USER MOD reduce.3.24.130724 H: found=0, std=0, add=705, rem=0, adj=18 USER MOD reduce.3.24.130724 removed 707 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 THR OG1 : rot -170:sc= -0.256 USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 THR OG1 : rot 180:sc= 0 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 38 MET CE :methyl -162:sc= -0.114 (180deg=-0.516) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 41 TYR OH : rot 30:sc= 1.24 USER MOD Single : A 48 ASN : amide:sc= -0.28 K(o=-0.28,f=-3.3!) USER MOD Single : A 49 HIS : no HD1:sc= -0.915 X(o=-0.92,f=-1.1) USER MOD Single : B 213 THR OG1 : rot -140:sc= -1.51! USER MOD Single : B 214 LYS NZ :NH3+ 160:sc= -0.899 (180deg=-1.58!) USER MOD Single : B 221 TYR OH : rot 180:sc= 0 USER MOD Single : B 229 LYS NZ :NH3+ 165:sc= -0.0202 (180deg=-0.249) USER MOD Single : B 230 SER OG : rot 180:sc= 0 USER MOD Single : B 235 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 236 THR OG1 : rot 180:sc= 0 USER MOD Single : B 237 SER OG : rot 180:sc= 0 USER MOD Single : B 238 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 239 SER OG : rot -150:sc= 0.814 USER MOD Single : B 241 TYR OH : rot 69:sc= 1.66 USER MOD Single : B 248 ASN : amide:sc= -0.778 K(o=-0.78,f=-5.7!) USER MOD Single : B 249 HIS : no HE2:sc= 0.0449 K(o=0.045,f=-0.59) USER MOD ----------------------------------------------------------------- ATOM 145 N LYS A 11 4.051 12.829 -9.853 1.00 32.42 N ATOM 146 CA LYS A 11 5.308 12.518 -10.558 1.00 50.12 C ATOM 147 C LYS A 11 6.369 11.942 -9.604 1.00 65.23 C ATOM 148 O LYS A 11 7.254 11.190 -10.013 1.00 71.43 O ATOM 149 CB LYS A 11 5.865 13.793 -11.209 1.00 50.35 C ATOM 150 CG LYS A 11 6.000 14.960 -10.231 1.00 42.41 C ATOM 151 CD LYS A 11 6.754 16.144 -10.831 1.00 32.02 C ATOM 152 CE LYS A 11 8.228 15.826 -11.060 1.00 35.03 C ATOM 153 NZ LYS A 11 8.972 16.992 -11.605 1.00 71.14 N ATOM 0 HA LYS A 11 5.084 11.768 -11.317 1.00 50.12 H new ATOM 0 HB2 LYS A 11 6.842 13.575 -11.642 1.00 50.35 H new ATOM 0 HB3 LYS A 11 5.212 14.089 -12.030 1.00 50.35 H new ATOM 0 HG2 LYS A 11 5.007 15.286 -9.920 1.00 42.41 H new ATOM 0 HG3 LYS A 11 6.519 14.620 -9.335 1.00 42.41 H new ATOM 0 HD2 LYS A 11 6.293 16.426 -11.778 1.00 32.02 H new ATOM 0 HD3 LYS A 11 6.668 17.003 -10.166 1.00 32.02 H new ATOM 0 HE2 LYS A 11 8.682 15.514 -10.119 1.00 35.03 H new ATOM 0 HE3 LYS A 11 8.315 14.986 -11.750 1.00 35.03 H new ATOM 0 HZ1 LYS A 11 9.969 16.733 -11.746 1.00 71.14 H new ATOM 0 HZ2 LYS A 11 8.556 17.274 -12.515 1.00 71.14 H new ATOM 0 HZ3 LYS A 11 8.912 17.786 -10.936 1.00 71.14 H new ATOM 167 N ASP A 12 6.255 12.308 -8.336 1.00 63.22 N ATOM 168 CA ASP A 12 7.265 12.008 -7.325 1.00 5.23 C ATOM 169 C ASP A 12 7.300 10.518 -6.926 1.00 55.24 C ATOM 170 O ASP A 12 8.370 9.906 -6.869 1.00 22.53 O ATOM 171 CB ASP A 12 6.983 12.871 -6.098 1.00 11.11 C ATOM 172 CG ASP A 12 6.847 14.342 -6.455 1.00 13.02 C ATOM 173 OD1 ASP A 12 5.730 14.773 -6.819 1.00 3.14 O ATOM 174 OD2 ASP A 12 7.851 15.071 -6.377 1.00 0.21 O ATOM 0 H ASP A 12 5.454 12.826 -7.974 1.00 63.22 H new ATOM 0 HA ASP A 12 8.244 12.231 -7.749 1.00 5.23 H new ATOM 0 HB2 ASP A 12 6.067 12.529 -5.617 1.00 11.11 H new ATOM 0 HB3 ASP A 12 7.789 12.747 -5.374 1.00 11.11 H new ATOM 179 N THR A 13 6.133 9.945 -6.643 1.00 71.45 N ATOM 180 CA THR A 13 6.044 8.561 -6.145 1.00 42.45 C ATOM 181 C THR A 13 6.312 7.525 -7.243 1.00 60.15 C ATOM 182 O THR A 13 6.118 7.789 -8.432 1.00 61.34 O ATOM 183 CB THR A 13 4.657 8.258 -5.527 1.00 61.14 C ATOM 184 OG1 THR A 13 3.623 8.431 -6.514 1.00 73.24 O ATOM 185 CG2 THR A 13 4.378 9.153 -4.319 1.00 64.10 C ATOM 0 H THR A 13 5.232 10.411 -6.748 1.00 71.45 H new ATOM 0 HA THR A 13 6.816 8.482 -5.380 1.00 42.45 H new ATOM 0 HB THR A 13 4.663 7.222 -5.188 1.00 61.14 H new ATOM 0 HG1 THR A 13 2.746 8.392 -6.079 1.00 73.24 H new ATOM 0 HG21 THR A 13 3.397 8.915 -3.909 1.00 64.10 H new ATOM 0 HG22 THR A 13 5.140 8.985 -3.558 1.00 64.10 H new ATOM 0 HG23 THR A 13 4.398 10.198 -4.628 1.00 64.10 H new ATOM 193 N LYS A 14 6.758 6.339 -6.828 1.00 31.15 N ATOM 194 CA LYS A 14 7.014 5.232 -7.755 1.00 0.11 C ATOM 195 C LYS A 14 5.876 4.193 -7.693 1.00 14.02 C ATOM 196 O LYS A 14 5.378 3.875 -6.609 1.00 43.21 O ATOM 197 CB LYS A 14 8.357 4.554 -7.428 1.00 65.30 C ATOM 198 CG LYS A 14 9.525 5.523 -7.244 1.00 25.51 C ATOM 199 CD LYS A 14 9.727 6.437 -8.454 1.00 41.45 C ATOM 200 CE LYS A 14 10.075 5.659 -9.720 1.00 53.10 C ATOM 201 NZ LYS A 14 10.254 6.560 -10.890 1.00 24.04 N ATOM 0 H LYS A 14 6.951 6.118 -5.851 1.00 31.15 H new ATOM 0 HA LYS A 14 7.060 5.642 -8.764 1.00 0.11 H new ATOM 0 HB2 LYS A 14 8.241 3.966 -6.517 1.00 65.30 H new ATOM 0 HB3 LYS A 14 8.602 3.856 -8.229 1.00 65.30 H new ATOM 0 HG2 LYS A 14 9.350 6.133 -6.358 1.00 25.51 H new ATOM 0 HG3 LYS A 14 10.438 4.956 -7.065 1.00 25.51 H new ATOM 0 HD2 LYS A 14 8.819 7.015 -8.624 1.00 41.45 H new ATOM 0 HD3 LYS A 14 10.523 7.150 -8.239 1.00 41.45 H new ATOM 0 HE2 LYS A 14 10.990 5.089 -9.557 1.00 53.10 H new ATOM 0 HE3 LYS A 14 9.285 4.939 -9.933 1.00 53.10 H new ATOM 0 HZ1 LYS A 14 10.489 5.995 -11.731 1.00 24.04 H new ATOM 0 HZ2 LYS A 14 9.373 7.085 -11.062 1.00 24.04 H new ATOM 0 HZ3 LYS A 14 11.025 7.231 -10.697 1.00 24.04 H new ATOM 215 N PRO A 15 5.447 3.655 -8.855 1.00 63.34 N ATOM 216 CA PRO A 15 4.343 2.677 -8.928 1.00 24.11 C ATOM 217 C PRO A 15 4.704 1.283 -8.370 1.00 55.13 C ATOM 218 O PRO A 15 5.745 0.711 -8.703 1.00 43.42 O ATOM 219 CB PRO A 15 4.035 2.587 -10.440 1.00 44.31 C ATOM 220 CG PRO A 15 4.782 3.721 -11.070 1.00 73.30 C ATOM 221 CD PRO A 15 5.976 3.964 -10.193 1.00 61.32 C ATOM 0 HA PRO A 15 3.500 2.999 -8.316 1.00 24.11 H new ATOM 0 HB2 PRO A 15 4.357 1.630 -10.850 1.00 44.31 H new ATOM 0 HB3 PRO A 15 2.965 2.670 -10.628 1.00 44.31 H new ATOM 0 HG2 PRO A 15 5.088 3.471 -12.086 1.00 73.30 H new ATOM 0 HG3 PRO A 15 4.157 4.612 -11.135 1.00 73.30 H new ATOM 0 HD2 PRO A 15 6.814 3.319 -10.458 1.00 61.32 H new ATOM 0 HD3 PRO A 15 6.330 4.992 -10.263 1.00 61.32 H new ATOM 229 N VAL A 16 3.822 0.744 -7.527 1.00 21.03 N ATOM 230 CA VAL A 16 3.965 -0.616 -6.991 1.00 63.24 C ATOM 231 C VAL A 16 2.589 -1.300 -6.869 1.00 23.45 C ATOM 232 O VAL A 16 1.645 -0.734 -6.317 1.00 75.22 O ATOM 233 CB VAL A 16 4.687 -0.621 -5.614 1.00 64.24 C ATOM 234 CG1 VAL A 16 3.980 0.295 -4.615 1.00 64.14 C ATOM 235 CG2 VAL A 16 4.806 -2.044 -5.061 1.00 52.23 C ATOM 0 H VAL A 16 2.991 1.233 -7.196 1.00 21.03 H new ATOM 0 HA VAL A 16 4.581 -1.177 -7.694 1.00 63.24 H new ATOM 0 HB VAL A 16 5.694 -0.233 -5.767 1.00 64.24 H new ATOM 0 HG11 VAL A 16 4.508 0.270 -3.662 1.00 64.14 H new ATOM 0 HG12 VAL A 16 3.972 1.315 -4.999 1.00 64.14 H new ATOM 0 HG13 VAL A 16 2.955 -0.046 -4.471 1.00 64.14 H new ATOM 0 HG21 VAL A 16 5.315 -2.019 -4.097 1.00 52.23 H new ATOM 0 HG22 VAL A 16 3.811 -2.470 -4.935 1.00 52.23 H new ATOM 0 HG23 VAL A 16 5.378 -2.658 -5.757 1.00 52.23 H new ATOM 245 N VAL A 17 2.475 -2.517 -7.400 1.00 23.13 N ATOM 246 CA VAL A 17 1.189 -3.226 -7.438 1.00 71.02 C ATOM 247 C VAL A 17 0.997 -4.141 -6.218 1.00 1.31 C ATOM 248 O VAL A 17 1.687 -5.153 -6.065 1.00 52.43 O ATOM 249 CB VAL A 17 1.055 -4.067 -8.731 1.00 1.01 C ATOM 250 CG1 VAL A 17 -0.327 -4.715 -8.823 1.00 64.44 C ATOM 251 CG2 VAL A 17 1.338 -3.206 -9.961 1.00 24.14 C ATOM 0 H VAL A 17 3.253 -3.034 -7.810 1.00 23.13 H new ATOM 0 HA VAL A 17 0.414 -2.460 -7.420 1.00 71.02 H new ATOM 0 HB VAL A 17 1.795 -4.867 -8.696 1.00 1.01 H new ATOM 0 HG11 VAL A 17 -0.394 -5.300 -9.740 1.00 64.44 H new ATOM 0 HG12 VAL A 17 -0.480 -5.368 -7.964 1.00 64.44 H new ATOM 0 HG13 VAL A 17 -1.093 -3.939 -8.830 1.00 64.44 H new ATOM 0 HG21 VAL A 17 1.239 -3.813 -10.861 1.00 24.14 H new ATOM 0 HG22 VAL A 17 0.626 -2.382 -10.000 1.00 24.14 H new ATOM 0 HG23 VAL A 17 2.351 -2.808 -9.901 1.00 24.14 H new ATOM 261 N VAL A 18 0.043 -3.789 -5.362 1.00 23.10 N ATOM 262 CA VAL A 18 -0.270 -4.583 -4.171 1.00 53.32 C ATOM 263 C VAL A 18 -1.537 -5.427 -4.389 1.00 71.12 C ATOM 264 O VAL A 18 -2.415 -5.061 -5.171 1.00 0.53 O ATOM 265 CB VAL A 18 -0.447 -3.680 -2.921 1.00 15.34 C ATOM 266 CG1 VAL A 18 -1.617 -2.712 -3.098 1.00 10.53 C ATOM 267 CG2 VAL A 18 -0.617 -4.523 -1.655 1.00 54.04 C ATOM 0 H VAL A 18 -0.532 -2.954 -5.469 1.00 23.10 H new ATOM 0 HA VAL A 18 0.573 -5.252 -3.997 1.00 53.32 H new ATOM 0 HB VAL A 18 0.460 -3.086 -2.809 1.00 15.34 H new ATOM 0 HG11 VAL A 18 -1.715 -2.093 -2.206 1.00 10.53 H new ATOM 0 HG12 VAL A 18 -1.434 -2.075 -3.963 1.00 10.53 H new ATOM 0 HG13 VAL A 18 -2.537 -3.277 -3.251 1.00 10.53 H new ATOM 0 HG21 VAL A 18 -0.739 -3.866 -0.794 1.00 54.04 H new ATOM 0 HG22 VAL A 18 -1.498 -5.157 -1.756 1.00 54.04 H new ATOM 0 HG23 VAL A 18 0.265 -5.148 -1.513 1.00 54.04 H new ATOM 277 N ARG A 19 -1.626 -6.563 -3.702 1.00 64.21 N ATOM 278 CA ARG A 19 -2.762 -7.479 -3.852 1.00 74.31 C ATOM 279 C ARG A 19 -3.596 -7.570 -2.559 1.00 74.54 C ATOM 280 O ARG A 19 -3.084 -7.951 -1.506 1.00 70.21 O ATOM 281 CB ARG A 19 -2.242 -8.867 -4.262 1.00 4.43 C ATOM 282 CG ARG A 19 -1.698 -8.922 -5.689 1.00 32.53 C ATOM 283 CD ARG A 19 -1.039 -10.264 -6.003 1.00 23.00 C ATOM 284 NE ARG A 19 0.246 -10.426 -5.315 1.00 74.24 N ATOM 285 CZ ARG A 19 0.789 -11.583 -5.044 1.00 14.24 C ATOM 286 NH1 ARG A 19 0.173 -12.681 -5.340 1.00 42.43 N ATOM 287 NH2 ARG A 19 1.952 -11.636 -4.475 1.00 62.00 N ATOM 0 H ARG A 19 -0.923 -6.875 -3.032 1.00 64.21 H new ATOM 0 HA ARG A 19 -3.420 -7.091 -4.629 1.00 74.31 H new ATOM 0 HB2 ARG A 19 -1.455 -9.169 -3.571 1.00 4.43 H new ATOM 0 HB3 ARG A 19 -3.050 -9.592 -4.162 1.00 4.43 H new ATOM 0 HG2 ARG A 19 -2.511 -8.745 -6.393 1.00 32.53 H new ATOM 0 HG3 ARG A 19 -0.973 -8.121 -5.831 1.00 32.53 H new ATOM 0 HD2 ARG A 19 -1.709 -11.073 -5.712 1.00 23.00 H new ATOM 0 HD3 ARG A 19 -0.886 -10.349 -7.079 1.00 23.00 H new ATOM 0 HE ARG A 19 0.746 -9.584 -5.031 1.00 74.24 H new ATOM 0 HH11 ARG A 19 -0.743 -12.647 -5.788 1.00 42.43 H new ATOM 0 HH12 ARG A 19 0.603 -13.581 -5.126 1.00 42.43 H new ATOM 0 HH21 ARG A 19 2.444 -10.774 -4.239 1.00 62.00 H new ATOM 0 HH22 ARG A 19 2.376 -12.539 -4.264 1.00 62.00 H new ATOM 301 N LEU A 20 -4.885 -7.220 -2.649 1.00 13.41 N ATOM 302 CA LEU A 20 -5.790 -7.247 -1.486 1.00 24.01 C ATOM 303 C LEU A 20 -7.059 -8.075 -1.780 1.00 34.10 C ATOM 304 O LEU A 20 -7.483 -8.187 -2.930 1.00 4.25 O ATOM 305 CB LEU A 20 -6.169 -5.809 -1.086 1.00 43.22 C ATOM 306 CG LEU A 20 -6.982 -5.672 0.216 1.00 3.44 C ATOM 307 CD1 LEU A 20 -6.193 -6.217 1.404 1.00 32.34 C ATOM 308 CD2 LEU A 20 -7.383 -4.214 0.452 1.00 42.11 C ATOM 0 H LEU A 20 -5.328 -6.914 -3.515 1.00 13.41 H new ATOM 0 HA LEU A 20 -5.267 -7.725 -0.658 1.00 24.01 H new ATOM 0 HB2 LEU A 20 -5.254 -5.226 -0.985 1.00 43.22 H new ATOM 0 HB3 LEU A 20 -6.742 -5.364 -1.899 1.00 43.22 H new ATOM 0 HG LEU A 20 -7.893 -6.262 0.114 1.00 3.44 H new ATOM 0 HD11 LEU A 20 -6.785 -6.111 2.313 1.00 32.34 H new ATOM 0 HD12 LEU A 20 -5.968 -7.271 1.239 1.00 32.34 H new ATOM 0 HD13 LEU A 20 -5.262 -5.659 1.509 1.00 32.34 H new ATOM 0 HD21 LEU A 20 -7.956 -4.139 1.376 1.00 42.11 H new ATOM 0 HD22 LEU A 20 -6.487 -3.598 0.530 1.00 42.11 H new ATOM 0 HD23 LEU A 20 -7.992 -3.865 -0.382 1.00 42.11 H new ATOM 320 N TYR A 21 -7.663 -8.648 -0.737 1.00 0.53 N ATOM 321 CA TYR A 21 -8.824 -9.541 -0.894 1.00 50.44 C ATOM 322 C TYR A 21 -10.116 -8.776 -1.247 1.00 22.43 C ATOM 323 O TYR A 21 -10.464 -7.794 -0.589 1.00 62.03 O ATOM 324 CB TYR A 21 -9.033 -10.350 0.393 1.00 61.24 C ATOM 325 CG TYR A 21 -7.887 -11.295 0.706 1.00 54.44 C ATOM 326 CD1 TYR A 21 -6.794 -10.876 1.457 1.00 3.30 C ATOM 327 CD2 TYR A 21 -7.899 -12.603 0.240 1.00 40.31 C ATOM 328 CE1 TYR A 21 -5.748 -11.735 1.735 1.00 64.22 C ATOM 329 CE2 TYR A 21 -6.858 -13.467 0.515 1.00 33.40 C ATOM 330 CZ TYR A 21 -5.787 -13.030 1.261 1.00 53.01 C ATOM 331 OH TYR A 21 -4.746 -13.892 1.535 1.00 45.14 O ATOM 0 H TYR A 21 -7.370 -8.512 0.230 1.00 0.53 H new ATOM 0 HA TYR A 21 -8.608 -10.210 -1.727 1.00 50.44 H new ATOM 0 HB2 TYR A 21 -9.165 -9.662 1.228 1.00 61.24 H new ATOM 0 HB3 TYR A 21 -9.955 -10.925 0.306 1.00 61.24 H new ATOM 0 HD1 TYR A 21 -6.762 -9.863 1.829 1.00 3.30 H new ATOM 0 HD2 TYR A 21 -8.736 -12.950 -0.347 1.00 40.31 H new ATOM 0 HE1 TYR A 21 -4.906 -11.395 2.319 1.00 64.22 H new ATOM 0 HE2 TYR A 21 -6.884 -14.482 0.146 1.00 33.40 H new ATOM 0 HH TYR A 21 -4.929 -14.765 1.130 1.00 45.14 H new ATOM 341 N PRO A 22 -10.859 -9.239 -2.281 1.00 52.33 N ATOM 342 CA PRO A 22 -12.114 -8.588 -2.728 1.00 25.41 C ATOM 343 C PRO A 22 -13.125 -8.375 -1.590 1.00 43.41 C ATOM 344 O PRO A 22 -13.698 -7.293 -1.447 1.00 64.30 O ATOM 345 CB PRO A 22 -12.675 -9.574 -3.763 1.00 43.14 C ATOM 346 CG PRO A 22 -11.483 -10.320 -4.264 1.00 43.13 C ATOM 347 CD PRO A 22 -10.537 -10.427 -3.098 1.00 41.04 C ATOM 0 HA PRO A 22 -11.926 -7.588 -3.118 1.00 25.41 H new ATOM 0 HB2 PRO A 22 -13.403 -10.248 -3.313 1.00 43.14 H new ATOM 0 HB3 PRO A 22 -13.183 -9.051 -4.573 1.00 43.14 H new ATOM 0 HG2 PRO A 22 -11.766 -11.308 -4.628 1.00 43.13 H new ATOM 0 HG3 PRO A 22 -11.016 -9.795 -5.097 1.00 43.13 H new ATOM 0 HD2 PRO A 22 -10.690 -11.351 -2.540 1.00 41.04 H new ATOM 0 HD3 PRO A 22 -9.497 -10.420 -3.423 1.00 41.04 H new ATOM 355 N ASP A 23 -13.318 -9.419 -0.778 1.00 70.12 N ATOM 356 CA ASP A 23 -14.236 -9.380 0.373 1.00 60.04 C ATOM 357 C ASP A 23 -14.009 -8.128 1.240 1.00 20.12 C ATOM 358 O ASP A 23 -14.950 -7.551 1.787 1.00 44.51 O ATOM 359 CB ASP A 23 -14.039 -10.655 1.209 1.00 22.31 C ATOM 360 CG ASP A 23 -14.918 -10.705 2.451 1.00 1.31 C ATOM 361 OD1 ASP A 23 -16.111 -11.061 2.333 1.00 15.34 O ATOM 362 OD2 ASP A 23 -14.415 -10.422 3.557 1.00 44.42 O ATOM 0 H ASP A 23 -12.845 -10.315 -0.897 1.00 70.12 H new ATOM 0 HA ASP A 23 -15.260 -9.331 0.002 1.00 60.04 H new ATOM 0 HB2 ASP A 23 -14.251 -11.525 0.587 1.00 22.31 H new ATOM 0 HB3 ASP A 23 -12.994 -10.726 1.510 1.00 22.31 H new ATOM 367 N GLU A 24 -12.751 -7.712 1.347 1.00 40.43 N ATOM 368 CA GLU A 24 -12.379 -6.549 2.157 1.00 3.40 C ATOM 369 C GLU A 24 -12.308 -5.262 1.311 1.00 62.31 C ATOM 370 O GLU A 24 -12.549 -4.164 1.815 1.00 0.32 O ATOM 371 CB GLU A 24 -11.041 -6.833 2.849 1.00 55.02 C ATOM 372 CG GLU A 24 -11.089 -8.085 3.725 1.00 61.13 C ATOM 373 CD GLU A 24 -9.736 -8.480 4.291 1.00 24.14 C ATOM 374 OE1 GLU A 24 -9.339 -7.923 5.335 1.00 73.23 O ATOM 375 OE2 GLU A 24 -9.077 -9.369 3.705 1.00 34.44 O ATOM 0 H GLU A 24 -11.965 -8.164 0.881 1.00 40.43 H new ATOM 0 HA GLU A 24 -13.149 -6.382 2.910 1.00 3.40 H new ATOM 0 HB2 GLU A 24 -10.263 -6.951 2.094 1.00 55.02 H new ATOM 0 HB3 GLU A 24 -10.763 -5.975 3.462 1.00 55.02 H new ATOM 0 HG2 GLU A 24 -11.783 -7.917 4.548 1.00 61.13 H new ATOM 0 HG3 GLU A 24 -11.485 -8.914 3.139 1.00 61.13 H new ATOM 382 N ILE A 25 -11.988 -5.402 0.023 1.00 33.31 N ATOM 383 CA ILE A 25 -11.971 -4.256 -0.902 1.00 54.12 C ATOM 384 C ILE A 25 -13.374 -3.644 -1.061 1.00 72.20 C ATOM 385 O ILE A 25 -13.524 -2.423 -1.154 1.00 41.54 O ATOM 386 CB ILE A 25 -11.419 -4.652 -2.299 1.00 32.14 C ATOM 387 CG1 ILE A 25 -9.954 -5.105 -2.186 1.00 65.52 C ATOM 388 CG2 ILE A 25 -11.546 -3.491 -3.289 1.00 2.41 C ATOM 389 CD1 ILE A 25 -9.332 -5.516 -3.506 1.00 61.11 C ATOM 0 H ILE A 25 -11.737 -6.292 -0.407 1.00 33.31 H new ATOM 0 HA ILE A 25 -11.306 -3.512 -0.463 1.00 54.12 H new ATOM 0 HB ILE A 25 -12.014 -5.483 -2.676 1.00 32.14 H new ATOM 0 HG12 ILE A 25 -9.366 -4.294 -1.756 1.00 65.52 H new ATOM 0 HG13 ILE A 25 -9.896 -5.944 -1.492 1.00 65.52 H new ATOM 0 HG21 ILE A 25 -11.152 -3.795 -4.259 1.00 2.41 H new ATOM 0 HG22 ILE A 25 -12.595 -3.215 -3.394 1.00 2.41 H new ATOM 0 HG23 ILE A 25 -10.981 -2.635 -2.920 1.00 2.41 H new ATOM 0 HD11 ILE A 25 -8.299 -5.822 -3.342 1.00 61.11 H new ATOM 0 HD12 ILE A 25 -9.894 -6.348 -3.929 1.00 61.11 H new ATOM 0 HD13 ILE A 25 -9.355 -4.674 -4.197 1.00 61.11 H new ATOM 401 N GLU A 26 -14.399 -4.500 -1.079 1.00 70.20 N ATOM 402 CA GLU A 26 -15.794 -4.046 -1.171 1.00 21.22 C ATOM 403 C GLU A 26 -16.130 -3.089 -0.012 1.00 33.31 C ATOM 404 O GLU A 26 -16.824 -2.089 -0.192 1.00 62.14 O ATOM 405 CB GLU A 26 -16.752 -5.253 -1.159 1.00 41.03 C ATOM 406 CG GLU A 26 -18.200 -4.892 -1.481 1.00 2.45 C ATOM 407 CD GLU A 26 -19.150 -6.074 -1.350 1.00 75.24 C ATOM 408 OE1 GLU A 26 -19.188 -6.930 -2.261 1.00 74.35 O ATOM 409 OE2 GLU A 26 -19.868 -6.156 -0.328 1.00 3.40 O ATOM 0 H GLU A 26 -14.291 -5.513 -1.031 1.00 70.20 H new ATOM 0 HA GLU A 26 -15.919 -3.508 -2.111 1.00 21.22 H new ATOM 0 HB2 GLU A 26 -16.402 -5.990 -1.881 1.00 41.03 H new ATOM 0 HB3 GLU A 26 -16.715 -5.725 -0.177 1.00 41.03 H new ATOM 0 HG2 GLU A 26 -18.527 -4.094 -0.814 1.00 2.45 H new ATOM 0 HG3 GLU A 26 -18.254 -4.500 -2.497 1.00 2.45 H new ATOM 416 N ALA A 27 -15.617 -3.400 1.177 1.00 54.02 N ATOM 417 CA ALA A 27 -15.781 -2.530 2.348 1.00 54.40 C ATOM 418 C ALA A 27 -14.835 -1.317 2.280 1.00 63.02 C ATOM 419 O ALA A 27 -15.181 -0.213 2.705 1.00 23.03 O ATOM 420 CB ALA A 27 -15.539 -3.321 3.628 1.00 52.13 C ATOM 0 H ALA A 27 -15.082 -4.249 1.359 1.00 54.02 H new ATOM 0 HA ALA A 27 -16.805 -2.155 2.350 1.00 54.40 H new ATOM 0 HB1 ALA A 27 -15.663 -2.665 4.490 1.00 52.13 H new ATOM 0 HB2 ALA A 27 -16.254 -4.141 3.690 1.00 52.13 H new ATOM 0 HB3 ALA A 27 -14.526 -3.723 3.621 1.00 52.13 H new ATOM 426 N LEU A 28 -13.641 -1.532 1.731 1.00 24.35 N ATOM 427 CA LEU A 28 -12.639 -0.466 1.586 1.00 24.13 C ATOM 428 C LEU A 28 -13.207 0.747 0.830 1.00 62.15 C ATOM 429 O LEU A 28 -12.971 1.895 1.206 1.00 51.43 O ATOM 430 CB LEU A 28 -11.401 -1.006 0.854 1.00 21.41 C ATOM 431 CG LEU A 28 -10.248 -0.001 0.671 1.00 23.55 C ATOM 432 CD1 LEU A 28 -9.684 0.437 2.025 1.00 4.42 C ATOM 433 CD2 LEU A 28 -9.150 -0.594 -0.211 1.00 11.34 C ATOM 0 H LEU A 28 -13.338 -2.439 1.376 1.00 24.35 H new ATOM 0 HA LEU A 28 -12.357 -0.135 2.586 1.00 24.13 H new ATOM 0 HB2 LEU A 28 -11.024 -1.869 1.403 1.00 21.41 H new ATOM 0 HB3 LEU A 28 -11.708 -1.363 -0.129 1.00 21.41 H new ATOM 0 HG LEU A 28 -10.645 0.883 0.172 1.00 23.55 H new ATOM 0 HD11 LEU A 28 -8.871 1.146 1.868 1.00 4.42 H new ATOM 0 HD12 LEU A 28 -10.471 0.911 2.611 1.00 4.42 H new ATOM 0 HD13 LEU A 28 -9.307 -0.434 2.561 1.00 4.42 H new ATOM 0 HD21 LEU A 28 -8.345 0.132 -0.328 1.00 11.34 H new ATOM 0 HD22 LEU A 28 -8.758 -1.498 0.254 1.00 11.34 H new ATOM 0 HD23 LEU A 28 -9.562 -0.839 -1.190 1.00 11.34 H new ATOM 445 N LYS A 29 -13.975 0.485 -0.226 1.00 63.24 N ATOM 446 CA LYS A 29 -14.577 1.555 -1.035 1.00 40.31 C ATOM 447 C LYS A 29 -15.843 2.150 -0.381 1.00 71.14 C ATOM 448 O LYS A 29 -16.620 2.850 -1.034 1.00 41.43 O ATOM 449 CB LYS A 29 -14.900 1.039 -2.444 1.00 24.11 C ATOM 450 CG LYS A 29 -15.815 -0.184 -2.469 1.00 24.42 C ATOM 451 CD LYS A 29 -16.118 -0.630 -3.896 1.00 63.41 C ATOM 452 CE LYS A 29 -14.849 -0.985 -4.665 1.00 14.01 C ATOM 453 NZ LYS A 29 -15.133 -1.265 -6.096 1.00 11.43 N ATOM 0 H LYS A 29 -14.198 -0.458 -0.545 1.00 63.24 H new ATOM 0 HA LYS A 29 -13.843 2.358 -1.101 1.00 40.31 H new ATOM 0 HB2 LYS A 29 -15.369 1.841 -3.014 1.00 24.11 H new ATOM 0 HB3 LYS A 29 -13.967 0.791 -2.951 1.00 24.11 H new ATOM 0 HG2 LYS A 29 -15.345 -1.002 -1.924 1.00 24.42 H new ATOM 0 HG3 LYS A 29 -16.747 0.048 -1.954 1.00 24.42 H new ATOM 0 HD2 LYS A 29 -16.782 -1.494 -3.873 1.00 63.41 H new ATOM 0 HD3 LYS A 29 -16.649 0.165 -4.419 1.00 63.41 H new ATOM 0 HE2 LYS A 29 -14.136 -0.164 -4.590 1.00 14.01 H new ATOM 0 HE3 LYS A 29 -14.380 -1.857 -4.210 1.00 14.01 H new ATOM 0 HZ1 LYS A 29 -14.247 -1.502 -6.586 1.00 11.43 H new ATOM 0 HZ2 LYS A 29 -15.794 -2.065 -6.169 1.00 11.43 H new ATOM 0 HZ3 LYS A 29 -15.558 -0.424 -6.537 1.00 11.43 H new ATOM 467 N SER A 30 -16.054 1.857 0.901 1.00 33.55 N ATOM 468 CA SER A 30 -17.139 2.484 1.677 1.00 61.20 C ATOM 469 C SER A 30 -16.577 3.568 2.606 1.00 42.43 C ATOM 470 O SER A 30 -17.149 4.648 2.749 1.00 64.24 O ATOM 471 CB SER A 30 -17.889 1.430 2.508 1.00 50.52 C ATOM 472 OG SER A 30 -18.911 2.023 3.300 1.00 65.13 O ATOM 0 H SER A 30 -15.492 1.190 1.430 1.00 33.55 H new ATOM 0 HA SER A 30 -17.836 2.942 0.975 1.00 61.20 H new ATOM 0 HB2 SER A 30 -18.328 0.686 1.843 1.00 50.52 H new ATOM 0 HB3 SER A 30 -17.185 0.905 3.154 1.00 50.52 H new ATOM 0 HG SER A 30 -19.370 1.328 3.815 1.00 65.13 H new ATOM 478 N ARG A 31 -15.437 3.262 3.217 1.00 20.13 N ATOM 479 CA ARG A 31 -14.759 4.172 4.156 1.00 31.01 C ATOM 480 C ARG A 31 -14.029 5.333 3.447 1.00 44.03 C ATOM 481 O ARG A 31 -13.749 6.363 4.063 1.00 3.12 O ATOM 482 CB ARG A 31 -13.759 3.365 4.996 1.00 41.12 C ATOM 483 CG ARG A 31 -12.821 2.508 4.150 1.00 43.13 C ATOM 484 CD ARG A 31 -11.992 1.545 4.988 1.00 65.24 C ATOM 485 NE ARG A 31 -10.997 2.235 5.800 1.00 24.04 N ATOM 486 CZ ARG A 31 -10.478 1.745 6.888 1.00 64.21 C ATOM 487 NH1 ARG A 31 -10.882 0.610 7.360 1.00 43.10 N ATOM 488 NH2 ARG A 31 -9.563 2.406 7.519 1.00 34.24 N ATOM 0 H ARG A 31 -14.950 2.376 3.080 1.00 20.13 H new ATOM 0 HA ARG A 31 -15.523 4.623 4.789 1.00 31.01 H new ATOM 0 HB2 ARG A 31 -13.167 4.050 5.603 1.00 41.12 H new ATOM 0 HB3 ARG A 31 -14.307 2.722 5.684 1.00 41.12 H new ATOM 0 HG2 ARG A 31 -13.406 1.942 3.426 1.00 43.13 H new ATOM 0 HG3 ARG A 31 -12.154 3.157 3.583 1.00 43.13 H new ATOM 0 HD2 ARG A 31 -12.653 0.970 5.637 1.00 65.24 H new ATOM 0 HD3 ARG A 31 -11.492 0.833 4.331 1.00 65.24 H new ATOM 0 HE ARG A 31 -10.689 3.159 5.497 1.00 24.04 H new ATOM 0 HH11 ARG A 31 -11.615 0.089 6.878 1.00 43.10 H new ATOM 0 HH12 ARG A 31 -10.468 0.236 8.214 1.00 43.10 H new ATOM 0 HH21 ARG A 31 -9.250 3.309 7.164 1.00 34.24 H new ATOM 0 HH22 ARG A 31 -9.155 2.024 8.372 1.00 34.24 H new ATOM 502 N VAL A 32 -13.707 5.165 2.165 1.00 33.21 N ATOM 503 CA VAL A 32 -12.976 6.200 1.414 1.00 23.12 C ATOM 504 C VAL A 32 -13.875 7.403 1.047 1.00 73.43 C ATOM 505 O VAL A 32 -15.010 7.228 0.595 1.00 25.52 O ATOM 506 CB VAL A 32 -12.332 5.624 0.124 1.00 2.23 C ATOM 507 CG1 VAL A 32 -11.308 4.544 0.467 1.00 5.31 C ATOM 508 CG2 VAL A 32 -13.394 5.076 -0.829 1.00 55.24 C ATOM 0 H VAL A 32 -13.936 4.332 1.623 1.00 33.21 H new ATOM 0 HA VAL A 32 -12.187 6.552 2.079 1.00 23.12 H new ATOM 0 HB VAL A 32 -11.816 6.440 -0.383 1.00 2.23 H new ATOM 0 HG11 VAL A 32 -10.869 4.154 -0.451 1.00 5.31 H new ATOM 0 HG12 VAL A 32 -10.523 4.972 1.091 1.00 5.31 H new ATOM 0 HG13 VAL A 32 -11.800 3.734 1.006 1.00 5.31 H new ATOM 0 HG21 VAL A 32 -12.911 4.680 -1.723 1.00 55.24 H new ATOM 0 HG22 VAL A 32 -13.951 4.280 -0.334 1.00 55.24 H new ATOM 0 HG23 VAL A 32 -14.078 5.877 -1.111 1.00 55.24 H new ATOM 518 N PRO A 33 -13.392 8.644 1.275 1.00 11.13 N ATOM 519 CA PRO A 33 -14.105 9.876 0.874 1.00 40.33 C ATOM 520 C PRO A 33 -14.071 10.135 -0.650 1.00 54.40 C ATOM 521 O PRO A 33 -13.474 9.373 -1.414 1.00 32.12 O ATOM 522 CB PRO A 33 -13.352 10.998 1.626 1.00 24.33 C ATOM 523 CG PRO A 33 -12.441 10.299 2.587 1.00 22.53 C ATOM 524 CD PRO A 33 -12.140 8.960 1.975 1.00 72.44 C ATOM 0 HA PRO A 33 -15.165 9.812 1.118 1.00 40.33 H new ATOM 0 HB2 PRO A 33 -12.787 11.622 0.934 1.00 24.33 H new ATOM 0 HB3 PRO A 33 -14.047 11.653 2.151 1.00 24.33 H new ATOM 0 HG2 PRO A 33 -11.526 10.871 2.743 1.00 22.53 H new ATOM 0 HG3 PRO A 33 -12.916 10.185 3.561 1.00 22.53 H new ATOM 0 HD2 PRO A 33 -11.293 9.007 1.291 1.00 72.44 H new ATOM 0 HD3 PRO A 33 -11.898 8.213 2.731 1.00 72.44 H new ATOM 532 N ALA A 34 -14.709 11.229 -1.078 1.00 75.32 N ATOM 533 CA ALA A 34 -14.755 11.606 -2.501 1.00 2.04 C ATOM 534 C ALA A 34 -13.363 11.982 -3.032 1.00 55.52 C ATOM 535 O ALA A 34 -12.933 11.501 -4.083 1.00 33.02 O ATOM 536 CB ALA A 34 -15.731 12.761 -2.709 1.00 43.43 C ATOM 0 H ALA A 34 -15.203 11.873 -0.460 1.00 75.32 H new ATOM 0 HA ALA A 34 -15.101 10.739 -3.064 1.00 2.04 H new ATOM 0 HB1 ALA A 34 -15.756 13.030 -3.765 1.00 43.43 H new ATOM 0 HB2 ALA A 34 -16.728 12.458 -2.388 1.00 43.43 H new ATOM 0 HB3 ALA A 34 -15.407 13.621 -2.123 1.00 43.43 H new ATOM 542 N ASN A 35 -12.665 12.851 -2.302 1.00 63.14 N ATOM 543 CA ASN A 35 -11.302 13.243 -2.670 1.00 62.13 C ATOM 544 C ASN A 35 -10.326 12.063 -2.519 1.00 20.32 C ATOM 545 O ASN A 35 -9.861 11.498 -3.510 1.00 62.32 O ATOM 546 CB ASN A 35 -10.835 14.439 -1.829 1.00 5.12 C ATOM 547 CG ASN A 35 -11.570 15.719 -2.192 1.00 24.43 C ATOM 548 OD1 ASN A 35 -11.150 16.460 -3.074 1.00 73.32 O ATOM 549 ND2 ASN A 35 -12.670 15.993 -1.520 1.00 1.21 N ATOM 0 H ASN A 35 -13.018 13.297 -1.455 1.00 63.14 H new ATOM 0 HA ASN A 35 -11.312 13.541 -3.718 1.00 62.13 H new ATOM 0 HB2 ASN A 35 -10.990 14.220 -0.772 1.00 5.12 H new ATOM 0 HB3 ASN A 35 -9.764 14.584 -1.971 1.00 5.12 H new ATOM 0 HD21 ASN A 35 -13.197 16.841 -1.728 1.00 1.21 H new ATOM 0 HD22 ASN A 35 -12.994 15.357 -0.792 1.00 1.21 H new ATOM 556 N THR A 36 -10.035 11.680 -1.278 1.00 54.52 N ATOM 557 CA THR A 36 -9.139 10.548 -1.009 1.00 32.23 C ATOM 558 C THR A 36 -9.801 9.213 -1.391 1.00 71.14 C ATOM 559 O THR A 36 -10.441 8.567 -0.564 1.00 61.43 O ATOM 560 CB THR A 36 -8.718 10.503 0.485 1.00 31.30 C ATOM 561 OG1 THR A 36 -8.196 11.777 0.890 1.00 22.35 O ATOM 562 CG2 THR A 36 -7.664 9.427 0.733 1.00 13.23 C ATOM 0 H THR A 36 -10.403 12.133 -0.442 1.00 54.52 H new ATOM 0 HA THR A 36 -8.250 10.694 -1.622 1.00 32.23 H new ATOM 0 HB THR A 36 -9.605 10.263 1.071 1.00 31.30 H new ATOM 0 HG1 THR A 36 -7.935 11.739 1.834 1.00 22.35 H new ATOM 0 HG21 THR A 36 -7.391 9.422 1.788 1.00 13.23 H new ATOM 0 HG22 THR A 36 -8.067 8.452 0.457 1.00 13.23 H new ATOM 0 HG23 THR A 36 -6.780 9.638 0.131 1.00 13.23 H new ATOM 570 N SER A 37 -9.665 8.822 -2.660 1.00 20.01 N ATOM 571 CA SER A 37 -10.264 7.573 -3.160 1.00 12.44 C ATOM 572 C SER A 37 -9.432 6.342 -2.764 1.00 62.13 C ATOM 573 O SER A 37 -8.447 6.457 -2.040 1.00 20.45 O ATOM 574 CB SER A 37 -10.427 7.634 -4.685 1.00 65.01 C ATOM 575 OG SER A 37 -11.301 8.688 -5.074 1.00 62.05 O ATOM 0 H SER A 37 -9.147 9.349 -3.363 1.00 20.01 H new ATOM 0 HA SER A 37 -11.246 7.471 -2.697 1.00 12.44 H new ATOM 0 HB2 SER A 37 -9.452 7.778 -5.151 1.00 65.01 H new ATOM 0 HB3 SER A 37 -10.817 6.683 -5.049 1.00 65.01 H new ATOM 0 HG SER A 37 -11.383 8.702 -6.050 1.00 62.05 H new ATOM 581 N MET A 38 -9.833 5.166 -3.257 1.00 42.12 N ATOM 582 CA MET A 38 -9.221 3.887 -2.855 1.00 45.43 C ATOM 583 C MET A 38 -7.680 3.880 -2.959 1.00 24.32 C ATOM 584 O MET A 38 -6.987 3.671 -1.960 1.00 52.52 O ATOM 585 CB MET A 38 -9.805 2.744 -3.696 1.00 4.34 C ATOM 586 CG MET A 38 -11.303 2.538 -3.500 1.00 63.51 C ATOM 587 SD MET A 38 -11.959 1.194 -4.507 1.00 3.11 S ATOM 588 CE MET A 38 -11.705 1.844 -6.161 1.00 25.25 C ATOM 0 H MET A 38 -10.584 5.069 -3.940 1.00 42.12 H new ATOM 0 HA MET A 38 -9.461 3.746 -1.801 1.00 45.43 H new ATOM 0 HB2 MET A 38 -9.610 2.945 -4.750 1.00 4.34 H new ATOM 0 HB3 MET A 38 -9.285 1.819 -3.446 1.00 4.34 H new ATOM 0 HG2 MET A 38 -11.502 2.329 -2.449 1.00 63.51 H new ATOM 0 HG3 MET A 38 -11.828 3.461 -3.747 1.00 63.51 H new ATOM 0 HE1 MET A 38 -12.331 1.298 -6.867 1.00 25.25 H new ATOM 0 HE2 MET A 38 -11.972 2.901 -6.182 1.00 25.25 H new ATOM 0 HE3 MET A 38 -10.658 1.729 -6.440 1.00 25.25 H new ATOM 598 N SER A 39 -7.147 4.103 -4.161 1.00 51.33 N ATOM 599 CA SER A 39 -5.688 4.053 -4.384 1.00 41.43 C ATOM 600 C SER A 39 -4.945 5.118 -3.560 1.00 51.24 C ATOM 601 O SER A 39 -3.900 4.841 -2.967 1.00 13.04 O ATOM 602 CB SER A 39 -5.359 4.215 -5.877 1.00 2.15 C ATOM 603 OG SER A 39 -5.865 5.433 -6.395 1.00 43.04 O ATOM 0 H SER A 39 -7.693 4.319 -4.995 1.00 51.33 H new ATOM 0 HA SER A 39 -5.346 3.074 -4.049 1.00 41.43 H new ATOM 0 HB2 SER A 39 -4.279 4.180 -6.018 1.00 2.15 H new ATOM 0 HB3 SER A 39 -5.780 3.379 -6.435 1.00 2.15 H new ATOM 0 HG SER A 39 -5.637 5.504 -7.345 1.00 43.04 H new ATOM 609 N ALA A 40 -5.487 6.335 -3.522 1.00 72.44 N ATOM 610 CA ALA A 40 -4.917 7.409 -2.696 1.00 33.53 C ATOM 611 C ALA A 40 -5.005 7.071 -1.197 1.00 22.44 C ATOM 612 O ALA A 40 -4.143 7.457 -0.404 1.00 22.44 O ATOM 613 CB ALA A 40 -5.622 8.730 -2.986 1.00 61.35 C ATOM 0 H ALA A 40 -6.317 6.605 -4.050 1.00 72.44 H new ATOM 0 HA ALA A 40 -3.862 7.507 -2.954 1.00 33.53 H new ATOM 0 HB1 ALA A 40 -5.190 9.517 -2.367 1.00 61.35 H new ATOM 0 HB2 ALA A 40 -5.497 8.986 -4.038 1.00 61.35 H new ATOM 0 HB3 ALA A 40 -6.684 8.633 -2.760 1.00 61.35 H new ATOM 619 N TYR A 41 -6.049 6.335 -0.823 1.00 34.00 N ATOM 620 CA TYR A 41 -6.271 5.937 0.569 1.00 21.34 C ATOM 621 C TYR A 41 -5.219 4.914 1.018 1.00 32.11 C ATOM 622 O TYR A 41 -4.679 5.006 2.117 1.00 10.03 O ATOM 623 CB TYR A 41 -7.684 5.365 0.728 1.00 22.44 C ATOM 624 CG TYR A 41 -8.122 5.171 2.167 1.00 4.32 C ATOM 625 CD1 TYR A 41 -8.383 6.267 2.984 1.00 41.30 C ATOM 626 CD2 TYR A 41 -8.283 3.899 2.706 1.00 70.01 C ATOM 627 CE1 TYR A 41 -8.791 6.100 4.294 1.00 14.24 C ATOM 628 CE2 TYR A 41 -8.694 3.726 4.013 1.00 71.45 C ATOM 629 CZ TYR A 41 -8.947 4.827 4.802 1.00 1.12 C ATOM 630 OH TYR A 41 -9.360 4.654 6.105 1.00 12.13 O ATOM 0 H TYR A 41 -6.762 5.998 -1.470 1.00 34.00 H new ATOM 0 HA TYR A 41 -6.174 6.818 1.204 1.00 21.34 H new ATOM 0 HB2 TYR A 41 -8.390 6.031 0.232 1.00 22.44 H new ATOM 0 HB3 TYR A 41 -7.735 4.406 0.213 1.00 22.44 H new ATOM 0 HD1 TYR A 41 -8.265 7.265 2.588 1.00 41.30 H new ATOM 0 HD2 TYR A 41 -8.083 3.033 2.093 1.00 70.01 H new ATOM 0 HE1 TYR A 41 -8.986 6.961 4.916 1.00 14.24 H new ATOM 0 HE2 TYR A 41 -8.817 2.731 4.415 1.00 71.45 H new ATOM 0 HH TYR A 41 -9.931 5.405 6.370 1.00 12.13 H new ATOM 640 N ILE A 42 -4.926 3.943 0.157 1.00 34.52 N ATOM 641 CA ILE A 42 -3.852 2.979 0.426 1.00 64.11 C ATOM 642 C ILE A 42 -2.494 3.698 0.533 1.00 44.34 C ATOM 643 O ILE A 42 -1.625 3.309 1.315 1.00 62.13 O ATOM 644 CB ILE A 42 -3.778 1.893 -0.681 1.00 65.11 C ATOM 645 CG1 ILE A 42 -5.121 1.145 -0.791 1.00 41.20 C ATOM 646 CG2 ILE A 42 -2.635 0.913 -0.412 1.00 60.15 C ATOM 647 CD1 ILE A 42 -5.526 0.423 0.478 1.00 52.24 C ATOM 0 H ILE A 42 -5.411 3.799 -0.729 1.00 34.52 H new ATOM 0 HA ILE A 42 -4.079 2.493 1.375 1.00 64.11 H new ATOM 0 HB ILE A 42 -3.578 2.389 -1.631 1.00 65.11 H new ATOM 0 HG12 ILE A 42 -5.902 1.857 -1.057 1.00 41.20 H new ATOM 0 HG13 ILE A 42 -5.058 0.422 -1.604 1.00 41.20 H new ATOM 0 HG21 ILE A 42 -2.605 0.163 -1.202 1.00 60.15 H new ATOM 0 HG22 ILE A 42 -1.689 1.454 -0.390 1.00 60.15 H new ATOM 0 HG23 ILE A 42 -2.795 0.423 0.548 1.00 60.15 H new ATOM 0 HD11 ILE A 42 -6.481 -0.079 0.322 1.00 52.24 H new ATOM 0 HD12 ILE A 42 -4.766 -0.315 0.735 1.00 52.24 H new ATOM 0 HD13 ILE A 42 -5.623 1.143 1.291 1.00 52.24 H new ATOM 659 N ARG A 43 -2.337 4.766 -0.251 1.00 62.45 N ATOM 660 CA ARG A 43 -1.103 5.561 -0.255 1.00 30.53 C ATOM 661 C ARG A 43 -0.827 6.190 1.125 1.00 41.11 C ATOM 662 O ARG A 43 0.292 6.121 1.636 1.00 22.12 O ATOM 663 CB ARG A 43 -1.186 6.650 -1.338 1.00 64.04 C ATOM 664 CG ARG A 43 0.120 7.410 -1.554 1.00 54.22 C ATOM 665 CD ARG A 43 0.007 8.411 -2.702 1.00 71.44 C ATOM 666 NE ARG A 43 -0.928 9.493 -2.398 1.00 0.40 N ATOM 667 CZ ARG A 43 -1.660 10.115 -3.286 1.00 73.12 C ATOM 668 NH1 ARG A 43 -1.645 9.757 -4.532 1.00 41.02 N ATOM 669 NH2 ARG A 43 -2.415 11.093 -2.916 1.00 14.44 N ATOM 0 H ARG A 43 -3.052 5.103 -0.895 1.00 62.45 H new ATOM 0 HA ARG A 43 -0.271 4.893 -0.480 1.00 30.53 H new ATOM 0 HB2 ARG A 43 -1.487 6.190 -2.279 1.00 64.04 H new ATOM 0 HB3 ARG A 43 -1.967 7.360 -1.066 1.00 64.04 H new ATOM 0 HG2 ARG A 43 0.391 7.935 -0.638 1.00 54.22 H new ATOM 0 HG3 ARG A 43 0.922 6.703 -1.765 1.00 54.22 H new ATOM 0 HD2 ARG A 43 0.990 8.831 -2.914 1.00 71.44 H new ATOM 0 HD3 ARG A 43 -0.320 7.893 -3.604 1.00 71.44 H new ATOM 0 HE ARG A 43 -1.016 9.784 -1.424 1.00 0.40 H new ATOM 0 HH11 ARG A 43 -1.056 8.980 -4.832 1.00 41.02 H new ATOM 0 HH12 ARG A 43 -2.222 10.252 -5.212 1.00 41.02 H new ATOM 0 HH21 ARG A 43 -2.439 11.377 -1.937 1.00 14.44 H new ATOM 0 HH22 ARG A 43 -2.988 11.583 -3.603 1.00 14.44 H new ATOM 683 N ARG A 44 -1.850 6.799 1.730 1.00 73.40 N ATOM 684 CA ARG A 44 -1.708 7.385 3.071 1.00 13.34 C ATOM 685 C ARG A 44 -1.548 6.299 4.154 1.00 51.33 C ATOM 686 O ARG A 44 -0.911 6.531 5.184 1.00 40.43 O ATOM 687 CB ARG A 44 -2.896 8.305 3.409 1.00 43.42 C ATOM 688 CG ARG A 44 -4.265 7.660 3.214 1.00 55.31 C ATOM 689 CD ARG A 44 -5.392 8.498 3.812 1.00 42.24 C ATOM 690 NE ARG A 44 -5.421 8.415 5.274 1.00 44.33 N ATOM 691 CZ ARG A 44 -6.169 9.160 6.044 1.00 74.12 C ATOM 692 NH1 ARG A 44 -6.885 10.116 5.546 1.00 24.44 N ATOM 693 NH2 ARG A 44 -6.181 8.958 7.319 1.00 25.53 N ATOM 0 H ARG A 44 -2.778 6.900 1.320 1.00 73.40 H new ATOM 0 HA ARG A 44 -0.799 7.986 3.059 1.00 13.34 H new ATOM 0 HB2 ARG A 44 -2.805 8.630 4.445 1.00 43.42 H new ATOM 0 HB3 ARG A 44 -2.837 9.199 2.788 1.00 43.42 H new ATOM 0 HG2 ARG A 44 -4.448 7.517 2.149 1.00 55.31 H new ATOM 0 HG3 ARG A 44 -4.267 6.672 3.674 1.00 55.31 H new ATOM 0 HD2 ARG A 44 -5.270 9.538 3.510 1.00 42.24 H new ATOM 0 HD3 ARG A 44 -6.347 8.160 3.411 1.00 42.24 H new ATOM 0 HE ARG A 44 -4.815 7.728 5.722 1.00 44.33 H new ATOM 0 HH11 ARG A 44 -6.870 10.295 4.542 1.00 24.44 H new ATOM 0 HH12 ARG A 44 -7.465 10.691 6.158 1.00 24.44 H new ATOM 0 HH21 ARG A 44 -5.607 8.218 7.724 1.00 25.53 H new ATOM 0 HH22 ARG A 44 -6.764 9.538 7.922 1.00 25.53 H new ATOM 707 N ILE A 45 -2.130 5.116 3.926 1.00 11.14 N ATOM 708 CA ILE A 45 -1.977 3.992 4.863 1.00 32.21 C ATOM 709 C ILE A 45 -0.507 3.555 4.978 1.00 24.52 C ATOM 710 O ILE A 45 0.037 3.443 6.081 1.00 54.40 O ATOM 711 CB ILE A 45 -2.846 2.771 4.452 1.00 41.41 C ATOM 712 CG1 ILE A 45 -4.342 3.116 4.551 1.00 63.41 C ATOM 713 CG2 ILE A 45 -2.515 1.552 5.317 1.00 12.44 C ATOM 714 CD1 ILE A 45 -5.264 1.986 4.134 1.00 32.31 C ATOM 0 H ILE A 45 -2.706 4.911 3.110 1.00 11.14 H new ATOM 0 HA ILE A 45 -2.321 4.351 5.833 1.00 32.21 H new ATOM 0 HB ILE A 45 -2.618 2.523 3.415 1.00 41.41 H new ATOM 0 HG12 ILE A 45 -4.572 3.399 5.578 1.00 63.41 H new ATOM 0 HG13 ILE A 45 -4.546 3.987 3.927 1.00 63.41 H new ATOM 0 HG21 ILE A 45 -3.135 0.710 5.011 1.00 12.44 H new ATOM 0 HG22 ILE A 45 -1.464 1.292 5.193 1.00 12.44 H new ATOM 0 HG23 ILE A 45 -2.710 1.785 6.364 1.00 12.44 H new ATOM 0 HD11 ILE A 45 -6.301 2.307 4.232 1.00 32.31 H new ATOM 0 HD12 ILE A 45 -5.064 1.717 3.097 1.00 32.31 H new ATOM 0 HD13 ILE A 45 -5.091 1.120 4.773 1.00 32.31 H new ATOM 726 N ILE A 46 0.133 3.306 3.836 1.00 3.14 N ATOM 727 CA ILE A 46 1.548 2.921 3.823 1.00 4.34 C ATOM 728 C ILE A 46 2.455 4.094 4.242 1.00 72.41 C ATOM 729 O ILE A 46 3.448 3.895 4.939 1.00 62.04 O ATOM 730 CB ILE A 46 1.992 2.374 2.438 1.00 31.03 C ATOM 731 CG1 ILE A 46 1.741 3.412 1.329 1.00 75.40 C ATOM 732 CG2 ILE A 46 1.267 1.065 2.126 1.00 72.14 C ATOM 733 CD1 ILE A 46 2.151 2.947 -0.055 1.00 34.42 C ATOM 0 H ILE A 46 -0.299 3.363 2.914 1.00 3.14 H new ATOM 0 HA ILE A 46 1.656 2.118 4.552 1.00 4.34 H new ATOM 0 HB ILE A 46 3.063 2.177 2.476 1.00 31.03 H new ATOM 0 HG12 ILE A 46 0.681 3.666 1.317 1.00 75.40 H new ATOM 0 HG13 ILE A 46 2.285 4.325 1.570 1.00 75.40 H new ATOM 0 HG21 ILE A 46 1.588 0.694 1.153 1.00 72.14 H new ATOM 0 HG22 ILE A 46 1.504 0.326 2.892 1.00 72.14 H new ATOM 0 HG23 ILE A 46 0.191 1.240 2.111 1.00 72.14 H new ATOM 0 HD11 ILE A 46 1.942 3.734 -0.780 1.00 34.42 H new ATOM 0 HD12 ILE A 46 3.217 2.721 -0.062 1.00 34.42 H new ATOM 0 HD13 ILE A 46 1.588 2.052 -0.320 1.00 34.42 H new ATOM 745 N LEU A 47 2.091 5.315 3.840 1.00 51.30 N ATOM 746 CA LEU A 47 2.847 6.523 4.216 1.00 21.11 C ATOM 747 C LEU A 47 2.996 6.647 5.742 1.00 43.13 C ATOM 748 O LEU A 47 4.109 6.623 6.278 1.00 64.23 O ATOM 749 CB LEU A 47 2.153 7.776 3.655 1.00 31.23 C ATOM 750 CG LEU A 47 2.835 9.114 3.982 1.00 10.15 C ATOM 751 CD1 LEU A 47 4.243 9.154 3.400 1.00 61.42 C ATOM 752 CD2 LEU A 47 2.002 10.287 3.467 1.00 35.00 C ATOM 0 H LEU A 47 1.277 5.498 3.253 1.00 51.30 H new ATOM 0 HA LEU A 47 3.845 6.436 3.787 1.00 21.11 H new ATOM 0 HB2 LEU A 47 2.086 7.678 2.572 1.00 31.23 H new ATOM 0 HB3 LEU A 47 1.132 7.806 4.036 1.00 31.23 H new ATOM 0 HG LEU A 47 2.911 9.203 5.066 1.00 10.15 H new ATOM 0 HD11 LEU A 47 4.710 10.109 3.642 1.00 61.42 H new ATOM 0 HD12 LEU A 47 4.835 8.343 3.824 1.00 61.42 H new ATOM 0 HD13 LEU A 47 4.193 9.039 2.317 1.00 61.42 H new ATOM 0 HD21 LEU A 47 2.504 11.224 3.710 1.00 35.00 H new ATOM 0 HD22 LEU A 47 1.888 10.206 2.386 1.00 35.00 H new ATOM 0 HD23 LEU A 47 1.019 10.270 3.938 1.00 35.00 H new ATOM 764 N ASN A 48 1.866 6.758 6.439 1.00 60.31 N ATOM 765 CA ASN A 48 1.861 6.875 7.903 1.00 3.31 C ATOM 766 C ASN A 48 2.564 5.678 8.572 1.00 74.24 C ATOM 767 O ASN A 48 3.070 5.786 9.691 1.00 61.24 O ATOM 768 CB ASN A 48 0.419 6.998 8.414 1.00 2.52 C ATOM 769 CG ASN A 48 -0.273 8.259 7.914 1.00 3.14 C ATOM 770 OD1 ASN A 48 0.026 8.772 6.841 1.00 24.31 O ATOM 771 ND2 ASN A 48 -1.208 8.770 8.688 1.00 42.35 N ATOM 0 H ASN A 48 0.938 6.770 6.015 1.00 60.31 H new ATOM 0 HA ASN A 48 2.417 7.774 8.169 1.00 3.31 H new ATOM 0 HB2 ASN A 48 -0.151 6.125 8.096 1.00 2.52 H new ATOM 0 HB3 ASN A 48 0.422 6.997 9.504 1.00 2.52 H new ATOM 0 HD21 ASN A 48 -1.704 9.613 8.400 1.00 42.35 H new ATOM 0 HD22 ASN A 48 -1.436 8.322 9.576 1.00 42.35 H new ATOM 778 N HIS A 49 2.596 4.542 7.874 1.00 10.14 N ATOM 779 CA HIS A 49 3.254 3.332 8.380 1.00 32.51 C ATOM 780 C HIS A 49 4.786 3.432 8.235 1.00 25.24 C ATOM 781 O HIS A 49 5.532 3.041 9.136 1.00 53.24 O ATOM 782 CB HIS A 49 2.729 2.101 7.626 1.00 2.41 C ATOM 783 CG HIS A 49 3.120 0.786 8.239 1.00 5.31 C ATOM 784 ND1 HIS A 49 2.218 -0.046 8.857 1.00 44.43 N ATOM 785 CD2 HIS A 49 4.315 0.150 8.306 1.00 42.11 C ATOM 786 CE1 HIS A 49 2.833 -1.129 9.281 1.00 22.03 C ATOM 787 NE2 HIS A 49 4.107 -1.040 8.960 1.00 32.00 N ATOM 0 H HIS A 49 2.173 4.432 6.953 1.00 10.14 H new ATOM 0 HA HIS A 49 3.022 3.232 9.440 1.00 32.51 H new ATOM 0 HB2 HIS A 49 1.642 2.156 7.577 1.00 2.41 H new ATOM 0 HB3 HIS A 49 3.097 2.134 6.600 1.00 2.41 H new ATOM 0 HD2 HIS A 49 5.256 0.511 7.918 1.00 42.11 H new ATOM 0 HE1 HIS A 49 2.371 -1.953 9.804 1.00 22.03 H new ATOM 0 HE2 HIS A 49 4.821 -1.739 9.163 1.00 32.00 H new ATOM 796 N LEU A 50 5.247 3.956 7.098 1.00 12.53 N ATOM 797 CA LEU A 50 6.687 4.092 6.827 1.00 63.23 C ATOM 798 C LEU A 50 7.346 5.136 7.741 1.00 3.10 C ATOM 799 O LEU A 50 8.485 4.956 8.176 1.00 31.31 O ATOM 800 CB LEU A 50 6.932 4.443 5.345 1.00 33.44 C ATOM 801 CG LEU A 50 7.158 3.244 4.401 1.00 32.11 C ATOM 802 CD1 LEU A 50 8.457 2.521 4.749 1.00 72.24 C ATOM 803 CD2 LEU A 50 5.980 2.273 4.449 1.00 15.12 C ATOM 0 H LEU A 50 4.646 4.295 6.346 1.00 12.53 H new ATOM 0 HA LEU A 50 7.149 3.128 7.042 1.00 63.23 H new ATOM 0 HB2 LEU A 50 6.078 5.013 4.980 1.00 33.44 H new ATOM 0 HB3 LEU A 50 7.801 5.098 5.285 1.00 33.44 H new ATOM 0 HG LEU A 50 7.236 3.631 3.385 1.00 32.11 H new ATOM 0 HD11 LEU A 50 8.597 1.679 4.071 1.00 72.24 H new ATOM 0 HD12 LEU A 50 9.295 3.211 4.649 1.00 72.24 H new ATOM 0 HD13 LEU A 50 8.407 2.157 5.775 1.00 72.24 H new ATOM 0 HD21 LEU A 50 6.168 1.439 3.773 1.00 15.12 H new ATOM 0 HD22 LEU A 50 5.859 1.897 5.465 1.00 15.12 H new ATOM 0 HD23 LEU A 50 5.070 2.789 4.143 1.00 15.12 H new ATOM 815 N GLU A 51 6.634 6.225 8.032 1.00 53.15 N ATOM 816 CA GLU A 51 7.143 7.250 8.957 1.00 22.11 C ATOM 817 C GLU A 51 6.928 6.837 10.426 1.00 34.24 C ATOM 818 O GLU A 51 7.233 7.593 11.353 1.00 42.13 O ATOM 819 CB GLU A 51 6.485 8.610 8.675 1.00 51.02 C ATOM 820 CG GLU A 51 4.984 8.657 8.941 1.00 21.31 C ATOM 821 CD GLU A 51 4.382 10.018 8.610 1.00 2.24 C ATOM 822 OE1 GLU A 51 4.717 11.007 9.300 1.00 5.24 O ATOM 823 OE2 GLU A 51 3.592 10.115 7.649 1.00 0.44 O ATOM 0 H GLU A 51 5.711 6.424 7.647 1.00 53.15 H new ATOM 0 HA GLU A 51 8.216 7.344 8.791 1.00 22.11 H new ATOM 0 HB2 GLU A 51 6.973 9.369 9.287 1.00 51.02 H new ATOM 0 HB3 GLU A 51 6.665 8.877 7.633 1.00 51.02 H new ATOM 0 HG2 GLU A 51 4.488 7.888 8.348 1.00 21.31 H new ATOM 0 HG3 GLU A 51 4.795 8.423 9.989 1.00 21.31 H new ATOM 830 N ASP A 52 6.381 5.639 10.628 1.00 63.35 N ATOM 831 CA ASP A 52 6.262 5.046 11.963 1.00 11.14 C ATOM 832 C ASP A 52 7.451 4.105 12.227 1.00 13.03 C ATOM 833 O ASP A 52 8.183 4.265 13.204 1.00 73.34 O ATOM 834 CB ASP A 52 4.938 4.282 12.087 1.00 31.05 C ATOM 835 CG ASP A 52 4.756 3.640 13.454 1.00 4.04 C ATOM 836 OD1 ASP A 52 4.460 4.368 14.423 1.00 63.14 O ATOM 837 OD2 ASP A 52 4.898 2.401 13.561 1.00 10.44 O ATOM 0 H ASP A 52 6.010 5.055 9.879 1.00 63.35 H new ATOM 0 HA ASP A 52 6.273 5.842 12.707 1.00 11.14 H new ATOM 0 HB2 ASP A 52 4.110 4.965 11.898 1.00 31.05 H new ATOM 0 HB3 ASP A 52 4.896 3.510 11.319 1.00 31.05 H new ATOM 1022 N ASP B 212 -7.292 -14.895 -5.435 1.00 2.41 N ATOM 1023 CA ASP B 212 -7.719 -14.622 -4.060 1.00 32.32 C ATOM 1024 C ASP B 212 -7.675 -13.117 -3.761 1.00 43.32 C ATOM 1025 O ASP B 212 -8.364 -12.620 -2.868 1.00 15.31 O ATOM 1026 CB ASP B 212 -6.811 -15.377 -3.077 1.00 35.42 C ATOM 1027 CG ASP B 212 -5.363 -14.897 -3.117 1.00 52.34 C ATOM 1028 OD1 ASP B 212 -4.801 -14.767 -4.228 1.00 42.35 O ATOM 1029 OD2 ASP B 212 -4.776 -14.657 -2.039 1.00 32.25 O ATOM 0 HA ASP B 212 -8.747 -14.964 -3.943 1.00 32.32 H new ATOM 0 HB2 ASP B 212 -7.200 -15.258 -2.066 1.00 35.42 H new ATOM 0 HB3 ASP B 212 -6.842 -16.442 -3.307 1.00 35.42 H new ATOM 1034 N THR B 213 -6.855 -12.402 -4.525 1.00 4.42 N ATOM 1035 CA THR B 213 -6.638 -10.968 -4.324 1.00 63.11 C ATOM 1036 C THR B 213 -6.719 -10.183 -5.645 1.00 42.14 C ATOM 1037 O THR B 213 -6.287 -10.662 -6.698 1.00 24.44 O ATOM 1038 CB THR B 213 -5.257 -10.709 -3.672 1.00 52.24 C ATOM 1039 OG1 THR B 213 -4.216 -11.338 -4.442 1.00 42.42 O ATOM 1040 CG2 THR B 213 -5.211 -11.225 -2.233 1.00 61.40 C ATOM 0 H THR B 213 -6.322 -12.797 -5.300 1.00 4.42 H new ATOM 0 HA THR B 213 -7.432 -10.621 -3.663 1.00 63.11 H new ATOM 0 HB THR B 213 -5.099 -9.631 -3.655 1.00 52.24 H new ATOM 0 HG1 THR B 213 -3.555 -11.734 -3.836 1.00 42.42 H new ATOM 0 HG21 THR B 213 -4.228 -11.027 -1.807 1.00 61.40 H new ATOM 0 HG22 THR B 213 -5.973 -10.718 -1.640 1.00 61.40 H new ATOM 0 HG23 THR B 213 -5.400 -12.298 -2.225 1.00 61.40 H new ATOM 1048 N LYS B 214 -7.287 -8.975 -5.580 1.00 14.05 N ATOM 1049 CA LYS B 214 -7.354 -8.074 -6.738 1.00 41.32 C ATOM 1050 C LYS B 214 -6.123 -7.148 -6.780 1.00 24.32 C ATOM 1051 O LYS B 214 -5.955 -6.292 -5.907 1.00 35.21 O ATOM 1052 CB LYS B 214 -8.639 -7.225 -6.682 1.00 74.13 C ATOM 1053 CG LYS B 214 -9.933 -8.037 -6.726 1.00 43.21 C ATOM 1054 CD LYS B 214 -10.213 -8.635 -8.110 1.00 53.22 C ATOM 1055 CE LYS B 214 -10.966 -7.668 -9.031 1.00 63.13 C ATOM 1056 NZ LYS B 214 -10.182 -6.447 -9.366 1.00 3.53 N ATOM 0 H LYS B 214 -7.710 -8.595 -4.733 1.00 14.05 H new ATOM 0 HA LYS B 214 -7.366 -8.684 -7.641 1.00 41.32 H new ATOM 0 HB2 LYS B 214 -8.628 -6.631 -5.768 1.00 74.13 H new ATOM 0 HB3 LYS B 214 -8.635 -6.525 -7.518 1.00 74.13 H new ATOM 0 HG2 LYS B 214 -9.877 -8.841 -5.992 1.00 43.21 H new ATOM 0 HG3 LYS B 214 -10.767 -7.398 -6.436 1.00 43.21 H new ATOM 0 HD2 LYS B 214 -9.269 -8.915 -8.578 1.00 53.22 H new ATOM 0 HD3 LYS B 214 -10.796 -9.549 -7.995 1.00 53.22 H new ATOM 0 HE2 LYS B 214 -11.231 -8.186 -9.953 1.00 63.13 H new ATOM 0 HE3 LYS B 214 -11.899 -7.373 -8.552 1.00 63.13 H new ATOM 0 HZ1 LYS B 214 -10.571 -6.009 -10.225 1.00 3.53 H new ATOM 0 HZ2 LYS B 214 -10.238 -5.771 -8.577 1.00 3.53 H new ATOM 0 HZ3 LYS B 214 -9.188 -6.707 -9.529 1.00 3.53 H new ATOM 1070 N PRO B 215 -5.231 -7.322 -7.779 1.00 61.20 N ATOM 1071 CA PRO B 215 -4.044 -6.460 -7.946 1.00 4.13 C ATOM 1072 C PRO B 215 -4.401 -4.989 -8.237 1.00 31.41 C ATOM 1073 O PRO B 215 -5.040 -4.680 -9.247 1.00 73.42 O ATOM 1074 CB PRO B 215 -3.305 -7.085 -9.146 1.00 53.41 C ATOM 1075 CG PRO B 215 -3.857 -8.467 -9.266 1.00 21.35 C ATOM 1076 CD PRO B 215 -5.286 -8.376 -8.808 1.00 25.35 C ATOM 0 HA PRO B 215 -3.450 -6.423 -7.033 1.00 4.13 H new ATOM 0 HB2 PRO B 215 -3.477 -6.511 -10.057 1.00 53.41 H new ATOM 0 HB3 PRO B 215 -2.228 -7.104 -8.979 1.00 53.41 H new ATOM 0 HG2 PRO B 215 -3.797 -8.824 -10.294 1.00 21.35 H new ATOM 0 HG3 PRO B 215 -3.293 -9.169 -8.651 1.00 21.35 H new ATOM 0 HD2 PRO B 215 -5.957 -8.110 -9.625 1.00 25.35 H new ATOM 0 HD3 PRO B 215 -5.641 -9.322 -8.400 1.00 25.35 H new ATOM 1084 N VAL B 216 -3.990 -4.095 -7.338 1.00 45.24 N ATOM 1085 CA VAL B 216 -4.184 -2.648 -7.510 1.00 45.23 C ATOM 1086 C VAL B 216 -2.839 -1.900 -7.412 1.00 71.12 C ATOM 1087 O VAL B 216 -1.995 -2.221 -6.573 1.00 13.01 O ATOM 1088 CB VAL B 216 -5.182 -2.085 -6.459 1.00 34.15 C ATOM 1089 CG1 VAL B 216 -4.718 -2.384 -5.033 1.00 12.25 C ATOM 1090 CG2 VAL B 216 -5.405 -0.582 -6.657 1.00 42.03 C ATOM 0 H VAL B 216 -3.515 -4.348 -6.472 1.00 45.24 H new ATOM 0 HA VAL B 216 -4.604 -2.489 -8.503 1.00 45.23 H new ATOM 0 HB VAL B 216 -6.136 -2.590 -6.611 1.00 34.15 H new ATOM 0 HG11 VAL B 216 -5.438 -1.977 -4.323 1.00 12.25 H new ATOM 0 HG12 VAL B 216 -4.641 -3.462 -4.894 1.00 12.25 H new ATOM 0 HG13 VAL B 216 -3.743 -1.926 -4.864 1.00 12.25 H new ATOM 0 HG21 VAL B 216 -6.107 -0.217 -5.908 1.00 42.03 H new ATOM 0 HG22 VAL B 216 -4.456 -0.056 -6.552 1.00 42.03 H new ATOM 0 HG23 VAL B 216 -5.811 -0.402 -7.653 1.00 42.03 H new ATOM 1100 N VAL B 217 -2.635 -0.907 -8.277 1.00 75.24 N ATOM 1101 CA VAL B 217 -1.354 -0.187 -8.329 1.00 75.12 C ATOM 1102 C VAL B 217 -1.336 1.062 -7.426 1.00 64.23 C ATOM 1103 O VAL B 217 -1.929 2.098 -7.743 1.00 22.51 O ATOM 1104 CB VAL B 217 -0.973 0.195 -9.788 1.00 1.13 C ATOM 1105 CG1 VAL B 217 -2.067 1.025 -10.461 1.00 51.11 C ATOM 1106 CG2 VAL B 217 0.367 0.931 -9.821 1.00 23.21 C ATOM 0 H VAL B 217 -3.331 -0.582 -8.948 1.00 75.24 H new ATOM 0 HA VAL B 217 -0.604 -0.878 -7.943 1.00 75.12 H new ATOM 0 HB VAL B 217 -0.873 -0.731 -10.354 1.00 1.13 H new ATOM 0 HG11 VAL B 217 -1.763 1.272 -11.478 1.00 51.11 H new ATOM 0 HG12 VAL B 217 -2.994 0.452 -10.488 1.00 51.11 H new ATOM 0 HG13 VAL B 217 -2.225 1.944 -9.897 1.00 51.11 H new ATOM 0 HG21 VAL B 217 0.615 1.189 -10.851 1.00 23.21 H new ATOM 0 HG22 VAL B 217 0.297 1.841 -9.225 1.00 23.21 H new ATOM 0 HG23 VAL B 217 1.146 0.288 -9.411 1.00 23.21 H new ATOM 1116 N VAL B 218 -0.643 0.951 -6.296 1.00 34.02 N ATOM 1117 CA VAL B 218 -0.456 2.076 -5.371 1.00 74.32 C ATOM 1118 C VAL B 218 0.924 2.722 -5.607 1.00 14.21 C ATOM 1119 O VAL B 218 1.752 2.168 -6.326 1.00 61.35 O ATOM 1120 CB VAL B 218 -0.595 1.611 -3.892 1.00 63.04 C ATOM 1121 CG1 VAL B 218 0.528 0.647 -3.503 1.00 22.13 C ATOM 1122 CG2 VAL B 218 -0.657 2.806 -2.936 1.00 63.12 C ATOM 0 H VAL B 218 -0.196 0.086 -5.993 1.00 34.02 H new ATOM 0 HA VAL B 218 -1.233 2.816 -5.562 1.00 74.32 H new ATOM 0 HB VAL B 218 -1.537 1.070 -3.806 1.00 63.04 H new ATOM 0 HG11 VAL B 218 0.402 0.341 -2.464 1.00 22.13 H new ATOM 0 HG12 VAL B 218 0.492 -0.232 -4.147 1.00 22.13 H new ATOM 0 HG13 VAL B 218 1.491 1.144 -3.620 1.00 22.13 H new ATOM 0 HG21 VAL B 218 -0.754 2.447 -1.911 1.00 63.12 H new ATOM 0 HG22 VAL B 218 0.256 3.395 -3.030 1.00 63.12 H new ATOM 0 HG23 VAL B 218 -1.517 3.428 -3.186 1.00 63.12 H new ATOM 1132 N ARG B 219 1.173 3.897 -5.035 1.00 75.14 N ATOM 1133 CA ARG B 219 2.446 4.600 -5.253 1.00 3.14 C ATOM 1134 C ARG B 219 3.030 5.152 -3.939 1.00 25.00 C ATOM 1135 O ARG B 219 2.319 5.773 -3.150 1.00 42.25 O ATOM 1136 CB ARG B 219 2.246 5.739 -6.263 1.00 61.14 C ATOM 1137 CG ARG B 219 1.739 5.274 -7.623 1.00 4.12 C ATOM 1138 CD ARG B 219 1.517 6.436 -8.586 1.00 43.41 C ATOM 1139 NE ARG B 219 2.757 7.146 -8.902 1.00 23.34 N ATOM 1140 CZ ARG B 219 3.184 7.362 -10.117 1.00 54.01 C ATOM 1141 NH1 ARG B 219 2.551 6.877 -11.137 1.00 55.12 N ATOM 1142 NH2 ARG B 219 4.262 8.046 -10.312 1.00 72.10 N ATOM 0 H ARG B 219 0.520 4.384 -4.421 1.00 75.14 H new ATOM 0 HA ARG B 219 3.160 3.879 -5.651 1.00 3.14 H new ATOM 0 HB2 ARG B 219 1.540 6.459 -5.849 1.00 61.14 H new ATOM 0 HB3 ARG B 219 3.192 6.262 -6.398 1.00 61.14 H new ATOM 0 HG2 ARG B 219 2.456 4.577 -8.057 1.00 4.12 H new ATOM 0 HG3 ARG B 219 0.804 4.729 -7.493 1.00 4.12 H new ATOM 0 HD2 ARG B 219 1.072 6.060 -9.507 1.00 43.41 H new ATOM 0 HD3 ARG B 219 0.803 7.134 -8.149 1.00 43.41 H new ATOM 0 HE ARG B 219 3.322 7.493 -8.127 1.00 23.34 H new ATOM 0 HH11 ARG B 219 1.709 6.319 -10.996 1.00 55.12 H new ATOM 0 HH12 ARG B 219 2.895 7.053 -12.081 1.00 55.12 H new ATOM 0 HH21 ARG B 219 4.781 8.418 -9.517 1.00 72.10 H new ATOM 0 HH22 ARG B 219 4.595 8.214 -11.261 1.00 72.10 H new ATOM 1156 N LEU B 220 4.329 4.928 -3.720 1.00 24.41 N ATOM 1157 CA LEU B 220 5.016 5.411 -2.509 1.00 51.32 C ATOM 1158 C LEU B 220 6.237 6.281 -2.875 1.00 1.23 C ATOM 1159 O LEU B 220 6.740 6.220 -3.995 1.00 73.43 O ATOM 1160 CB LEU B 220 5.445 4.217 -1.637 1.00 65.04 C ATOM 1161 CG LEU B 220 6.075 4.565 -0.273 1.00 24.32 C ATOM 1162 CD1 LEU B 220 5.109 5.378 0.587 1.00 21.35 C ATOM 1163 CD2 LEU B 220 6.509 3.294 0.458 1.00 42.01 C ATOM 0 H LEU B 220 4.931 4.415 -4.364 1.00 24.41 H new ATOM 0 HA LEU B 220 4.322 6.032 -1.943 1.00 51.32 H new ATOM 0 HB2 LEU B 220 4.572 3.589 -1.461 1.00 65.04 H new ATOM 0 HB3 LEU B 220 6.159 3.618 -2.202 1.00 65.04 H new ATOM 0 HG LEU B 220 6.958 5.177 -0.456 1.00 24.32 H new ATOM 0 HD11 LEU B 220 5.579 5.609 1.543 1.00 21.35 H new ATOM 0 HD12 LEU B 220 4.856 6.305 0.073 1.00 21.35 H new ATOM 0 HD13 LEU B 220 4.201 4.800 0.760 1.00 21.35 H new ATOM 0 HD21 LEU B 220 6.951 3.560 1.418 1.00 42.01 H new ATOM 0 HD22 LEU B 220 5.642 2.655 0.622 1.00 42.01 H new ATOM 0 HD23 LEU B 220 7.244 2.761 -0.145 1.00 42.01 H new ATOM 1175 N TYR B 221 6.705 7.089 -1.925 1.00 63.44 N ATOM 1176 CA TYR B 221 7.801 8.036 -2.172 1.00 73.41 C ATOM 1177 C TYR B 221 9.169 7.323 -2.284 1.00 33.45 C ATOM 1178 O TYR B 221 9.427 6.344 -1.581 1.00 13.24 O ATOM 1179 CB TYR B 221 7.836 9.084 -1.049 1.00 70.13 C ATOM 1180 CG TYR B 221 6.527 9.843 -0.874 1.00 13.13 C ATOM 1181 CD1 TYR B 221 5.419 9.234 -0.289 1.00 10.30 C ATOM 1182 CD2 TYR B 221 6.401 11.168 -1.286 1.00 34.11 C ATOM 1183 CE1 TYR B 221 4.232 9.918 -0.120 1.00 2.31 C ATOM 1184 CE2 TYR B 221 5.214 11.855 -1.119 1.00 10.10 C ATOM 1185 CZ TYR B 221 4.132 11.227 -0.537 1.00 12.25 C ATOM 1186 OH TYR B 221 2.949 11.911 -0.360 1.00 62.41 O ATOM 0 H TYR B 221 6.343 7.110 -0.972 1.00 63.44 H new ATOM 0 HA TYR B 221 7.614 8.526 -3.128 1.00 73.41 H new ATOM 0 HB2 TYR B 221 8.086 8.589 -0.111 1.00 70.13 H new ATOM 0 HB3 TYR B 221 8.634 9.797 -1.256 1.00 70.13 H new ATOM 0 HD1 TYR B 221 5.490 8.207 0.038 1.00 10.30 H new ATOM 0 HD2 TYR B 221 7.244 11.665 -1.743 1.00 34.11 H new ATOM 0 HE1 TYR B 221 3.385 9.429 0.337 1.00 2.31 H new ATOM 0 HE2 TYR B 221 5.133 12.882 -1.443 1.00 10.10 H new ATOM 0 HH TYR B 221 3.043 12.823 -0.706 1.00 62.41 H new ATOM 1196 N PRO B 222 10.072 7.825 -3.164 1.00 2.45 N ATOM 1197 CA PRO B 222 11.383 7.190 -3.432 1.00 43.45 C ATOM 1198 C PRO B 222 12.203 6.910 -2.160 1.00 13.11 C ATOM 1199 O PRO B 222 12.717 5.807 -1.980 1.00 3.41 O ATOM 1200 CB PRO B 222 12.107 8.209 -4.341 1.00 43.32 C ATOM 1201 CG PRO B 222 11.312 9.471 -4.232 1.00 33.31 C ATOM 1202 CD PRO B 222 9.894 9.043 -3.970 1.00 0.21 C ATOM 0 HA PRO B 222 11.257 6.207 -3.887 1.00 43.45 H new ATOM 0 HB2 PRO B 222 13.136 8.363 -4.017 1.00 43.32 H new ATOM 0 HB3 PRO B 222 12.147 7.857 -5.372 1.00 43.32 H new ATOM 0 HG2 PRO B 222 11.686 10.100 -3.424 1.00 33.31 H new ATOM 0 HG3 PRO B 222 11.380 10.056 -5.149 1.00 33.31 H new ATOM 0 HD2 PRO B 222 9.332 9.807 -3.432 1.00 0.21 H new ATOM 0 HD3 PRO B 222 9.353 8.842 -4.895 1.00 0.21 H new ATOM 1210 N ASP B 223 12.324 7.912 -1.289 1.00 75.21 N ATOM 1211 CA ASP B 223 13.022 7.767 0.000 1.00 20.42 C ATOM 1212 C ASP B 223 12.580 6.500 0.747 1.00 31.32 C ATOM 1213 O ASP B 223 13.384 5.618 1.061 1.00 21.33 O ATOM 1214 CB ASP B 223 12.720 8.978 0.895 1.00 60.52 C ATOM 1215 CG ASP B 223 13.142 10.304 0.291 1.00 54.12 C ATOM 1216 OD1 ASP B 223 12.929 10.514 -0.920 1.00 2.41 O ATOM 1217 OD2 ASP B 223 13.684 11.147 1.034 1.00 14.23 O ATOM 0 H ASP B 223 11.945 8.845 -1.451 1.00 75.21 H new ATOM 0 HA ASP B 223 14.088 7.698 -0.216 1.00 20.42 H new ATOM 0 HB2 ASP B 223 11.650 9.007 1.102 1.00 60.52 H new ATOM 0 HB3 ASP B 223 13.226 8.847 1.851 1.00 60.52 H new ATOM 1222 N GLU B 224 11.284 6.430 1.010 1.00 33.43 N ATOM 1223 CA GLU B 224 10.700 5.380 1.840 1.00 61.05 C ATOM 1224 C GLU B 224 10.758 4.004 1.156 1.00 61.30 C ATOM 1225 O GLU B 224 10.918 2.982 1.819 1.00 24.20 O ATOM 1226 CB GLU B 224 9.266 5.791 2.200 1.00 33.14 C ATOM 1227 CG GLU B 224 9.230 7.129 2.940 1.00 74.53 C ATOM 1228 CD GLU B 224 7.842 7.737 3.066 1.00 32.15 C ATOM 1229 OE1 GLU B 224 7.448 8.511 2.167 1.00 32.02 O ATOM 1230 OE2 GLU B 224 7.168 7.487 4.084 1.00 53.04 O ATOM 0 H GLU B 224 10.603 7.101 0.654 1.00 33.43 H new ATOM 0 HA GLU B 224 11.283 5.272 2.754 1.00 61.05 H new ATOM 0 HB2 GLU B 224 8.669 5.862 1.291 1.00 33.14 H new ATOM 0 HB3 GLU B 224 8.811 5.019 2.821 1.00 33.14 H new ATOM 0 HG2 GLU B 224 9.645 6.990 3.938 1.00 74.53 H new ATOM 0 HG3 GLU B 224 9.878 7.836 2.421 1.00 74.53 H new ATOM 1237 N ILE B 225 10.657 3.982 -0.174 1.00 62.11 N ATOM 1238 CA ILE B 225 10.830 2.740 -0.940 1.00 33.03 C ATOM 1239 C ILE B 225 12.291 2.262 -0.895 1.00 12.24 C ATOM 1240 O ILE B 225 12.566 1.068 -0.746 1.00 31.15 O ATOM 1241 CB ILE B 225 10.406 2.917 -2.424 1.00 43.21 C ATOM 1242 CG1 ILE B 225 8.917 3.283 -2.514 1.00 72.30 C ATOM 1243 CG2 ILE B 225 10.694 1.649 -3.229 1.00 4.40 C ATOM 1244 CD1 ILE B 225 8.403 3.442 -3.932 1.00 23.45 C ATOM 0 H ILE B 225 10.457 4.804 -0.744 1.00 62.11 H new ATOM 0 HA ILE B 225 10.186 1.994 -0.474 1.00 33.03 H new ATOM 0 HB ILE B 225 10.992 3.730 -2.851 1.00 43.21 H new ATOM 0 HG12 ILE B 225 8.333 2.512 -2.012 1.00 72.30 H new ATOM 0 HG13 ILE B 225 8.749 4.213 -1.972 1.00 72.30 H new ATOM 0 HG21 ILE B 225 10.388 1.798 -4.265 1.00 4.40 H new ATOM 0 HG22 ILE B 225 11.761 1.430 -3.194 1.00 4.40 H new ATOM 0 HG23 ILE B 225 10.138 0.814 -2.803 1.00 4.40 H new ATOM 0 HD11 ILE B 225 7.344 3.700 -3.908 1.00 23.45 H new ATOM 0 HD12 ILE B 225 8.959 4.234 -4.434 1.00 23.45 H new ATOM 0 HD13 ILE B 225 8.536 2.506 -4.474 1.00 23.45 H new ATOM 1256 N GLU B 226 13.220 3.213 -1.016 1.00 73.34 N ATOM 1257 CA GLU B 226 14.658 2.916 -1.036 1.00 40.54 C ATOM 1258 C GLU B 226 15.100 2.177 0.237 1.00 44.12 C ATOM 1259 O GLU B 226 15.917 1.255 0.180 1.00 33.32 O ATOM 1260 CB GLU B 226 15.455 4.222 -1.215 1.00 70.12 C ATOM 1261 CG GLU B 226 16.963 4.030 -1.364 1.00 5.11 C ATOM 1262 CD GLU B 226 17.680 5.307 -1.785 1.00 42.51 C ATOM 1263 OE1 GLU B 226 17.776 5.563 -3.006 1.00 51.22 O ATOM 1264 OE2 GLU B 226 18.148 6.061 -0.903 1.00 74.03 O ATOM 0 H GLU B 226 13.001 4.205 -1.103 1.00 73.34 H new ATOM 0 HA GLU B 226 14.860 2.255 -1.879 1.00 40.54 H new ATOM 0 HB2 GLU B 226 15.080 4.744 -2.095 1.00 70.12 H new ATOM 0 HB3 GLU B 226 15.267 4.868 -0.357 1.00 70.12 H new ATOM 0 HG2 GLU B 226 17.376 3.682 -0.417 1.00 5.11 H new ATOM 0 HG3 GLU B 226 17.155 3.251 -2.101 1.00 5.11 H new ATOM 1271 N ALA B 227 14.547 2.581 1.379 1.00 75.25 N ATOM 1272 CA ALA B 227 14.837 1.921 2.659 1.00 72.15 C ATOM 1273 C ALA B 227 13.969 0.661 2.867 1.00 50.11 C ATOM 1274 O ALA B 227 14.473 -0.396 3.258 1.00 21.52 O ATOM 1275 CB ALA B 227 14.630 2.901 3.810 1.00 32.40 C ATOM 0 H ALA B 227 13.895 3.362 1.448 1.00 75.25 H new ATOM 0 HA ALA B 227 15.879 1.600 2.638 1.00 72.15 H new ATOM 0 HB1 ALA B 227 14.847 2.403 4.755 1.00 32.40 H new ATOM 0 HB2 ALA B 227 15.298 3.753 3.687 1.00 32.40 H new ATOM 0 HB3 ALA B 227 13.597 3.247 3.811 1.00 32.40 H new ATOM 1281 N LEU B 228 12.668 0.776 2.589 1.00 32.33 N ATOM 1282 CA LEU B 228 11.712 -0.325 2.802 1.00 25.42 C ATOM 1283 C LEU B 228 12.130 -1.619 2.081 1.00 62.55 C ATOM 1284 O LEU B 228 11.992 -2.718 2.623 1.00 74.02 O ATOM 1285 CB LEU B 228 10.315 0.098 2.324 1.00 32.43 C ATOM 1286 CG LEU B 228 9.186 -0.921 2.568 1.00 32.14 C ATOM 1287 CD1 LEU B 228 8.976 -1.150 4.063 1.00 62.53 C ATOM 1288 CD2 LEU B 228 7.889 -0.457 1.903 1.00 52.02 C ATOM 0 H LEU B 228 12.246 1.625 2.213 1.00 32.33 H new ATOM 0 HA LEU B 228 11.700 -0.535 3.871 1.00 25.42 H new ATOM 0 HB2 LEU B 228 10.049 1.032 2.820 1.00 32.43 H new ATOM 0 HB3 LEU B 228 10.365 0.307 1.255 1.00 32.43 H new ATOM 0 HG LEU B 228 9.480 -1.870 2.119 1.00 32.14 H new ATOM 0 HD11 LEU B 228 8.174 -1.873 4.211 1.00 62.53 H new ATOM 0 HD12 LEU B 228 9.896 -1.533 4.505 1.00 62.53 H new ATOM 0 HD13 LEU B 228 8.708 -0.208 4.541 1.00 62.53 H new ATOM 0 HD21 LEU B 228 7.103 -1.190 2.087 1.00 52.02 H new ATOM 0 HD22 LEU B 228 7.591 0.506 2.318 1.00 52.02 H new ATOM 0 HD23 LEU B 228 8.047 -0.356 0.829 1.00 52.02 H new ATOM 1300 N LYS B 229 12.653 -1.485 0.864 1.00 3.31 N ATOM 1301 CA LYS B 229 13.024 -2.650 0.047 1.00 44.33 C ATOM 1302 C LYS B 229 14.187 -3.458 0.660 1.00 44.23 C ATOM 1303 O LYS B 229 14.485 -4.564 0.209 1.00 13.31 O ATOM 1304 CB LYS B 229 13.392 -2.204 -1.375 1.00 73.52 C ATOM 1305 CG LYS B 229 14.637 -1.325 -1.445 1.00 60.50 C ATOM 1306 CD LYS B 229 14.912 -0.847 -2.867 1.00 1.41 C ATOM 1307 CE LYS B 229 16.204 -0.045 -2.959 1.00 30.05 C ATOM 1308 NZ LYS B 229 17.391 -0.860 -2.585 1.00 34.13 N ATOM 0 H LYS B 229 12.831 -0.585 0.418 1.00 3.31 H new ATOM 0 HA LYS B 229 12.154 -3.306 0.016 1.00 44.33 H new ATOM 0 HB2 LYS B 229 13.548 -3.088 -1.993 1.00 73.52 H new ATOM 0 HB3 LYS B 229 12.550 -1.660 -1.804 1.00 73.52 H new ATOM 0 HG2 LYS B 229 14.511 -0.463 -0.790 1.00 60.50 H new ATOM 0 HG3 LYS B 229 15.498 -1.883 -1.076 1.00 60.50 H new ATOM 0 HD2 LYS B 229 14.971 -1.707 -3.534 1.00 1.41 H new ATOM 0 HD3 LYS B 229 14.079 -0.234 -3.211 1.00 1.41 H new ATOM 0 HE2 LYS B 229 16.327 0.330 -3.975 1.00 30.05 H new ATOM 0 HE3 LYS B 229 16.139 0.824 -2.304 1.00 30.05 H new ATOM 0 HZ1 LYS B 229 18.257 -0.376 -2.897 1.00 34.13 H new ATOM 0 HZ2 LYS B 229 17.416 -0.983 -1.553 1.00 34.13 H new ATOM 0 HZ3 LYS B 229 17.331 -1.792 -3.044 1.00 34.13 H new ATOM 1322 N SER B 230 14.847 -2.904 1.676 1.00 2.30 N ATOM 1323 CA SER B 230 15.957 -3.601 2.351 1.00 21.34 C ATOM 1324 C SER B 230 15.451 -4.527 3.472 1.00 75.23 C ATOM 1325 O SER B 230 16.020 -5.595 3.719 1.00 14.41 O ATOM 1326 CB SER B 230 16.955 -2.586 2.926 1.00 13.22 C ATOM 1327 OG SER B 230 18.045 -3.235 3.567 1.00 11.12 O ATOM 0 H SER B 230 14.639 -1.979 2.053 1.00 2.30 H new ATOM 0 HA SER B 230 16.457 -4.218 1.604 1.00 21.34 H new ATOM 0 HB2 SER B 230 17.329 -1.948 2.125 1.00 13.22 H new ATOM 0 HB3 SER B 230 16.446 -1.937 3.639 1.00 13.22 H new ATOM 0 HG SER B 230 18.664 -2.563 3.921 1.00 11.12 H new ATOM 1333 N ARG B 231 14.371 -4.126 4.137 1.00 32.32 N ATOM 1334 CA ARG B 231 13.816 -4.899 5.263 1.00 53.32 C ATOM 1335 C ARG B 231 12.802 -5.965 4.806 1.00 44.44 C ATOM 1336 O ARG B 231 11.948 -6.392 5.588 1.00 74.32 O ATOM 1337 CB ARG B 231 13.165 -3.953 6.285 1.00 34.43 C ATOM 1338 CG ARG B 231 12.132 -3.002 5.684 1.00 3.22 C ATOM 1339 CD ARG B 231 11.465 -2.135 6.747 1.00 2.32 C ATOM 1340 NE ARG B 231 10.547 -2.904 7.590 1.00 22.01 N ATOM 1341 CZ ARG B 231 10.254 -2.604 8.827 1.00 60.34 C ATOM 1342 NH1 ARG B 231 10.859 -1.633 9.431 1.00 12.12 N ATOM 1343 NH2 ARG B 231 9.379 -3.305 9.472 1.00 1.34 N ATOM 0 H ARG B 231 13.857 -3.272 3.922 1.00 32.32 H new ATOM 0 HA ARG B 231 14.648 -5.427 5.730 1.00 53.32 H new ATOM 0 HB2 ARG B 231 12.686 -4.549 7.062 1.00 34.43 H new ATOM 0 HB3 ARG B 231 13.945 -3.366 6.769 1.00 34.43 H new ATOM 0 HG2 ARG B 231 12.615 -2.362 4.945 1.00 3.22 H new ATOM 0 HG3 ARG B 231 11.372 -3.579 5.157 1.00 3.22 H new ATOM 0 HD2 ARG B 231 12.231 -1.675 7.372 1.00 2.32 H new ATOM 0 HD3 ARG B 231 10.919 -1.325 6.263 1.00 2.32 H new ATOM 0 HE ARG B 231 10.107 -3.730 7.184 1.00 22.01 H new ATOM 0 HH11 ARG B 231 11.572 -1.093 8.941 1.00 12.12 H new ATOM 0 HH12 ARG B 231 10.622 -1.407 10.397 1.00 12.12 H new ATOM 0 HH21 ARG B 231 8.918 -4.092 9.015 1.00 1.34 H new ATOM 0 HH22 ARG B 231 9.150 -3.071 10.438 1.00 1.34 H new ATOM 1357 N VAL B 232 12.905 -6.407 3.553 1.00 1.43 N ATOM 1358 CA VAL B 232 12.020 -7.455 3.029 1.00 52.11 C ATOM 1359 C VAL B 232 12.639 -8.857 3.210 1.00 15.14 C ATOM 1360 O VAL B 232 13.830 -9.061 2.951 1.00 2.43 O ATOM 1361 CB VAL B 232 11.685 -7.223 1.528 1.00 30.35 C ATOM 1362 CG1 VAL B 232 10.948 -5.897 1.339 1.00 34.44 C ATOM 1363 CG2 VAL B 232 12.947 -7.268 0.669 1.00 30.43 C ATOM 0 H VAL B 232 13.589 -6.059 2.881 1.00 1.43 H new ATOM 0 HA VAL B 232 11.096 -7.402 3.604 1.00 52.11 H new ATOM 0 HB VAL B 232 11.029 -8.030 1.201 1.00 30.35 H new ATOM 0 HG11 VAL B 232 10.723 -5.753 0.282 1.00 34.44 H new ATOM 0 HG12 VAL B 232 10.019 -5.912 1.909 1.00 34.44 H new ATOM 0 HG13 VAL B 232 11.576 -5.078 1.691 1.00 34.44 H new ATOM 0 HG21 VAL B 232 12.682 -7.103 -0.375 1.00 30.43 H new ATOM 0 HG22 VAL B 232 13.637 -6.490 0.996 1.00 30.43 H new ATOM 0 HG23 VAL B 232 13.423 -8.243 0.773 1.00 30.43 H new ATOM 1373 N PRO B 233 11.846 -9.834 3.700 1.00 14.33 N ATOM 1374 CA PRO B 233 12.290 -11.234 3.848 1.00 22.34 C ATOM 1375 C PRO B 233 12.424 -11.964 2.496 1.00 10.11 C ATOM 1376 O PRO B 233 11.667 -11.704 1.560 1.00 75.42 O ATOM 1377 CB PRO B 233 11.180 -11.881 4.706 1.00 23.03 C ATOM 1378 CG PRO B 233 10.351 -10.743 5.214 1.00 1.14 C ATOM 1379 CD PRO B 233 10.471 -9.658 4.183 1.00 62.23 C ATOM 0 HA PRO B 233 13.282 -11.294 4.296 1.00 22.34 H new ATOM 0 HB2 PRO B 233 10.578 -12.571 4.114 1.00 23.03 H new ATOM 0 HB3 PRO B 233 11.605 -12.455 5.529 1.00 23.03 H new ATOM 0 HG2 PRO B 233 9.312 -11.044 5.346 1.00 1.14 H new ATOM 0 HG3 PRO B 233 10.709 -10.401 6.185 1.00 1.14 H new ATOM 0 HD2 PRO B 233 9.741 -9.776 3.382 1.00 62.23 H new ATOM 0 HD3 PRO B 233 10.315 -8.669 4.614 1.00 62.23 H new ATOM 1387 N ALA B 234 13.378 -12.892 2.411 1.00 54.44 N ATOM 1388 CA ALA B 234 13.634 -13.647 1.175 1.00 63.12 C ATOM 1389 C ALA B 234 12.371 -14.339 0.627 1.00 3.11 C ATOM 1390 O ALA B 234 12.172 -14.415 -0.591 1.00 10.45 O ATOM 1391 CB ALA B 234 14.732 -14.679 1.415 1.00 52.13 C ATOM 0 H ALA B 234 13.992 -13.143 3.186 1.00 54.44 H new ATOM 0 HA ALA B 234 13.956 -12.928 0.421 1.00 63.12 H new ATOM 0 HB1 ALA B 234 14.916 -15.235 0.496 1.00 52.13 H new ATOM 0 HB2 ALA B 234 15.647 -14.172 1.722 1.00 52.13 H new ATOM 0 HB3 ALA B 234 14.418 -15.369 2.199 1.00 52.13 H new ATOM 1397 N ASN B 235 11.523 -14.836 1.528 1.00 52.05 N ATOM 1398 CA ASN B 235 10.307 -15.567 1.136 1.00 73.04 C ATOM 1399 C ASN B 235 9.076 -14.644 1.044 1.00 4.35 C ATOM 1400 O ASN B 235 7.951 -15.114 0.870 1.00 15.50 O ATOM 1401 CB ASN B 235 10.033 -16.702 2.131 1.00 22.03 C ATOM 1402 CG ASN B 235 11.184 -17.688 2.207 1.00 12.43 C ATOM 1403 OD1 ASN B 235 11.236 -18.665 1.473 1.00 1.01 O ATOM 1404 ND2 ASN B 235 12.120 -17.440 3.100 1.00 30.42 N ATOM 0 H ASN B 235 11.652 -14.748 2.536 1.00 52.05 H new ATOM 0 HA ASN B 235 10.483 -15.980 0.143 1.00 73.04 H new ATOM 0 HB2 ASN B 235 9.852 -16.280 3.120 1.00 22.03 H new ATOM 0 HB3 ASN B 235 9.125 -17.228 1.838 1.00 22.03 H new ATOM 0 HD21 ASN B 235 12.916 -18.071 3.193 1.00 30.42 H new ATOM 0 HD22 ASN B 235 12.049 -16.617 3.698 1.00 30.42 H new ATOM 1411 N THR B 236 9.293 -13.332 1.137 1.00 75.44 N ATOM 1412 CA THR B 236 8.190 -12.359 1.079 1.00 12.15 C ATOM 1413 C THR B 236 8.507 -11.218 0.106 1.00 21.02 C ATOM 1414 O THR B 236 9.266 -10.304 0.430 1.00 75.45 O ATOM 1415 CB THR B 236 7.880 -11.755 2.473 1.00 62.12 C ATOM 1416 OG1 THR B 236 7.562 -12.797 3.407 1.00 1.32 O ATOM 1417 CG2 THR B 236 6.716 -10.769 2.407 1.00 43.54 C ATOM 0 H THR B 236 10.217 -12.915 1.252 1.00 75.44 H new ATOM 0 HA THR B 236 7.315 -12.906 0.728 1.00 12.15 H new ATOM 0 HB THR B 236 8.771 -11.221 2.804 1.00 62.12 H new ATOM 0 HG1 THR B 236 7.370 -12.403 4.284 1.00 1.32 H new ATOM 0 HG21 THR B 236 6.525 -10.364 3.401 1.00 43.54 H new ATOM 0 HG22 THR B 236 6.966 -9.956 1.726 1.00 43.54 H new ATOM 0 HG23 THR B 236 5.824 -11.282 2.047 1.00 43.54 H new ATOM 1425 N SER B 237 7.926 -11.283 -1.088 1.00 23.03 N ATOM 1426 CA SER B 237 8.135 -10.248 -2.110 1.00 21.52 C ATOM 1427 C SER B 237 7.450 -8.930 -1.726 1.00 3.51 C ATOM 1428 O SER B 237 6.646 -8.889 -0.794 1.00 64.30 O ATOM 1429 CB SER B 237 7.612 -10.727 -3.470 1.00 32.55 C ATOM 1430 OG SER B 237 8.284 -11.909 -3.888 1.00 24.50 O ATOM 0 H SER B 237 7.306 -12.039 -1.377 1.00 23.03 H new ATOM 0 HA SER B 237 9.208 -10.066 -2.178 1.00 21.52 H new ATOM 0 HB2 SER B 237 6.541 -10.917 -3.405 1.00 32.55 H new ATOM 0 HB3 SER B 237 7.752 -9.943 -4.214 1.00 32.55 H new ATOM 0 HG SER B 237 7.932 -12.196 -4.757 1.00 24.50 H new ATOM 1436 N MET B 238 7.759 -7.857 -2.458 1.00 41.44 N ATOM 1437 CA MET B 238 7.219 -6.520 -2.156 1.00 41.04 C ATOM 1438 C MET B 238 5.682 -6.521 -2.084 1.00 50.53 C ATOM 1439 O MET B 238 5.097 -5.958 -1.159 1.00 12.45 O ATOM 1440 CB MET B 238 7.688 -5.503 -3.205 1.00 14.02 C ATOM 1441 CG MET B 238 9.200 -5.323 -3.260 1.00 71.11 C ATOM 1442 SD MET B 238 9.712 -4.139 -4.523 1.00 65.44 S ATOM 1443 CE MET B 238 11.487 -4.109 -4.270 1.00 73.44 C ATOM 0 H MET B 238 8.381 -7.883 -3.266 1.00 41.44 H new ATOM 0 HA MET B 238 7.600 -6.234 -1.175 1.00 41.04 H new ATOM 0 HB2 MET B 238 7.334 -5.819 -4.186 1.00 14.02 H new ATOM 0 HB3 MET B 238 7.225 -4.539 -2.994 1.00 14.02 H new ATOM 0 HG2 MET B 238 9.558 -4.988 -2.287 1.00 71.11 H new ATOM 0 HG3 MET B 238 9.670 -6.286 -3.458 1.00 71.11 H new ATOM 0 HE1 MET B 238 11.944 -3.420 -4.980 1.00 73.44 H new ATOM 0 HE2 MET B 238 11.704 -3.780 -3.254 1.00 73.44 H new ATOM 0 HE3 MET B 238 11.893 -5.109 -4.423 1.00 73.44 H new ATOM 1453 N SER B 239 5.039 -7.160 -3.059 1.00 54.51 N ATOM 1454 CA SER B 239 3.569 -7.241 -3.107 1.00 32.51 C ATOM 1455 C SER B 239 2.981 -7.829 -1.813 1.00 34.33 C ATOM 1456 O SER B 239 2.103 -7.229 -1.187 1.00 73.04 O ATOM 1457 CB SER B 239 3.122 -8.093 -4.303 1.00 24.00 C ATOM 1458 OG SER B 239 3.570 -9.437 -4.181 1.00 54.00 O ATOM 0 H SER B 239 5.509 -7.632 -3.831 1.00 54.51 H new ATOM 0 HA SER B 239 3.195 -6.223 -3.216 1.00 32.51 H new ATOM 0 HB2 SER B 239 2.035 -8.076 -4.377 1.00 24.00 H new ATOM 0 HB3 SER B 239 3.511 -7.661 -5.225 1.00 24.00 H new ATOM 0 HG SER B 239 3.711 -9.817 -5.073 1.00 54.00 H new ATOM 1464 N ALA B 240 3.461 -9.009 -1.422 1.00 63.33 N ATOM 1465 CA ALA B 240 3.014 -9.665 -0.187 1.00 70.34 C ATOM 1466 C ALA B 240 3.411 -8.855 1.058 1.00 20.53 C ATOM 1467 O ALA B 240 2.658 -8.777 2.031 1.00 5.22 O ATOM 1468 CB ALA B 240 3.587 -11.075 -0.109 1.00 0.01 C ATOM 0 H ALA B 240 4.163 -9.535 -1.943 1.00 63.33 H new ATOM 0 HA ALA B 240 1.926 -9.721 -0.210 1.00 70.34 H new ATOM 0 HB1 ALA B 240 3.250 -11.554 0.810 1.00 0.01 H new ATOM 0 HB2 ALA B 240 3.245 -11.655 -0.967 1.00 0.01 H new ATOM 0 HB3 ALA B 240 4.676 -11.026 -0.115 1.00 0.01 H new ATOM 1474 N TYR B 241 4.593 -8.244 1.011 1.00 32.22 N ATOM 1475 CA TYR B 241 5.100 -7.441 2.127 1.00 61.43 C ATOM 1476 C TYR B 241 4.173 -6.248 2.410 1.00 43.42 C ATOM 1477 O TYR B 241 3.820 -5.983 3.557 1.00 4.41 O ATOM 1478 CB TYR B 241 6.525 -6.955 1.822 1.00 40.21 C ATOM 1479 CG TYR B 241 7.288 -6.463 3.039 1.00 2.14 C ATOM 1480 CD1 TYR B 241 7.740 -7.361 4.001 1.00 44.23 C ATOM 1481 CD2 TYR B 241 7.572 -5.113 3.222 1.00 61.12 C ATOM 1482 CE1 TYR B 241 8.445 -6.929 5.107 1.00 31.15 C ATOM 1483 CE2 TYR B 241 8.281 -4.677 4.323 1.00 3.10 C ATOM 1484 CZ TYR B 241 8.716 -5.589 5.261 1.00 24.24 C ATOM 1485 OH TYR B 241 9.432 -5.160 6.354 1.00 74.53 O ATOM 0 H TYR B 241 5.222 -8.289 0.209 1.00 32.22 H new ATOM 0 HA TYR B 241 5.125 -8.067 3.019 1.00 61.43 H new ATOM 0 HB2 TYR B 241 7.084 -7.770 1.361 1.00 40.21 H new ATOM 0 HB3 TYR B 241 6.473 -6.150 1.089 1.00 40.21 H new ATOM 0 HD1 TYR B 241 7.536 -8.415 3.881 1.00 44.23 H new ATOM 0 HD2 TYR B 241 7.232 -4.395 2.491 1.00 61.12 H new ATOM 0 HE1 TYR B 241 8.782 -7.639 5.847 1.00 31.15 H new ATOM 0 HE2 TYR B 241 8.494 -3.626 4.449 1.00 3.10 H new ATOM 0 HH TYR B 241 10.358 -5.471 6.281 1.00 74.53 H new ATOM 1495 N ILE B 242 3.778 -5.540 1.350 1.00 12.54 N ATOM 1496 CA ILE B 242 2.826 -4.431 1.471 1.00 24.14 C ATOM 1497 C ILE B 242 1.425 -4.950 1.836 1.00 43.13 C ATOM 1498 O ILE B 242 0.673 -4.289 2.561 1.00 4.31 O ATOM 1499 CB ILE B 242 2.749 -3.601 0.161 1.00 10.05 C ATOM 1500 CG1 ILE B 242 4.138 -3.057 -0.214 1.00 34.31 C ATOM 1501 CG2 ILE B 242 1.744 -2.454 0.301 1.00 52.21 C ATOM 1502 CD1 ILE B 242 4.748 -2.143 0.832 1.00 53.20 C ATOM 0 H ILE B 242 4.102 -5.714 0.398 1.00 12.54 H new ATOM 0 HA ILE B 242 3.187 -3.783 2.270 1.00 24.14 H new ATOM 0 HB ILE B 242 2.406 -4.258 -0.638 1.00 10.05 H new ATOM 0 HG12 ILE B 242 4.812 -3.897 -0.384 1.00 34.31 H new ATOM 0 HG13 ILE B 242 4.062 -2.514 -1.156 1.00 34.31 H new ATOM 0 HG21 ILE B 242 1.707 -1.887 -0.629 1.00 52.21 H new ATOM 0 HG22 ILE B 242 0.756 -2.860 0.517 1.00 52.21 H new ATOM 0 HG23 ILE B 242 2.052 -1.797 1.115 1.00 52.21 H new ATOM 0 HD11 ILE B 242 5.726 -1.802 0.492 1.00 53.20 H new ATOM 0 HD12 ILE B 242 4.098 -1.282 0.987 1.00 53.20 H new ATOM 0 HD13 ILE B 242 4.859 -2.687 1.770 1.00 53.20 H new ATOM 1514 N ARG B 243 1.084 -6.147 1.346 1.00 61.20 N ATOM 1515 CA ARG B 243 -0.198 -6.777 1.682 1.00 50.51 C ATOM 1516 C ARG B 243 -0.343 -6.928 3.205 1.00 71.15 C ATOM 1517 O ARG B 243 -1.338 -6.498 3.781 1.00 1.40 O ATOM 1518 CB ARG B 243 -0.341 -8.150 1.000 1.00 75.30 C ATOM 1519 CG ARG B 243 -1.703 -8.810 1.230 1.00 10.50 C ATOM 1520 CD ARG B 243 -1.826 -10.164 0.527 1.00 44.35 C ATOM 1521 NE ARG B 243 -0.931 -11.173 1.096 1.00 71.33 N ATOM 1522 CZ ARG B 243 -1.036 -12.463 0.880 1.00 51.40 C ATOM 1523 NH1 ARG B 243 -1.967 -12.936 0.111 1.00 73.45 N ATOM 1524 NH2 ARG B 243 -0.207 -13.279 1.445 1.00 54.32 N ATOM 0 H ARG B 243 1.673 -6.696 0.720 1.00 61.20 H new ATOM 0 HA ARG B 243 -0.992 -6.128 1.313 1.00 50.51 H new ATOM 0 HB2 ARG B 243 -0.180 -8.033 -0.072 1.00 75.30 H new ATOM 0 HB3 ARG B 243 0.442 -8.813 1.369 1.00 75.30 H new ATOM 0 HG2 ARG B 243 -1.862 -8.944 2.300 1.00 10.50 H new ATOM 0 HG3 ARG B 243 -2.490 -8.146 0.872 1.00 10.50 H new ATOM 0 HD2 ARG B 243 -2.856 -10.515 0.598 1.00 44.35 H new ATOM 0 HD3 ARG B 243 -1.603 -10.041 -0.533 1.00 44.35 H new ATOM 0 HE ARG B 243 -0.175 -10.852 1.701 1.00 71.33 H new ATOM 0 HH11 ARG B 243 -2.630 -12.303 -0.336 1.00 73.45 H new ATOM 0 HH12 ARG B 243 -2.036 -13.941 -0.047 1.00 73.45 H new ATOM 0 HH21 ARG B 243 0.526 -12.919 2.057 1.00 54.32 H new ATOM 0 HH22 ARG B 243 -0.286 -14.282 1.279 1.00 54.32 H new ATOM 1538 N ARG B 244 0.674 -7.503 3.856 1.00 65.35 N ATOM 1539 CA ARG B 244 0.649 -7.691 5.318 1.00 4.11 C ATOM 1540 C ARG B 244 0.922 -6.369 6.071 1.00 13.42 C ATOM 1541 O ARG B 244 1.190 -6.367 7.274 1.00 61.21 O ATOM 1542 CB ARG B 244 1.657 -8.774 5.745 1.00 12.23 C ATOM 1543 CG ARG B 244 3.119 -8.399 5.529 1.00 64.34 C ATOM 1544 CD ARG B 244 4.060 -9.524 5.953 1.00 73.23 C ATOM 1545 NE ARG B 244 3.853 -9.927 7.348 1.00 62.25 N ATOM 1546 CZ ARG B 244 4.614 -10.772 7.995 1.00 41.25 C ATOM 1547 NH1 ARG B 244 5.638 -11.317 7.421 1.00 32.43 N ATOM 1548 NH2 ARG B 244 4.336 -11.081 9.217 1.00 44.32 N ATOM 0 H ARG B 244 1.521 -7.845 3.401 1.00 65.35 H new ATOM 0 HA ARG B 244 -0.354 -8.022 5.587 1.00 4.11 H new ATOM 0 HB2 ARG B 244 1.505 -8.998 6.801 1.00 12.23 H new ATOM 0 HB3 ARG B 244 1.444 -9.689 5.192 1.00 12.23 H new ATOM 0 HG2 ARG B 244 3.283 -8.165 4.477 1.00 64.34 H new ATOM 0 HG3 ARG B 244 3.351 -7.498 6.096 1.00 64.34 H new ATOM 0 HD2 ARG B 244 3.909 -10.385 5.302 1.00 73.23 H new ATOM 0 HD3 ARG B 244 5.092 -9.201 5.820 1.00 73.23 H new ATOM 0 HE ARG B 244 3.062 -9.521 7.848 1.00 62.25 H new ATOM 0 HH11 ARG B 244 5.861 -11.089 6.452 1.00 32.43 H new ATOM 0 HH12 ARG B 244 6.223 -11.974 7.938 1.00 32.43 H new ATOM 0 HH21 ARG B 244 3.525 -10.667 9.676 1.00 44.32 H new ATOM 0 HH22 ARG B 244 4.928 -11.740 9.724 1.00 44.32 H new ATOM 1562 N ILE B 245 0.869 -5.249 5.350 1.00 54.22 N ATOM 1563 CA ILE B 245 0.931 -3.918 5.960 1.00 34.02 C ATOM 1564 C ILE B 245 -0.448 -3.235 5.913 1.00 63.55 C ATOM 1565 O ILE B 245 -0.981 -2.814 6.943 1.00 23.43 O ATOM 1566 CB ILE B 245 1.984 -3.016 5.261 1.00 25.51 C ATOM 1567 CG1 ILE B 245 3.402 -3.566 5.501 1.00 64.32 C ATOM 1568 CG2 ILE B 245 1.873 -1.569 5.745 1.00 22.11 C ATOM 1569 CD1 ILE B 245 4.496 -2.771 4.818 1.00 30.24 C ATOM 0 H ILE B 245 0.783 -5.237 4.334 1.00 54.22 H new ATOM 0 HA ILE B 245 1.232 -4.053 6.999 1.00 34.02 H new ATOM 0 HB ILE B 245 1.786 -3.025 4.189 1.00 25.51 H new ATOM 0 HG12 ILE B 245 3.596 -3.585 6.573 1.00 64.32 H new ATOM 0 HG13 ILE B 245 3.444 -4.597 5.151 1.00 64.32 H new ATOM 0 HG21 ILE B 245 2.621 -0.958 5.240 1.00 22.11 H new ATOM 0 HG22 ILE B 245 0.878 -1.185 5.519 1.00 22.11 H new ATOM 0 HG23 ILE B 245 2.040 -1.532 6.821 1.00 22.11 H new ATOM 0 HD11 ILE B 245 5.464 -3.222 5.036 1.00 30.24 H new ATOM 0 HD12 ILE B 245 4.329 -2.773 3.741 1.00 30.24 H new ATOM 0 HD13 ILE B 245 4.483 -1.745 5.185 1.00 30.24 H new ATOM 1581 N ILE B 246 -1.025 -3.134 4.715 1.00 61.10 N ATOM 1582 CA ILE B 246 -2.345 -2.510 4.542 1.00 14.10 C ATOM 1583 C ILE B 246 -3.474 -3.406 5.082 1.00 43.52 C ATOM 1584 O ILE B 246 -4.411 -2.920 5.721 1.00 21.44 O ATOM 1585 CB ILE B 246 -2.634 -2.153 3.059 1.00 21.12 C ATOM 1586 CG1 ILE B 246 -2.615 -3.410 2.169 1.00 65.43 C ATOM 1587 CG2 ILE B 246 -1.627 -1.119 2.559 1.00 20.10 C ATOM 1588 CD1 ILE B 246 -2.972 -3.137 0.722 1.00 43.42 C ATOM 0 H ILE B 246 -0.604 -3.474 3.850 1.00 61.10 H new ATOM 0 HA ILE B 246 -2.319 -1.587 5.121 1.00 14.10 H new ATOM 0 HB ILE B 246 -3.634 -1.723 3.001 1.00 21.12 H new ATOM 0 HG12 ILE B 246 -1.623 -3.859 2.211 1.00 65.43 H new ATOM 0 HG13 ILE B 246 -3.313 -4.142 2.574 1.00 65.43 H new ATOM 0 HG21 ILE B 246 -1.840 -0.877 1.518 1.00 20.10 H new ATOM 0 HG22 ILE B 246 -1.702 -0.216 3.164 1.00 20.10 H new ATOM 0 HG23 ILE B 246 -0.619 -1.525 2.638 1.00 20.10 H new ATOM 0 HD11 ILE B 246 -2.938 -4.068 0.157 1.00 43.42 H new ATOM 0 HD12 ILE B 246 -3.976 -2.717 0.668 1.00 43.42 H new ATOM 0 HD13 ILE B 246 -2.259 -2.429 0.299 1.00 43.42 H new ATOM 1600 N LEU B 247 -3.370 -4.714 4.836 1.00 2.01 N ATOM 1601 CA LEU B 247 -4.358 -5.687 5.327 1.00 31.32 C ATOM 1602 C LEU B 247 -4.494 -5.604 6.852 1.00 41.44 C ATOM 1603 O LEU B 247 -5.597 -5.523 7.396 1.00 31.11 O ATOM 1604 CB LEU B 247 -3.937 -7.109 4.920 1.00 23.22 C ATOM 1605 CG LEU B 247 -4.899 -8.239 5.324 1.00 70.50 C ATOM 1606 CD1 LEU B 247 -6.245 -8.068 4.630 1.00 50.32 C ATOM 1607 CD2 LEU B 247 -4.292 -9.607 5.006 1.00 23.21 C ATOM 0 H LEU B 247 -2.609 -5.129 4.298 1.00 2.01 H new ATOM 0 HA LEU B 247 -5.324 -5.451 4.880 1.00 31.32 H new ATOM 0 HB2 LEU B 247 -3.813 -7.134 3.837 1.00 23.22 H new ATOM 0 HB3 LEU B 247 -2.960 -7.317 5.357 1.00 23.22 H new ATOM 0 HG LEU B 247 -5.061 -8.184 6.401 1.00 70.50 H new ATOM 0 HD11 LEU B 247 -6.913 -8.876 4.927 1.00 50.32 H new ATOM 0 HD12 LEU B 247 -6.683 -7.112 4.916 1.00 50.32 H new ATOM 0 HD13 LEU B 247 -6.103 -8.094 3.550 1.00 50.32 H new ATOM 0 HD21 LEU B 247 -4.989 -10.392 5.300 1.00 23.21 H new ATOM 0 HD22 LEU B 247 -4.096 -9.678 3.936 1.00 23.21 H new ATOM 0 HD23 LEU B 247 -3.358 -9.727 5.555 1.00 23.21 H new ATOM 1619 N ASN B 248 -3.352 -5.606 7.529 1.00 51.31 N ATOM 1620 CA ASN B 248 -3.304 -5.551 8.991 1.00 71.41 C ATOM 1621 C ASN B 248 -3.847 -4.221 9.537 1.00 10.52 C ATOM 1622 O ASN B 248 -4.174 -4.117 10.723 1.00 10.24 O ATOM 1623 CB ASN B 248 -1.867 -5.775 9.472 1.00 45.02 C ATOM 1624 CG ASN B 248 -1.268 -7.065 8.927 1.00 51.43 C ATOM 1625 OD1 ASN B 248 -1.582 -7.499 7.823 1.00 34.02 O ATOM 1626 ND2 ASN B 248 -0.403 -7.692 9.695 1.00 24.51 N ATOM 0 H ASN B 248 -2.435 -5.646 7.085 1.00 51.31 H new ATOM 0 HA ASN B 248 -3.946 -6.344 9.374 1.00 71.41 H new ATOM 0 HB2 ASN B 248 -1.248 -4.932 9.165 1.00 45.02 H new ATOM 0 HB3 ASN B 248 -1.851 -5.802 10.562 1.00 45.02 H new ATOM 0 HD21 ASN B 248 0.025 -8.562 9.377 1.00 24.51 H new ATOM 0 HD22 ASN B 248 -0.160 -7.308 10.608 1.00 24.51 H new ATOM 1633 N HIS B 249 -3.945 -3.201 8.680 1.00 64.34 N ATOM 1634 CA HIS B 249 -4.535 -1.921 9.087 1.00 33.45 C ATOM 1635 C HIS B 249 -6.034 -1.860 8.755 1.00 13.13 C ATOM 1636 O HIS B 249 -6.767 -1.065 9.338 1.00 75.41 O ATOM 1637 CB HIS B 249 -3.800 -0.729 8.460 1.00 35.13 C ATOM 1638 CG HIS B 249 -4.298 0.597 8.969 1.00 24.21 C ATOM 1639 ND1 HIS B 249 -4.228 0.971 10.297 1.00 35.43 N ATOM 1640 CD2 HIS B 249 -4.901 1.630 8.328 1.00 41.52 C ATOM 1641 CE1 HIS B 249 -4.763 2.164 10.447 1.00 64.10 C ATOM 1642 NE2 HIS B 249 -5.179 2.589 9.273 1.00 55.10 N ATOM 0 H HIS B 249 -3.628 -3.234 7.711 1.00 64.34 H new ATOM 0 HA HIS B 249 -4.422 -1.854 10.169 1.00 33.45 H new ATOM 0 HB2 HIS B 249 -2.734 -0.815 8.668 1.00 35.13 H new ATOM 0 HB3 HIS B 249 -3.917 -0.765 7.377 1.00 35.13 H new ATOM 0 HD1 HIS B 249 -3.824 0.409 11.046 1.00 35.43 H new ATOM 0 HD2 HIS B 249 -5.121 1.688 7.272 1.00 41.52 H new ATOM 0 HE1 HIS B 249 -4.847 2.704 11.378 1.00 64.10 H new ATOM 1651 N LEU B 250 -6.484 -2.696 7.820 1.00 31.52 N ATOM 1652 CA LEU B 250 -7.913 -2.794 7.496 1.00 23.32 C ATOM 1653 C LEU B 250 -8.683 -3.327 8.721 1.00 64.32 C ATOM 1654 O LEU B 250 -9.750 -2.821 9.073 1.00 34.25 O ATOM 1655 CB LEU B 250 -8.105 -3.703 6.258 1.00 0.20 C ATOM 1656 CG LEU B 250 -9.480 -3.646 5.549 1.00 23.21 C ATOM 1657 CD1 LEU B 250 -10.573 -4.333 6.370 1.00 43.51 C ATOM 1658 CD2 LEU B 250 -9.868 -2.200 5.235 1.00 62.34 C ATOM 0 H LEU B 250 -5.885 -3.315 7.273 1.00 31.52 H new ATOM 0 HA LEU B 250 -8.311 -1.809 7.251 1.00 23.32 H new ATOM 0 HB2 LEU B 250 -7.337 -3.447 5.528 1.00 0.20 H new ATOM 0 HB3 LEU B 250 -7.924 -4.734 6.563 1.00 0.20 H new ATOM 0 HG LEU B 250 -9.385 -4.192 4.611 1.00 23.21 H new ATOM 0 HD11 LEU B 250 -11.522 -4.271 5.837 1.00 43.51 H new ATOM 0 HD12 LEU B 250 -10.310 -5.380 6.522 1.00 43.51 H new ATOM 0 HD13 LEU B 250 -10.667 -3.839 7.337 1.00 43.51 H new ATOM 0 HD21 LEU B 250 -10.837 -2.183 4.737 1.00 62.34 H new ATOM 0 HD22 LEU B 250 -9.926 -1.629 6.162 1.00 62.34 H new ATOM 0 HD23 LEU B 250 -9.117 -1.755 4.582 1.00 62.34 H new ATOM 1670 N GLU B 251 -8.118 -4.348 9.364 1.00 71.35 N ATOM 1671 CA GLU B 251 -8.637 -4.868 10.642 1.00 32.13 C ATOM 1672 C GLU B 251 -8.314 -3.915 11.810 1.00 52.22 C ATOM 1673 O GLU B 251 -9.091 -3.784 12.757 1.00 61.03 O ATOM 1674 CB GLU B 251 -8.028 -6.251 10.923 1.00 74.40 C ATOM 1675 CG GLU B 251 -6.502 -6.260 10.866 1.00 32.32 C ATOM 1676 CD GLU B 251 -5.887 -7.605 11.220 1.00 32.33 C ATOM 1677 OE1 GLU B 251 -5.861 -8.505 10.353 1.00 71.04 O ATOM 1678 OE2 GLU B 251 -5.407 -7.760 12.364 1.00 23.13 O ATOM 0 H GLU B 251 -7.293 -4.840 9.022 1.00 71.35 H new ATOM 0 HA GLU B 251 -9.721 -4.948 10.559 1.00 32.13 H new ATOM 0 HB2 GLU B 251 -8.350 -6.589 11.908 1.00 74.40 H new ATOM 0 HB3 GLU B 251 -8.416 -6.966 10.198 1.00 74.40 H new ATOM 0 HG2 GLU B 251 -6.183 -5.977 9.863 1.00 32.32 H new ATOM 0 HG3 GLU B 251 -6.117 -5.503 11.549 1.00 32.32 H new ATOM 1685 N ASP B 252 -7.155 -3.264 11.727 1.00 55.41 N ATOM 1686 CA ASP B 252 -6.690 -2.322 12.754 1.00 4.55 C ATOM 1687 C ASP B 252 -7.671 -1.146 12.930 1.00 10.04 C ATOM 1688 O ASP B 252 -8.318 -1.016 13.971 1.00 34.01 O ATOM 1689 CB ASP B 252 -5.305 -1.811 12.353 1.00 33.12 C ATOM 1690 CG ASP B 252 -4.665 -0.913 13.386 1.00 34.24 C ATOM 1691 OD1 ASP B 252 -4.196 -1.439 14.414 1.00 63.44 O ATOM 1692 OD2 ASP B 252 -4.606 0.310 13.159 1.00 53.35 O ATOM 0 H ASP B 252 -6.508 -3.372 10.946 1.00 55.41 H new ATOM 0 HA ASP B 252 -6.636 -2.838 13.713 1.00 4.55 H new ATOM 0 HB2 ASP B 252 -4.651 -2.664 12.172 1.00 33.12 H new ATOM 0 HB3 ASP B 252 -5.387 -1.267 11.412 1.00 33.12 H new ATOM 1697 N GLU B 253 -7.754 -0.296 11.907 1.00 64.34 N ATOM 1698 CA GLU B 253 -8.713 0.823 11.865 1.00 35.22 C ATOM 1699 C GLU B 253 -8.942 1.293 10.419 1.00 62.24 C ATOM 1700 O GLU B 253 -8.149 2.122 9.908 1.00 38.43 O ATOM 1701 CB GLU B 253 -8.253 2.007 12.745 1.00 41.34 C ATOM 1702 CG GLU B 253 -8.863 2.020 14.145 1.00 62.11 C ATOM 1703 CD GLU B 253 -10.387 2.014 14.125 1.00 32.34 C ATOM 1704 OE1 GLU B 253 -10.993 3.070 13.829 1.00 14.03 O ATOM 1705 OE2 GLU B 253 -10.992 0.959 14.404 1.00 74.40 O ATOM 1706 OXT GLU B 253 -9.916 0.829 9.794 1.00 38.43 O ATOM 0 H GLU B 253 -7.160 -0.358 11.080 1.00 64.34 H new ATOM 0 HA GLU B 253 -9.656 0.454 12.269 1.00 35.22 H new ATOM 0 HB2 GLU B 253 -7.167 1.978 12.834 1.00 41.34 H new ATOM 0 HB3 GLU B 253 -8.507 2.940 12.241 1.00 41.34 H new ATOM 0 HG2 GLU B 253 -8.508 1.151 14.699 1.00 62.11 H new ATOM 0 HG3 GLU B 253 -8.515 2.903 14.680 1.00 62.11 H new