 109 3.904 -12.023 -4.774 1.00 0.00 H new ATOM 0 HD21 LEU A 109 4.447 -14.715 -3.381 1.00 0.00 H new ATOM 0 HD22 LEU A 109 3.279 -13.512 -2.785 1.00 0.00 H new ATOM 0 HD23 LEU A 109 2.752 -15.182 -3.102 1.00 0.00 H new ATOM 501 N PRO A 110 0.161 -16.050 -3.245 1.00 0.00 N ATOM 502 CA PRO A 110 -0.502 -16.444 -1.998 1.00 0.00 C ATOM 503 C PRO A 110 -0.132 -15.534 -0.831 1.00 0.00 C ATOM 504 O PRO A 110 1.046 -15.353 -0.521 1.00 0.00 O ATOM 505 CB PRO A 110 0.016 -17.863 -1.752 1.00 0.00 C ATOM 506 CG PRO A 110 1.334 -17.908 -2.442 1.00 0.00 C ATOM 507 CD PRO A 110 1.204 -17.015 -3.645 1.00 0.00 C ATOM 0 HA PRO A 110 -1.587 -16.379 -2.077 1.00 0.00 H new ATOM 0 HB2 PRO A 110 0.120 -18.068 -0.686 1.00 0.00 H new ATOM 0 HB3 PRO A 110 -0.668 -18.610 -2.155 1.00 0.00 H new ATOM 0 HG2 PRO A 110 2.131 -17.562 -1.784 1.00 0.00 H new ATOM 0 HG3 PRO A 110 1.585 -18.927 -2.738 1.00 0.00 H new ATOM 0 HD2 PRO A 110 2.145 -16.516 -3.878 1.00 0.00 H new ATOM 0 HD3 PRO A 110 0.912 -17.577 -4.532 1.00 0.00 H new ATOM 515 N CYS A 111 -1.145 -14.964 -0.187 1.00 0.00 N ATOM 516 CA CYS A 111 -0.927 -14.073 0.947 1.00 0.00 C ATOM 517 C CYS A 111 -1.959 -14.330 2.041 1.00 0.00 C ATOM 518 O CYS A 111 -2.945 -15.034 1.824 1.00 0.00 O ATOM 519 CB CYS A 111 -0.994 -12.613 0.497 1.00 0.00 C ATOM 520 SG CYS A 111 0.255 -12.161 -0.730 1.00 0.00 S ATOM 0 H CYS A 111 -2.126 -15.103 -0.431 1.00 0.00 H new ATOM 0 HA CYS A 111 0.065 -14.273 1.352 1.00 0.00 H new ATOM 0 HB2 CYS A 111 -1.983 -12.417 0.083 1.00 0.00 H new ATOM 0 HB3 CYS A 111 -0.881 -11.969 1.369 1.00 0.00 H new ATOM 0 HG CYS A 111 1.073 -13.156 -0.904 1.00 0.00 H new ATOM 526 N SER A 112 -1.724 -13.757 3.216 1.00 0.00 N ATOM 527 CA SER A 112 -2.635 -13.929 4.342 1.00 0.00 C ATOM 528 C SER A 112 -3.507 -12.693 4.536 1.00 0.00 C ATOM 529 O SER A 112 -3.239 -11.635 3.965 1.00 0.00 O ATOM 530 CB SER A 112 -1.846 -14.217 5.622 1.00 0.00 C ATOM 531 OG SER A 112 -0.779 -15.115 5.372 1.00 0.00 O ATOM 0 H SER A 112 -0.913 -13.171 3.414 1.00 0.00 H new ATOM 0 HA SER A 112 -3.285 -14.776 4.123 1.00 0.00 H new ATOM 0 HB2 SER A 112 -1.453 -13.285 6.028 1.00 0.00 H new ATOM 0 HB3 SER A 112 -2.511 -14.638 6.376 1.00 0.00 H new ATOM 0 HG SER A 112 -0.290 -15.281 6.205 1.00 0.00 H new ATOM 537 N PHE A 113 -4.552 -12.834 5.346 1.00 0.00 N ATOM 538 CA PHE A 113 -5.467 -11.731 5.619 1.00 0.00 C ATOM 539 C PHE A 113 -4.722 -10.541 6.215 1.00 0.00 C ATOM 540 O PHE A 113 -4.889 -9.406 5.769 1.00 0.00 O ATOM 541 CB PHE A 113 -6.577 -12.189 6.571 1.00 0.00 C ATOM 542 CG PHE A 113 -7.488 -11.081 7.020 1.00 0.00 C ATOM 543 CD1 PHE A 113 -7.178 -10.322 8.137 1.00 0.00 C ATOM 544 CD2 PHE A 113 -8.654 -10.799 6.325 1.00 0.00 C ATOM 545 CE1 PHE A 113 -8.013 -9.302 8.553 1.00 0.00 C ATOM 546 CE2 PHE A 113 -9.493 -9.781 6.736 1.00 0.00 C ATOM 547 CZ PHE A 113 -9.172 -9.031 7.852 1.00 0.00 C ATOM 0 H PHE A 113 -4.786 -13.703 5.826 1.00 0.00 H new ATOM 0 HA PHE A 113 -5.914 -11.417 4.676 1.00 0.00 H new ATOM 0 HB2 PHE A 113 -7.172 -12.958 6.077 1.00 0.00 H new ATOM 0 HB3 PHE A 113 -6.123 -12.651 7.448 1.00 0.00 H new ATOM 0 HD1 PHE A 113 -6.273 -10.530 8.689 1.00 0.00 H new ATOM 0 HD2 PHE A 113 -8.909 -11.382 5.452 1.00 0.00 H new ATOM 0 HE1 PHE A 113 -7.760 -8.718 9.425 1.00 0.00 H new ATOM 0 HE2 PHE A 113 -10.399 -9.571 6.186 1.00 0.00 H new ATOM 0 HZ PHE A 113 -9.826 -8.235 8.175 1.00 0.00 H new ATOM 557 N ALA A 114 -3.917 -10.803 7.239 1.00 0.00 N ATOM 558 CA ALA A 114 -3.168 -9.746 7.908 1.00 0.00 C ATOM 559 C ALA A 114 -2.297 -8.969 6.929 1.00 0.00 C ATOM 560 O ALA A 114 -2.333 -7.739 6.906 1.00 0.00 O ATOM 561 CB ALA A 114 -2.310 -10.326 9.019 1.00 0.00 C ATOM 0 H ALA A 114 -3.767 -11.736 7.623 1.00 0.00 H new ATOM 0 HA ALA A 114 -3.891 -9.053 8.338 1.00 0.00 H new ATOM 0 HB1 ALA A 114 -1.757 -9.524 9.508 1.00 0.00 H new ATOM 0 HB2 ALA A 114 -2.948 -10.825 9.749 1.00 0.00 H new ATOM 0 HB3 ALA A 114 -1.608 -11.046 8.598 1.00 0.00 H new ATOM 567 N THR A 115 -1.517 -9.677 6.117 1.00 0.00 N ATOM 568 CA THR A 115 -0.652 -9.024 5.145 1.00 0.00 C ATOM 569 C THR A 115 -1.479 -8.246 4.132 1.00 0.00 C ATOM 570 O THR A 115 -1.163 -7.105 3.804 1.00 0.00 O ATOM 571 CB THR A 115 0.217 -10.059 4.428 1.00 0.00 C ATOM 572 OG1 THR A 115 1.008 -10.779 5.356 1.00 0.00 O ATOM 573 CG2 THR A 115 1.151 -9.451 3.403 1.00 0.00 C ATOM 0 H THR A 115 -1.467 -10.696 6.114 1.00 0.00 H new ATOM 0 HA THR A 115 -0.004 -8.326 5.676 1.00 0.00 H new ATOM 0 HB THR A 115 -0.484 -10.716 3.912 1.00 0.00 H new ATOM 0 HG1 THR A 115 1.555 -11.437 4.878 1.00 0.00 H new ATOM 0 HG21 THR A 115 1.738 -10.240 2.932 1.00 0.00 H new ATOM 0 HG22 THR A 115 0.568 -8.930 2.644 1.00 0.00 H new ATOM 0 HG23 THR A 115 1.820 -8.745 3.894 1.00 0.00 H new ATOM 581 N LEU A 116 -2.547 -8.868 3.643 1.00 0.00 N ATOM 582 CA LEU A 116 -3.423 -8.223 2.673 1.00 0.00 C ATOM 583 C LEU A 116 -3.887 -6.869 3.194 1.00 0.00 C ATOM 584 O LEU A 116 -3.878 -5.874 2.469 1.00 0.00 O ATOM 585 CB LEU A 116 -4.633 -9.111 2.375 1.00 0.00 C ATOM 586 CG LEU A 116 -4.365 -10.271 1.415 1.00 0.00 C ATOM 587 CD1 LEU A 116 -5.602 -11.145 1.276 1.00 0.00 C ATOM 588 CD2 LEU A 116 -3.925 -9.747 0.057 1.00 0.00 C ATOM 0 H LEU A 116 -2.826 -9.815 3.902 1.00 0.00 H new ATOM 0 HA LEU A 116 -2.862 -8.071 1.751 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -5.007 -9.517 3.315 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -5.426 -8.490 1.958 1.00 0.00 H new ATOM 0 HG LEU A 116 -3.560 -10.880 1.826 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -5.393 -11.965 0.589 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -5.874 -11.549 2.251 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -6.427 -10.548 0.888 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -3.739 -10.586 -0.614 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -4.709 -9.116 -0.361 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -3.011 -9.163 0.171 1.00 0.00 H new ATOM 600 N ALA A 117 -4.294 -6.842 4.458 1.00 0.00 N ATOM 601 CA ALA A 117 -4.767 -5.619 5.088 1.00 0.00 C ATOM 602 C ALA A 117 -3.620 -4.653 5.375 1.00 0.00 C ATOM 603 O ALA A 117 -3.793 -3.436 5.300 1.00 0.00 O ATOM 604 CB ALA A 117 -5.507 -5.959 6.373 1.00 0.00 C ATOM 0 H ALA A 117 -4.305 -7.659 5.068 1.00 0.00 H new ATOM 0 HA ALA A 117 -5.447 -5.122 4.397 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -5.860 -5.041 6.843 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -6.358 -6.600 6.144 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -4.833 -6.479 7.054 1.00 0.00 H new ATOM 610 N LEU A 118 -2.450 -5.194 5.707 1.00 0.00 N ATOM 611 CA LEU A 118 -1.287 -4.362 6.005 1.00 0.00 C ATOM 612 C LEU A 118 -0.780 -3.657 4.749 1.00 0.00 C ATOM 613 O LEU A 118 -0.612 -2.436 4.734 1.00 0.00 O ATOM 614 CB LEU A 118 -0.169 -5.212 6.613 1.00 0.00 C ATOM 615 CG LEU A 118 1.136 -4.465 6.893 1.00 0.00 C ATOM 616 CD1 LEU A 118 1.800 -5.002 8.151 1.00 0.00 C ATOM 617 CD2 LEU A 118 2.077 -4.575 5.702 1.00 0.00 C ATOM 0 H LEU A 118 -2.283 -6.198 5.776 1.00 0.00 H new ATOM 0 HA LEU A 118 -1.592 -3.603 6.725 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -0.529 -5.644 7.546 1.00 0.00 H new ATOM 0 HB3 LEU A 118 0.043 -6.042 5.939 1.00 0.00 H new ATOM 0 HG LEU A 118 0.903 -3.412 7.052 1.00 0.00 H new ATOM 0 HD11 LEU A 118 2.727 -4.458 8.334 1.00 0.00 H new ATOM 0 HD12 LEU A 118 1.129 -4.872 9.000 1.00 0.00 H new ATOM 0 HD13 LEU A 118 2.020 -6.062 8.022 1.00 0.00 H new ATOM 0 HD21 LEU A 118 3.001 -4.038 5.917 1.00 0.00 H new ATOM 0 HD22 LEU A 118 2.303 -5.624 5.512 1.00 0.00 H new ATOM 0 HD23 LEU A 118 1.602 -4.141 4.822 1.00 0.00 H new ATOM 629 N LEU A 119 -0.548 -4.431 3.694 1.00 0.00 N ATOM 630 CA LEU A 119 -0.070 -3.880 2.433 1.00 0.00 C ATOM 631 C LEU A 119 -1.114 -2.948 1.832 1.00 0.00 C ATOM 632 O LEU A 119 -0.782 -1.942 1.204 1.00 0.00 O ATOM 633 CB LEU A 119 0.257 -5.004 1.448 1.00 0.00 C ATOM 634 CG LEU A 119 1.164 -6.107 1.998 1.00 0.00 C ATOM 635 CD1 LEU A 119 1.194 -7.295 1.049 1.00 0.00 C ATOM 636 CD2 LEU A 119 2.569 -5.574 2.231 1.00 0.00 C ATOM 0 H LEU A 119 -0.684 -5.442 3.688 1.00 0.00 H new ATOM 0 HA LEU A 119 0.839 -3.311 2.629 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -0.677 -5.456 1.114 1.00 0.00 H new ATOM 0 HB3 LEU A 119 0.733 -4.569 0.569 1.00 0.00 H new ATOM 0 HG LEU A 119 0.760 -6.441 2.954 1.00 0.00 H new ATOM 0 HD11 LEU A 119 1.844 -8.070 1.456 1.00 0.00 H new ATOM 0 HD12 LEU A 119 0.186 -7.692 0.931 1.00 0.00 H new ATOM 0 HD13 LEU A 119 1.574 -6.976 0.078 1.00 0.00 H new ATOM 0 HD21 LEU A 119 3.201 -6.372 2.622 1.00 0.00 H new ATOM 0 HD22 LEU A 119 2.982 -5.213 1.289 1.00 0.00 H new ATOM 0 HD23 LEU A 119 2.533 -4.755 2.949 1.00 0.00 H new ATOM 648 N GLY A 120 -2.380 -3.286 2.044 1.00 0.00 N ATOM 649 CA GLY A 120 -3.460 -2.468 1.533 1.00 0.00 C ATOM 650 C GLY A 120 -3.577 -1.157 2.283 1.00 0.00 C ATOM 651 O GLY A 120 -3.604 -0.087 1.677 1.00 0.00 O ATOM 0 H GLY A 120 -2.677 -4.113 2.562 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -3.294 -2.268 0.474 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -4.399 -3.016 1.611 1.00 0.00 H new ATOM 655 N SER A 121 -3.643 -1.245 3.608 1.00 0.00 N ATOM 656 CA SER A 121 -3.757 -0.061 4.452 1.00 0.00 C ATOM 657 C SER A 121 -2.627 0.925 4.172 1.00 0.00 C ATOM 658 O SER A 121 -2.817 2.140 4.254 1.00 0.00 O ATOM 659 CB SER A 121 -3.742 -0.461 5.929 1.00 0.00 C ATOM 660 OG SER A 121 -2.655 -1.324 6.213 1.00 0.00 O ATOM 0 H SER A 121 -3.619 -2.126 4.121 1.00 0.00 H new ATOM 0 HA SER A 121 -4.704 0.427 4.220 1.00 0.00 H new ATOM 0 HB2 SER A 121 -3.673 0.432 6.550 1.00 0.00 H new ATOM 0 HB3 SER A 121 -4.679 -0.955 6.185 1.00 0.00 H new ATOM 0 HG SER A 121 -2.840 -2.214 5.847 1.00 0.00 H new ATOM 666 N TYR A 122 -1.452 0.401 3.831 1.00 0.00 N ATOM 667 CA TYR A 122 -0.303 1.247 3.535 1.00 0.00 C ATOM 668 C TYR A 122 -0.490 1.961 2.202 1.00 0.00 C ATOM 669 O TYR A 122 -0.273 3.168 2.097 1.00 0.00 O ATOM 670 CB TYR A 122 0.978 0.413 3.507 1.00 0.00 C ATOM 671 CG TYR A 122 1.542 0.126 4.880 1.00 0.00 C ATOM 672 CD1 TYR A 122 1.638 1.130 5.834 1.00 0.00 C ATOM 673 CD2 TYR A 122 1.978 -1.148 5.221 1.00 0.00 C ATOM 674 CE1 TYR A 122 2.153 0.873 7.090 1.00 0.00 C ATOM 675 CE2 TYR A 122 2.494 -1.414 6.475 1.00 0.00 C ATOM 676 CZ TYR A 122 2.579 -0.400 7.406 1.00 0.00 C ATOM 677 OH TYR A 122 3.092 -0.660 8.656 1.00 0.00 O ATOM 0 H TYR A 122 -1.273 -0.600 3.754 1.00 0.00 H new ATOM 0 HA TYR A 122 -0.219 1.997 4.322 1.00 0.00 H new ATOM 0 HB2 TYR A 122 0.776 -0.531 3.001 1.00 0.00 H new ATOM 0 HB3 TYR A 122 1.730 0.936 2.916 1.00 0.00 H new ATOM 0 HD1 TYR A 122 1.305 2.128 5.590 1.00 0.00 H new ATOM 0 HD2 TYR A 122 1.913 -1.944 4.494 1.00 0.00 H new ATOM 0 HE1 TYR A 122 2.222 1.665 7.821 1.00 0.00 H new ATOM 0 HE2 TYR A 122 2.829 -2.410 6.725 1.00 0.00 H new ATOM 0 HH TYR A 122 3.344 -1.605 8.716 1.00 0.00 H new ATOM 687 N THR A 123 -0.900 1.208 1.184 1.00 0.00 N ATOM 688 CA THR A 123 -1.121 1.775 -0.141 1.00 0.00 C ATOM 689 C THR A 123 -2.147 2.899 -0.079 1.00 0.00 C ATOM 690 O THR A 123 -1.991 3.930 -0.731 1.00 0.00 O ATOM 691 CB THR A 123 -1.585 0.691 -1.115 1.00 0.00 C ATOM 692 OG1 THR A 123 -0.724 -0.432 -1.063 1.00 0.00 O ATOM 693 CG2 THR A 123 -1.641 1.162 -2.552 1.00 0.00 C ATOM 0 H THR A 123 -1.085 0.207 1.252 1.00 0.00 H new ATOM 0 HA THR A 123 -0.177 2.186 -0.498 1.00 0.00 H new ATOM 0 HB THR A 123 -2.594 0.429 -0.796 1.00 0.00 H new ATOM 0 HG1 THR A 123 -0.935 -0.970 -0.271 1.00 0.00 H new ATOM 0 HG21 THR A 123 -1.977 0.345 -3.190 1.00 0.00 H new ATOM 0 HG22 THR A 123 -2.337 1.997 -2.634 1.00 0.00 H new ATOM 0 HG23 THR A 123 -0.649 1.484 -2.868 1.00 0.00 H new ATOM 701 N ILE A 124 -3.192 2.700 0.720 1.00 0.00 N ATOM 702 CA ILE A 124 -4.232 3.707 0.874 1.00 0.00 C ATOM 703 C ILE A 124 -3.646 4.980 1.475 1.00 0.00 C ATOM 704 O ILE A 124 -3.872 6.078 0.971 1.00 0.00 O ATOM 705 CB ILE A 124 -5.384 3.198 1.768 1.00 0.00 C ATOM 706 CG1 ILE A 124 -5.992 1.925 1.173 1.00 0.00 C ATOM 707 CG2 ILE A 124 -6.453 4.269 1.936 1.00 0.00 C ATOM 708 CD1 ILE A 124 -6.725 2.155 -0.131 1.00 0.00 C ATOM 0 H ILE A 124 -3.339 1.853 1.268 1.00 0.00 H new ATOM 0 HA ILE A 124 -4.635 3.920 -0.116 1.00 0.00 H new ATOM 0 HB ILE A 124 -4.978 2.966 2.753 1.00 0.00 H new ATOM 0 HG12 ILE A 124 -5.199 1.195 1.010 1.00 0.00 H new ATOM 0 HG13 ILE A 124 -6.682 1.490 1.896 1.00 0.00 H new ATOM 0 HG21 ILE A 124 -7.254 3.887 2.569 1.00 0.00 H new ATOM 0 HG22 ILE A 124 -6.013 5.152 2.399 1.00 0.00 H new ATOM 0 HG23 ILE A 124 -6.858 4.535 0.960 1.00 0.00 H new ATOM 0 HD11 ILE A 124 -7.129 1.210 -0.493 1.00 0.00 H new ATOM 0 HD12 ILE A 124 -7.540 2.860 0.029 1.00 0.00 H new ATOM 0 HD13 ILE A 124 -6.034 2.561 -0.870 1.00 0.00 H new ATOM 720 N GLN A 125 -2.885 4.820 2.553 1.00 0.00 N ATOM 721 CA GLN A 125 -2.255 5.951 3.223 1.00 0.00 C ATOM 722 C GLN A 125 -1.376 6.733 2.247 1.00 0.00 C ATOM 723 O GLN A 125 -1.346 7.961 2.273 1.00 0.00 O ATOM 724 CB GLN A 125 -1.423 5.457 4.414 1.00 0.00 C ATOM 725 CG GLN A 125 -0.422 6.475 4.943 1.00 0.00 C ATOM 726 CD GLN A 125 -1.086 7.727 5.480 1.00 0.00 C ATOM 727 OE1 GLN A 125 -1.137 8.754 4.805 1.00 0.00 O ATOM 728 NE2 GLN A 125 -1.598 7.648 6.703 1.00 0.00 N ATOM 0 H GLN A 125 -2.690 3.915 2.982 1.00 0.00 H new ATOM 0 HA GLN A 125 -3.035 6.618 3.590 1.00 0.00 H new ATOM 0 HB2 GLN A 125 -2.098 5.175 5.222 1.00 0.00 H new ATOM 0 HB3 GLN A 125 -0.886 4.556 4.118 1.00 0.00 H new ATOM 0 HG2 GLN A 125 0.172 6.017 5.734 1.00 0.00 H new ATOM 0 HG3 GLN A 125 0.267 6.749 4.144 1.00 0.00 H new ATOM 0 HE21 GLN A 125 -1.533 6.776 7.228 1.00 0.00 H new ATOM 0 HE22 GLN A 125 -2.056 8.460 7.118 1.00 0.00 H new ATOM 737 N SER A 126 -0.662 6.011 1.392 1.00 0.00 N ATOM 738 CA SER A 126 0.219 6.636 0.411 1.00 0.00 C ATOM 739 C SER A 126 -0.566 7.171 -0.786 1.00 0.00 C ATOM 740 O SER A 126 -0.105 8.071 -1.488 1.00 0.00 O ATOM 741 CB SER A 126 1.273 5.634 -0.066 1.00 0.00 C ATOM 742 OG SER A 126 2.477 5.771 0.668 1.00 0.00 O ATOM 0 H SER A 126 -0.675 4.992 1.357 1.00 0.00 H new ATOM 0 HA SER A 126 0.712 7.478 0.897 1.00 0.00 H new ATOM 0 HB2 SER A 126 0.890 4.619 0.044 1.00 0.00 H new ATOM 0 HB3 SER A 126 1.471 5.787 -1.127 1.00 0.00 H new ATOM 0 HG SER A 126 3.133 5.119 0.345 1.00 0.00 H new ATOM 748 N GLU A 127 -1.741 6.599 -1.025 1.00 0.00 N ATOM 749 CA GLU A 127 -2.572 7.008 -2.151 1.00 0.00 C ATOM 750 C GLU A 127 -3.370 8.259 -1.826 1.00 0.00 C ATOM 751 O GLU A 127 -3.530 9.144 -2.667 1.00 0.00 O ATOM 752 CB GLU A 127 -3.531 5.879 -2.543 1.00 0.00 C ATOM 753 CG GLU A 127 -3.150 5.180 -3.838 1.00 0.00 C ATOM 754 CD GLU A 127 -3.533 5.982 -5.067 1.00 0.00 C ATOM 755 OE1 GLU A 127 -2.779 6.909 -5.430 1.00 0.00 O ATOM 756 OE2 GLU A 127 -4.587 5.682 -5.666 1.00 0.00 O ATOM 0 H GLU A 127 -2.139 5.852 -0.455 1.00 0.00 H new ATOM 0 HA GLU A 127 -1.907 7.230 -2.986 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -3.562 5.144 -1.739 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -4.537 6.286 -2.642 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -2.075 5.000 -3.847 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -3.637 4.206 -3.878 1.00 0.00 H new ATOM 763 N LEU A 128 -3.902 8.310 -0.615 1.00 0.00 N ATOM 764 CA LEU A 128 -4.723 9.429 -0.188 1.00 0.00 C ATOM 765 C LEU A 128 -4.076 10.226 0.944 1.00 0.00 C ATOM 766 O LEU A 128 -4.664 11.187 1.443 1.00 0.00 O ATOM 767 CB LEU A 128 -6.072 8.885 0.261 1.00 0.00 C ATOM 768 CG LEU A 128 -6.755 7.964 -0.754 1.00 0.00 C ATOM 769 CD1 LEU A 128 -6.902 6.561 -0.191 1.00 0.00 C ATOM 770 CD2 LEU A 128 -8.108 8.518 -1.164 1.00 0.00 C ATOM 0 H LEU A 128 -3.778 7.585 0.092 1.00 0.00 H new ATOM 0 HA LEU A 128 -4.839 10.115 -1.027 1.00 0.00 H new ATOM 0 HB2 LEU A 128 -5.937 8.339 1.195 1.00 0.00 H new ATOM 0 HB3 LEU A 128 -6.735 9.724 0.475 1.00 0.00 H new ATOM 0 HG LEU A 128 -6.125 7.914 -1.642 1.00 0.00 H new ATOM 0 HD11 LEU A 128 -7.390 5.923 -0.928 1.00 0.00 H new ATOM 0 HD12 LEU A 128 -5.917 6.158 0.043 1.00 0.00 H new ATOM 0 HD13 LEU A 128 -7.505 6.594 0.716 1.00 0.00 H new ATOM 0 HD21 LEU A 128 -8.573 7.846 -1.885 1.00 0.00 H new ATOM 0 HD22 LEU A 128 -8.747 8.605 -0.285 1.00 0.00 H new ATOM 0 HD23 LEU A 128 -7.977 9.501 -1.616 1.00 0.00 H new ATOM 782 N GLY A 129 -2.871 9.836 1.347 1.00 0.00 N ATOM 783 CA GLY A 129 -2.190 10.543 2.412 1.00 0.00 C ATOM 784 C GLY A 129 -2.943 10.477 3.723 1.00 0.00 C ATOM 785 O GLY A 129 -3.614 9.487 4.017 1.00 0.00 O ATOM 0 H GLY A 129 -2.357 9.046 0.956 1.00 0.00 H new ATOM 0 HA2 GLY A 129 -1.194 10.120 2.546 1.00 0.00 H new ATOM 0 HA3 GLY A 129 -2.057 11.586 2.125 1.00 0.00 H new ATOM 956 N VAL A 141 -13.338 2.519 0.860 1.00 0.00 N ATOM 957 CA VAL A 141 -12.261 1.773 0.217 1.00 0.00 C ATOM 958 C VAL A 141 -12.789 0.879 -0.906 1.00 0.00 C ATOM 959 O VAL A 141 -12.021 0.172 -1.559 1.00 0.00 O ATOM 960 CB VAL A 141 -11.494 0.902 1.230 1.00 0.00 C ATOM 961 CG1 VAL A 141 -10.217 0.361 0.608 1.00 0.00 C ATOM 962 CG2 VAL A 141 -11.185 1.694 2.492 1.00 0.00 C ATOM 0 HA VAL A 141 -11.582 2.514 -0.205 1.00 0.00 H new ATOM 0 HB VAL A 141 -12.125 0.057 1.505 1.00 0.00 H new ATOM 0 HG11 VAL A 141 -9.688 -0.252 1.338 1.00 0.00 H new ATOM 0 HG12 VAL A 141 -10.465 -0.245 -0.263 1.00 0.00 H new ATOM 0 HG13 VAL A 141 -9.581 1.192 0.303 1.00 0.00 H new ATOM 0 HG21 VAL A 141 -10.643 1.061 3.195 1.00 0.00 H new ATOM 0 HG22 VAL A 141 -10.574 2.560 2.238 1.00 0.00 H new ATOM 0 HG23 VAL A 141 -12.116 2.029 2.949 1.00 0.00 H new ATOM 972 N SER A 142 -14.101 0.918 -1.131 1.00 0.00 N ATOM 973 CA SER A 142 -14.732 0.118 -2.175 1.00 0.00 C ATOM 974 C SER A 142 -14.211 0.490 -3.563 1.00 0.00 C ATOM 975 O SER A 142 -14.422 -0.244 -4.528 1.00 0.00 O ATOM 976 CB SER A 142 -16.251 0.293 -2.128 1.00 0.00 C ATOM 977 OG SER A 142 -16.648 1.485 -2.785 1.00 0.00 O ATOM 0 H SER A 142 -14.750 1.499 -0.600 1.00 0.00 H new ATOM 0 HA SER A 142 -14.479 -0.926 -1.989 1.00 0.00 H new ATOM 0 HB2 SER A 142 -16.734 -0.563 -2.599 1.00 0.00 H new ATOM 0 HB3 SER A 142 -16.586 0.317 -1.091 1.00 0.00 H new ATOM 0 HG SER A 142 -17.623 1.573 -2.742 1.00 0.00 H new ATOM 983 N ASP A 143 -13.525 1.626 -3.660 1.00 0.00 N ATOM 984 CA ASP A 143 -12.975 2.076 -4.933 1.00 0.00 C ATOM 985 C ASP A 143 -11.537 1.594 -5.105 1.00 0.00 C ATOM 986 O ASP A 143 -11.055 1.437 -6.226 1.00 0.00 O ATOM 987 CB ASP A 143 -13.030 3.603 -5.024 1.00 0.00 C ATOM 988 CG ASP A 143 -13.471 4.085 -6.392 1.00 0.00 C ATOM 989 OD1 ASP A 143 -14.617 3.783 -6.787 1.00 0.00 O ATOM 990 OD2 ASP A 143 -12.671 4.764 -7.069 1.00 0.00 O ATOM 0 H ASP A 143 -13.338 2.249 -2.874 1.00 0.00 H new ATOM 0 HA ASP A 143 -13.579 1.650 -5.734 1.00 0.00 H new ATOM 0 HB2 ASP A 143 -13.717 3.985 -4.269 1.00 0.00 H new ATOM 0 HB3 ASP A 143 -12.046 4.013 -4.797 1.00 0.00 H new ATOM 995 N PHE A 144 -10.856 1.361 -3.985 1.00 0.00 N ATOM 996 CA PHE A 144 -9.473 0.897 -4.013 1.00 0.00 C ATOM 997 C PHE A 144 -9.406 -0.626 -3.953 1.00 0.00 C ATOM 998 O PHE A 144 -9.952 -1.247 -3.041 1.00 0.00 O ATOM 999 CB PHE A 144 -8.688 1.499 -2.846 1.00 0.00 C ATOM 1000 CG PHE A 144 -8.433 2.972 -2.990 1.00 0.00 C ATOM 1001 CD1 PHE A 144 -9.446 3.890 -2.761 1.00 0.00 C ATOM 1002 CD2 PHE A 144 -7.180 3.439 -3.356 1.00 0.00 C ATOM 1003 CE1 PHE A 144 -9.214 5.246 -2.894 1.00 0.00 C ATOM 1004 CE2 PHE A 144 -6.943 4.794 -3.490 1.00 0.00 C ATOM 1005 CZ PHE A 144 -7.961 5.698 -3.258 1.00 0.00 C ATOM 0 H PHE A 144 -11.240 1.486 -3.048 1.00 0.00 H new ATOM 0 HA PHE A 144 -9.026 1.225 -4.952 1.00 0.00 H new ATOM 0 HB2 PHE A 144 -9.236 1.322 -1.921 1.00 0.00 H new ATOM 0 HB3 PHE A 144 -7.734 0.981 -2.755 1.00 0.00 H new ATOM 0 HD1 PHE A 144 -10.428 3.542 -2.475 1.00 0.00 H new ATOM 0 HD2 PHE A 144 -6.380 2.736 -3.538 1.00 0.00 H new ATOM 0 HE1 PHE A 144 -10.012 5.951 -2.713 1.00 0.00 H new ATOM 0 HE2 PHE A 144 -5.963 5.146 -3.776 1.00 0.00 H new ATOM 0 HZ PHE A 144 -7.777 6.757 -3.361 1.00 0.00 H new ATOM 1015 N LYS A 145 -8.736 -1.222 -4.934 1.00 0.00 N ATOM 1016 CA LYS A 145 -8.599 -2.673 -4.997 1.00 0.00 C ATOM 1017 C LYS A 145 -7.480 -3.161 -4.081 1.00 0.00 C ATOM 1018 O LYS A 145 -6.321 -3.236 -4.487 1.00 0.00 O ATOM 1019 CB LYS A 145 -8.323 -3.117 -6.435 1.00 0.00 C ATOM 1020 CG LYS A 145 -7.118 -2.433 -7.062 1.00 0.00 C ATOM 1021 CD LYS A 145 -7.522 -1.546 -8.229 1.00 0.00 C ATOM 1022 CE LYS A 145 -6.345 -1.271 -9.152 1.00 0.00 C ATOM 1023 NZ LYS A 145 -6.786 -1.005 -10.550 1.00 0.00 N ATOM 0 H LYS A 145 -8.279 -0.722 -5.697 1.00 0.00 H new ATOM 0 HA LYS A 145 -9.537 -3.113 -4.658 1.00 0.00 H new ATOM 0 HB2 LYS A 145 -8.167 -4.196 -6.450 1.00 0.00 H new ATOM 0 HB3 LYS A 145 -9.204 -2.914 -7.045 1.00 0.00 H new ATOM 0 HG2 LYS A 145 -6.606 -1.834 -6.309 1.00 0.00 H new ATOM 0 HG3 LYS A 145 -6.409 -3.186 -7.405 1.00 0.00 H new ATOM 0 HD2 LYS A 145 -8.323 -2.025 -8.792 1.00 0.00 H new ATOM 0 HD3 LYS A 145 -7.918 -0.603 -7.851 1.00 0.00 H new ATOM 0 HE2 LYS A 145 -5.784 -0.414 -8.779 1.00 0.00 H new ATOM 0 HE3 LYS A 145 -5.668 -2.125 -9.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 145 -5.955 -0.822 -11.147 1.00 0.00 H new ATOM 0 HZ2 LYS A 145 -7.300 -1.832 -10.915 1.00 0.00 H new ATOM 0 HZ3 LYS A 145 -7.412 -0.175 -10.565 1.00 0.00 H new ATOM 1037 N LEU A 146 -7.836 -3.492 -2.844 1.00 0.00 N ATOM 1038 CA LEU A 146 -6.862 -3.974 -1.871 1.00 0.00 C ATOM 1039 C LEU A 146 -6.596 -5.467 -2.054 1.00 0.00 C ATOM 1040 O LEU A 146 -5.555 -5.976 -1.638 1.00 0.00 O ATOM 1041 CB LEU A 146 -7.351 -3.708 -0.446 1.00 0.00 C ATOM 1042 CG LEU A 146 -8.046 -2.361 -0.236 1.00 0.00 C ATOM 1043 CD1 LEU A 146 -8.926 -2.403 1.005 1.00 0.00 C ATOM 1044 CD2 LEU A 146 -7.018 -1.244 -0.130 1.00 0.00 C ATOM 0 H LEU A 146 -8.792 -3.435 -2.492 1.00 0.00 H new ATOM 0 HA LEU A 146 -5.931 -3.432 -2.037 1.00 0.00 H new ATOM 0 HB2 LEU A 146 -8.041 -4.503 -0.161 1.00 0.00 H new ATOM 0 HB3 LEU A 146 -6.499 -3.768 0.231 1.00 0.00 H new ATOM 0 HG LEU A 146 -8.682 -2.161 -1.098 1.00 0.00 H new ATOM 0 HD11 LEU A 146 -9.412 -1.437 1.139 1.00 0.00 H new ATOM 0 HD12 LEU A 146 -9.684 -3.178 0.888 1.00 0.00 H new ATOM 0 HD13 LEU A 146 -8.313 -2.625 1.878 1.00 0.00 H new ATOM 0 HD21 LEU A 146 -7.529 -0.293 0.019 1.00 0.00 H new ATOM 0 HD22 LEU A 146 -6.357 -1.437 0.715 1.00 0.00 H new ATOM 0 HD23 LEU A 146 -6.431 -1.201 -1.048 1.00 0.00 H new ATOM 1056 N ALA A 147 -7.543 -6.164 -2.677 1.00 0.00 N ATOM 1057 CA ALA A 147 -7.407 -7.597 -2.911 1.00 0.00 C ATOM 1058 C ALA A 147 -8.579 -8.131 -3.730 1.00 0.00 C ATOM 1059 O ALA A 147 -9.597 -7.456 -3.886 1.00 0.00 O ATOM 1060 CB ALA A 147 -7.302 -8.339 -1.586 1.00 0.00 C ATOM 0 H ALA A 147 -8.411 -5.759 -3.028 1.00 0.00 H new ATOM 0 HA ALA A 147 -6.493 -7.765 -3.481 1.00 0.00 H new ATOM 0 HB1 ALA A 147 -7.201 -9.408 -1.775 1.00 0.00 H new ATOM 0 HB2 ALA A 147 -6.430 -7.983 -1.038 1.00 0.00 H new ATOM 0 HB3 ALA A 147 -8.200 -8.158 -0.996 1.00 0.00 H new ATOM 1066 N PRO A 148 -8.452 -9.358 -4.266 1.00 0.00 N ATOM 1067 CA PRO A 148 -9.509 -9.980 -5.072 1.00 0.00 C ATOM 1068 C PRO A 148 -10.757 -10.287 -4.250 1.00 0.00 C ATOM 1069 O PRO A 148 -11.875 -9.976 -4.661 1.00 0.00 O ATOM 1070 CB PRO A 148 -8.866 -11.276 -5.572 1.00 0.00 C ATOM 1071 CG PRO A 148 -7.782 -11.569 -4.593 1.00 0.00 C ATOM 1072 CD PRO A 148 -7.274 -10.233 -4.129 1.00 0.00 C ATOM 0 HA PRO A 148 -9.848 -9.323 -5.873 1.00 0.00 H new ATOM 0 HB2 PRO A 148 -9.592 -12.088 -5.612 1.00 0.00 H new ATOM 0 HB3 PRO A 148 -8.467 -11.156 -6.579 1.00 0.00 H new ATOM 0 HG2 PRO A 148 -8.160 -12.155 -3.756 1.00 0.00 H new ATOM 0 HG3 PRO A 148 -6.985 -12.151 -5.055 1.00 0.00 H new ATOM 0 HD2 PRO A 148 -6.920 -10.273 -3.099 1.00 0.00 H new ATOM 0 HD3 PRO A 148 -6.441 -9.885 -4.740 1.00 0.00 H new ATOM 1080 N ASN A 149 -10.557 -10.897 -3.087 1.00 0.00 N ATOM 1081 CA ASN A 149 -11.666 -11.244 -2.206 1.00 0.00 C ATOM 1082 C ASN A 149 -11.720 -10.303 -1.006 1.00 0.00 C ATOM 1083 O ASN A 149 -11.444 -10.704 0.125 1.00 0.00 O ATOM 1084 CB ASN A 149 -11.533 -12.692 -1.730 1.00 0.00 C ATOM 1085 CG ASN A 149 -12.046 -13.686 -2.754 1.00 0.00 C ATOM 1086 OD1 ASN A 149 -13.249 -13.783 -2.993 1.00 0.00 O ATOM 1087 ND2 ASN A 149 -11.132 -14.430 -3.365 1.00 0.00 N ATOM 0 H ASN A 149 -9.638 -11.161 -2.733 1.00 0.00 H new ATOM 0 HA ASN A 149 -12.593 -11.139 -2.769 1.00 0.00 H new ATOM 0 HB2 ASN A 149 -10.486 -12.906 -1.513 1.00 0.00 H new ATOM 0 HB3 ASN A 149 -12.084 -12.817 -0.798 1.00 0.00 H new ATOM 0 HD21 ASN A 149 -11.417 -15.116 -4.064 1.00 0.00 H new ATOM 0 HD22 ASN A 149 -10.145 -14.316 -3.135 1.00 0.00 H new ATOM 1094 N GLN A 150 -12.077 -9.048 -1.262 1.00 0.00 N ATOM 1095 CA GLN A 150 -12.166 -8.049 -0.204 1.00 0.00 C ATOM 1096 C GLN A 150 -13.431 -8.245 0.627 1.00 0.00 C ATOM 1097 O GLN A 150 -14.544 -8.177 0.106 1.00 0.00 O ATOM 1098 CB GLN A 150 -12.146 -6.641 -0.800 1.00 0.00 C ATOM 1099 CG GLN A 150 -11.953 -5.546 0.236 1.00 0.00 C ATOM 1100 CD GLN A 150 -11.730 -4.183 -0.390 1.00 0.00 C ATOM 1101 OE1 GLN A 150 -10.578 -4.005 -1.027 1.00 0.00 O flip ATOM 1102 NE2 GLN A 150 -12.583 -3.300 -0.303 1.00 0.00 N flip ATOM 0 H GLN A 150 -12.309 -8.700 -2.192 1.00 0.00 H new ATOM 0 HA GLN A 150 -11.302 -8.172 0.449 1.00 0.00 H new ATOM 0 HB2 GLN A 150 -11.345 -6.578 -1.537 1.00 0.00 H new ATOM 0 HB3 GLN A 150 -13.082 -6.467 -1.331 1.00 0.00 H new ATOM 0 HG2 GLN A 150 -12.829 -5.505 0.884 1.00 0.00 H new ATOM 0 HG3 GLN A 150 -11.101 -5.795 0.868 1.00 0.00 H new ATOM 0 HE21 GLN A 150 -13.454 -3.480 0.196 1.00 0.00 H new ATOM 0 HE22 GLN A 150 -12.419 -2.388 -0.730 1.00 0.00 H new ATOM 1111 N THR A 151 -13.249 -8.491 1.920 1.00 0.00 N ATOM 1112 CA THR A 151 -14.376 -8.699 2.824 1.00 0.00 C ATOM 1113 C THR A 151 -14.435 -7.602 3.882 1.00 0.00 C ATOM 1114 O THR A 151 -13.461 -6.880 4.095 1.00 0.00 O ATOM 1115 CB THR A 151 -14.271 -10.068 3.499 1.00 0.00 C ATOM 1116 OG1 THR A 151 -15.190 -10.170 4.572 1.00 0.00 O ATOM 1117 CG2 THR A 151 -12.892 -10.362 4.046 1.00 0.00 C ATOM 0 H THR A 151 -12.334 -8.551 2.366 1.00 0.00 H new ATOM 0 HA THR A 151 -15.292 -8.661 2.235 1.00 0.00 H new ATOM 0 HB THR A 151 -14.495 -10.793 2.717 1.00 0.00 H new ATOM 0 HG1 THR A 151 -15.109 -11.053 4.990 1.00 0.00 H new ATOM 0 HG21 THR A 151 -12.888 -11.348 4.511 1.00 0.00 H new ATOM 0 HG22 THR A 151 -12.166 -10.341 3.233 1.00 0.00 H new ATOM 0 HG23 THR A 151 -12.627 -9.609 4.789 1.00 0.00 H new ATOM 1125 N LYS A 152 -15.587 -7.478 4.538 1.00 0.00 N ATOM 1126 CA LYS A 152 -15.782 -6.465 5.573 1.00 0.00 C ATOM 1127 C LYS A 152 -14.595 -6.412 6.530 1.00 0.00 C ATOM 1128 O LYS A 152 -14.137 -5.334 6.907 1.00 0.00 O ATOM 1129 CB LYS A 152 -17.067 -6.748 6.354 1.00 0.00 C ATOM 1130 CG LYS A 152 -17.031 -8.053 7.132 1.00 0.00 C ATOM 1131 CD LYS A 152 -18.432 -8.557 7.440 1.00 0.00 C ATOM 1132 CE LYS A 152 -18.463 -9.365 8.727 1.00 0.00 C ATOM 1133 NZ LYS A 152 -19.559 -10.373 8.725 1.00 0.00 N ATOM 0 H LYS A 152 -16.402 -8.068 4.370 1.00 0.00 H new ATOM 0 HA LYS A 152 -15.864 -5.496 5.080 1.00 0.00 H new ATOM 0 HB2 LYS A 152 -17.250 -5.927 7.047 1.00 0.00 H new ATOM 0 HB3 LYS A 152 -17.907 -6.772 5.659 1.00 0.00 H new ATOM 0 HG2 LYS A 152 -16.491 -8.805 6.558 1.00 0.00 H new ATOM 0 HG3 LYS A 152 -16.483 -7.908 8.063 1.00 0.00 H new ATOM 0 HD2 LYS A 152 -19.114 -7.711 7.524 1.00 0.00 H new ATOM 0 HD3 LYS A 152 -18.788 -9.173 6.614 1.00 0.00 H new ATOM 0 HE2 LYS A 152 -17.506 -9.870 8.862 1.00 0.00 H new ATOM 0 HE3 LYS A 152 -18.591 -8.692 9.575 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 -19.545 -10.902 9.620 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 -20.474 -9.890 8.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 -19.424 -11.031 7.931 1.00 0.00 H new ATOM 1147 N GLU A 153 -14.099 -7.582 6.920 1.00 0.00 N ATOM 1148 CA GLU A 153 -12.963 -7.664 7.831 1.00 0.00 C ATOM 1149 C GLU A 153 -11.753 -6.935 7.255 1.00 0.00 C ATOM 1150 O GLU A 153 -11.162 -6.077 7.912 1.00 0.00 O ATOM 1151 CB GLU A 153 -12.608 -9.126 8.109 1.00 0.00 C ATOM 1152 CG GLU A 153 -13.752 -9.924 8.713 1.00 0.00 C ATOM 1153 CD GLU A 153 -14.179 -9.395 10.069 1.00 0.00 C ATOM 1154 OE1 GLU A 153 -13.357 -9.438 11.009 1.00 0.00 O ATOM 1155 OE2 GLU A 153 -15.335 -8.938 10.190 1.00 0.00 O ATOM 0 H GLU A 153 -14.465 -8.485 6.620 1.00 0.00 H new ATOM 0 HA GLU A 153 -13.244 -7.183 8.768 1.00 0.00 H new ATOM 0 HB2 GLU A 153 -12.297 -9.599 7.178 1.00 0.00 H new ATOM 0 HB3 GLU A 153 -11.754 -9.162 8.785 1.00 0.00 H new ATOM 0 HG2 GLU A 153 -14.604 -9.902 8.034 1.00 0.00 H new ATOM 0 HG3 GLU A 153 -13.450 -10.967 8.812 1.00 0.00 H new ATOM 1162 N LEU A 154 -11.395 -7.277 6.022 1.00 0.00 N ATOM 1163 CA LEU A 154 -10.260 -6.651 5.355 1.00 0.00 C ATOM 1164 C LEU A 154 -10.513 -5.160 5.158 1.00 0.00 C ATOM 1165 O LEU A 154 -9.608 -4.341 5.309 1.00 0.00 O ATOM 1166 CB LEU A 154 -10.003 -7.326 4.005 1.00 0.00 C ATOM 1167 CG LEU A 154 -8.916 -6.676 3.146 1.00 0.00 C ATOM 1168 CD1 LEU A 154 -7.578 -6.695 3.869 1.00 0.00 C ATOM 1169 CD2 LEU A 154 -8.808 -7.382 1.802 1.00 0.00 C ATOM 0 H LEU A 154 -11.874 -7.984 5.465 1.00 0.00 H new ATOM 0 HA LEU A 154 -9.378 -6.773 5.984 1.00 0.00 H new ATOM 0 HB2 LEU A 154 -9.729 -8.366 4.183 1.00 0.00 H new ATOM 0 HB3 LEU A 154 -10.934 -7.335 3.438 1.00 0.00 H new ATOM 0 HG LEU A 154 -9.193 -5.637 2.969 1.00 0.00 H new ATOM 0 HD11 LEU A 154 -6.819 -6.228 3.241 1.00 0.00 H new ATOM 0 HD12 LEU A 154 -7.663 -6.145 4.806 1.00 0.00 H new ATOM 0 HD13 LEU A 154 -7.292 -7.726 4.078 1.00 0.00 H new ATOM 0 HD21 LEU A 154 -8.031 -6.908 1.203 1.00 0.00 H new ATOM 0 HD22 LEU A 154 -8.555 -8.430 1.961 1.00 0.00 H new ATOM 0 HD23 LEU A 154 -9.761 -7.315 1.278 1.00 0.00 H new ATOM 1181 N GLU A 155 -11.753 -4.818 4.824 1.00 0.00 N ATOM 1182 CA GLU A 155 -12.129 -3.425 4.610 1.00 0.00 C ATOM 1183 C GLU A 155 -11.927 -2.611 5.885 1.00 0.00 C ATOM 1184 O GLU A 155 -11.243 -1.587 5.880 1.00 0.00 O ATOM 1185 CB GLU A 155 -13.588 -3.331 4.157 1.00 0.00 C ATOM 1186 CG GLU A 155 -13.754 -3.278 2.647 1.00 0.00 C ATOM 1187 CD GLU A 155 -15.176 -2.961 2.228 1.00 0.00 C ATOM 1188 OE1 GLU A 155 -15.699 -1.908 2.651 1.00 0.00 O ATOM 1189 OE2 GLU A 155 -15.767 -3.765 1.477 1.00 0.00 O ATOM 0 H GLU A 155 -12.514 -5.485 4.696 1.00 0.00 H new ATOM 0 HA GLU A 155 -11.488 -3.015 3.829 1.00 0.00 H new ATOM 0 HB2 GLU A 155 -14.136 -4.190 4.544 1.00 0.00 H new ATOM 0 HB3 GLU A 155 -14.039 -2.441 4.595 1.00 0.00 H new ATOM 0 HG2 GLU A 155 -13.082 -2.524 2.237 1.00 0.00 H new ATOM 0 HG3 GLU A 155 -13.458 -4.236 2.219 1.00 0.00 H new ATOM 1196 N GLU A 156 -12.529 -3.074 6.975 1.00 0.00 N ATOM 1197 CA GLU A 156 -12.421 -2.393 8.261 1.00 0.00 C ATOM 1198 C GLU A 156 -10.960 -2.218 8.668 1.00 0.00 C ATOM 1199 O GLU A 156 -10.545 -1.134 9.075 1.00 0.00 O ATOM 1200 CB GLU A 156 -13.173 -3.173 9.340 1.00 0.00 C ATOM 1201 CG GLU A 156 -14.682 -3.163 9.159 1.00 0.00 C ATOM 1202 CD GLU A 156 -15.395 -4.059 10.153 1.00 0.00 C ATOM 1203 OE1 GLU A 156 -15.578 -5.257 9.847 1.00 0.00 O ATOM 1204 OE2 GLU A 156 -15.769 -3.564 11.236 1.00 0.00 O ATOM 0 H GLU A 156 -13.098 -3.920 6.994 1.00 0.00 H new ATOM 0 HA GLU A 156 -12.869 -1.405 8.157 1.00 0.00 H new ATOM 0 HB2 GLU A 156 -12.823 -4.205 9.341 1.00 0.00 H new ATOM 0 HB3 GLU A 156 -12.930 -2.753 10.316 1.00 0.00 H new ATOM 0 HG2 GLU A 156 -15.050 -2.143 9.266 1.00 0.00 H new ATOM 0 HG3 GLU A 156 -14.925 -3.485 8.146 1.00 0.00 H new ATOM 1211 N LYS A 157 -10.192 -3.297 8.574 1.00 0.00 N ATOM 1212 CA LYS A 157 -8.781 -3.271 8.950 1.00 0.00 C ATOM 1213 C LYS A 157 -8.008 -2.220 8.155 1.00 0.00 C ATOM 1214 O LYS A 157 -7.105 -1.573 8.685 1.00 0.00 O ATOM 1215 CB LYS A 157 -8.154 -4.649 8.735 1.00 0.00 C ATOM 1216 CG LYS A 157 -7.029 -4.965 9.708 1.00 0.00 C ATOM 1217 CD LYS A 157 -7.568 -5.331 11.081 1.00 0.00 C ATOM 1218 CE LYS A 157 -6.462 -5.829 11.999 1.00 0.00 C ATOM 1219 NZ LYS A 157 -6.963 -6.829 12.982 1.00 0.00 N ATOM 0 H LYS A 157 -10.522 -4.203 8.240 1.00 0.00 H new ATOM 0 HA LYS A 157 -8.723 -3.005 10.006 1.00 0.00 H new ATOM 0 HB2 LYS A 157 -8.929 -5.410 8.829 1.00 0.00 H new ATOM 0 HB3 LYS A 157 -7.770 -4.709 7.717 1.00 0.00 H new ATOM 0 HG2 LYS A 157 -6.431 -5.789 9.319 1.00 0.00 H new ATOM 0 HG3 LYS A 157 -6.367 -4.103 9.793 1.00 0.00 H new ATOM 0 HD2 LYS A 157 -8.049 -4.461 11.528 1.00 0.00 H new ATOM 0 HD3 LYS A 157 -8.333 -6.101 10.980 1.00 0.00 H new ATOM 0 HE2 LYS A 157 -5.667 -6.275 11.401 1.00 0.00 H new ATOM 0 HE3 LYS A 157 -6.025 -4.984 12.531 1.00 0.00 H new ATOM 0 HZ1 LYS A 157 -6.179 -7.143 13.588 1.00 0.00 H new ATOM 0 HZ2 LYS A 157 -7.704 -6.397 13.570 1.00 0.00 H new ATOM 0 HZ3 LYS A 157 -7.357 -7.647 12.475 1.00 0.00 H new ATOM 1233 N VAL A 158 -8.362 -2.053 6.885 1.00 0.00 N ATOM 1234 CA VAL A 158 -7.691 -1.077 6.031 1.00 0.00 C ATOM 1235 C VAL A 158 -7.975 0.351 6.494 1.00 0.00 C ATOM 1236 O VAL A 158 -7.054 1.142 6.699 1.00 0.00 O ATOM 1237 CB VAL A 158 -8.119 -1.226 4.556 1.00 0.00 C ATOM 1238 CG1 VAL A 158 -7.374 -0.234 3.672 1.00 0.00 C ATOM 1239 CG2 VAL A 158 -7.892 -2.653 4.076 1.00 0.00 C ATOM 0 H VAL A 158 -9.106 -2.578 6.425 1.00 0.00 H new ATOM 0 HA VAL A 158 -6.622 -1.274 6.110 1.00 0.00 H new ATOM 0 HB VAL A 158 -9.184 -1.006 4.486 1.00 0.00 H new ATOM 0 HG11 VAL A 158 -7.693 -0.358 2.637 1.00 0.00 H new ATOM 0 HG12 VAL A 158 -7.594 0.782 4.000 1.00 0.00 H new ATOM 0 HG13 VAL A 158 -6.302 -0.415 3.746 1.00 0.00 H new ATOM 0 HG21 VAL A 158 -8.199 -2.740 3.034 1.00 0.00 H new ATOM 0 HG22 VAL A 158 -6.835 -2.903 4.164 1.00 0.00 H new ATOM 0 HG23 VAL A 158 -8.479 -3.340 4.686 1.00 0.00 H new ATOM 1249 N MET A 159 -9.254 0.674 6.653 1.00 0.00 N ATOM 1250 CA MET A 159 -9.660 2.007 7.085 1.00 0.00 C ATOM 1251 C MET A 159 -9.210 2.284 8.517 1.00 0.00 C ATOM 1252 O MET A 159 -8.768 3.387 8.837 1.00 0.00 O ATOM 1253 CB MET A 159 -11.178 2.159 6.979 1.00 0.00 C ATOM 1254 CG MET A 159 -11.717 1.908 5.580 1.00 0.00 C ATOM 1255 SD MET A 159 -13.520 1.897 5.522 1.00 0.00 S ATOM 1256 CE MET A 159 -13.870 0.266 6.173 1.00 0.00 C ATOM 0 H MET A 159 -10.028 0.030 6.489 1.00 0.00 H new ATOM 0 HA MET A 159 -9.179 2.732 6.429 1.00 0.00 H new ATOM 0 HB2 MET A 159 -11.654 1.466 7.673 1.00 0.00 H new ATOM 0 HB3 MET A 159 -11.457 3.165 7.292 1.00 0.00 H new ATOM 0 HG2 MET A 159 -11.340 2.678 4.906 1.00 0.00 H new ATOM 0 HG3 MET A 159 -11.340 0.953 5.215 1.00 0.00 H new ATOM 0 HE1 MET A 159 -14.170 -0.394 5.359 1.00 0.00 H new ATOM 0 HE2 MET A 159 -12.977 -0.133 6.654 1.00 0.00 H new ATOM 0 HE3 MET A 159 -14.677 0.331 6.903 1.00 0.00 H new ATOM 1266 N GLU A 160 -9.330 1.277 9.374 1.00 0.00 N ATOM 1267 CA GLU A 160 -8.941 1.410 10.774 1.00 0.00 C ATOM 1268 C GLU A 160 -7.444 1.668 10.903 1.00 0.00 C ATOM 1269 O GLU A 160 -7.019 2.558 11.639 1.00 0.00 O ATOM 1270 CB GLU A 160 -9.322 0.149 11.551 1.00 0.00 C ATOM 1271 CG GLU A 160 -9.321 0.339 13.059 1.00 0.00 C ATOM 1272 CD GLU A 160 -8.895 -0.910 13.804 1.00 0.00 C ATOM 1273 OE1 GLU A 160 -8.011 -1.632 13.296 1.00 0.00 O ATOM 1274 OE2 GLU A 160 -9.445 -1.168 14.895 1.00 0.00 O ATOM 0 H GLU A 160 -9.694 0.358 9.124 1.00 0.00 H new ATOM 0 HA GLU A 160 -9.474 2.263 11.193 1.00 0.00 H new ATOM 0 HB2 GLU A 160 -10.313 -0.177 11.235 1.00 0.00 H new ATOM 0 HB3 GLU A 160 -8.627 -0.650 11.294 1.00 0.00 H new ATOM 0 HG2 GLU A 160 -8.650 1.158 13.318 1.00 0.00 H new ATOM 0 HG3 GLU A 160 -10.320 0.629 13.385 1.00 0.00 H new ATOM 1281 N LEU A 161 -6.648 0.882 10.186 1.00 0.00 N ATOM 1282 CA LEU A 161 -5.198 1.027 10.224 1.00 0.00 C ATOM 1283 C LEU A 161 -4.776 2.415 9.755 1.00 0.00 C ATOM 1284 O LEU A 161 -3.878 3.029 10.331 1.00 0.00 O ATOM 1285 CB LEU A 161 -4.535 -0.043 9.354 1.00 0.00 C ATOM 1286 CG LEU A 161 -4.556 -1.457 9.938 1.00 0.00 C ATOM 1287 CD1 LEU A 161 -4.220 -2.482 8.867 1.00 0.00 C ATOM 1288 CD2 LEU A 161 -3.586 -1.565 11.106 1.00 0.00 C ATOM 0 H LEU A 161 -6.982 0.139 9.572 1.00 0.00 H new ATOM 0 HA LEU A 161 -4.872 0.899 11.256 1.00 0.00 H new ATOM 0 HB2 LEU A 161 -5.032 -0.060 8.384 1.00 0.00 H new ATOM 0 HB3 LEU A 161 -3.499 0.245 9.177 1.00 0.00 H new ATOM 0 HG LEU A 161 -5.561 -1.663 10.306 1.00 0.00 H new ATOM 0 HD11 LEU A 161 -4.240 -3.482 9.301 1.00 0.00 H new ATOM 0 HD12 LEU A 161 -4.953 -2.421 8.062 1.00 0.00 H new ATOM 0 HD13 LEU A 161 -3.226 -2.279 8.468 1.00 0.00 H new ATOM 0 HD21 LEU A 161 -3.614 -2.577 11.510 1.00 0.00 H new ATOM 0 HD22 LEU A 161 -2.577 -1.339 10.763 1.00 0.00 H new ATOM 0 HD23 LEU A 161 -3.872 -0.857 11.883 1.00 0.00 H new ATOM 1300 N HIS A 162 -5.429 2.905 8.705 1.00 0.00 N ATOM 1301 CA HIS A 162 -5.119 4.222 8.158 1.00 0.00 C ATOM 1302 C HIS A 162 -5.304 5.310 9.212 1.00 0.00 C ATOM 1303 O HIS A 162 -4.379 6.065 9.507 1.00 0.00 O ATOM 1304 CB HIS A 162 -6.009 4.513 6.948 1.00 0.00 C ATOM 1305 CG HIS A 162 -5.613 5.743 6.190 1.00 0.00 C ATOM 1306 ND1 HIS A 162 -5.769 5.868 4.826 1.00 0.00 N ATOM 1307 CD2 HIS A 162 -5.067 6.909 6.613 1.00 0.00 C ATOM 1308 CE1 HIS A 162 -5.336 7.056 4.442 1.00 0.00 C ATOM 1309 NE2 HIS A 162 -4.906 7.706 5.507 1.00 0.00 N ATOM 0 H HIS A 162 -6.175 2.410 8.216 1.00 0.00 H new ATOM 0 HA HIS A 162 -4.075 4.221 7.845 1.00 0.00 H new ATOM 0 HB2 HIS A 162 -5.981 3.657 6.274 1.00 0.00 H new ATOM 0 HB3 HIS A 162 -7.040 4.621 7.284 1.00 0.00 H new ATOM 0 HD2 HIS A 162 -4.807 7.164 7.630 1.00 0.00 H new ATOM 0 HE1 HIS A 162 -5.334 7.431 3.429 1.00 0.00 H new ATOM 0 HE2 HIS A 162 -4.517 8.649 5.508 1.00 0.00 H new ATOM 1318 N LYS A 163 -6.506 5.384 9.774 1.00 0.00 N ATOM 1319 CA LYS A 163 -6.813 6.380 10.794 1.00 0.00 C ATOM 1320 C LYS A 163 -6.032 6.111 12.076 1.00 0.00 C ATOM 1321 O LYS A 163 -5.678 7.037 12.806 1.00 0.00 O ATOM 1322 CB LYS A 163 -8.314 6.389 11.091 1.00 0.00 C ATOM 1323 CG LYS A 163 -8.747 7.527 12.000 1.00 0.00 C ATOM 1324 CD LYS A 163 -9.816 7.078 12.984 1.00 0.00 C ATOM 1325 CE LYS A 163 -10.335 8.243 13.811 1.00 0.00 C ATOM 1326 NZ LYS A 163 -11.776 8.085 14.152 1.00 0.00 N ATOM 0 H LYS A 163 -7.283 4.766 9.540 1.00 0.00 H new ATOM 0 HA LYS A 163 -6.517 7.357 10.410 1.00 0.00 H new ATOM 0 HB2 LYS A 163 -8.862 6.457 10.151 1.00 0.00 H new ATOM 0 HB3 LYS A 163 -8.590 5.441 11.553 1.00 0.00 H new ATOM 0 HG2 LYS A 163 -7.884 7.906 12.547 1.00 0.00 H new ATOM 0 HG3 LYS A 163 -9.129 8.351 11.397 1.00 0.00 H new ATOM 0 HD2 LYS A 163 -10.642 6.619 12.441 1.00 0.00 H new ATOM 0 HD3 LYS A 163 -9.406 6.315 13.645 1.00 0.00 H new ATOM 0 HE2 LYS A 163 -9.752 8.325 14.728 1.00 0.00 H new ATOM 0 HE3 LYS A 163 -10.193 9.172 13.259 1.00 0.00 H new ATOM 0 HZ1 LYS A 163 -12.091 8.900 14.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 163 -12.336 8.032 13.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 163 -11.909 7.212 14.701 1.00 0.00 H new ATOM 1340 N SER A 164 -5.770 4.837 12.345 1.00 0.00 N ATOM 1341 CA SER A 164 -5.034 4.443 13.541 1.00 0.00 C ATOM 1342 C SER A 164 -3.567 4.855 13.450 1.00 0.00 C ATOM 1343 O SER A 164 -2.890 4.992 14.469 1.00 0.00 O ATOM 1344 CB SER A 164 -5.137 2.931 13.752 1.00 0.00 C ATOM 1345 OG SER A 164 -4.597 2.553 15.007 1.00 0.00 O ATOM 0 H SER A 164 -6.056 4.059 11.751 1.00 0.00 H new ATOM 0 HA SER A 164 -5.480 4.957 14.392 1.00 0.00 H new ATOM 0 HB2 SER A 164 -6.181 2.623 13.694 1.00 0.00 H new ATOM 0 HB3 SER A 164 -4.607 2.412 12.953 1.00 0.00 H new ATOM 0 HG SER A 164 -4.676 1.583 15.118 1.00 0.00 H new ATOM 1424 N THR A 169 4.547 9.833 7.385 1.00 0.00 N ATOM 1425 CA THR A 169 4.917 10.531 6.159 1.00 0.00 C ATOM 1426 C THR A 169 4.873 9.582 4.966 1.00 0.00 C ATOM 1427 O THR A 169 4.901 8.362 5.133 1.00 0.00 O ATOM 1428 CB THR A 169 6.316 11.133 6.294 1.00 0.00 C ATOM 1429 OG1 THR A 169 7.168 10.264 7.019 1.00 0.00 O ATOM 1430 CG2 THR A 169 6.326 12.475 6.994 1.00 0.00 C ATOM 0 HA THR A 169 4.199 11.334 5.993 1.00 0.00 H new ATOM 0 HB THR A 169 6.670 11.272 5.272 1.00 0.00 H new ATOM 0 HG1 THR A 169 6.725 9.989 7.849 1.00 0.00 H new ATOM 0 HG21 THR A 169 7.349 12.845 7.056 1.00 0.00 H new ATOM 0 HG22 THR A 169 5.717 13.183 6.432 1.00 0.00 H new ATOM 0 HG23 THR A 169 5.919 12.364 7.999 1.00 0.00 H new ATOM 1438 N PRO A 170 4.807 10.127 3.740 1.00 0.00 N ATOM 1439 CA PRO A 170 4.765 9.318 2.520 1.00 0.00 C ATOM 1440 C PRO A 170 5.886 8.286 2.485 1.00 0.00 C ATOM 1441 O PRO A 170 5.642 7.097 2.280 1.00 0.00 O ATOM 1442 CB PRO A 170 4.936 10.343 1.386 1.00 0.00 C ATOM 1443 CG PRO A 170 5.343 11.618 2.052 1.00 0.00 C ATOM 1444 CD PRO A 170 4.776 11.563 3.440 1.00 0.00 C ATOM 0 HA PRO A 170 3.840 8.746 2.443 1.00 0.00 H new ATOM 0 HB2 PRO A 170 5.692 10.015 0.673 1.00 0.00 H new ATOM 0 HB3 PRO A 170 4.007 10.471 0.830 1.00 0.00 H new ATOM 0 HG2 PRO A 170 6.428 11.715 2.078 1.00 0.00 H new ATOM 0 HG3 PRO A 170 4.959 12.481 1.508 1.00 0.00 H new ATOM 0 HD2 PRO A 170 5.375 12.138 4.146 1.00 0.00 H new ATOM 0 HD3 PRO A 170 3.763 11.964 3.481 1.00 0.00 H new ATOM 1452 N ALA A 171 7.116 8.749 2.685 1.00 0.00 N ATOM 1453 CA ALA A 171 8.279 7.867 2.676 1.00 0.00 C ATOM 1454 C ALA A 171 8.087 6.685 3.620 1.00 0.00 C ATOM 1455 O ALA A 171 8.445 5.553 3.294 1.00 0.00 O ATOM 1456 CB ALA A 171 9.532 8.644 3.052 1.00 0.00 C ATOM 0 H ALA A 171 7.334 9.731 2.855 1.00 0.00 H new ATOM 0 HA ALA A 171 8.394 7.474 1.666 1.00 0.00 H new ATOM 0 HB1 ALA A 171 10.392 7.975 3.042 1.00 0.00 H new ATOM 0 HB2 ALA A 171 9.690 9.449 2.334 1.00 0.00 H new ATOM 0 HB3 ALA A 171 9.413 9.066 4.050 1.00 0.00 H new ATOM 1462 N GLN A 172 7.516 6.953 4.791 1.00 0.00 N ATOM 1463 CA GLN A 172 7.275 5.907 5.779 1.00 0.00 C ATOM 1464 C GLN A 172 6.404 4.802 5.190 1.00 0.00 C ATOM 1465 O GLN A 172 6.661 3.616 5.400 1.00 0.00 O ATOM 1466 CB GLN A 172 6.607 6.494 7.025 1.00 0.00 C ATOM 1467 CG GLN A 172 7.579 6.771 8.161 1.00 0.00 C ATOM 1468 CD GLN A 172 7.010 7.723 9.195 1.00 0.00 C ATOM 1469 OE1 GLN A 172 7.529 8.945 9.223 1.00 0.00 O flip ATOM 1470 NE2 GLN A 172 6.114 7.364 9.959 1.00 0.00 N flip ATOM 0 H GLN A 172 7.212 7.883 5.078 1.00 0.00 H new ATOM 0 HA GLN A 172 8.236 5.478 6.064 1.00 0.00 H new ATOM 0 HB2 GLN A 172 6.103 7.422 6.754 1.00 0.00 H new ATOM 0 HB3 GLN A 172 5.839 5.804 7.375 1.00 0.00 H new ATOM 0 HG2 GLN A 172 7.844 5.831 8.645 1.00 0.00 H new ATOM 0 HG3 GLN A 172 8.499 7.190 7.753 1.00 0.00 H new ATOM 0 HE21 GLN A 172 5.745 6.415 9.902 1.00 0.00 H new ATOM 0 HE22 GLN A 172 5.741 8.016 10.649 1.00 0.00 H new ATOM 1479 N ALA A 173 5.379 5.199 4.444 1.00 0.00 N ATOM 1480 CA ALA A 173 4.477 4.243 3.816 1.00 0.00 C ATOM 1481 C ALA A 173 5.173 3.526 2.665 1.00 0.00 C ATOM 1482 O ALA A 173 5.005 2.321 2.476 1.00 0.00 O ATOM 1483 CB ALA A 173 3.219 4.944 3.326 1.00 0.00 C ATOM 0 H ALA A 173 5.153 6.176 4.260 1.00 0.00 H new ATOM 0 HA ALA A 173 4.191 3.499 4.559 1.00 0.00 H new ATOM 0 HB1 ALA A 173 2.555 4.216 2.859 1.00 0.00 H new ATOM 0 HB2 ALA A 173 2.710 5.410 4.170 1.00 0.00 H new ATOM 0 HB3 ALA A 173 3.489 5.709 2.597 1.00 0.00 H new ATOM 1489 N ASP A 174 5.964 4.277 1.904 1.00 0.00 N ATOM 1490 CA ASP A 174 6.699 3.717 0.777 1.00 0.00 C ATOM 1491 C ASP A 174 7.669 2.640 1.255 1.00 0.00 C ATOM 1492 O ASP A 174 7.785 1.570 0.652 1.00 0.00 O ATOM 1493 CB ASP A 174 7.468 4.821 0.048 1.00 0.00 C ATOM 1494 CG ASP A 174 6.712 5.356 -1.153 1.00 0.00 C ATOM 1495 OD1 ASP A 174 5.480 5.160 -1.214 1.00 0.00 O ATOM 1496 OD2 ASP A 174 7.352 5.969 -2.032 1.00 0.00 O ATOM 0 H ASP A 174 6.112 5.276 2.049 1.00 0.00 H new ATOM 0 HA ASP A 174 5.984 3.266 0.089 1.00 0.00 H new ATOM 0 HB2 ASP A 174 7.669 5.638 0.741 1.00 0.00 H new ATOM 0 HB3 ASP A 174 8.434 4.434 -0.277 1.00 0.00 H new ATOM 1501 N LEU A 175 8.353 2.936 2.354 1.00 0.00 N ATOM 1502 CA LEU A 175 9.315 2.013 2.945 1.00 0.00 C ATOM 1503 C LEU A 175 8.619 0.834 3.622 1.00 0.00 C ATOM 1504 O LEU A 175 9.112 -0.292 3.590 1.00 0.00 O ATOM 1505 CB LEU A 175 10.189 2.751 3.961 1.00 0.00 C ATOM 1506 CG LEU A 175 11.494 2.046 4.332 1.00 0.00 C ATOM 1507 CD1 LEU A 175 12.302 1.727 3.084 1.00 0.00 C ATOM 1508 CD2 LEU A 175 12.305 2.905 5.291 1.00 0.00 C ATOM 0 H LEU A 175 8.257 3.817 2.858 1.00 0.00 H new ATOM 0 HA LEU A 175 9.938 1.620 2.141 1.00 0.00 H new ATOM 0 HB2 LEU A 175 10.428 3.737 3.562 1.00 0.00 H new ATOM 0 HB3 LEU A 175 9.608 2.907 4.870 1.00 0.00 H new ATOM 0 HG LEU A 175 11.251 1.107 4.830 1.00 0.00 H new ATOM 0 HD11 LEU A 175 13.227 1.226 3.368 1.00 0.00 H new ATOM 0 HD12 LEU A 175 11.721 1.075 2.431 1.00 0.00 H new ATOM 0 HD13 LEU A 175 12.537 2.652 2.557 1.00 0.00 H new ATOM 0 HD21 LEU A 175 13.231 2.390 5.546 1.00 0.00 H new ATOM 0 HD22 LEU A 175 12.539 3.858 4.817 1.00 0.00 H new ATOM 0 HD23 LEU A 175 11.727 3.083 6.198 1.00 0.00 H new ATOM 1520 N GLU A 176 7.482 1.108 4.255 1.00 0.00 N ATOM 1521 CA GLU A 176 6.728 0.078 4.965 1.00 0.00 C ATOM 1522 C GLU A 176 6.289 -1.056 4.040 1.00 0.00 C ATOM 1523 O GLU A 176 6.564 -2.225 4.313 1.00 0.00 O ATOM 1524 CB GLU A 176 5.508 0.697 5.649 1.00 0.00 C ATOM 1525 CG GLU A 176 5.802 1.228 7.043 1.00 0.00 C ATOM 1526 CD GLU A 176 4.776 2.240 7.513 1.00 0.00 C ATOM 1527 OE1 GLU A 176 4.056 2.797 6.659 1.00 0.00 O ATOM 1528 OE2 GLU A 176 4.692 2.475 8.737 1.00 0.00 O ATOM 0 H GLU A 176 7.061 2.037 4.291 1.00 0.00 H new ATOM 0 HA GLU A 176 7.391 -0.351 5.716 1.00 0.00 H new ATOM 0 HB2 GLU A 176 5.128 1.511 5.031 1.00 0.00 H new ATOM 0 HB3 GLU A 176 4.718 -0.051 5.712 1.00 0.00 H new ATOM 0 HG2 GLU A 176 5.833 0.395 7.745 1.00 0.00 H new ATOM 0 HG3 GLU A 176 6.790 1.688 7.051 1.00 0.00 H new ATOM 1535 N PHE A 177 5.610 -0.716 2.949 1.00 0.00 N ATOM 1536 CA PHE A 177 5.146 -1.730 2.006 1.00 0.00 C ATOM 1537 C PHE A 177 6.325 -2.357 1.270 1.00 0.00 C ATOM 1538 O PHE A 177 6.413 -3.580 1.156 1.00 0.00 O ATOM 1539 CB PHE A 177 4.150 -1.129 1.009 1.00 0.00 C ATOM 1540 CG PHE A 177 3.809 -2.044 -0.135 1.00 0.00 C ATOM 1541 CD1 PHE A 177 3.028 -3.170 0.069 1.00 0.00 C ATOM 1542 CD2 PHE A 177 4.272 -1.776 -1.413 1.00 0.00 C ATOM 1543 CE1 PHE A 177 2.715 -4.012 -0.982 1.00 0.00 C ATOM 1544 CE2 PHE A 177 3.962 -2.614 -2.467 1.00 0.00 C ATOM 1545 CZ PHE A 177 3.183 -3.733 -2.251 1.00 0.00 C ATOM 0 H PHE A 177 5.370 0.243 2.697 1.00 0.00 H new ATOM 0 HA PHE A 177 4.636 -2.511 2.570 1.00 0.00 H new ATOM 0 HB2 PHE A 177 3.234 -0.867 1.538 1.00 0.00 H new ATOM 0 HB3 PHE A 177 4.564 -0.203 0.610 1.00 0.00 H new ATOM 0 HD1 PHE A 177 2.660 -3.392 1.060 1.00 0.00 H new ATOM 0 HD2 PHE A 177 4.882 -0.902 -1.587 1.00 0.00 H new ATOM 0 HE1 PHE A 177 2.105 -4.887 -0.811 1.00 0.00 H new ATOM 0 HE2 PHE A 177 4.329 -2.394 -3.459 1.00 0.00 H new ATOM 0 HZ PHE A 177 2.940 -4.389 -3.073 1.00 0.00 H new ATOM 1555 N LEU A 178 7.235 -1.521 0.779 1.00 0.00 N ATOM 1556 CA LEU A 178 8.407 -2.015 0.067 1.00 0.00 C ATOM 1557 C LEU A 178 9.209 -2.957 0.959 1.00 0.00 C ATOM 1558 O LEU A 178 9.731 -3.974 0.501 1.00 0.00 O ATOM 1559 CB LEU A 178 9.286 -0.850 -0.394 1.00 0.00 C ATOM 1560 CG LEU A 178 8.741 -0.060 -1.585 1.00 0.00 C ATOM 1561 CD1 LEU A 178 9.745 0.990 -2.033 1.00 0.00 C ATOM 1562 CD2 LEU A 178 8.397 -0.996 -2.735 1.00 0.00 C ATOM 0 H LEU A 178 7.184 -0.506 0.861 1.00 0.00 H new ATOM 0 HA LEU A 178 8.070 -2.564 -0.812 1.00 0.00 H new ATOM 0 HB2 LEU A 178 9.425 -0.166 0.443 1.00 0.00 H new ATOM 0 HB3 LEU A 178 10.270 -1.239 -0.655 1.00 0.00 H new ATOM 0 HG LEU A 178 7.829 0.448 -1.272 1.00 0.00 H new ATOM 0 HD11 LEU A 178 9.340 1.542 -2.881 1.00 0.00 H new ATOM 0 HD12 LEU A 178 9.942 1.679 -1.212 1.00 0.00 H new ATOM 0 HD13 LEU A 178 10.674 0.502 -2.328 1.00 0.00 H new ATOM 0 HD21 LEU A 178 8.011 -0.416 -3.573 1.00 0.00 H new ATOM 0 HD22 LEU A 178 9.293 -1.533 -3.047 1.00 0.00 H new ATOM 0 HD23 LEU A 178 7.641 -1.710 -2.409 1.00 0.00 H new ATOM 1574 N GLU A 179 9.293 -2.610 2.239 1.00 0.00 N ATOM 1575 CA GLU A 179 10.018 -3.413 3.210 1.00 0.00 C ATOM 1576 C GLU A 179 9.303 -4.736 3.459 1.00 0.00 C ATOM 1577 O GLU A 179 9.937 -5.763 3.705 1.00 0.00 O ATOM 1578 CB GLU A 179 10.158 -2.639 4.521 1.00 0.00 C ATOM 1579 CG GLU A 179 10.870 -3.413 5.613 1.00 0.00 C ATOM 1580 CD GLU A 179 9.920 -4.239 6.457 1.00 0.00 C ATOM 1581 OE1 GLU A 179 9.223 -3.653 7.313 1.00 0.00 O ATOM 1582 OE2 GLU A 179 9.871 -5.472 6.262 1.00 0.00 O ATOM 0 H GLU A 179 8.863 -1.771 2.628 1.00 0.00 H new ATOM 0 HA GLU A 179 11.009 -3.629 2.811 1.00 0.00 H new ATOM 0 HB2 GLU A 179 10.702 -1.714 4.330 1.00 0.00 H new ATOM 0 HB3 GLU A 179 9.166 -2.358 4.875 1.00 0.00 H new ATOM 0 HG2 GLU A 179 11.614 -4.070 5.162 1.00 0.00 H new ATOM 0 HG3 GLU A 179 11.408 -2.716 6.255 1.00 0.00 H new ATOM 1589 N ASN A 180 7.979 -4.703 3.382 1.00 0.00 N ATOM 1590 CA ASN A 180 7.176 -5.899 3.588 1.00 0.00 C ATOM 1591 C ASN A 180 7.288 -6.829 2.385 1.00 0.00 C ATOM 1592 O ASN A 180 7.554 -8.021 2.530 1.00 0.00 O ATOM 1593 CB ASN A 180 5.715 -5.514 3.824 1.00 0.00 C ATOM 1594 CG ASN A 180 5.289 -5.714 5.265 1.00 0.00 C ATOM 1595 OD1 ASN A 180 4.423 -6.538 5.560 1.00 0.00 O ATOM 1596 ND2 ASN A 180 5.898 -4.959 6.172 1.00 0.00 N ATOM 0 H ASN A 180 7.440 -3.861 3.179 1.00 0.00 H new ATOM 0 HA ASN A 180 7.550 -6.424 4.467 1.00 0.00 H new ATOM 0 HB2 ASN A 180 5.568 -4.470 3.546 1.00 0.00 H new ATOM 0 HB3 ASN A 180 5.076 -6.110 3.173 1.00 0.00 H new ATOM 0 HD21 ASN A 180 5.654 -5.049 7.158 1.00 0.00 H new ATOM 0 HD22 ASN A 180 6.610 -4.289 5.883 1.00 0.00 H new ATOM 1603 N ALA A 181 7.092 -6.269 1.196 1.00 0.00 N ATOM 1604 CA ALA A 181 7.178 -7.044 -0.035 1.00 0.00 C ATOM 1605 C ALA A 181 8.585 -7.597 -0.225 1.00 0.00 C ATOM 1606 O ALA A 181 8.764 -8.725 -0.683 1.00 0.00 O ATOM 1607 CB ALA A 181 6.776 -6.190 -1.229 1.00 0.00 C ATOM 0 H ALA A 181 6.873 -5.282 1.059 1.00 0.00 H new ATOM 0 HA ALA A 181 6.487 -7.884 0.039 1.00 0.00 H new ATOM 0 HB1 ALA A 181 6.846 -6.783 -2.141 1.00 0.00 H new ATOM 0 HB2 ALA A 181 5.751 -5.843 -1.099 1.00 0.00 H new ATOM 0 HB3 ALA A 181 7.443 -5.331 -1.303 1.00 0.00 H new ATOM 1613 N LYS A 182 9.582 -6.794 0.136 1.00 0.00 N ATOM 1614 CA LYS A 182 10.975 -7.203 0.012 1.00 0.00 C ATOM 1615 C LYS A 182 11.282 -8.359 0.958 1.00 0.00 C ATOM 1616 O LYS A 182 12.010 -9.287 0.605 1.00 0.00 O ATOM 1617 CB LYS A 182 11.904 -6.025 0.307 1.00 0.00 C ATOM 1618 CG LYS A 182 13.333 -6.245 -0.163 1.00 0.00 C ATOM 1619 CD LYS A 182 14.325 -5.473 0.691 1.00 0.00 C ATOM 1620 CE LYS A 182 15.474 -4.930 -0.144 1.00 0.00 C ATOM 1621 NZ LYS A 182 16.772 -5.003 0.582 1.00 0.00 N ATOM 0 H LYS A 182 9.450 -5.857 0.516 1.00 0.00 H new ATOM 0 HA LYS A 182 11.143 -7.537 -1.012 1.00 0.00 H new ATOM 0 HB2 LYS A 182 11.506 -5.130 -0.172 1.00 0.00 H new ATOM 0 HB3 LYS A 182 11.908 -5.836 1.381 1.00 0.00 H new ATOM 0 HG2 LYS A 182 13.570 -7.308 -0.126 1.00 0.00 H new ATOM 0 HG3 LYS A 182 13.427 -5.933 -1.203 1.00 0.00 H new ATOM 0 HD2 LYS A 182 13.814 -4.649 1.189 1.00 0.00 H new ATOM 0 HD3 LYS A 182 14.717 -6.123 1.473 1.00 0.00 H new ATOM 0 HE2 LYS A 182 15.546 -5.495 -1.073 1.00 0.00 H new ATOM 0 HE3 LYS A 182 15.268 -3.895 -0.415 1.00 0.00 H new ATOM 0 HZ1 LYS A 182 17.529 -4.623 -0.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 182 16.713 -4.443 1.456 1.00 0.00 H new ATOM 0 HZ3 LYS A 182 16.982 -5.994 0.819 1.00 0.00 H new ATOM 1635 N LYS A 183 10.716 -8.299 2.160 1.00 0.00 N ATOM 1636 CA LYS A 183 10.923 -9.345 3.156 1.00 0.00 C ATOM 1637 C LYS A 183 10.332 -10.672 2.687 1.00 0.00 C ATOM 1638 O LYS A 183 10.655 -11.730 3.227 1.00 0.00 O ATOM 1639 CB LYS A 183 10.286 -8.942 4.487 1.00 0.00 C ATOM 1640 CG LYS A 183 11.132 -9.301 5.699 1.00 0.00 C ATOM 1641 CD LYS A 183 11.421 -8.083 6.562 1.00 0.00 C ATOM 1642 CE LYS A 183 10.498 -8.022 7.768 1.00 0.00 C ATOM 1643 NZ LYS A 183 11.163 -8.525 9.002 1.00 0.00 N ATOM 0 H LYS A 183 10.111 -7.538 2.468 1.00 0.00 H new ATOM 0 HA LYS A 183 11.997 -9.471 3.292 1.00 0.00 H new ATOM 0 HB2 LYS A 183 10.108 -7.867 4.484 1.00 0.00 H new ATOM 0 HB3 LYS A 183 9.314 -9.426 4.576 1.00 0.00 H new ATOM 0 HG2 LYS A 183 10.615 -10.054 6.294 1.00 0.00 H new ATOM 0 HG3 LYS A 183 12.071 -9.745 5.369 1.00 0.00 H new ATOM 0 HD2 LYS A 183 12.458 -8.111 6.897 1.00 0.00 H new ATOM 0 HD3 LYS A 183 11.303 -7.178 5.966 1.00 0.00 H new ATOM 0 HE2 LYS A 183 10.173 -6.994 7.924 1.00 0.00 H new ATOM 0 HE3 LYS A 183 9.604 -8.613 7.571 1.00 0.00 H new ATOM 0 HZ1 LYS A 183 10.501 -8.467 9.802 1.00 0.00 H new ATOM 0 HZ2 LYS A 183 11.451 -9.514 8.862 1.00 0.00 H new ATOM 0 HZ3 LYS A 183 12.002 -7.945 9.205 1.00 0.00 H new ATOM 1657 N LEU A 184 9.458 -10.608 1.688 1.00 0.00 N ATOM 1658 CA LEU A 184 8.815 -11.803 1.158 1.00 0.00 C ATOM 1659 C LEU A 184 9.333 -12.151 -0.236 1.00 0.00 C ATOM 1660 O LEU A 184 9.073 -13.240 -0.748 1.00 0.00 O ATOM 1661 CB LEU A 184 7.307 -11.603 1.127 1.00 0.00 C ATOM 1662 CG LEU A 184 6.644 -11.682 2.500 1.00 0.00 C ATOM 1663 CD1 LEU A 184 6.150 -10.316 2.937 1.00 0.00 C ATOM 1664 CD2 LEU A 184 5.513 -12.689 2.486 1.00 0.00 C ATOM 0 H LEU A 184 9.179 -9.741 1.230 1.00 0.00 H new ATOM 0 HA LEU A 184 9.058 -12.638 1.815 1.00 0.00 H new ATOM 0 HB2 LEU A 184 7.088 -10.631 0.684 1.00 0.00 H new ATOM 0 HB3 LEU A 184 6.864 -12.357 0.476 1.00 0.00 H new ATOM 0 HG LEU A 184 7.388 -12.017 3.223 1.00 0.00 H new ATOM 0 HD11 LEU A 184 5.681 -10.395 3.918 1.00 0.00 H new ATOM 0 HD12 LEU A 184 6.991 -9.625 2.992 1.00 0.00 H new ATOM 0 HD13 LEU A 184 5.422 -9.944 2.216 1.00 0.00 H new ATOM 0 HD21 LEU A 184 5.052 -12.732 3.473 1.00 0.00 H new ATOM 0 HD22 LEU A 184 4.767 -12.388 1.750 1.00 0.00 H new ATOM 0 HD23 LEU A 184 5.905 -13.672 2.225 1.00 0.00 H new ATOM 1676 N SER A 185 10.067 -11.223 -0.847 1.00 0.00 N ATOM 1677 CA SER A 185 10.618 -11.439 -2.181 1.00 0.00 C ATOM 1678 C SER A 185 9.506 -11.560 -3.218 1.00 0.00 C ATOM 1679 O SER A 185 9.212 -12.652 -3.706 1.00 0.00 O ATOM 1680 CB SER A 185 11.491 -12.696 -2.200 1.00 0.00 C ATOM 1681 OG SER A 185 12.506 -12.597 -3.184 1.00 0.00 O ATOM 0 H SER A 185 10.293 -10.316 -0.439 1.00 0.00 H new ATOM 0 HA SER A 185 11.233 -10.576 -2.435 1.00 0.00 H new ATOM 0 HB2 SER A 185 11.944 -12.843 -1.219 1.00 0.00 H new ATOM 0 HB3 SER A 185 10.871 -13.570 -2.399 1.00 0.00 H new ATOM 0 HG SER A 185 13.051 -13.412 -3.175 1.00 0.00 H new ATOM 1687 N MET A 186 8.892 -10.430 -3.552 1.00 0.00 N ATOM 1688 CA MET A 186 7.813 -10.407 -4.534 1.00 0.00 C ATOM 1689 C MET A 186 8.314 -9.889 -5.879 1.00 0.00 C ATOM 1690 O MET A 186 7.769 -10.232 -6.928 1.00 0.00 O ATOM 1691 CB MET A 186 6.659 -9.535 -4.036 1.00 0.00 C ATOM 1692 CG MET A 186 6.175 -9.902 -2.642 1.00 0.00 C ATOM 1693 SD MET A 186 4.727 -8.954 -2.137 1.00 0.00 S ATOM 1694 CE MET A 186 3.416 -10.119 -2.497 1.00 0.00 C ATOM 0 H MET A 186 9.123 -9.518 -3.158 1.00 0.00 H new ATOM 0 HA MET A 186 7.455 -11.428 -4.668 1.00 0.00 H new ATOM 0 HB2 MET A 186 6.976 -8.492 -4.038 1.00 0.00 H new ATOM 0 HB3 MET A 186 5.826 -9.617 -4.734 1.00 0.00 H new ATOM 0 HG2 MET A 186 5.937 -10.965 -2.613 1.00 0.00 H new ATOM 0 HG3 MET A 186 6.981 -9.736 -1.927 1.00 0.00 H new ATOM 0 HE1 MET A 186 2.503 -9.808 -1.988 1.00 0.00 H new ATOM 0 HE2 MET A 186 3.240 -10.148 -3.572 1.00 0.00 H new ATOM 0 HE3 MET A 186 3.705 -11.111 -2.150 1.00 0.00 H new ATOM 1704 N TYR A 187 9.353 -9.061 -5.840 1.00 0.00 N ATOM 1705 CA TYR A 187 9.926 -8.496 -7.056 1.00 0.00 C ATOM 1706 C TYR A 187 11.445 -8.636 -7.058 1.00 0.00 C ATOM 1707 O TYR A 187 12.003 -9.004 -8.114 1.00 0.00 O ATOM 1708 CB TYR A 187 9.538 -7.023 -7.193 1.00 0.00 C ATOM 1709 CG TYR A 187 9.892 -6.186 -5.984 1.00 0.00 C ATOM 1710 CD1 TYR A 187 9.266 -6.395 -4.761 1.00 0.00 C ATOM 1711 CD2 TYR A 187 10.852 -5.185 -6.066 1.00 0.00 C ATOM 1712 CE1 TYR A 187 9.586 -5.632 -3.655 1.00 0.00 C ATOM 1713 CE2 TYR A 187 11.178 -4.417 -4.964 1.00 0.00 C ATOM 1714 CZ TYR A 187 10.542 -4.644 -3.761 1.00 0.00 C ATOM 1715 OH TYR A 187 10.864 -3.882 -2.662 1.00 0.00 O ATOM 1716 OXT TYR A 187 12.063 -8.376 -6.005 1.00 0.00 O ATOM 0 H TYR A 187 9.815 -8.767 -4.980 1.00 0.00 H new ATOM 0 HA TYR A 187 9.527 -9.049 -7.906 1.00 0.00 H new ATOM 0 HB2 TYR A 187 10.033 -6.606 -8.070 1.00 0.00 H new ATOM 0 HB3 TYR A 187 8.465 -6.954 -7.370 1.00 0.00 H new ATOM 0 HD1 TYR A 187 8.516 -7.167 -4.674 1.00 0.00 H new ATOM 0 HD2 TYR A 187 11.352 -5.004 -7.006 1.00 0.00 H new ATOM 0 HE1 TYR A 187 9.090 -5.808 -2.712 1.00 0.00 H new ATOM 0 HE2 TYR A 187 11.927 -3.643 -5.044 1.00 0.00 H new ATOM 0 HH TYR A 187 11.556 -3.232 -2.906 1.00 0.00 H new