USER MOD reduce.3.24.130724 H: found=0, std=0, add=670, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 671 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 27 HIS : no HD1:sc= -1.86! K(o=-3.5!,f=1.1) USER MOD Set 1.2: A 31 GLN : amide:sc= -1.65! K(o=-3.5!,f=-0.25) USER MOD Single : A 11 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 CYS SG : rot 73:sc= -0.814 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 36 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 37 TYR OH : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 97:sc= 0.0359 USER MOD Single : A 39 HIS : no HD1:sc= -0.0076 X(o=-0.0076,f=-0.36) USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 46 SER OG : rot 80:sc= 0.0772 USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0.061) USER MOD Single : A 52 GLN : amide:sc= 0.386 X(o=0.39,f=0) USER MOD Single : A 53 THR OG1 : rot 16:sc= 0.322 USER MOD Single : A 55 LYS NZ :NH3+ -132:sc= 0.314 (180deg=0) USER MOD Single : A 57 THR OG1 : rot 27:sc= -0.227 USER MOD Single : A 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 61 MET CE :methyl 170:sc= -0.256 (180deg=-0.462) USER MOD Single : A 64 GLN : amide:sc= -0.0646 X(o=-0.065,f=0) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 114 GLN : amide:sc= 0 X(o=0,f=0.14) USER MOD Single : A 115 TYR OH : rot 180:sc= 0 USER MOD Single : A 117 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00483) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 145 N VAL A 10 187.046 12.056 12.836 1.00 0.00 N ATOM 146 CA VAL A 10 188.115 11.106 12.497 1.00 0.00 C ATOM 147 C VAL A 10 188.870 10.633 13.751 1.00 0.00 C ATOM 148 O VAL A 10 189.961 11.124 14.069 1.00 0.00 O ATOM 149 CB VAL A 10 189.116 11.681 11.440 1.00 0.00 C ATOM 150 CG1 VAL A 10 188.505 11.636 10.049 1.00 0.00 C ATOM 151 CG2 VAL A 10 189.562 13.109 11.775 1.00 0.00 C ATOM 0 HA VAL A 10 187.623 10.245 12.045 1.00 0.00 H new ATOM 0 HB VAL A 10 190.004 11.049 11.465 1.00 0.00 H new ATOM 0 HG11 VAL A 10 189.215 12.040 9.327 1.00 0.00 H new ATOM 0 HG12 VAL A 10 188.269 10.604 9.788 1.00 0.00 H new ATOM 0 HG13 VAL A 10 187.592 12.232 10.033 1.00 0.00 H new ATOM 0 HG21 VAL A 10 190.255 13.462 11.012 1.00 0.00 H new ATOM 0 HG22 VAL A 10 188.692 13.764 11.806 1.00 0.00 H new ATOM 0 HG23 VAL A 10 190.057 13.117 12.746 1.00 0.00 H new ATOM 161 N SER A 11 188.253 9.685 14.469 1.00 0.00 N ATOM 162 CA SER A 11 188.831 9.114 15.690 1.00 0.00 C ATOM 163 C SER A 11 188.508 7.622 15.800 1.00 0.00 C ATOM 164 O SER A 11 189.380 6.817 16.139 1.00 0.00 O ATOM 165 CB SER A 11 188.315 9.854 16.933 1.00 0.00 C ATOM 166 OG SER A 11 188.642 11.232 16.879 1.00 0.00 O ATOM 0 H SER A 11 187.344 9.295 14.220 1.00 0.00 H new ATOM 0 HA SER A 11 189.913 9.233 15.634 1.00 0.00 H new ATOM 0 HB2 SER A 11 187.234 9.736 17.007 1.00 0.00 H new ATOM 0 HB3 SER A 11 188.747 9.410 17.830 1.00 0.00 H new ATOM 0 HG SER A 11 188.301 11.681 17.681 1.00 0.00 H new ATOM 171 N ALA A 12 187.247 7.269 15.509 1.00 0.00 N ATOM 172 CA ALA A 12 186.788 5.880 15.567 1.00 0.00 C ATOM 173 C ALA A 12 186.794 5.223 14.182 1.00 0.00 C ATOM 174 O ALA A 12 186.657 4.000 14.071 1.00 0.00 O ATOM 175 CB ALA A 12 185.396 5.814 16.178 1.00 0.00 C ATOM 0 H ALA A 12 186.526 7.934 15.230 1.00 0.00 H new ATOM 0 HA ALA A 12 187.483 5.325 16.197 1.00 0.00 H new ATOM 0 HB1 ALA A 12 185.064 4.776 16.216 1.00 0.00 H new ATOM 0 HB2 ALA A 12 185.422 6.224 17.188 1.00 0.00 H new ATOM 0 HB3 ALA A 12 184.703 6.394 15.568 1.00 0.00 H new ATOM 181 N GLU A 13 186.956 6.043 13.133 1.00 0.00 N ATOM 182 CA GLU A 13 186.981 5.559 11.747 1.00 0.00 C ATOM 183 C GLU A 13 188.393 5.149 11.314 1.00 0.00 C ATOM 184 O GLU A 13 188.552 4.355 10.383 1.00 0.00 O ATOM 185 CB GLU A 13 186.442 6.633 10.795 1.00 0.00 C ATOM 186 CG GLU A 13 184.934 6.827 10.875 1.00 0.00 C ATOM 187 CD GLU A 13 184.435 7.898 9.926 1.00 0.00 C ATOM 188 OE1 GLU A 13 184.096 7.559 8.772 1.00 0.00 O ATOM 189 OE2 GLU A 13 184.382 9.076 10.335 1.00 0.00 O1- ATOM 0 H GLU A 13 187.072 7.052 13.221 1.00 0.00 H new ATOM 0 HA GLU A 13 186.342 4.677 11.700 1.00 0.00 H new ATOM 0 HB2 GLU A 13 186.933 7.581 11.017 1.00 0.00 H new ATOM 0 HB3 GLU A 13 186.711 6.367 9.773 1.00 0.00 H new ATOM 0 HG2 GLU A 13 184.437 5.884 10.647 1.00 0.00 H new ATOM 0 HG3 GLU A 13 184.659 7.094 11.895 1.00 0.00 H new ATOM 196 N VAL A 14 189.410 5.696 11.999 1.00 0.00 N ATOM 197 CA VAL A 14 190.824 5.400 11.699 1.00 0.00 C ATOM 198 C VAL A 14 191.240 4.025 12.258 1.00 0.00 C ATOM 199 O VAL A 14 192.197 3.418 11.770 1.00 0.00 O ATOM 200 CB VAL A 14 191.786 6.499 12.258 1.00 0.00 C ATOM 201 CG1 VAL A 14 193.165 6.414 11.606 1.00 0.00 C ATOM 202 CG2 VAL A 14 191.210 7.900 12.065 1.00 0.00 C ATOM 0 H VAL A 14 189.280 6.351 12.770 1.00 0.00 H new ATOM 0 HA VAL A 14 190.910 5.387 10.613 1.00 0.00 H new ATOM 0 HB VAL A 14 191.891 6.312 13.327 1.00 0.00 H new ATOM 0 HG11 VAL A 14 193.810 7.191 12.016 1.00 0.00 H new ATOM 0 HG12 VAL A 14 193.603 5.436 11.807 1.00 0.00 H new ATOM 0 HG13 VAL A 14 193.068 6.554 10.529 1.00 0.00 H new ATOM 0 HG21 VAL A 14 191.906 8.638 12.465 1.00 0.00 H new ATOM 0 HG22 VAL A 14 191.055 8.086 11.002 1.00 0.00 H new ATOM 0 HG23 VAL A 14 190.258 7.977 12.590 1.00 0.00 H new ATOM 212 N GLY A 15 190.504 3.543 13.275 1.00 0.00 N ATOM 213 CA GLY A 15 190.799 2.250 13.897 1.00 0.00 C ATOM 214 C GLY A 15 190.415 1.062 13.025 1.00 0.00 C ATOM 215 O GLY A 15 191.193 0.112 12.890 1.00 0.00 O ATOM 0 H GLY A 15 189.705 4.031 13.679 1.00 0.00 H new ATOM 0 HA2 GLY A 15 191.864 2.197 14.122 1.00 0.00 H new ATOM 0 HA3 GLY A 15 190.268 2.182 14.847 1.00 0.00 H new ATOM 219 N GLU A 16 189.219 1.130 12.421 1.00 0.00 N ATOM 220 CA GLU A 16 188.712 0.062 11.545 1.00 0.00 C ATOM 221 C GLU A 16 189.421 0.068 10.186 1.00 0.00 C ATOM 222 O GLU A 16 189.619 -0.991 9.578 1.00 0.00 O ATOM 223 CB GLU A 16 187.200 0.205 11.342 1.00 0.00 C ATOM 224 CG GLU A 16 186.375 -0.171 12.565 1.00 0.00 C ATOM 225 CD GLU A 16 184.885 -0.011 12.335 1.00 0.00 C ATOM 226 OE1 GLU A 16 184.243 -0.987 11.895 1.00 0.00 O ATOM 227 OE2 GLU A 16 184.360 1.093 12.594 1.00 0.00 O1- ATOM 0 H GLU A 16 188.581 1.919 12.524 1.00 0.00 H new ATOM 0 HA GLU A 16 188.920 -0.889 12.035 1.00 0.00 H new ATOM 0 HB2 GLU A 16 186.976 1.236 11.068 1.00 0.00 H new ATOM 0 HB3 GLU A 16 186.895 -0.421 10.504 1.00 0.00 H new ATOM 0 HG2 GLU A 16 186.588 -1.204 12.838 1.00 0.00 H new ATOM 0 HG3 GLU A 16 186.678 0.450 13.408 1.00 0.00 H new ATOM 234 N LYS A 17 189.813 1.267 9.728 1.00 0.00 N ATOM 235 CA LYS A 17 190.513 1.435 8.448 1.00 0.00 C ATOM 236 C LYS A 17 191.952 0.923 8.535 1.00 0.00 C ATOM 237 O LYS A 17 192.449 0.292 7.599 1.00 0.00 O ATOM 238 CB LYS A 17 190.500 2.904 8.010 1.00 0.00 C ATOM 239 CG LYS A 17 189.140 3.387 7.527 1.00 0.00 C ATOM 240 CD LYS A 17 189.208 4.813 7.003 1.00 0.00 C ATOM 241 CE LYS A 17 187.838 5.312 6.571 1.00 0.00 C ATOM 242 NZ LYS A 17 187.894 6.710 6.059 1.00 0.00 N1+ ATOM 0 H LYS A 17 189.655 2.140 10.231 1.00 0.00 H new ATOM 0 HA LYS A 17 189.984 0.843 7.701 1.00 0.00 H new ATOM 0 HB2 LYS A 17 190.821 3.526 8.846 1.00 0.00 H new ATOM 0 HB3 LYS A 17 191.229 3.042 7.212 1.00 0.00 H new ATOM 0 HG2 LYS A 17 188.777 2.726 6.740 1.00 0.00 H new ATOM 0 HG3 LYS A 17 188.422 3.333 8.345 1.00 0.00 H new ATOM 0 HD2 LYS A 17 189.608 5.468 7.777 1.00 0.00 H new ATOM 0 HD3 LYS A 17 189.896 4.860 6.159 1.00 0.00 H new ATOM 0 HE2 LYS A 17 187.440 4.657 5.796 1.00 0.00 H new ATOM 0 HE3 LYS A 17 187.150 5.261 7.415 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 186.941 7.014 5.775 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 188.250 7.340 6.807 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 188.531 6.754 5.238 1.00 0.00 H new ATOM 256 N CYS A 18 192.606 1.185 9.679 1.00 0.00 N ATOM 257 CA CYS A 18 193.986 0.738 9.919 1.00 0.00 C ATOM 258 C CYS A 18 194.041 -0.777 10.135 1.00 0.00 C ATOM 259 O CYS A 18 194.982 -1.442 9.689 1.00 0.00 O ATOM 260 CB CYS A 18 194.581 1.463 11.128 1.00 0.00 C ATOM 261 SG CYS A 18 194.929 3.215 10.842 1.00 0.00 S ATOM 0 H CYS A 18 192.198 1.707 10.455 1.00 0.00 H new ATOM 0 HA CYS A 18 194.577 0.981 9.036 1.00 0.00 H new ATOM 0 HB2 CYS A 18 193.891 1.373 11.967 1.00 0.00 H new ATOM 0 HB3 CYS A 18 195.505 0.963 11.419 1.00 0.00 H new ATOM 0 HG CYS A 18 193.812 3.879 10.805 1.00 0.00 H new ATOM 267 N GLU A 19 193.011 -1.311 10.814 1.00 0.00 N ATOM 268 CA GLU A 19 192.901 -2.752 11.084 1.00 0.00 C ATOM 269 C GLU A 19 192.605 -3.535 9.798 1.00 0.00 C ATOM 270 O GLU A 19 193.038 -4.682 9.651 1.00 0.00 O ATOM 271 CB GLU A 19 191.807 -3.024 12.121 1.00 0.00 C ATOM 272 CG GLU A 19 192.220 -2.694 13.548 1.00 0.00 C ATOM 273 CD GLU A 19 191.120 -2.973 14.553 1.00 0.00 C ATOM 274 OE1 GLU A 19 191.071 -4.105 15.080 1.00 0.00 O ATOM 275 OE2 GLU A 19 190.308 -2.061 14.812 1.00 0.00 O1- ATOM 0 H GLU A 19 192.238 -0.760 11.188 1.00 0.00 H new ATOM 0 HA GLU A 19 193.859 -3.088 11.481 1.00 0.00 H new ATOM 0 HB2 GLU A 19 190.923 -2.441 11.864 1.00 0.00 H new ATOM 0 HB3 GLU A 19 191.522 -4.075 12.068 1.00 0.00 H new ATOM 0 HG2 GLU A 19 193.103 -3.277 13.811 1.00 0.00 H new ATOM 0 HG3 GLU A 19 192.502 -1.643 13.607 1.00 0.00 H new ATOM 282 N ALA A 20 191.873 -2.892 8.869 1.00 0.00 N ATOM 283 CA ALA A 20 191.519 -3.500 7.579 1.00 0.00 C ATOM 284 C ALA A 20 192.727 -3.574 6.642 1.00 0.00 C ATOM 285 O ALA A 20 192.934 -4.587 5.965 1.00 0.00 O ATOM 286 CB ALA A 20 190.378 -2.732 6.924 1.00 0.00 C ATOM 0 H ALA A 20 191.515 -1.945 8.992 1.00 0.00 H new ATOM 0 HA ALA A 20 191.189 -4.521 7.772 1.00 0.00 H new ATOM 0 HB1 ALA A 20 190.128 -3.195 5.970 1.00 0.00 H new ATOM 0 HB2 ALA A 20 189.505 -2.751 7.576 1.00 0.00 H new ATOM 0 HB3 ALA A 20 190.683 -1.699 6.757 1.00 0.00 H new ATOM 292 N ILE A 21 193.527 -2.495 6.621 1.00 0.00 N ATOM 293 CA ILE A 21 194.744 -2.431 5.791 1.00 0.00 C ATOM 294 C ILE A 21 195.826 -3.358 6.375 1.00 0.00 C ATOM 295 O ILE A 21 196.687 -3.854 5.644 1.00 0.00 O ATOM 296 CB ILE A 21 195.297 -0.969 5.655 1.00 0.00 C ATOM 297 CG1 ILE A 21 194.199 0.035 5.189 1.00 0.00 C ATOM 298 CG2 ILE A 21 196.510 -0.907 4.715 1.00 0.00 C ATOM 299 CD1 ILE A 21 193.491 -0.297 3.874 1.00 0.00 C ATOM 0 H ILE A 21 193.353 -1.653 7.170 1.00 0.00 H new ATOM 0 HA ILE A 21 194.475 -2.766 4.789 1.00 0.00 H new ATOM 0 HB ILE A 21 195.620 -0.670 6.652 1.00 0.00 H new ATOM 0 HG12 ILE A 21 193.446 0.107 5.974 1.00 0.00 H new ATOM 0 HG13 ILE A 21 194.655 1.020 5.093 1.00 0.00 H new ATOM 0 HG21 ILE A 21 196.865 0.121 4.646 1.00 0.00 H new ATOM 0 HG22 ILE A 21 197.306 -1.540 5.106 1.00 0.00 H new ATOM 0 HG23 ILE A 21 196.221 -1.258 3.724 1.00 0.00 H new ATOM 0 HD11 ILE A 21 192.750 0.472 3.655 1.00 0.00 H new ATOM 0 HD12 ILE A 21 194.222 -0.337 3.067 1.00 0.00 H new ATOM 0 HD13 ILE A 21 192.995 -1.264 3.962 1.00 0.00 H new ATOM 311 N GLY A 22 195.760 -3.577 7.703 1.00 0.00 N ATOM 312 CA GLY A 22 196.704 -4.458 8.387 1.00 0.00 C ATOM 313 C GLY A 22 196.476 -5.927 8.052 1.00 0.00 C ATOM 314 O GLY A 22 197.431 -6.657 7.765 1.00 0.00 O ATOM 0 H GLY A 22 195.062 -3.154 8.315 1.00 0.00 H new ATOM 0 HA2 GLY A 22 197.721 -4.179 8.112 1.00 0.00 H new ATOM 0 HA3 GLY A 22 196.614 -4.316 9.464 1.00 0.00 H new ATOM 318 N VAL A 23 195.198 -6.354 8.078 1.00 0.00 N ATOM 319 CA VAL A 23 194.827 -7.746 7.755 1.00 0.00 C ATOM 320 C VAL A 23 194.983 -8.038 6.254 1.00 0.00 C ATOM 321 O VAL A 23 195.280 -9.170 5.862 1.00 0.00 O ATOM 322 CB VAL A 23 193.383 -8.112 8.216 1.00 0.00 C ATOM 323 CG1 VAL A 23 193.353 -8.350 9.718 1.00 0.00 C ATOM 324 CG2 VAL A 23 192.361 -7.041 7.832 1.00 0.00 C ATOM 0 H VAL A 23 194.407 -5.757 8.319 1.00 0.00 H new ATOM 0 HA VAL A 23 195.521 -8.373 8.314 1.00 0.00 H new ATOM 0 HB VAL A 23 193.103 -9.029 7.697 1.00 0.00 H new ATOM 0 HG11 VAL A 23 192.339 -8.605 10.026 1.00 0.00 H new ATOM 0 HG12 VAL A 23 194.025 -9.170 9.970 1.00 0.00 H new ATOM 0 HG13 VAL A 23 193.673 -7.446 10.236 1.00 0.00 H new ATOM 0 HG21 VAL A 23 191.371 -7.343 8.175 1.00 0.00 H new ATOM 0 HG22 VAL A 23 192.634 -6.094 8.298 1.00 0.00 H new ATOM 0 HG23 VAL A 23 192.349 -6.922 6.749 1.00 0.00 H new ATOM 334 N LYS A 24 194.783 -6.995 5.428 1.00 0.00 N ATOM 335 CA LYS A 24 194.920 -7.103 3.968 1.00 0.00 C ATOM 336 C LYS A 24 196.394 -7.174 3.560 1.00 0.00 C ATOM 337 O LYS A 24 196.744 -7.854 2.591 1.00 0.00 O ATOM 338 CB LYS A 24 194.249 -5.916 3.272 1.00 0.00 C ATOM 339 CG LYS A 24 192.729 -5.993 3.251 1.00 0.00 C ATOM 340 CD LYS A 24 192.119 -4.788 2.553 1.00 0.00 C ATOM 341 CE LYS A 24 190.601 -4.866 2.531 1.00 0.00 C ATOM 342 NZ LYS A 24 189.995 -3.686 1.854 1.00 0.00 N1+ ATOM 0 H LYS A 24 194.524 -6.063 5.752 1.00 0.00 H new ATOM 0 HA LYS A 24 194.426 -8.023 3.656 1.00 0.00 H new ATOM 0 HB2 LYS A 24 194.550 -4.996 3.773 1.00 0.00 H new ATOM 0 HB3 LYS A 24 194.614 -5.854 2.247 1.00 0.00 H new ATOM 0 HG2 LYS A 24 192.417 -6.905 2.743 1.00 0.00 H new ATOM 0 HG3 LYS A 24 192.353 -6.052 4.272 1.00 0.00 H new ATOM 0 HD2 LYS A 24 192.430 -3.876 3.062 1.00 0.00 H new ATOM 0 HD3 LYS A 24 192.496 -4.728 1.532 1.00 0.00 H new ATOM 0 HE2 LYS A 24 190.292 -5.777 2.019 1.00 0.00 H new ATOM 0 HE3 LYS A 24 190.226 -4.931 3.552 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 188.959 -3.777 1.860 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 190.269 -2.818 2.357 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 190.333 -3.638 0.872 1.00 0.00 H new ATOM 356 N LEU A 25 197.248 -6.464 4.317 1.00 0.00 N ATOM 357 CA LEU A 25 198.698 -6.439 4.074 1.00 0.00 C ATOM 358 C LEU A 25 199.338 -7.791 4.423 1.00 0.00 C ATOM 359 O LEU A 25 200.194 -8.291 3.685 1.00 0.00 O ATOM 360 CB LEU A 25 199.350 -5.309 4.890 1.00 0.00 C ATOM 361 CG LEU A 25 200.666 -4.750 4.328 1.00 0.00 C ATOM 362 CD1 LEU A 25 200.806 -3.276 4.673 1.00 0.00 C ATOM 363 CD2 LEU A 25 201.858 -5.531 4.866 1.00 0.00 C ATOM 0 H LEU A 25 196.953 -5.895 5.110 1.00 0.00 H new ATOM 0 HA LEU A 25 198.866 -6.252 3.013 1.00 0.00 H new ATOM 0 HB2 LEU A 25 198.636 -4.490 4.975 1.00 0.00 H new ATOM 0 HB3 LEU A 25 199.535 -5.676 5.900 1.00 0.00 H new ATOM 0 HG LEU A 25 200.645 -4.857 3.243 1.00 0.00 H new ATOM 0 HD11 LEU A 25 201.743 -2.895 4.268 1.00 0.00 H new ATOM 0 HD12 LEU A 25 199.972 -2.721 4.243 1.00 0.00 H new ATOM 0 HD13 LEU A 25 200.803 -3.154 5.756 1.00 0.00 H new ATOM 0 HD21 LEU A 25 202.779 -5.118 4.455 1.00 0.00 H new ATOM 0 HD22 LEU A 25 201.881 -5.457 5.953 1.00 0.00 H new ATOM 0 HD23 LEU A 25 201.768 -6.578 4.575 1.00 0.00 H new ATOM 375 N LEU A 26 198.901 -8.381 5.555 1.00 0.00 N ATOM 376 CA LEU A 26 199.405 -9.687 6.013 1.00 0.00 C ATOM 377 C LEU A 26 198.922 -10.815 5.095 1.00 0.00 C ATOM 378 O LEU A 26 199.673 -11.751 4.796 1.00 0.00 O ATOM 379 CB LEU A 26 198.961 -9.959 7.457 1.00 0.00 C ATOM 380 CG LEU A 26 199.575 -9.045 8.526 1.00 0.00 C ATOM 381 CD1 LEU A 26 198.628 -8.896 9.705 1.00 0.00 C ATOM 382 CD2 LEU A 26 200.920 -9.589 8.996 1.00 0.00 C ATOM 0 H LEU A 26 198.198 -7.970 6.169 1.00 0.00 H new ATOM 0 HA LEU A 26 200.494 -9.656 5.978 1.00 0.00 H new ATOM 0 HB2 LEU A 26 197.876 -9.868 7.507 1.00 0.00 H new ATOM 0 HB3 LEU A 26 199.206 -10.992 7.704 1.00 0.00 H new ATOM 0 HG LEU A 26 199.737 -8.063 8.081 1.00 0.00 H new ATOM 0 HD11 LEU A 26 199.079 -8.245 10.454 1.00 0.00 H new ATOM 0 HD12 LEU A 26 197.688 -8.461 9.364 1.00 0.00 H new ATOM 0 HD13 LEU A 26 198.436 -9.875 10.144 1.00 0.00 H new ATOM 0 HD21 LEU A 26 201.336 -8.925 9.753 1.00 0.00 H new ATOM 0 HD22 LEU A 26 200.782 -10.583 9.421 1.00 0.00 H new ATOM 0 HD23 LEU A 26 201.604 -9.648 8.150 1.00 0.00 H new ATOM 394 N HIS A 27 197.665 -10.696 4.639 1.00 0.00 N ATOM 395 CA HIS A 27 197.052 -11.677 3.733 1.00 0.00 C ATOM 396 C HIS A 27 197.667 -11.580 2.330 1.00 0.00 C ATOM 397 O HIS A 27 197.771 -12.585 1.619 1.00 0.00 O ATOM 398 CB HIS A 27 195.537 -11.453 3.662 1.00 0.00 C ATOM 399 CG HIS A 27 194.750 -12.709 3.443 1.00 0.00 C ATOM 400 ND1 HIS A 27 194.094 -13.372 4.459 1.00 0.00 N ATOM 401 CD2 HIS A 27 194.513 -13.424 2.318 1.00 0.00 C ATOM 402 CE1 HIS A 27 193.489 -14.440 3.968 1.00 0.00 C ATOM 403 NE2 HIS A 27 193.728 -14.493 2.672 1.00 0.00 N ATOM 0 H HIS A 27 197.049 -9.922 4.887 1.00 0.00 H new ATOM 0 HA HIS A 27 197.246 -12.676 4.124 1.00 0.00 H new ATOM 0 HB2 HIS A 27 195.205 -10.984 4.588 1.00 0.00 H new ATOM 0 HB3 HIS A 27 195.320 -10.754 2.855 1.00 0.00 H new ATOM 0 HD2 HIS A 27 194.874 -13.196 1.326 1.00 0.00 H new ATOM 0 HE1 HIS A 27 192.900 -15.148 4.532 1.00 0.00 H new ATOM 0 HE2 HIS A 27 193.385 -15.212 2.035 1.00 0.00 H new ATOM 412 N LEU A 28 198.079 -10.357 1.955 1.00 0.00 N ATOM 413 CA LEU A 28 198.709 -10.094 0.655 1.00 0.00 C ATOM 414 C LEU A 28 200.156 -10.607 0.635 1.00 0.00 C ATOM 415 O LEU A 28 200.662 -11.005 -0.416 1.00 0.00 O ATOM 416 CB LEU A 28 198.678 -8.587 0.347 1.00 0.00 C ATOM 417 CG LEU A 28 198.769 -8.205 -1.139 1.00 0.00 C ATOM 418 CD1 LEU A 28 197.394 -8.237 -1.798 1.00 0.00 C ATOM 419 CD2 LEU A 28 199.400 -6.828 -1.294 1.00 0.00 C ATOM 0 H LEU A 28 197.984 -9.529 2.543 1.00 0.00 H new ATOM 0 HA LEU A 28 198.146 -10.626 -0.112 1.00 0.00 H new ATOM 0 HB2 LEU A 28 197.756 -8.171 0.754 1.00 0.00 H new ATOM 0 HB3 LEU A 28 199.503 -8.110 0.876 1.00 0.00 H new ATOM 0 HG LEU A 28 199.401 -8.939 -1.639 1.00 0.00 H new ATOM 0 HD11 LEU A 28 197.488 -7.963 -2.849 1.00 0.00 H new ATOM 0 HD12 LEU A 28 196.977 -9.241 -1.721 1.00 0.00 H new ATOM 0 HD13 LEU A 28 196.733 -7.530 -1.296 1.00 0.00 H new ATOM 0 HD21 LEU A 28 199.458 -6.571 -2.352 1.00 0.00 H new ATOM 0 HD22 LEU A 28 198.792 -6.088 -0.774 1.00 0.00 H new ATOM 0 HD23 LEU A 28 200.403 -6.837 -0.868 1.00 0.00 H new ATOM 431 N GLU A 29 200.807 -10.594 1.814 1.00 0.00 N ATOM 432 CA GLU A 29 202.188 -11.081 1.960 1.00 0.00 C ATOM 433 C GLU A 29 202.245 -12.609 1.878 1.00 0.00 C ATOM 434 O GLU A 29 203.150 -13.170 1.251 1.00 0.00 O ATOM 435 CB GLU A 29 202.790 -10.605 3.287 1.00 0.00 C ATOM 436 CG GLU A 29 203.254 -9.158 3.262 1.00 0.00 C ATOM 437 CD GLU A 29 203.814 -8.704 4.596 1.00 0.00 C ATOM 438 OE1 GLU A 29 203.016 -8.317 5.475 1.00 0.00 O ATOM 439 OE2 GLU A 29 205.052 -8.734 4.761 1.00 0.00 O1- ATOM 0 H GLU A 29 200.395 -10.250 2.681 1.00 0.00 H new ATOM 0 HA GLU A 29 202.774 -10.670 1.138 1.00 0.00 H new ATOM 0 HB2 GLU A 29 202.048 -10.726 4.077 1.00 0.00 H new ATOM 0 HB3 GLU A 29 203.635 -11.244 3.543 1.00 0.00 H new ATOM 0 HG2 GLU A 29 204.016 -9.038 2.492 1.00 0.00 H new ATOM 0 HG3 GLU A 29 202.417 -8.516 2.986 1.00 0.00 H new ATOM 446 N ASP A 30 201.264 -13.269 2.516 1.00 0.00 N ATOM 447 CA ASP A 30 201.161 -14.737 2.510 1.00 0.00 C ATOM 448 C ASP A 30 200.768 -15.258 1.122 1.00 0.00 C ATOM 449 O ASP A 30 201.256 -16.305 0.683 1.00 0.00 O ATOM 450 CB ASP A 30 200.146 -15.209 3.553 1.00 0.00 C ATOM 451 CG ASP A 30 200.678 -15.105 4.970 1.00 0.00 C ATOM 452 OD1 ASP A 30 201.466 -15.986 5.373 1.00 0.00 O ATOM 453 OD2 ASP A 30 200.306 -14.146 5.677 1.00 0.00 O1- ATOM 0 H ASP A 30 200.526 -12.805 3.046 1.00 0.00 H new ATOM 0 HA ASP A 30 202.142 -15.140 2.763 1.00 0.00 H new ATOM 0 HB2 ASP A 30 199.237 -14.615 3.465 1.00 0.00 H new ATOM 0 HB3 ASP A 30 199.872 -16.243 3.346 1.00 0.00 H new ATOM 458 N GLN A 31 199.885 -14.510 0.438 1.00 0.00 N ATOM 459 CA GLN A 31 199.420 -14.863 -0.913 1.00 0.00 C ATOM 460 C GLN A 31 200.499 -14.590 -1.969 1.00 0.00 C ATOM 461 O GLN A 31 200.562 -15.279 -2.989 1.00 0.00 O ATOM 462 CB GLN A 31 198.148 -14.084 -1.267 1.00 0.00 C ATOM 463 CG GLN A 31 196.901 -14.582 -0.552 1.00 0.00 C ATOM 464 CD GLN A 31 195.638 -13.903 -1.049 1.00 0.00 C ATOM 465 OE1 GLN A 31 195.239 -12.858 -0.534 1.00 0.00 O ATOM 466 NE2 GLN A 31 195.003 -14.495 -2.052 1.00 0.00 N ATOM 0 H GLN A 31 199.476 -13.650 0.804 1.00 0.00 H new ATOM 0 HA GLN A 31 199.201 -15.931 -0.912 1.00 0.00 H new ATOM 0 HB2 GLN A 31 198.299 -13.032 -1.024 1.00 0.00 H new ATOM 0 HB3 GLN A 31 197.986 -14.143 -2.343 1.00 0.00 H new ATOM 0 HG2 GLN A 31 196.811 -15.659 -0.693 1.00 0.00 H new ATOM 0 HG3 GLN A 31 197.006 -14.408 0.519 1.00 0.00 H new ATOM 0 HE21 GLN A 31 195.370 -15.360 -2.448 1.00 0.00 H new ATOM 0 HE22 GLN A 31 194.148 -14.085 -2.427 1.00 0.00 H new ATOM 475 N LEU A 32 201.350 -13.583 -1.701 1.00 0.00 N ATOM 476 CA LEU A 32 202.442 -13.201 -2.610 1.00 0.00 C ATOM 477 C LEU A 32 203.578 -14.228 -2.569 1.00 0.00 C ATOM 478 O LEU A 32 204.157 -14.567 -3.608 1.00 0.00 O ATOM 479 CB LEU A 32 202.972 -11.805 -2.235 1.00 0.00 C ATOM 480 CG LEU A 32 203.598 -10.993 -3.377 1.00 0.00 C ATOM 481 CD1 LEU A 32 203.427 -9.504 -3.119 1.00 0.00 C ATOM 482 CD2 LEU A 32 205.076 -11.328 -3.539 1.00 0.00 C ATOM 0 H LEU A 32 201.300 -13.016 -0.855 1.00 0.00 H new ATOM 0 HA LEU A 32 202.049 -13.174 -3.626 1.00 0.00 H new ATOM 0 HB2 LEU A 32 202.149 -11.227 -1.814 1.00 0.00 H new ATOM 0 HB3 LEU A 32 203.717 -11.921 -1.447 1.00 0.00 H new ATOM 0 HG LEU A 32 203.084 -11.256 -4.301 1.00 0.00 H new ATOM 0 HD11 LEU A 32 203.875 -8.939 -3.936 1.00 0.00 H new ATOM 0 HD12 LEU A 32 202.365 -9.266 -3.053 1.00 0.00 H new ATOM 0 HD13 LEU A 32 203.918 -9.238 -2.183 1.00 0.00 H new ATOM 0 HD21 LEU A 32 205.495 -10.739 -4.355 1.00 0.00 H new ATOM 0 HD22 LEU A 32 205.605 -11.096 -2.615 1.00 0.00 H new ATOM 0 HD23 LEU A 32 205.186 -12.389 -3.764 1.00 0.00 H new ATOM 494 N LEU A 33 203.879 -14.722 -1.358 1.00 0.00 N ATOM 495 CA LEU A 33 204.929 -15.728 -1.151 1.00 0.00 C ATOM 496 C LEU A 33 204.482 -17.090 -1.698 1.00 0.00 C ATOM 497 O LEU A 33 205.277 -17.822 -2.296 1.00 0.00 O ATOM 498 CB LEU A 33 205.271 -15.829 0.345 1.00 0.00 C ATOM 499 CG LEU A 33 206.657 -16.399 0.678 1.00 0.00 C ATOM 500 CD1 LEU A 33 207.216 -15.737 1.929 1.00 0.00 C ATOM 501 CD2 LEU A 33 206.585 -17.907 0.870 1.00 0.00 C ATOM 0 H LEU A 33 203.405 -14.437 -0.501 1.00 0.00 H new ATOM 0 HA LEU A 33 205.823 -15.422 -1.693 1.00 0.00 H new ATOM 0 HB2 LEU A 33 205.193 -14.834 0.784 1.00 0.00 H new ATOM 0 HB3 LEU A 33 204.518 -16.451 0.829 1.00 0.00 H new ATOM 0 HG LEU A 33 207.323 -16.188 -0.158 1.00 0.00 H new ATOM 0 HD11 LEU A 33 208.199 -16.152 2.152 1.00 0.00 H new ATOM 0 HD12 LEU A 33 207.304 -14.663 1.764 1.00 0.00 H new ATOM 0 HD13 LEU A 33 206.546 -15.921 2.769 1.00 0.00 H new ATOM 0 HD21 LEU A 33 207.577 -18.292 1.105 1.00 0.00 H new ATOM 0 HD22 LEU A 33 205.903 -18.137 1.689 1.00 0.00 H new ATOM 0 HD23 LEU A 33 206.223 -18.374 -0.046 1.00 0.00 H new ATOM 513 N GLY A 34 203.192 -17.405 -1.489 1.00 0.00 N ATOM 514 CA GLY A 34 202.613 -18.657 -1.974 1.00 0.00 C ATOM 515 C GLY A 34 202.422 -18.675 -3.488 1.00 0.00 C ATOM 516 O GLY A 34 202.454 -19.740 -4.106 1.00 0.00 O ATOM 0 H GLY A 34 202.536 -16.806 -0.987 1.00 0.00 H new ATOM 0 HA2 GLY A 34 203.258 -19.486 -1.684 1.00 0.00 H new ATOM 0 HA3 GLY A 34 201.650 -18.818 -1.489 1.00 0.00 H new ATOM 520 N ALA A 35 202.226 -17.479 -4.075 1.00 0.00 N ATOM 521 CA ALA A 35 202.041 -17.330 -5.525 1.00 0.00 C ATOM 522 C ALA A 35 203.376 -17.347 -6.274 1.00 0.00 C ATOM 523 O ALA A 35 203.442 -17.794 -7.422 1.00 0.00 O ATOM 524 CB ALA A 35 201.287 -16.046 -5.832 1.00 0.00 C ATOM 0 H ALA A 35 202.192 -16.599 -3.561 1.00 0.00 H new ATOM 0 HA ALA A 35 201.456 -18.183 -5.869 1.00 0.00 H new ATOM 0 HB1 ALA A 35 201.157 -15.949 -6.910 1.00 0.00 H new ATOM 0 HB2 ALA A 35 200.310 -16.074 -5.350 1.00 0.00 H new ATOM 0 HB3 ALA A 35 201.853 -15.193 -5.456 1.00 0.00 H new ATOM 530 N MET A 36 204.436 -16.854 -5.612 1.00 0.00 N ATOM 531 CA MET A 36 205.784 -16.810 -6.199 1.00 0.00 C ATOM 532 C MET A 36 206.488 -18.170 -6.103 1.00 0.00 C ATOM 533 O MET A 36 207.285 -18.521 -6.979 1.00 0.00 O ATOM 534 CB MET A 36 206.636 -15.740 -5.512 1.00 0.00 C ATOM 535 CG MET A 36 206.279 -14.315 -5.917 1.00 0.00 C ATOM 536 SD MET A 36 207.386 -13.082 -5.199 1.00 0.00 S ATOM 537 CE MET A 36 208.799 -13.192 -6.297 1.00 0.00 C ATOM 0 H MET A 36 204.384 -16.479 -4.665 1.00 0.00 H new ATOM 0 HA MET A 36 205.669 -16.558 -7.253 1.00 0.00 H new ATOM 0 HB2 MET A 36 206.526 -15.839 -4.432 1.00 0.00 H new ATOM 0 HB3 MET A 36 207.686 -15.921 -5.743 1.00 0.00 H new ATOM 0 HG2 MET A 36 206.308 -14.233 -7.004 1.00 0.00 H new ATOM 0 HG3 MET A 36 205.256 -14.101 -5.609 1.00 0.00 H new ATOM 0 HE1 MET A 36 209.565 -12.486 -5.976 1.00 0.00 H new ATOM 0 HE2 MET A 36 209.204 -14.204 -6.269 1.00 0.00 H new ATOM 0 HE3 MET A 36 208.489 -12.953 -7.314 1.00 0.00 H new ATOM 547 N TYR A 37 206.186 -18.923 -5.035 1.00 0.00 N ATOM 548 CA TYR A 37 206.778 -20.250 -4.812 1.00 0.00 C ATOM 549 C TYR A 37 206.055 -21.332 -5.631 1.00 0.00 C ATOM 550 O TYR A 37 206.698 -22.216 -6.205 1.00 0.00 O ATOM 551 CB TYR A 37 206.741 -20.599 -3.319 1.00 0.00 C ATOM 552 CG TYR A 37 207.795 -21.602 -2.895 1.00 0.00 C ATOM 553 CD1 TYR A 37 207.534 -22.966 -2.923 1.00 0.00 C ATOM 554 CD2 TYR A 37 209.049 -21.183 -2.467 1.00 0.00 C ATOM 555 CE1 TYR A 37 208.493 -23.884 -2.537 1.00 0.00 C ATOM 556 CE2 TYR A 37 210.012 -22.094 -2.080 1.00 0.00 C ATOM 557 CZ TYR A 37 209.729 -23.443 -2.117 1.00 0.00 C ATOM 558 OH TYR A 37 210.687 -24.353 -1.733 1.00 0.00 O ATOM 0 H TYR A 37 205.531 -18.633 -4.308 1.00 0.00 H new ATOM 0 HA TYR A 37 207.815 -20.217 -5.146 1.00 0.00 H new ATOM 0 HB2 TYR A 37 206.870 -19.685 -2.739 1.00 0.00 H new ATOM 0 HB3 TYR A 37 205.756 -20.996 -3.073 1.00 0.00 H new ATOM 0 HD1 TYR A 37 206.566 -23.315 -3.252 1.00 0.00 H new ATOM 0 HD2 TYR A 37 209.274 -20.127 -2.437 1.00 0.00 H new ATOM 0 HE1 TYR A 37 208.274 -24.941 -2.565 1.00 0.00 H new ATOM 0 HE2 TYR A 37 210.982 -21.752 -1.750 1.00 0.00 H new ATOM 0 HH TYR A 37 211.501 -23.878 -1.466 1.00 0.00 H new ATOM 568 N SER A 38 204.719 -21.245 -5.675 1.00 0.00 N ATOM 569 CA SER A 38 203.886 -22.203 -6.414 1.00 0.00 C ATOM 570 C SER A 38 203.718 -21.803 -7.886 1.00 0.00 C ATOM 571 O SER A 38 203.464 -22.659 -8.738 1.00 0.00 O ATOM 572 CB SER A 38 202.513 -22.327 -5.754 1.00 0.00 C ATOM 573 OG SER A 38 202.628 -22.781 -4.417 1.00 0.00 O ATOM 0 H SER A 38 204.188 -20.513 -5.203 1.00 0.00 H new ATOM 0 HA SER A 38 204.396 -23.166 -6.386 1.00 0.00 H new ATOM 0 HB2 SER A 38 202.010 -21.360 -5.771 1.00 0.00 H new ATOM 0 HB3 SER A 38 201.893 -23.019 -6.324 1.00 0.00 H new ATOM 0 HG SER A 38 202.604 -22.014 -3.808 1.00 0.00 H new ATOM 579 N HIS A 39 203.862 -20.489 -8.172 1.00 0.00 N ATOM 580 CA HIS A 39 203.731 -19.922 -9.537 1.00 0.00 C ATOM 581 C HIS A 39 202.315 -20.108 -10.102 1.00 0.00 C ATOM 582 O HIS A 39 201.895 -21.231 -10.407 1.00 0.00 O ATOM 583 CB HIS A 39 204.776 -20.513 -10.508 1.00 0.00 C ATOM 584 CG HIS A 39 206.187 -20.132 -10.181 1.00 0.00 C ATOM 585 ND1 HIS A 39 206.873 -19.140 -10.850 1.00 0.00 N ATOM 586 CD2 HIS A 39 207.043 -20.616 -9.248 1.00 0.00 C ATOM 587 CE1 HIS A 39 208.090 -19.032 -10.345 1.00 0.00 C ATOM 588 NE2 HIS A 39 208.217 -19.916 -9.373 1.00 0.00 N ATOM 0 H HIS A 39 204.073 -19.788 -7.461 1.00 0.00 H new ATOM 0 HA HIS A 39 203.920 -18.853 -9.444 1.00 0.00 H new ATOM 0 HB2 HIS A 39 204.692 -21.600 -10.501 1.00 0.00 H new ATOM 0 HB3 HIS A 39 204.545 -20.182 -11.521 1.00 0.00 H new ATOM 0 HD2 HIS A 39 206.839 -21.405 -8.539 1.00 0.00 H new ATOM 0 HE1 HIS A 39 208.851 -18.339 -10.672 1.00 0.00 H new ATOM 0 HE2 HIS A 39 209.053 -20.056 -8.806 1.00 0.00 H new ATOM 597 N ASP A 40 201.587 -18.990 -10.220 1.00 0.00 N ATOM 598 CA ASP A 40 200.216 -18.986 -10.744 1.00 0.00 C ATOM 599 C ASP A 40 199.977 -17.761 -11.630 1.00 0.00 C ATOM 600 O ASP A 40 200.747 -16.798 -11.585 1.00 0.00 O ATOM 601 CB ASP A 40 199.198 -19.010 -9.593 1.00 0.00 C ATOM 602 CG ASP A 40 199.180 -20.338 -8.856 1.00 0.00 C ATOM 603 OD1 ASP A 40 199.941 -20.481 -7.875 1.00 0.00 O ATOM 604 OD2 ASP A 40 198.406 -21.230 -9.259 1.00 0.00 O1- ATOM 0 H ASP A 40 201.931 -18.067 -9.956 1.00 0.00 H new ATOM 0 HA ASP A 40 200.083 -19.883 -11.349 1.00 0.00 H new ATOM 0 HB2 ASP A 40 199.432 -18.211 -8.889 1.00 0.00 H new ATOM 0 HB3 ASP A 40 198.203 -18.805 -9.988 1.00 0.00 H new ATOM 609 N GLU A 41 198.906 -17.807 -12.434 1.00 0.00 N ATOM 610 CA GLU A 41 198.558 -16.706 -13.338 1.00 0.00 C ATOM 611 C GLU A 41 197.449 -15.826 -12.748 1.00 0.00 C ATOM 612 O GLU A 41 197.498 -14.598 -12.867 1.00 0.00 O ATOM 613 CB GLU A 41 198.128 -17.262 -14.702 1.00 0.00 C ATOM 614 CG GLU A 41 198.456 -16.344 -15.875 1.00 0.00 C ATOM 615 CD GLU A 41 198.009 -16.919 -17.206 1.00 0.00 C ATOM 616 OE1 GLU A 41 198.812 -17.632 -17.844 1.00 0.00 O ATOM 617 OE2 GLU A 41 196.856 -16.656 -17.609 1.00 0.00 O1- ATOM 0 H GLU A 41 198.264 -18.599 -12.475 1.00 0.00 H new ATOM 0 HA GLU A 41 199.443 -16.083 -13.468 1.00 0.00 H new ATOM 0 HB2 GLU A 41 198.614 -18.225 -14.860 1.00 0.00 H new ATOM 0 HB3 GLU A 41 197.054 -17.445 -14.686 1.00 0.00 H new ATOM 0 HG2 GLU A 41 197.976 -15.378 -15.721 1.00 0.00 H new ATOM 0 HG3 GLU A 41 199.531 -16.165 -15.903 1.00 0.00 H new ATOM 624 N ALA A 42 196.455 -16.468 -12.116 1.00 0.00 N ATOM 625 CA ALA A 42 195.311 -15.771 -11.502 1.00 0.00 C ATOM 626 C ALA A 42 195.715 -14.909 -10.296 1.00 0.00 C ATOM 627 O ALA A 42 195.072 -13.892 -10.010 1.00 0.00 O ATOM 628 CB ALA A 42 194.250 -16.780 -11.088 1.00 0.00 C ATOM 0 H ALA A 42 196.420 -17.482 -12.015 1.00 0.00 H new ATOM 0 HA ALA A 42 194.909 -15.094 -12.256 1.00 0.00 H new ATOM 0 HB1 ALA A 42 193.408 -16.257 -10.635 1.00 0.00 H new ATOM 0 HB2 ALA A 42 193.907 -17.328 -11.965 1.00 0.00 H new ATOM 0 HB3 ALA A 42 194.674 -17.478 -10.366 1.00 0.00 H new ATOM 634 N LEU A 43 196.788 -15.321 -9.603 1.00 0.00 N ATOM 635 CA LEU A 43 197.295 -14.610 -8.417 1.00 0.00 C ATOM 636 C LEU A 43 197.871 -13.229 -8.761 1.00 0.00 C ATOM 637 O LEU A 43 197.845 -12.321 -7.925 1.00 0.00 O ATOM 638 CB LEU A 43 198.362 -15.464 -7.699 1.00 0.00 C ATOM 639 CG LEU A 43 197.869 -16.494 -6.646 1.00 0.00 C ATOM 640 CD1 LEU A 43 197.309 -15.803 -5.405 1.00 0.00 C ATOM 641 CD2 LEU A 43 196.837 -17.460 -7.229 1.00 0.00 C ATOM 0 H LEU A 43 197.327 -16.152 -9.847 1.00 0.00 H new ATOM 0 HA LEU A 43 196.445 -14.449 -7.753 1.00 0.00 H new ATOM 0 HB2 LEU A 43 198.927 -16.004 -8.459 1.00 0.00 H new ATOM 0 HB3 LEU A 43 199.059 -14.786 -7.206 1.00 0.00 H new ATOM 0 HG LEU A 43 198.741 -17.077 -6.349 1.00 0.00 H new ATOM 0 HD11 LEU A 43 196.974 -16.555 -4.690 1.00 0.00 H new ATOM 0 HD12 LEU A 43 198.086 -15.189 -4.949 1.00 0.00 H new ATOM 0 HD13 LEU A 43 196.467 -15.171 -5.689 1.00 0.00 H new ATOM 0 HD21 LEU A 43 196.520 -18.162 -6.458 1.00 0.00 H new ATOM 0 HD22 LEU A 43 195.974 -16.898 -7.585 1.00 0.00 H new ATOM 0 HD23 LEU A 43 197.281 -18.009 -8.060 1.00 0.00 H new ATOM 653 N PHE A 44 198.388 -13.079 -9.992 1.00 0.00 N ATOM 654 CA PHE A 44 198.965 -11.807 -10.455 1.00 0.00 C ATOM 655 C PHE A 44 197.878 -10.775 -10.773 1.00 0.00 C ATOM 656 O PHE A 44 198.069 -9.576 -10.544 1.00 0.00 O ATOM 657 CB PHE A 44 199.844 -12.033 -11.688 1.00 0.00 C ATOM 658 CG PHE A 44 201.213 -12.563 -11.364 1.00 0.00 C ATOM 659 CD1 PHE A 44 201.447 -13.926 -11.295 1.00 0.00 C ATOM 660 CD2 PHE A 44 202.269 -11.695 -11.127 1.00 0.00 C ATOM 661 CE1 PHE A 44 202.704 -14.416 -10.999 1.00 0.00 C ATOM 662 CE2 PHE A 44 203.529 -12.179 -10.830 1.00 0.00 C ATOM 663 CZ PHE A 44 203.747 -13.541 -10.766 1.00 0.00 C ATOM 0 H PHE A 44 198.418 -13.826 -10.686 1.00 0.00 H new ATOM 0 HA PHE A 44 199.578 -11.414 -9.644 1.00 0.00 H new ATOM 0 HB2 PHE A 44 199.343 -12.732 -12.358 1.00 0.00 H new ATOM 0 HB3 PHE A 44 199.947 -11.092 -12.228 1.00 0.00 H new ATOM 0 HD1 PHE A 44 200.635 -14.615 -11.475 1.00 0.00 H new ATOM 0 HD2 PHE A 44 202.105 -10.629 -11.175 1.00 0.00 H new ATOM 0 HE1 PHE A 44 202.871 -15.482 -10.950 1.00 0.00 H new ATOM 0 HE2 PHE A 44 204.343 -11.492 -10.648 1.00 0.00 H new ATOM 0 HZ PHE A 44 204.731 -13.921 -10.534 1.00 0.00 H new ATOM 673 N GLN A 45 196.735 -11.255 -11.286 1.00 0.00 N ATOM 674 CA GLN A 45 195.595 -10.390 -11.626 1.00 0.00 C ATOM 675 C GLN A 45 194.900 -9.883 -10.359 1.00 0.00 C ATOM 676 O GLN A 45 194.536 -8.706 -10.266 1.00 0.00 O ATOM 677 CB GLN A 45 194.593 -11.137 -12.516 1.00 0.00 C ATOM 678 CG GLN A 45 195.076 -11.350 -13.943 1.00 0.00 C ATOM 679 CD GLN A 45 194.065 -12.086 -14.798 1.00 0.00 C ATOM 680 OE1 GLN A 45 194.072 -13.316 -14.869 1.00 0.00 O ATOM 681 NE2 GLN A 45 193.185 -11.338 -15.452 1.00 0.00 N ATOM 0 H GLN A 45 196.575 -12.244 -11.475 1.00 0.00 H new ATOM 0 HA GLN A 45 195.978 -9.532 -12.178 1.00 0.00 H new ATOM 0 HB2 GLN A 45 194.376 -12.107 -12.068 1.00 0.00 H new ATOM 0 HB3 GLN A 45 193.656 -10.580 -12.539 1.00 0.00 H new ATOM 0 HG2 GLN A 45 195.294 -10.383 -14.397 1.00 0.00 H new ATOM 0 HG3 GLN A 45 196.010 -11.912 -13.926 1.00 0.00 H new ATOM 0 HE21 GLN A 45 193.215 -10.322 -15.365 1.00 0.00 H new ATOM 0 HE22 GLN A 45 192.479 -11.779 -16.041 1.00 0.00 H new ATOM 690 N SER A 46 194.732 -10.792 -9.384 1.00 0.00 N ATOM 691 CA SER A 46 194.109 -10.469 -8.093 1.00 0.00 C ATOM 692 C SER A 46 195.010 -9.552 -7.254 1.00 0.00 C ATOM 693 O SER A 46 194.519 -8.686 -6.525 1.00 0.00 O ATOM 694 CB SER A 46 193.804 -11.751 -7.315 1.00 0.00 C ATOM 695 OG SER A 46 192.919 -12.588 -8.039 1.00 0.00 O ATOM 0 H SER A 46 195.023 -11.766 -9.469 1.00 0.00 H new ATOM 0 HA SER A 46 193.177 -9.941 -8.295 1.00 0.00 H new ATOM 0 HB2 SER A 46 194.732 -12.286 -7.112 1.00 0.00 H new ATOM 0 HB3 SER A 46 193.364 -11.499 -6.350 1.00 0.00 H new ATOM 0 HG SER A 46 193.421 -13.086 -8.718 1.00 0.00 H new ATOM 701 N LEU A 47 196.334 -9.761 -7.375 1.00 0.00 N ATOM 702 CA LEU A 47 197.338 -8.967 -6.653 1.00 0.00 C ATOM 703 C LEU A 47 197.426 -7.534 -7.200 1.00 0.00 C ATOM 704 O LEU A 47 197.622 -6.585 -6.437 1.00 0.00 O ATOM 705 CB LEU A 47 198.712 -9.650 -6.741 1.00 0.00 C ATOM 706 CG LEU A 47 199.707 -9.300 -5.624 1.00 0.00 C ATOM 707 CD1 LEU A 47 199.498 -10.193 -4.407 1.00 0.00 C ATOM 708 CD2 LEU A 47 201.137 -9.419 -6.131 1.00 0.00 C ATOM 0 H LEU A 47 196.734 -10.483 -7.974 1.00 0.00 H new ATOM 0 HA LEU A 47 197.029 -8.907 -5.610 1.00 0.00 H new ATOM 0 HB2 LEU A 47 198.560 -10.729 -6.741 1.00 0.00 H new ATOM 0 HB3 LEU A 47 199.164 -9.391 -7.698 1.00 0.00 H new ATOM 0 HG LEU A 47 199.528 -8.268 -5.321 1.00 0.00 H new ATOM 0 HD11 LEU A 47 200.215 -9.924 -3.631 1.00 0.00 H new ATOM 0 HD12 LEU A 47 198.485 -10.059 -4.027 1.00 0.00 H new ATOM 0 HD13 LEU A 47 199.644 -11.235 -4.691 1.00 0.00 H new ATOM 0 HD21 LEU A 47 201.830 -9.168 -5.328 1.00 0.00 H new ATOM 0 HD22 LEU A 47 201.321 -10.441 -6.463 1.00 0.00 H new ATOM 0 HD23 LEU A 47 201.285 -8.734 -6.966 1.00 0.00 H new ATOM 720 N GLN A 48 197.274 -7.398 -8.527 1.00 0.00 N ATOM 721 CA GLN A 48 197.331 -6.092 -9.204 1.00 0.00 C ATOM 722 C GLN A 48 196.085 -5.248 -8.917 1.00 0.00 C ATOM 723 O GLN A 48 196.184 -4.033 -8.721 1.00 0.00 O ATOM 724 CB GLN A 48 197.498 -6.276 -10.716 1.00 0.00 C ATOM 725 CG GLN A 48 198.904 -6.683 -11.133 1.00 0.00 C ATOM 726 CD GLN A 48 199.038 -6.858 -12.634 1.00 0.00 C ATOM 727 OE1 GLN A 48 198.827 -7.949 -13.163 1.00 0.00 O ATOM 728 NE2 GLN A 48 199.393 -5.782 -13.326 1.00 0.00 N ATOM 0 H GLN A 48 197.109 -8.183 -9.157 1.00 0.00 H new ATOM 0 HA GLN A 48 198.197 -5.560 -8.808 1.00 0.00 H new ATOM 0 HB2 GLN A 48 196.793 -7.033 -11.061 1.00 0.00 H new ATOM 0 HB3 GLN A 48 197.236 -5.344 -11.217 1.00 0.00 H new ATOM 0 HG2 GLN A 48 199.613 -5.928 -10.794 1.00 0.00 H new ATOM 0 HG3 GLN A 48 199.171 -7.616 -10.637 1.00 0.00 H new ATOM 0 HE21 GLN A 48 199.558 -4.898 -12.845 1.00 0.00 H new ATOM 0 HE22 GLN A 48 199.501 -5.840 -14.339 1.00 0.00 H new ATOM 737 N GLY A 49 194.916 -5.909 -8.885 1.00 0.00 N ATOM 738 CA GLY A 49 193.650 -5.224 -8.610 1.00 0.00 C ATOM 739 C GLY A 49 193.516 -4.785 -7.157 1.00 0.00 C ATOM 740 O GLY A 49 193.028 -3.686 -6.879 1.00 0.00 O ATOM 0 H GLY A 49 194.825 -6.912 -9.046 1.00 0.00 H new ATOM 0 HA2 GLY A 49 193.567 -4.351 -9.257 1.00 0.00 H new ATOM 0 HA3 GLY A 49 192.822 -5.887 -8.862 1.00 0.00 H new ATOM 744 N GLU A 50 193.974 -5.649 -6.238 1.00 0.00 N ATOM 745 CA GLU A 50 193.926 -5.374 -4.793 1.00 0.00 C ATOM 746 C GLU A 50 194.944 -4.302 -4.391 1.00 0.00 C ATOM 747 O GLU A 50 194.670 -3.480 -3.511 1.00 0.00 O ATOM 748 CB GLU A 50 194.183 -6.657 -3.995 1.00 0.00 C ATOM 749 CG GLU A 50 193.022 -7.641 -4.017 1.00 0.00 C ATOM 750 CD GLU A 50 193.309 -8.900 -3.226 1.00 0.00 C ATOM 751 OE1 GLU A 50 192.993 -8.928 -2.018 1.00 0.00 O ATOM 752 OE2 GLU A 50 193.849 -9.861 -3.815 1.00 0.00 O1- ATOM 0 H GLU A 50 194.386 -6.552 -6.473 1.00 0.00 H new ATOM 0 HA GLU A 50 192.928 -5.000 -4.564 1.00 0.00 H new ATOM 0 HB2 GLU A 50 195.071 -7.149 -4.393 1.00 0.00 H new ATOM 0 HB3 GLU A 50 194.402 -6.392 -2.961 1.00 0.00 H new ATOM 0 HG2 GLU A 50 192.133 -7.157 -3.612 1.00 0.00 H new ATOM 0 HG3 GLU A 50 192.797 -7.909 -5.049 1.00 0.00 H new ATOM 759 N LEU A 51 196.110 -4.316 -5.057 1.00 0.00 N ATOM 760 CA LEU A 51 197.186 -3.349 -4.796 1.00 0.00 C ATOM 761 C LEU A 51 196.825 -1.956 -5.333 1.00 0.00 C ATOM 762 O LEU A 51 197.167 -0.937 -4.721 1.00 0.00 O ATOM 763 CB LEU A 51 198.499 -3.835 -5.428 1.00 0.00 C ATOM 764 CG LEU A 51 199.787 -3.297 -4.786 1.00 0.00 C ATOM 765 CD1 LEU A 51 200.216 -4.168 -3.612 1.00 0.00 C ATOM 766 CD2 LEU A 51 200.898 -3.213 -5.822 1.00 0.00 C ATOM 0 H LEU A 51 196.332 -4.994 -5.787 1.00 0.00 H new ATOM 0 HA LEU A 51 197.315 -3.272 -3.716 1.00 0.00 H new ATOM 0 HB2 LEU A 51 198.521 -4.924 -5.384 1.00 0.00 H new ATOM 0 HB3 LEU A 51 198.497 -3.558 -6.482 1.00 0.00 H new ATOM 0 HG LEU A 51 199.586 -2.295 -4.407 1.00 0.00 H new ATOM 0 HD11 LEU A 51 201.130 -3.766 -3.175 1.00 0.00 H new ATOM 0 HD12 LEU A 51 199.428 -4.178 -2.859 1.00 0.00 H new ATOM 0 HD13 LEU A 51 200.397 -5.185 -3.960 1.00 0.00 H new ATOM 0 HD21 LEU A 51 201.805 -2.830 -5.353 1.00 0.00 H new ATOM 0 HD22 LEU A 51 201.091 -4.205 -6.229 1.00 0.00 H new ATOM 0 HD23 LEU A 51 200.595 -2.543 -6.627 1.00 0.00 H new ATOM 778 N GLN A 52 196.123 -1.929 -6.477 1.00 0.00 N ATOM 779 CA GLN A 52 195.687 -0.674 -7.104 1.00 0.00 C ATOM 780 C GLN A 52 194.516 -0.051 -6.340 1.00 0.00 C ATOM 781 O GLN A 52 194.380 1.175 -6.294 1.00 0.00 O ATOM 782 CB GLN A 52 195.290 -0.911 -8.565 1.00 0.00 C ATOM 783 CG GLN A 52 196.475 -1.082 -9.503 1.00 0.00 C ATOM 784 CD GLN A 52 196.051 -1.315 -10.940 1.00 0.00 C ATOM 785 OE1 GLN A 52 195.890 -0.371 -11.712 1.00 0.00 O ATOM 786 NE2 GLN A 52 195.868 -2.579 -11.305 1.00 0.00 N ATOM 0 H GLN A 52 195.845 -2.767 -6.988 1.00 0.00 H new ATOM 0 HA GLN A 52 196.526 0.021 -7.072 1.00 0.00 H new ATOM 0 HB2 GLN A 52 194.662 -1.800 -8.622 1.00 0.00 H new ATOM 0 HB3 GLN A 52 194.685 -0.072 -8.908 1.00 0.00 H new ATOM 0 HG2 GLN A 52 197.105 -0.194 -9.453 1.00 0.00 H new ATOM 0 HG3 GLN A 52 197.082 -1.922 -9.166 1.00 0.00 H new ATOM 0 HE21 GLN A 52 196.013 -3.331 -10.631 1.00 0.00 H new ATOM 0 HE22 GLN A 52 195.582 -2.798 -12.259 1.00 0.00 H new ATOM 795 N THR A 53 193.679 -0.911 -5.732 1.00 0.00 N ATOM 796 CA THR A 53 192.521 -0.460 -4.946 1.00 0.00 C ATOM 797 C THR A 53 192.949 0.112 -3.593 1.00 0.00 C ATOM 798 O THR A 53 192.367 1.093 -3.118 1.00 0.00 O ATOM 799 CB THR A 53 191.503 -1.597 -4.713 1.00 0.00 C ATOM 800 OG1 THR A 53 192.179 -2.785 -4.282 1.00 0.00 O ATOM 801 CG2 THR A 53 190.705 -1.887 -5.977 1.00 0.00 C ATOM 0 H THR A 53 193.785 -1.925 -5.772 1.00 0.00 H new ATOM 0 HA THR A 53 192.043 0.324 -5.533 1.00 0.00 H new ATOM 0 HB THR A 53 190.810 -1.274 -3.936 1.00 0.00 H new ATOM 0 HG1 THR A 53 193.087 -2.557 -3.991 1.00 0.00 H new ATOM 0 HG21 THR A 53 189.996 -2.692 -5.783 1.00 0.00 H new ATOM 0 HG22 THR A 53 190.163 -0.991 -6.279 1.00 0.00 H new ATOM 0 HG23 THR A 53 191.384 -2.186 -6.775 1.00 0.00 H new ATOM 809 N VAL A 54 193.981 -0.498 -2.985 1.00 0.00 N ATOM 810 CA VAL A 54 194.509 -0.035 -1.688 1.00 0.00 C ATOM 811 C VAL A 54 195.318 1.259 -1.854 1.00 0.00 C ATOM 812 O VAL A 54 195.307 2.123 -0.973 1.00 0.00 O ATOM 813 CB VAL A 54 195.367 -1.110 -0.956 1.00 0.00 C ATOM 814 CG1 VAL A 54 194.486 -2.237 -0.437 1.00 0.00 C ATOM 815 CG2 VAL A 54 196.471 -1.668 -1.851 1.00 0.00 C ATOM 0 H VAL A 54 194.465 -1.310 -3.368 1.00 0.00 H new ATOM 0 HA VAL A 54 193.638 0.160 -1.062 1.00 0.00 H new ATOM 0 HB VAL A 54 195.848 -0.618 -0.111 1.00 0.00 H new ATOM 0 HG11 VAL A 54 195.104 -2.977 0.071 1.00 0.00 H new ATOM 0 HG12 VAL A 54 193.754 -1.834 0.263 1.00 0.00 H new ATOM 0 HG13 VAL A 54 193.968 -2.708 -1.272 1.00 0.00 H new ATOM 0 HG21 VAL A 54 197.044 -2.414 -1.300 1.00 0.00 H new ATOM 0 HG22 VAL A 54 196.026 -2.130 -2.732 1.00 0.00 H new ATOM 0 HG23 VAL A 54 197.132 -0.859 -2.161 1.00 0.00 H new ATOM 825 N LYS A 55 196.013 1.379 -3.002 1.00 0.00 N ATOM 826 CA LYS A 55 196.814 2.569 -3.320 1.00 0.00 C ATOM 827 C LYS A 55 195.915 3.768 -3.638 1.00 0.00 C ATOM 828 O LYS A 55 196.234 4.904 -3.272 1.00 0.00 O ATOM 829 CB LYS A 55 197.750 2.290 -4.500 1.00 0.00 C ATOM 830 CG LYS A 55 198.979 1.477 -4.129 1.00 0.00 C ATOM 831 CD LYS A 55 199.904 1.291 -5.320 1.00 0.00 C ATOM 832 CE LYS A 55 201.183 0.569 -4.927 1.00 0.00 C ATOM 833 NZ LYS A 55 202.081 0.352 -6.095 1.00 0.00 N1+ ATOM 0 H LYS A 55 196.033 0.660 -3.725 1.00 0.00 H new ATOM 0 HA LYS A 55 197.414 2.810 -2.443 1.00 0.00 H new ATOM 0 HB2 LYS A 55 197.195 1.760 -5.274 1.00 0.00 H new ATOM 0 HB3 LYS A 55 198.070 3.239 -4.930 1.00 0.00 H new ATOM 0 HG2 LYS A 55 199.517 1.976 -3.323 1.00 0.00 H new ATOM 0 HG3 LYS A 55 198.671 0.502 -3.750 1.00 0.00 H new ATOM 0 HD2 LYS A 55 199.389 0.725 -6.096 1.00 0.00 H new ATOM 0 HD3 LYS A 55 200.151 2.264 -5.746 1.00 0.00 H new ATOM 0 HE2 LYS A 55 201.708 1.149 -4.168 1.00 0.00 H new ATOM 0 HE3 LYS A 55 200.934 -0.392 -4.478 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 202.404 -0.637 -6.106 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 201.564 0.557 -6.974 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 202.904 0.984 -6.022 1.00 0.00 H new ATOM 847 N GLU A 56 194.786 3.497 -4.316 1.00 0.00 N ATOM 848 CA GLU A 56 193.809 4.537 -4.674 1.00 0.00 C ATOM 849 C GLU A 56 193.025 5.003 -3.441 1.00 0.00 C ATOM 850 O GLU A 56 192.653 6.177 -3.340 1.00 0.00 O ATOM 851 CB GLU A 56 192.841 4.026 -5.745 1.00 0.00 C ATOM 852 CG GLU A 56 193.446 3.968 -7.140 1.00 0.00 C ATOM 853 CD GLU A 56 192.469 3.455 -8.179 1.00 0.00 C ATOM 854 OE1 GLU A 56 191.748 4.282 -8.774 1.00 0.00 O ATOM 855 OE2 GLU A 56 192.422 2.226 -8.395 1.00 0.00 O1- ATOM 0 H GLU A 56 194.528 2.561 -4.628 1.00 0.00 H new ATOM 0 HA GLU A 56 194.362 5.387 -5.075 1.00 0.00 H new ATOM 0 HB2 GLU A 56 192.498 3.030 -5.466 1.00 0.00 H new ATOM 0 HB3 GLU A 56 191.963 4.672 -5.766 1.00 0.00 H new ATOM 0 HG2 GLU A 56 193.785 4.963 -7.426 1.00 0.00 H new ATOM 0 HG3 GLU A 56 194.325 3.324 -7.124 1.00 0.00 H new ATOM 862 N THR A 57 192.791 4.065 -2.505 1.00 0.00 N ATOM 863 CA THR A 57 192.072 4.353 -1.256 1.00 0.00 C ATOM 864 C THR A 57 192.940 5.155 -0.283 1.00 0.00 C ATOM 865 O THR A 57 192.436 6.023 0.438 1.00 0.00 O ATOM 866 CB THR A 57 191.599 3.060 -0.558 1.00 0.00 C ATOM 867 OG1 THR A 57 192.649 2.086 -0.556 1.00 0.00 O ATOM 868 CG2 THR A 57 190.366 2.486 -1.243 1.00 0.00 C ATOM 0 H THR A 57 193.093 3.095 -2.594 1.00 0.00 H new ATOM 0 HA THR A 57 191.200 4.946 -1.533 1.00 0.00 H new ATOM 0 HB THR A 57 191.337 3.310 0.470 1.00 0.00 H new ATOM 0 HG1 THR A 57 193.517 2.540 -0.587 1.00 0.00 H new ATOM 0 HG21 THR A 57 190.055 1.576 -0.730 1.00 0.00 H new ATOM 0 HG22 THR A 57 189.557 3.216 -1.208 1.00 0.00 H new ATOM 0 HG23 THR A 57 190.601 2.255 -2.282 1.00 0.00 H new ATOM 876 N LEU A 58 194.252 4.866 -0.284 1.00 0.00 N ATOM 877 CA LEU A 58 195.216 5.565 0.575 1.00 0.00 C ATOM 878 C LEU A 58 195.467 6.987 0.068 1.00 0.00 C ATOM 879 O LEU A 58 195.630 7.917 0.863 1.00 0.00 O ATOM 880 CB LEU A 58 196.542 4.794 0.646 1.00 0.00 C ATOM 881 CG LEU A 58 196.509 3.482 1.445 1.00 0.00 C ATOM 882 CD1 LEU A 58 197.619 2.553 0.982 1.00 0.00 C ATOM 883 CD2 LEU A 58 196.640 3.749 2.941 1.00 0.00 C ATOM 0 H LEU A 58 194.669 4.147 -0.876 1.00 0.00 H new ATOM 0 HA LEU A 58 194.789 5.621 1.576 1.00 0.00 H new ATOM 0 HB2 LEU A 58 196.866 4.571 -0.371 1.00 0.00 H new ATOM 0 HB3 LEU A 58 197.297 5.446 1.085 1.00 0.00 H new ATOM 0 HG LEU A 58 195.547 3.002 1.266 1.00 0.00 H new ATOM 0 HD11 LEU A 58 197.583 1.628 1.557 1.00 0.00 H new ATOM 0 HD12 LEU A 58 197.487 2.328 -0.076 1.00 0.00 H new ATOM 0 HD13 LEU A 58 198.584 3.036 1.133 1.00 0.00 H new ATOM 0 HD21 LEU A 58 196.614 2.804 3.483 1.00 0.00 H new ATOM 0 HD22 LEU A 58 197.585 4.255 3.139 1.00 0.00 H new ATOM 0 HD23 LEU A 58 195.815 4.380 3.272 1.00 0.00 H new ATOM 895 N GLN A 59 195.483 7.142 -1.270 1.00 0.00 N ATOM 896 CA GLN A 59 195.686 8.446 -1.915 1.00 0.00 C ATOM 897 C GLN A 59 194.470 9.354 -1.693 1.00 0.00 C ATOM 898 O GLN A 59 194.618 10.560 -1.469 1.00 0.00 O ATOM 899 CB GLN A 59 195.952 8.262 -3.414 1.00 0.00 C ATOM 900 CG GLN A 59 196.898 9.298 -4.005 1.00 0.00 C ATOM 901 CD GLN A 59 197.153 9.079 -5.484 1.00 0.00 C ATOM 902 OE1 GLN A 59 196.432 9.604 -6.334 1.00 0.00 O ATOM 903 NE2 GLN A 59 198.182 8.303 -5.799 1.00 0.00 N ATOM 0 H GLN A 59 195.356 6.371 -1.926 1.00 0.00 H new ATOM 0 HA GLN A 59 196.556 8.923 -1.463 1.00 0.00 H new ATOM 0 HB2 GLN A 59 196.368 7.268 -3.580 1.00 0.00 H new ATOM 0 HB3 GLN A 59 195.003 8.304 -3.949 1.00 0.00 H new ATOM 0 HG2 GLN A 59 196.480 10.293 -3.856 1.00 0.00 H new ATOM 0 HG3 GLN A 59 197.846 9.267 -3.468 1.00 0.00 H new ATOM 0 HE21 GLN A 59 198.753 7.889 -5.062 1.00 0.00 H new ATOM 0 HE22 GLN A 59 198.402 8.121 -6.778 1.00 0.00 H new ATOM 912 N ALA A 60 193.271 8.752 -1.741 1.00 0.00 N ATOM 913 CA ALA A 60 192.016 9.477 -1.524 1.00 0.00 C ATOM 914 C ALA A 60 191.887 9.914 -0.063 1.00 0.00 C ATOM 915 O ALA A 60 191.367 10.997 0.229 1.00 0.00 O ATOM 916 CB ALA A 60 190.828 8.615 -1.927 1.00 0.00 C ATOM 0 H ALA A 60 193.148 7.757 -1.930 1.00 0.00 H new ATOM 0 HA ALA A 60 192.026 10.370 -2.148 1.00 0.00 H new ATOM 0 HB1 ALA A 60 189.904 9.168 -1.760 1.00 0.00 H new ATOM 0 HB2 ALA A 60 190.909 8.354 -2.982 1.00 0.00 H new ATOM 0 HB3 ALA A 60 190.819 7.704 -1.328 1.00 0.00 H new ATOM 922 N MET A 61 192.394 9.065 0.846 1.00 0.00 N ATOM 923 CA MET A 61 192.369 9.336 2.288 1.00 0.00 C ATOM 924 C MET A 61 193.261 10.528 2.651 1.00 0.00 C ATOM 925 O MET A 61 192.855 11.391 3.431 1.00 0.00 O ATOM 926 CB MET A 61 192.808 8.098 3.076 1.00 0.00 C ATOM 927 CG MET A 61 191.713 7.052 3.236 1.00 0.00 C ATOM 928 SD MET A 61 192.237 5.619 4.204 1.00 0.00 S ATOM 929 CE MET A 61 192.189 6.274 5.873 1.00 0.00 C ATOM 0 H MET A 61 192.830 8.176 0.601 1.00 0.00 H new ATOM 0 HA MET A 61 191.342 9.585 2.556 1.00 0.00 H new ATOM 0 HB2 MET A 61 193.662 7.643 2.574 1.00 0.00 H new ATOM 0 HB3 MET A 61 193.148 8.409 4.064 1.00 0.00 H new ATOM 0 HG2 MET A 61 190.848 7.510 3.716 1.00 0.00 H new ATOM 0 HG3 MET A 61 191.391 6.718 2.250 1.00 0.00 H new ATOM 0 HE1 MET A 61 192.314 5.460 6.587 1.00 0.00 H new ATOM 0 HE2 MET A 61 192.993 6.998 6.003 1.00 0.00 H new ATOM 0 HE3 MET A 61 191.230 6.763 6.045 1.00 0.00 H new ATOM 939 N ILE A 62 194.464 10.577 2.054 1.00 0.00 N ATOM 940 CA ILE A 62 195.420 11.672 2.306 1.00 0.00 C ATOM 941 C ILE A 62 194.996 12.972 1.607 1.00 0.00 C ATOM 942 O ILE A 62 195.356 14.066 2.050 1.00 0.00 O ATOM 943 CB ILE A 62 196.883 11.310 1.904 1.00 0.00 C ATOM 944 CG1 ILE A 62 196.961 10.648 0.515 1.00 0.00 C ATOM 945 CG2 ILE A 62 197.501 10.400 2.959 1.00 0.00 C ATOM 946 CD1 ILE A 62 198.099 11.165 -0.343 1.00 0.00 C ATOM 0 H ILE A 62 194.798 9.874 1.395 1.00 0.00 H new ATOM 0 HA ILE A 62 195.403 11.828 3.385 1.00 0.00 H new ATOM 0 HB ILE A 62 197.447 12.241 1.847 1.00 0.00 H new ATOM 0 HG12 ILE A 62 197.073 9.571 0.641 1.00 0.00 H new ATOM 0 HG13 ILE A 62 196.019 10.811 -0.009 1.00 0.00 H new ATOM 0 HG21 ILE A 62 198.523 10.151 2.672 1.00 0.00 H new ATOM 0 HG22 ILE A 62 197.509 10.912 3.921 1.00 0.00 H new ATOM 0 HG23 ILE A 62 196.914 9.485 3.040 1.00 0.00 H new ATOM 0 HD11 ILE A 62 198.091 10.653 -1.305 1.00 0.00 H new ATOM 0 HD12 ILE A 62 197.978 12.237 -0.501 1.00 0.00 H new ATOM 0 HD13 ILE A 62 199.048 10.977 0.159 1.00 0.00 H new ATOM 958 N LEU A 63 194.231 12.833 0.513 1.00 0.00 N ATOM 959 CA LEU A 63 193.725 13.984 -0.243 1.00 0.00 C ATOM 960 C LEU A 63 192.448 14.550 0.395 1.00 0.00 C ATOM 961 O LEU A 63 192.089 15.706 0.154 1.00 0.00 O ATOM 962 CB LEU A 63 193.446 13.588 -1.700 1.00 0.00 C ATOM 963 CG LEU A 63 194.486 14.052 -2.731 1.00 0.00 C ATOM 964 CD1 LEU A 63 195.685 13.111 -2.766 1.00 0.00 C ATOM 965 CD2 LEU A 63 193.851 14.151 -4.110 1.00 0.00 C ATOM 0 H LEU A 63 193.950 11.929 0.133 1.00 0.00 H new ATOM 0 HA LEU A 63 194.492 14.758 -0.222 1.00 0.00 H new ATOM 0 HB2 LEU A 63 193.369 12.502 -1.753 1.00 0.00 H new ATOM 0 HB3 LEU A 63 192.474 13.990 -1.986 1.00 0.00 H new ATOM 0 HG LEU A 63 194.842 15.038 -2.433 1.00 0.00 H new ATOM 0 HD11 LEU A 63 196.404 13.465 -3.505 1.00 0.00 H new ATOM 0 HD12 LEU A 63 196.157 13.086 -1.784 1.00 0.00 H new ATOM 0 HD13 LEU A 63 195.353 12.108 -3.035 1.00 0.00 H new ATOM 0 HD21 LEU A 63 194.598 14.481 -4.832 1.00 0.00 H new ATOM 0 HD22 LEU A 63 193.468 13.174 -4.405 1.00 0.00 H new ATOM 0 HD23 LEU A 63 193.031 14.869 -4.082 1.00 0.00 H new ATOM 977 N GLN A 64 191.772 13.720 1.209 1.00 0.00 N ATOM 978 CA GLN A 64 190.539 14.125 1.896 1.00 0.00 C ATOM 979 C GLN A 64 190.819 14.811 3.237 1.00 0.00 C ATOM 980 O GLN A 64 190.135 15.778 3.589 1.00 0.00 O ATOM 981 CB GLN A 64 189.627 12.915 2.115 1.00 0.00 C ATOM 982 CG GLN A 64 188.826 12.522 0.884 1.00 0.00 C ATOM 983 CD GLN A 64 187.942 11.314 1.125 1.00 0.00 C ATOM 984 OE1 GLN A 64 186.787 11.446 1.530 1.00 0.00 O ATOM 985 NE2 GLN A 64 188.483 10.127 0.877 1.00 0.00 N ATOM 0 H GLN A 64 192.062 12.762 1.406 1.00 0.00 H new ATOM 0 HA GLN A 64 190.040 14.849 1.252 1.00 0.00 H new ATOM 0 HB2 GLN A 64 190.234 12.066 2.429 1.00 0.00 H new ATOM 0 HB3 GLN A 64 188.938 13.133 2.931 1.00 0.00 H new ATOM 0 HG2 GLN A 64 188.207 13.364 0.573 1.00 0.00 H new ATOM 0 HG3 GLN A 64 189.510 12.309 0.063 1.00 0.00 H new ATOM 0 HE21 GLN A 64 189.444 10.065 0.542 1.00 0.00 H new ATOM 0 HE22 GLN A 64 187.937 9.278 1.021 1.00 0.00 H new ATOM 994 N LEU A 65 191.819 14.314 3.977 1.00 0.00 N ATOM 995 CA LEU A 65 192.170 14.890 5.285 1.00 0.00 C ATOM 996 C LEU A 65 193.301 15.918 5.178 1.00 0.00 C ATOM 997 O LEU A 65 193.246 16.971 5.821 1.00 0.00 O ATOM 998 CB LEU A 65 192.519 13.788 6.312 1.00 0.00 C ATOM 999 CG LEU A 65 193.617 12.787 5.916 1.00 0.00 C ATOM 1000 CD1 LEU A 65 194.977 13.248 6.417 1.00 0.00 C ATOM 1001 CD2 LEU A 65 193.292 11.404 6.460 1.00 0.00 C ATOM 0 H LEU A 65 192.396 13.521 3.697 1.00 0.00 H new ATOM 0 HA LEU A 65 191.286 15.418 5.644 1.00 0.00 H new ATOM 0 HB2 LEU A 65 192.822 14.273 7.240 1.00 0.00 H new ATOM 0 HB3 LEU A 65 191.610 13.226 6.528 1.00 0.00 H new ATOM 0 HG LEU A 65 193.656 12.735 4.828 1.00 0.00 H new ATOM 0 HD11 LEU A 65 195.737 12.524 6.125 1.00 0.00 H new ATOM 0 HD12 LEU A 65 195.215 14.219 5.983 1.00 0.00 H new ATOM 0 HD13 LEU A 65 194.955 13.332 7.504 1.00 0.00 H new ATOM 0 HD21 LEU A 65 194.078 10.706 6.172 1.00 0.00 H new ATOM 0 HD22 LEU A 65 193.225 11.447 7.547 1.00 0.00 H new ATOM 0 HD23 LEU A 65 192.339 11.067 6.051 1.00 0.00 H new ATOM 1477 N GLU A 100 218.149 -12.557 -14.123 1.00 0.00 N ATOM 1478 CA GLU A 100 218.041 -11.091 -14.101 1.00 0.00 C ATOM 1479 C GLU A 100 216.600 -10.619 -14.335 1.00 0.00 C ATOM 1480 O GLU A 100 216.248 -9.494 -13.973 1.00 0.00 O ATOM 1481 CB GLU A 100 218.964 -10.473 -15.159 1.00 0.00 C ATOM 1482 CG GLU A 100 220.441 -10.537 -14.800 1.00 0.00 C ATOM 1483 CD GLU A 100 221.326 -9.925 -15.867 1.00 0.00 C ATOM 1484 OE1 GLU A 100 221.747 -10.662 -16.785 1.00 0.00 O ATOM 1485 OE2 GLU A 100 221.600 -8.708 -15.788 1.00 0.00 O1- ATOM 0 HA GLU A 100 218.347 -10.759 -13.109 1.00 0.00 H new ATOM 0 HB2 GLU A 100 218.808 -10.986 -16.108 1.00 0.00 H new ATOM 0 HB3 GLU A 100 218.681 -9.431 -15.310 1.00 0.00 H new ATOM 0 HG2 GLU A 100 220.605 -10.018 -13.856 1.00 0.00 H new ATOM 0 HG3 GLU A 100 220.729 -11.577 -14.646 1.00 0.00 H new ATOM 1492 N ALA A 101 215.778 -11.491 -14.940 1.00 0.00 N ATOM 1493 CA ALA A 101 214.369 -11.186 -15.230 1.00 0.00 C ATOM 1494 C ALA A 101 213.485 -11.287 -13.980 1.00 0.00 C ATOM 1495 O ALA A 101 212.477 -10.582 -13.871 1.00 0.00 O ATOM 1496 CB ALA A 101 213.847 -12.112 -16.318 1.00 0.00 C ATOM 0 H ALA A 101 216.069 -12.421 -15.240 1.00 0.00 H new ATOM 0 HA ALA A 101 214.324 -10.154 -15.577 1.00 0.00 H new ATOM 0 HB1 ALA A 101 212.803 -11.878 -16.525 1.00 0.00 H new ATOM 0 HB2 ALA A 101 214.436 -11.976 -17.225 1.00 0.00 H new ATOM 0 HB3 ALA A 101 213.927 -13.147 -15.985 1.00 0.00 H new ATOM 1502 N LEU A 102 213.876 -12.167 -13.048 1.00 0.00 N ATOM 1503 CA LEU A 102 213.132 -12.380 -11.799 1.00 0.00 C ATOM 1504 C LEU A 102 213.551 -11.385 -10.708 1.00 0.00 C ATOM 1505 O LEU A 102 212.758 -11.069 -9.816 1.00 0.00 O ATOM 1506 CB LEU A 102 213.331 -13.816 -11.296 1.00 0.00 C ATOM 1507 CG LEU A 102 212.695 -14.915 -12.158 1.00 0.00 C ATOM 1508 CD1 LEU A 102 213.463 -16.219 -12.008 1.00 0.00 C ATOM 1509 CD2 LEU A 102 211.231 -15.121 -11.783 1.00 0.00 C ATOM 0 H LEU A 102 214.710 -12.747 -13.137 1.00 0.00 H new ATOM 0 HA LEU A 102 212.077 -12.215 -12.018 1.00 0.00 H new ATOM 0 HB2 LEU A 102 214.401 -14.011 -11.222 1.00 0.00 H new ATOM 0 HB3 LEU A 102 212.923 -13.888 -10.288 1.00 0.00 H new ATOM 0 HG LEU A 102 212.741 -14.597 -13.200 1.00 0.00 H new ATOM 0 HD11 LEU A 102 212.999 -16.988 -12.626 1.00 0.00 H new ATOM 0 HD12 LEU A 102 214.495 -16.072 -12.326 1.00 0.00 H new ATOM 0 HD13 LEU A 102 213.446 -16.533 -10.964 1.00 0.00 H new ATOM 0 HD21 LEU A 102 210.802 -15.905 -12.408 1.00 0.00 H new ATOM 0 HD22 LEU A 102 211.161 -15.413 -10.735 1.00 0.00 H new ATOM 0 HD23 LEU A 102 210.682 -14.192 -11.938 1.00 0.00 H new ATOM 1521 N LYS A 103 214.800 -10.892 -10.793 1.00 0.00 N ATOM 1522 CA LYS A 103 215.342 -9.929 -9.818 1.00 0.00 C ATOM 1523 C LYS A 103 214.646 -8.567 -9.904 1.00 0.00 C ATOM 1524 O LYS A 103 214.410 -7.922 -8.881 1.00 0.00 O ATOM 1525 CB LYS A 103 216.851 -9.754 -10.023 1.00 0.00 C ATOM 1526 CG LYS A 103 217.681 -10.923 -9.514 1.00 0.00 C ATOM 1527 CD LYS A 103 219.168 -10.688 -9.729 1.00 0.00 C ATOM 1528 CE LYS A 103 219.996 -11.851 -9.209 1.00 0.00 C ATOM 1529 NZ LYS A 103 221.454 -11.627 -9.410 1.00 0.00 N1+ ATOM 0 H LYS A 103 215.456 -11.147 -11.532 1.00 0.00 H new ATOM 0 HA LYS A 103 215.153 -10.337 -8.825 1.00 0.00 H new ATOM 0 HB2 LYS A 103 217.050 -9.615 -11.086 1.00 0.00 H new ATOM 0 HB3 LYS A 103 217.174 -8.844 -9.517 1.00 0.00 H new ATOM 0 HG2 LYS A 103 217.485 -11.074 -8.452 1.00 0.00 H new ATOM 0 HG3 LYS A 103 217.378 -11.836 -10.027 1.00 0.00 H new ATOM 0 HD2 LYS A 103 219.365 -10.546 -10.792 1.00 0.00 H new ATOM 0 HD3 LYS A 103 219.469 -9.771 -9.223 1.00 0.00 H new ATOM 0 HE2 LYS A 103 219.794 -11.995 -8.148 1.00 0.00 H new ATOM 0 HE3 LYS A 103 219.696 -12.767 -9.718 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 221.984 -12.442 -9.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 221.651 -11.515 -10.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 221.746 -10.767 -8.903 1.00 0.00 H new ATOM 1543 N GLU A 104 214.314 -8.146 -11.135 1.00 0.00 N ATOM 1544 CA GLU A 104 213.631 -6.862 -11.383 1.00 0.00 C ATOM 1545 C GLU A 104 212.225 -6.843 -10.767 1.00 0.00 C ATOM 1546 O GLU A 104 211.797 -5.826 -10.211 1.00 0.00 O ATOM 1547 CB GLU A 104 213.542 -6.583 -12.888 1.00 0.00 C ATOM 1548 CG GLU A 104 214.869 -6.194 -13.524 1.00 0.00 C ATOM 1549 CD GLU A 104 214.747 -5.931 -15.012 1.00 0.00 C ATOM 1550 OE1 GLU A 104 214.496 -4.767 -15.391 1.00 0.00 O ATOM 1551 OE2 GLU A 104 214.903 -6.889 -15.799 1.00 0.00 O1- ATOM 0 H GLU A 104 214.509 -8.680 -11.982 1.00 0.00 H new ATOM 0 HA GLU A 104 214.222 -6.080 -10.906 1.00 0.00 H new ATOM 0 HB2 GLU A 104 213.157 -7.471 -13.390 1.00 0.00 H new ATOM 0 HB3 GLU A 104 212.821 -5.783 -13.057 1.00 0.00 H new ATOM 0 HG2 GLU A 104 215.256 -5.302 -13.032 1.00 0.00 H new ATOM 0 HG3 GLU A 104 215.595 -6.990 -13.358 1.00 0.00 H new ATOM 1558 N LYS A 105 211.528 -7.988 -10.859 1.00 0.00 N ATOM 1559 CA LYS A 105 210.170 -8.137 -10.312 1.00 0.00 C ATOM 1560 C LYS A 105 210.196 -8.257 -8.786 1.00 0.00 C ATOM 1561 O LYS A 105 209.280 -7.785 -8.107 1.00 0.00 O ATOM 1562 CB LYS A 105 209.480 -9.363 -10.920 1.00 0.00 C ATOM 1563 CG LYS A 105 209.049 -9.174 -12.366 1.00 0.00 C ATOM 1564 CD LYS A 105 208.371 -10.420 -12.914 1.00 0.00 C ATOM 1565 CE LYS A 105 207.929 -10.235 -14.360 1.00 0.00 C ATOM 1566 NZ LYS A 105 209.081 -10.250 -15.308 1.00 0.00 N1+ ATOM 0 H LYS A 105 211.887 -8.829 -11.311 1.00 0.00 H new ATOM 0 HA LYS A 105 209.606 -7.242 -10.575 1.00 0.00 H new ATOM 0 HB2 LYS A 105 210.157 -10.215 -10.862 1.00 0.00 H new ATOM 0 HB3 LYS A 105 208.604 -9.610 -10.320 1.00 0.00 H new ATOM 0 HG2 LYS A 105 208.366 -8.327 -12.435 1.00 0.00 H new ATOM 0 HG3 LYS A 105 209.919 -8.933 -12.977 1.00 0.00 H new ATOM 0 HD2 LYS A 105 209.056 -11.265 -12.849 1.00 0.00 H new ATOM 0 HD3 LYS A 105 207.505 -10.663 -12.298 1.00 0.00 H new ATOM 0 HE2 LYS A 105 207.230 -11.027 -14.628 1.00 0.00 H new ATOM 0 HE3 LYS A 105 207.394 -9.290 -14.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 105 208.733 -10.121 -16.279 1.00 0.00 H new ATOM 0 HZ2 LYS A 105 209.737 -9.479 -15.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 105 209.578 -11.161 -15.236 1.00 0.00 H new ATOM 1580 N ALA A 106 211.259 -8.886 -8.258 1.00 0.00 N ATOM 1581 CA ALA A 106 211.435 -9.070 -6.810 1.00 0.00 C ATOM 1582 C ALA A 106 211.774 -7.748 -6.112 1.00 0.00 C ATOM 1583 O ALA A 106 211.327 -7.499 -4.988 1.00 0.00 O ATOM 1584 CB ALA A 106 212.518 -10.103 -6.539 1.00 0.00 C ATOM 0 H ALA A 106 212.015 -9.278 -8.819 1.00 0.00 H new ATOM 0 HA ALA A 106 210.490 -9.428 -6.402 1.00 0.00 H new ATOM 0 HB1 ALA A 106 212.639 -10.230 -5.463 1.00 0.00 H new ATOM 0 HB2 ALA A 106 212.233 -11.055 -6.987 1.00 0.00 H new ATOM 0 HB3 ALA A 106 213.459 -9.765 -6.972 1.00 0.00 H new ATOM 1590 N ASP A 107 212.562 -6.905 -6.799 1.00 0.00 N ATOM 1591 CA ASP A 107 212.965 -5.593 -6.276 1.00 0.00 C ATOM 1592 C ASP A 107 211.818 -4.582 -6.358 1.00 0.00 C ATOM 1593 O ASP A 107 211.669 -3.735 -5.472 1.00 0.00 O ATOM 1594 CB ASP A 107 214.182 -5.059 -7.037 1.00 0.00 C ATOM 1595 CG ASP A 107 215.467 -5.768 -6.652 1.00 0.00 C ATOM 1596 OD1 ASP A 107 215.878 -5.656 -5.477 1.00 0.00 O ATOM 1597 OD2 ASP A 107 216.067 -6.430 -7.524 1.00 0.00 O1- ATOM 0 H ASP A 107 212.934 -7.113 -7.726 1.00 0.00 H new ATOM 0 HA ASP A 107 213.230 -5.727 -5.227 1.00 0.00 H new ATOM 0 HB2 ASP A 107 214.015 -5.173 -8.108 1.00 0.00 H new ATOM 0 HB3 ASP A 107 214.288 -3.992 -6.843 1.00 0.00 H new ATOM 1602 N SER A 108 211.005 -4.686 -7.425 1.00 0.00 N ATOM 1603 CA SER A 108 209.850 -3.798 -7.627 1.00 0.00 C ATOM 1604 C SER A 108 208.737 -4.104 -6.614 1.00 0.00 C ATOM 1605 O SER A 108 208.126 -3.187 -6.052 1.00 0.00 O ATOM 1606 CB SER A 108 209.318 -3.937 -9.059 1.00 0.00 C ATOM 1607 OG SER A 108 208.353 -2.940 -9.350 1.00 0.00 O ATOM 0 H SER A 108 211.129 -5.380 -8.162 1.00 0.00 H new ATOM 0 HA SER A 108 210.179 -2.771 -7.470 1.00 0.00 H new ATOM 0 HB2 SER A 108 210.145 -3.862 -9.765 1.00 0.00 H new ATOM 0 HB3 SER A 108 208.875 -4.924 -9.190 1.00 0.00 H new ATOM 0 HG SER A 108 208.033 -3.053 -10.269 1.00 0.00 H new ATOM 1613 N LEU A 109 208.505 -5.405 -6.374 1.00 0.00 N ATOM 1614 CA LEU A 109 207.485 -5.862 -5.420 1.00 0.00 C ATOM 1615 C LEU A 109 207.905 -5.566 -3.979 1.00 0.00 C ATOM 1616 O LEU A 109 207.067 -5.223 -3.142 1.00 0.00 O ATOM 1617 CB LEU A 109 207.217 -7.366 -5.589 1.00 0.00 C ATOM 1618 CG LEU A 109 206.503 -7.779 -6.887 1.00 0.00 C ATOM 1619 CD1 LEU A 109 206.768 -9.245 -7.191 1.00 0.00 C ATOM 1620 CD2 LEU A 109 205.000 -7.531 -6.789 1.00 0.00 C ATOM 0 H LEU A 109 209.014 -6.161 -6.831 1.00 0.00 H new ATOM 0 HA LEU A 109 206.567 -5.314 -5.631 1.00 0.00 H new ATOM 0 HB2 LEU A 109 208.170 -7.893 -5.538 1.00 0.00 H new ATOM 0 HB3 LEU A 109 206.618 -7.706 -4.744 1.00 0.00 H new ATOM 0 HG LEU A 109 206.899 -7.168 -7.698 1.00 0.00 H new ATOM 0 HD11 LEU A 109 206.257 -9.524 -8.112 1.00 0.00 H new ATOM 0 HD12 LEU A 109 207.840 -9.404 -7.308 1.00 0.00 H new ATOM 0 HD13 LEU A 109 206.398 -9.859 -6.370 1.00 0.00 H new ATOM 0 HD21 LEU A 109 204.520 -7.832 -7.720 1.00 0.00 H new ATOM 0 HD22 LEU A 109 204.588 -8.113 -5.964 1.00 0.00 H new ATOM 0 HD23 LEU A 109 204.817 -6.471 -6.612 1.00 0.00 H new ATOM 1632 N ALA A 110 209.217 -5.684 -3.708 1.00 0.00 N ATOM 1633 CA ALA A 110 209.778 -5.413 -2.378 1.00 0.00 C ATOM 1634 C ALA A 110 209.724 -3.918 -2.046 1.00 0.00 C ATOM 1635 O ALA A 110 209.515 -3.537 -0.890 1.00 0.00 O ATOM 1636 CB ALA A 110 211.209 -5.924 -2.293 1.00 0.00 C ATOM 0 H ALA A 110 209.911 -5.968 -4.400 1.00 0.00 H new ATOM 0 HA ALA A 110 209.171 -5.942 -1.643 1.00 0.00 H new ATOM 0 HB1 ALA A 110 211.611 -5.716 -1.302 1.00 0.00 H new ATOM 0 HB2 ALA A 110 211.223 -6.999 -2.472 1.00 0.00 H new ATOM 0 HB3 ALA A 110 211.819 -5.423 -3.045 1.00 0.00 H new ATOM 1642 N LYS A 111 209.900 -3.083 -3.084 1.00 0.00 N ATOM 1643 CA LYS A 111 209.852 -1.622 -2.942 1.00 0.00 C ATOM 1644 C LYS A 111 208.410 -1.139 -2.760 1.00 0.00 C ATOM 1645 O LYS A 111 208.167 -0.121 -2.106 1.00 0.00 O ATOM 1646 CB LYS A 111 210.480 -0.940 -4.160 1.00 0.00 C ATOM 1647 CG LYS A 111 211.999 -0.986 -4.176 1.00 0.00 C ATOM 1648 CD LYS A 111 212.566 -0.308 -5.413 1.00 0.00 C ATOM 1649 CE LYS A 111 214.085 -0.353 -5.428 1.00 0.00 C ATOM 1650 NZ LYS A 111 214.648 0.308 -6.636 1.00 0.00 N1+ ATOM 0 H LYS A 111 210.078 -3.401 -4.037 1.00 0.00 H new ATOM 0 HA LYS A 111 210.424 -1.354 -2.054 1.00 0.00 H new ATOM 0 HB2 LYS A 111 210.102 -1.415 -5.065 1.00 0.00 H new ATOM 0 HB3 LYS A 111 210.157 0.101 -4.188 1.00 0.00 H new ATOM 0 HG2 LYS A 111 212.388 -0.498 -3.282 1.00 0.00 H new ATOM 0 HG3 LYS A 111 212.333 -2.023 -4.144 1.00 0.00 H new ATOM 0 HD2 LYS A 111 212.178 -0.797 -6.307 1.00 0.00 H new ATOM 0 HD3 LYS A 111 212.232 0.729 -5.446 1.00 0.00 H new ATOM 0 HE2 LYS A 111 214.471 0.136 -4.534 1.00 0.00 H new ATOM 0 HE3 LYS A 111 214.418 -1.390 -5.394 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 215.686 0.256 -6.608 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 214.300 -0.174 -7.489 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 214.352 1.305 -6.656 1.00 0.00 H new ATOM 1664 N GLU A 112 207.458 -1.889 -3.350 1.00 0.00 N ATOM 1665 CA GLU A 112 206.024 -1.573 -3.248 1.00 0.00 C ATOM 1666 C GLU A 112 205.475 -1.900 -1.853 1.00 0.00 C ATOM 1667 O GLU A 112 204.650 -1.153 -1.315 1.00 0.00 O ATOM 1668 CB GLU A 112 205.227 -2.331 -4.315 1.00 0.00 C ATOM 1669 CG GLU A 112 205.415 -1.788 -5.724 1.00 0.00 C ATOM 1670 CD GLU A 112 204.621 -2.562 -6.758 1.00 0.00 C ATOM 1671 OE1 GLU A 112 205.125 -3.596 -7.244 1.00 0.00 O ATOM 1672 OE2 GLU A 112 203.492 -2.134 -7.083 1.00 0.00 O1- ATOM 0 H GLU A 112 207.661 -2.721 -3.904 1.00 0.00 H new ATOM 0 HA GLU A 112 205.912 -0.502 -3.415 1.00 0.00 H new ATOM 0 HB2 GLU A 112 205.522 -3.380 -4.298 1.00 0.00 H new ATOM 0 HB3 GLU A 112 204.168 -2.293 -4.059 1.00 0.00 H new ATOM 0 HG2 GLU A 112 205.113 -0.741 -5.749 1.00 0.00 H new ATOM 0 HG3 GLU A 112 206.473 -1.821 -5.984 1.00 0.00 H new ATOM 1679 N ILE A 113 205.952 -3.016 -1.271 1.00 0.00 N ATOM 1680 CA ILE A 113 205.527 -3.447 0.075 1.00 0.00 C ATOM 1681 C ILE A 113 206.176 -2.555 1.150 1.00 0.00 C ATOM 1682 O ILE A 113 205.564 -2.273 2.185 1.00 0.00 O ATOM 1683 CB ILE A 113 205.860 -4.950 0.354 1.00 0.00 C ATOM 1684 CG1 ILE A 113 205.284 -5.852 -0.755 1.00 0.00 C ATOM 1685 CG2 ILE A 113 205.310 -5.391 1.719 1.00 0.00 C ATOM 1686 CD1 ILE A 113 206.068 -7.132 -0.989 1.00 0.00 C ATOM 0 H ILE A 113 206.632 -3.636 -1.711 1.00 0.00 H new ATOM 0 HA ILE A 113 204.443 -3.342 0.117 1.00 0.00 H new ATOM 0 HB ILE A 113 206.945 -5.052 0.365 1.00 0.00 H new ATOM 0 HG12 ILE A 113 204.256 -6.111 -0.500 1.00 0.00 H new ATOM 0 HG13 ILE A 113 205.249 -5.286 -1.686 1.00 0.00 H new ATOM 0 HG21 ILE A 113 205.555 -6.440 1.888 1.00 0.00 H new ATOM 0 HG22 ILE A 113 205.757 -4.782 2.505 1.00 0.00 H new ATOM 0 HG23 ILE A 113 204.227 -5.264 1.733 1.00 0.00 H new ATOM 0 HD11 ILE A 113 205.595 -7.708 -1.785 1.00 0.00 H new ATOM 0 HD12 ILE A 113 207.090 -6.885 -1.277 1.00 0.00 H new ATOM 0 HD13 ILE A 113 206.082 -7.723 -0.073 1.00 0.00 H new ATOM 1698 N GLN A 114 207.417 -2.112 0.880 1.00 0.00 N ATOM 1699 CA GLN A 114 208.158 -1.232 1.796 1.00 0.00 C ATOM 1700 C GLN A 114 207.578 0.188 1.784 1.00 0.00 C ATOM 1701 O GLN A 114 207.557 0.865 2.815 1.00 0.00 O ATOM 1702 CB GLN A 114 209.642 -1.193 1.423 1.00 0.00 C ATOM 1703 CG GLN A 114 210.411 -2.441 1.832 1.00 0.00 C ATOM 1704 CD GLN A 114 211.877 -2.374 1.447 1.00 0.00 C ATOM 1705 OE1 GLN A 114 212.263 -2.792 0.355 1.00 0.00 O ATOM 1706 NE2 GLN A 114 212.701 -1.847 2.343 1.00 0.00 N ATOM 0 H GLN A 114 207.928 -2.351 0.030 1.00 0.00 H new ATOM 0 HA GLN A 114 208.057 -1.638 2.803 1.00 0.00 H new ATOM 0 HB2 GLN A 114 209.733 -1.059 0.345 1.00 0.00 H new ATOM 0 HB3 GLN A 114 210.102 -0.324 1.893 1.00 0.00 H new ATOM 0 HG2 GLN A 114 210.328 -2.578 2.910 1.00 0.00 H new ATOM 0 HG3 GLN A 114 209.956 -3.314 1.364 1.00 0.00 H new ATOM 0 HE21 GLN A 114 212.338 -1.513 3.236 1.00 0.00 H new ATOM 0 HE22 GLN A 114 213.698 -1.776 2.139 1.00 0.00 H new ATOM 1715 N TYR A 115 207.091 0.613 0.605 1.00 0.00 N ATOM 1716 CA TYR A 115 206.486 1.939 0.429 1.00 0.00 C ATOM 1717 C TYR A 115 205.111 2.000 1.108 1.00 0.00 C ATOM 1718 O TYR A 115 204.750 3.015 1.714 1.00 0.00 O ATOM 1719 CB TYR A 115 206.363 2.267 -1.065 1.00 0.00 C ATOM 1720 CG TYR A 115 206.330 3.752 -1.374 1.00 0.00 C ATOM 1721 CD1 TYR A 115 205.124 4.425 -1.516 1.00 0.00 C ATOM 1722 CD2 TYR A 115 207.507 4.476 -1.525 1.00 0.00 C ATOM 1723 CE1 TYR A 115 205.090 5.777 -1.799 1.00 0.00 C ATOM 1724 CE2 TYR A 115 207.481 5.829 -1.808 1.00 0.00 C ATOM 1725 CZ TYR A 115 206.270 6.474 -1.944 1.00 0.00 C ATOM 1726 OH TYR A 115 206.240 7.820 -2.226 1.00 0.00 O ATOM 0 H TYR A 115 207.107 0.050 -0.245 1.00 0.00 H new ATOM 0 HA TYR A 115 207.131 2.682 0.899 1.00 0.00 H new ATOM 0 HB2 TYR A 115 207.202 1.815 -1.595 1.00 0.00 H new ATOM 0 HB3 TYR A 115 205.455 1.806 -1.453 1.00 0.00 H new ATOM 0 HD1 TYR A 115 204.197 3.883 -1.403 1.00 0.00 H new ATOM 0 HD2 TYR A 115 208.457 3.973 -1.420 1.00 0.00 H new ATOM 0 HE1 TYR A 115 204.143 6.285 -1.906 1.00 0.00 H new ATOM 0 HE2 TYR A 115 208.404 6.378 -1.922 1.00 0.00 H new ATOM 0 HH TYR A 115 207.156 8.160 -2.295 1.00 0.00 H new ATOM 1736 N LEU A 116 204.363 0.887 1.012 1.00 0.00 N ATOM 1737 CA LEU A 116 203.035 0.772 1.630 1.00 0.00 C ATOM 1738 C LEU A 116 203.143 0.754 3.156 1.00 0.00 C ATOM 1739 O LEU A 116 202.324 1.362 3.848 1.00 0.00 O ATOM 1740 CB LEU A 116 202.318 -0.493 1.140 1.00 0.00 C ATOM 1741 CG LEU A 116 201.769 -0.435 -0.292 1.00 0.00 C ATOM 1742 CD1 LEU A 116 201.685 -1.833 -0.883 1.00 0.00 C ATOM 1743 CD2 LEU A 116 200.398 0.231 -0.322 1.00 0.00 C ATOM 0 H LEU A 116 204.660 0.051 0.509 1.00 0.00 H new ATOM 0 HA LEU A 116 202.452 1.644 1.334 1.00 0.00 H new ATOM 0 HB2 LEU A 116 203.011 -1.331 1.210 1.00 0.00 H new ATOM 0 HB3 LEU A 116 201.491 -0.705 1.818 1.00 0.00 H new ATOM 0 HG LEU A 116 202.454 0.162 -0.894 1.00 0.00 H new ATOM 0 HD11 LEU A 116 201.294 -1.776 -1.899 1.00 0.00 H new ATOM 0 HD12 LEU A 116 202.679 -2.281 -0.901 1.00 0.00 H new ATOM 0 HD13 LEU A 116 201.022 -2.447 -0.273 1.00 0.00 H new ATOM 0 HD21 LEU A 116 200.030 0.260 -1.348 1.00 0.00 H new ATOM 0 HD22 LEU A 116 199.704 -0.338 0.297 1.00 0.00 H new ATOM 0 HD23 LEU A 116 200.479 1.247 0.064 1.00 0.00 H new ATOM 1755 N LYS A 117 204.185 0.074 3.666 1.00 0.00 N ATOM 1756 CA LYS A 117 204.435 -0.023 5.113 1.00 0.00 C ATOM 1757 C LYS A 117 204.845 1.330 5.699 1.00 0.00 C ATOM 1758 O LYS A 117 204.447 1.673 6.817 1.00 0.00 O ATOM 1759 CB LYS A 117 205.520 -1.066 5.404 1.00 0.00 C ATOM 1760 CG LYS A 117 205.038 -2.505 5.289 1.00 0.00 C ATOM 1761 CD LYS A 117 206.139 -3.490 5.654 1.00 0.00 C ATOM 1762 CE LYS A 117 205.642 -4.930 5.626 1.00 0.00 C ATOM 1763 NZ LYS A 117 204.763 -5.246 6.788 1.00 0.00 N1+ ATOM 0 H LYS A 117 204.870 -0.419 3.093 1.00 0.00 H new ATOM 0 HA LYS A 117 203.504 -0.334 5.587 1.00 0.00 H new ATOM 0 HB2 LYS A 117 206.350 -0.915 4.714 1.00 0.00 H new ATOM 0 HB3 LYS A 117 205.908 -0.902 6.410 1.00 0.00 H new ATOM 0 HG2 LYS A 117 204.180 -2.656 5.944 1.00 0.00 H new ATOM 0 HG3 LYS A 117 204.699 -2.697 4.271 1.00 0.00 H new ATOM 0 HD2 LYS A 117 206.971 -3.379 4.959 1.00 0.00 H new ATOM 0 HD3 LYS A 117 206.521 -3.257 6.648 1.00 0.00 H new ATOM 0 HE2 LYS A 117 205.094 -5.105 4.700 1.00 0.00 H new ATOM 0 HE3 LYS A 117 206.496 -5.607 5.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 204.477 -6.245 6.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 205.281 -5.072 7.673 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 203.917 -4.642 6.758 1.00 0.00 H new ATOM 1777 N ASP A 118 205.642 2.092 4.930 1.00 0.00 N ATOM 1778 CA ASP A 118 206.097 3.427 5.345 1.00 0.00 C ATOM 1779 C ASP A 118 204.938 4.430 5.373 1.00 0.00 C ATOM 1780 O ASP A 118 204.913 5.333 6.215 1.00 0.00 O ATOM 1781 CB ASP A 118 207.203 3.934 4.416 1.00 0.00 C ATOM 1782 CG ASP A 118 208.561 3.349 4.754 1.00 0.00 C ATOM 1783 OD1 ASP A 118 209.064 3.617 5.865 1.00 0.00 O ATOM 1784 OD2 ASP A 118 209.126 2.627 3.905 1.00 0.00 O1- ATOM 0 H ASP A 118 205.985 1.803 4.014 1.00 0.00 H new ATOM 0 HA ASP A 118 206.495 3.337 6.356 1.00 0.00 H new ATOM 0 HB2 ASP A 118 206.950 3.684 3.386 1.00 0.00 H new ATOM 0 HB3 ASP A 118 207.254 5.021 4.477 1.00 0.00 H new ATOM 1789 N LEU A 119 203.978 4.255 4.447 1.00 0.00 N ATOM 1790 CA LEU A 119 202.797 5.127 4.358 1.00 0.00 C ATOM 1791 C LEU A 119 201.827 4.892 5.522 1.00 0.00 C ATOM 1792 O LEU A 119 201.253 5.847 6.058 1.00 0.00 O ATOM 1793 CB LEU A 119 202.073 4.916 3.021 1.00 0.00 C ATOM 1794 CG LEU A 119 202.767 5.517 1.790 1.00 0.00 C ATOM 1795 CD1 LEU A 119 202.366 4.760 0.535 1.00 0.00 C ATOM 1796 CD2 LEU A 119 202.426 6.997 1.642 1.00 0.00 C ATOM 0 H LEU A 119 203.999 3.513 3.747 1.00 0.00 H new ATOM 0 HA LEU A 119 203.148 6.157 4.418 1.00 0.00 H new ATOM 0 HB2 LEU A 119 201.950 3.845 2.860 1.00 0.00 H new ATOM 0 HB3 LEU A 119 201.073 5.344 3.098 1.00 0.00 H new ATOM 0 HG LEU A 119 203.844 5.425 1.929 1.00 0.00 H new ATOM 0 HD11 LEU A 119 202.866 5.198 -0.329 1.00 0.00 H new ATOM 0 HD12 LEU A 119 202.658 3.714 0.632 1.00 0.00 H new ATOM 0 HD13 LEU A 119 201.286 4.824 0.401 1.00 0.00 H new ATOM 0 HD21 LEU A 119 202.929 7.400 0.763 1.00 0.00 H new ATOM 0 HD22 LEU A 119 201.348 7.112 1.528 1.00 0.00 H new ATOM 0 HD23 LEU A 119 202.757 7.537 2.529 1.00 0.00 H new ATOM 1808 N ILE A 120 201.663 3.616 5.914 1.00 0.00 N ATOM 1809 CA ILE A 120 200.772 3.246 7.031 1.00 0.00 C ATOM 1810 C ILE A 120 201.391 3.670 8.376 1.00 0.00 C ATOM 1811 O ILE A 120 200.671 4.040 9.306 1.00 0.00 O ATOM 1812 CB ILE A 120 200.444 1.710 7.049 1.00 0.00 C ATOM 1813 CG1 ILE A 120 199.983 1.187 5.656 1.00 0.00 C ATOM 1814 CG2 ILE A 120 199.398 1.368 8.120 1.00 0.00 C ATOM 1815 CD1 ILE A 120 198.800 1.916 5.017 1.00 0.00 C ATOM 0 H ILE A 120 202.134 2.825 5.476 1.00 0.00 H new ATOM 0 HA ILE A 120 199.833 3.779 6.880 1.00 0.00 H new ATOM 0 HB ILE A 120 201.375 1.202 7.301 1.00 0.00 H new ATOM 0 HG12 ILE A 120 200.830 1.243 4.972 1.00 0.00 H new ATOM 0 HG13 ILE A 120 199.723 0.133 5.755 1.00 0.00 H new ATOM 0 HG21 ILE A 120 199.196 0.297 8.103 1.00 0.00 H new ATOM 0 HG22 ILE A 120 199.777 1.650 9.102 1.00 0.00 H new ATOM 0 HG23 ILE A 120 198.477 1.914 7.916 1.00 0.00 H new ATOM 0 HD11 ILE A 120 198.572 1.463 4.052 1.00 0.00 H new ATOM 0 HD12 ILE A 120 197.930 1.839 5.669 1.00 0.00 H new ATOM 0 HD13 ILE A 120 199.054 2.966 4.874 1.00 0.00 H new ATOM 1827 N GLU A 121 202.731 3.612 8.457 1.00 0.00 N ATOM 1828 CA GLU A 121 203.467 4.000 9.670 1.00 0.00 C ATOM 1829 C GLU A 121 203.471 5.522 9.861 1.00 0.00 C ATOM 1830 O GLU A 121 203.440 6.009 10.996 1.00 0.00 O ATOM 1831 CB GLU A 121 204.909 3.480 9.615 1.00 0.00 C ATOM 1832 CG GLU A 121 205.028 1.978 9.821 1.00 0.00 C ATOM 1833 CD GLU A 121 206.464 1.495 9.757 1.00 0.00 C ATOM 1834 OE1 GLU A 121 207.128 1.463 10.815 1.00 0.00 O ATOM 1835 OE2 GLU A 121 206.925 1.146 8.649 1.00 0.00 O1- ATOM 0 H GLU A 121 203.328 3.298 7.692 1.00 0.00 H new ATOM 0 HA GLU A 121 202.956 3.550 10.521 1.00 0.00 H new ATOM 0 HB2 GLU A 121 205.343 3.740 8.649 1.00 0.00 H new ATOM 0 HB3 GLU A 121 205.498 3.990 10.377 1.00 0.00 H new ATOM 0 HG2 GLU A 121 204.601 1.712 10.788 1.00 0.00 H new ATOM 0 HG3 GLU A 121 204.441 1.463 9.061 1.00 0.00 H new ATOM 1842 N GLU A 122 203.496 6.259 8.738 1.00 0.00 N ATOM 1843 CA GLU A 122 203.492 7.729 8.758 1.00 0.00 C ATOM 1844 C GLU A 122 202.106 8.280 9.103 1.00 0.00 C ATOM 1845 O GLU A 122 201.996 9.309 9.777 1.00 0.00 O ATOM 1846 CB GLU A 122 203.954 8.288 7.408 1.00 0.00 C ATOM 1847 CG GLU A 122 205.454 8.184 7.183 1.00 0.00 C ATOM 1848 CD GLU A 122 205.883 8.751 5.843 1.00 0.00 C ATOM 1849 OE1 GLU A 122 205.916 7.983 4.858 1.00 0.00 O ATOM 1850 OE2 GLU A 122 206.186 9.961 5.779 1.00 0.00 O1- ATOM 0 H GLU A 122 203.519 5.857 7.801 1.00 0.00 H new ATOM 0 HA GLU A 122 204.189 8.048 9.533 1.00 0.00 H new ATOM 0 HB2 GLU A 122 203.438 7.756 6.609 1.00 0.00 H new ATOM 0 HB3 GLU A 122 203.657 9.334 7.337 1.00 0.00 H new ATOM 0 HG2 GLU A 122 205.975 8.713 7.981 1.00 0.00 H new ATOM 0 HG3 GLU A 122 205.755 7.138 7.244 1.00 0.00 H new ATOM 1857 N VAL A 123 201.056 7.584 8.640 1.00 0.00 N ATOM 1858 CA VAL A 123 199.669 7.985 8.916 1.00 0.00 C ATOM 1859 C VAL A 123 199.286 7.650 10.376 1.00 0.00 C ATOM 1860 O VAL A 123 198.521 8.385 11.006 1.00 0.00 O ATOM 1861 CB VAL A 123 198.675 7.340 7.888 1.00 0.00 C ATOM 1862 CG1 VAL A 123 198.494 5.837 8.102 1.00 0.00 C ATOM 1863 CG2 VAL A 123 197.325 8.054 7.902 1.00 0.00 C ATOM 0 H VAL A 123 201.142 6.741 8.073 1.00 0.00 H new ATOM 0 HA VAL A 123 199.594 9.066 8.795 1.00 0.00 H new ATOM 0 HB VAL A 123 199.126 7.468 6.904 1.00 0.00 H new ATOM 0 HG11 VAL A 123 197.796 5.446 7.362 1.00 0.00 H new ATOM 0 HG12 VAL A 123 199.456 5.336 7.994 1.00 0.00 H new ATOM 0 HG13 VAL A 123 198.101 5.657 9.103 1.00 0.00 H new ATOM 0 HG21 VAL A 123 196.658 7.584 7.179 1.00 0.00 H new ATOM 0 HG22 VAL A 123 196.887 7.986 8.898 1.00 0.00 H new ATOM 0 HG23 VAL A 123 197.465 9.102 7.639 1.00 0.00 H new ATOM 1873 N ARG A 124 199.833 6.532 10.889 1.00 0.00 N ATOM 1874 CA ARG A 124 199.591 6.091 12.271 1.00 0.00 C ATOM 1875 C ARG A 124 200.298 7.004 13.281 1.00 0.00 C ATOM 1876 O ARG A 124 199.759 7.287 14.354 1.00 0.00 O ATOM 1877 CB ARG A 124 200.056 4.644 12.464 1.00 0.00 C ATOM 1878 CG ARG A 124 199.100 3.612 11.884 1.00 0.00 C ATOM 1879 CD ARG A 124 199.617 2.196 12.091 1.00 0.00 C ATOM 1880 NE ARG A 124 198.704 1.191 11.535 1.00 0.00 N ATOM 1881 CZ ARG A 124 198.932 -0.131 11.536 1.00 0.00 C ATOM 1882 NH1 ARG A 124 200.047 -0.638 12.062 1.00 0.00 N1+ ATOM 1883 NH2 ARG A 124 198.034 -0.950 11.006 1.00 0.00 N ATOM 0 H ARG A 124 200.450 5.915 10.360 1.00 0.00 H new ATOM 0 HA ARG A 124 198.517 6.148 12.451 1.00 0.00 H new ATOM 0 HB2 ARG A 124 201.035 4.521 12.000 1.00 0.00 H new ATOM 0 HB3 ARG A 124 200.182 4.451 13.529 1.00 0.00 H new ATOM 0 HG2 ARG A 124 198.122 3.716 12.354 1.00 0.00 H new ATOM 0 HG3 ARG A 124 198.964 3.799 10.819 1.00 0.00 H new ATOM 0 HD2 ARG A 124 200.596 2.095 11.622 1.00 0.00 H new ATOM 0 HD3 ARG A 124 199.753 2.012 13.157 1.00 0.00 H new ATOM 0 HE ARG A 124 197.834 1.521 11.118 1.00 0.00 H new ATOM 0 HH11 ARG A 124 200.745 -0.018 12.473 1.00 0.00 H new ATOM 0 HH12 ARG A 124 200.202 -1.646 12.053 1.00 0.00 H new ATOM 0 HH21 ARG A 124 197.177 -0.574 10.601 1.00 0.00 H new ATOM 0 HH22 ARG A 124 198.200 -1.956 11.003 1.00 0.00 H new ATOM 1897 N LYS A 125 201.510 7.455 12.916 1.00 0.00 N ATOM 1898 CA LYS A 125 202.315 8.348 13.765 1.00 0.00 C ATOM 1899 C LYS A 125 201.760 9.778 13.777 1.00 0.00 C ATOM 1900 O LYS A 125 201.798 10.456 14.809 1.00 0.00 O ATOM 1901 CB LYS A 125 203.774 8.363 13.295 1.00 0.00 C ATOM 1902 CG LYS A 125 204.547 7.102 13.649 1.00 0.00 C ATOM 1903 CD LYS A 125 205.984 7.174 13.159 1.00 0.00 C ATOM 1904 CE LYS A 125 206.753 5.910 13.504 1.00 0.00 C ATOM 1905 NZ LYS A 125 208.163 5.969 13.030 1.00 0.00 N1+ ATOM 0 H LYS A 125 201.956 7.213 12.031 1.00 0.00 H new ATOM 0 HA LYS A 125 202.265 7.959 14.782 1.00 0.00 H new ATOM 0 HB2 LYS A 125 203.796 8.500 12.214 1.00 0.00 H new ATOM 0 HB3 LYS A 125 204.279 9.223 13.735 1.00 0.00 H new ATOM 0 HG2 LYS A 125 204.537 6.959 14.730 1.00 0.00 H new ATOM 0 HG3 LYS A 125 204.054 6.236 13.208 1.00 0.00 H new ATOM 0 HD2 LYS A 125 205.994 7.324 12.079 1.00 0.00 H new ATOM 0 HD3 LYS A 125 206.479 8.036 13.606 1.00 0.00 H new ATOM 0 HE2 LYS A 125 206.739 5.760 14.584 1.00 0.00 H new ATOM 0 HE3 LYS A 125 206.256 5.049 13.057 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 208.652 5.088 13.285 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 208.177 6.086 11.997 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 208.646 6.775 13.476 1.00 0.00 H new ATOM 1919 N ALA A 126 201.248 10.221 12.618 1.00 0.00 N ATOM 1920 CA ALA A 126 200.676 11.566 12.466 1.00 0.00 C ATOM 1921 C ALA A 126 199.287 11.679 13.113 1.00 0.00 C ATOM 1922 O ALA A 126 198.976 12.693 13.745 1.00 0.00 O ATOM 1923 CB ALA A 126 200.604 11.941 10.993 1.00 0.00 C ATOM 0 H ALA A 126 201.219 9.661 11.766 1.00 0.00 H new ATOM 0 HA ALA A 126 201.334 12.263 12.985 1.00 0.00 H new ATOM 0 HB1 ALA A 126 200.179 12.939 10.892 1.00 0.00 H new ATOM 0 HB2 ALA A 126 201.606 11.929 10.565 1.00 0.00 H new ATOM 0 HB3 ALA A 126 199.975 11.224 10.465 1.00 0.00 H new