USER MOD reduce.3.24.130724 H: found=0, std=0, add=941, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 943 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: C 256 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: C 259 GLN : amide:sc= 0.00232 X(o=0.0023,f=-0.3) USER MOD Single : A 16 SER OG : rot 180:sc= 0.0136 USER MOD Single : A 17 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 22 ASN : amide:sc= -3.17! C(o=-3.2!,f=-5.9!) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 HIS : no HD1:sc= -0.0437 X(o=-0.044,f=-0.039) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 ASN : amide:sc= 0.0451 K(o=0.045,f=-2.3!) USER MOD Single : A 31 THR OG1 : rot 79:sc= 0.597 USER MOD Single : A 33 ASN : amide:sc=-0.00407 K(o=-0.0041,f=-1.1) USER MOD Single : A 34 CYS SG : rot 180:sc= 0 USER MOD Single : A 37 GLN : amide:sc= -2.07 K(o=-2.1,f=-4.3!) USER MOD Single : A 43 LYS NZ :NH3+ -128:sc= 0.0866 (180deg=0) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 54 LYS NZ :NH3+ -170:sc= 0.285 (180deg=-0.0207) USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 GLN : amide:sc= -0.844 X(o=-0.84,f=-0.64) USER MOD Single : A 61 TYR OH : rot 60:sc= -4.26! USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 67 ASN : amide:sc= -3.15! K(o=-3.1!,f=-0.28) USER MOD Single : C 216 SER OG : rot 180:sc= 0 USER MOD Single : C 217 HIS : no HD1:sc= -0.0241 X(o=-0.024,f=-0.0012) USER MOD Single : C 222 ASN : amide:sc= -2.95 K(o=-3,f=-2.4) USER MOD Single : C 224 LYS NZ :NH3+ 170:sc=-0.00105 (180deg=-0.0716) USER MOD Single : C 225 HIS : no HD1:sc= -0.183 X(o=-0.18,f=-0.25) USER MOD Single : C 227 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 230 ASN : amide:sc= 0.835 K(o=0.84,f=-4.5!) USER MOD Single : C 231 THR OG1 : rot -159:sc= 0.371 USER MOD Single : C 233 ASN : amide:sc= -0.105 X(o=-0.1,f=0) USER MOD Single : C 234 CYS SG : rot 180:sc= 0 USER MOD Single : C 237 GLN : amide:sc= -0.658 X(o=-0.66,f=-0.39) USER MOD Single : C 243 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 248 GLN : amide:sc= -0.619 K(o=-0.62,f=-3.1) USER MOD Single : C 254 LYS NZ :NH3+ 157:sc= -0.262 (180deg=-0.909!) USER MOD Single : C 261 TYR OH : rot -138:sc= -1.22 USER MOD Single : C 264 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C 267 ASN : amide:sc= -2.73! K(o=-2.7!,f=-0.23) USER MOD Single : C 268 LYS NZ :NH3+ -162:sc= -0.0959 (180deg=-0.459) USER MOD ----------------------------------------------------------------- ATOM 163 N CYS A 11 1.209 0.322 -13.936 1.00 72.13 N ATOM 164 CA CYS A 11 0.062 1.176 -13.889 1.00 3.03 C ATOM 165 C CYS A 11 0.459 2.591 -14.230 1.00 75.11 C ATOM 166 O CYS A 11 1.457 3.095 -13.727 1.00 34.22 O ATOM 167 CB CYS A 11 -0.576 1.124 -12.506 1.00 34.31 C ATOM 168 SG CYS A 11 -2.004 2.218 -12.294 1.00 63.42 S ATOM 0 HA CYS A 11 -0.667 0.830 -14.621 1.00 3.03 H new ATOM 0 HB2 CYS A 11 -0.886 0.099 -12.301 1.00 34.31 H new ATOM 0 HB3 CYS A 11 0.178 1.383 -11.762 1.00 34.31 H new ATOM 173 N ARG A 12 -0.273 3.186 -15.135 1.00 2.11 N ATOM 174 CA ARG A 12 -0.088 4.572 -15.517 1.00 54.50 C ATOM 175 C ARG A 12 -1.408 5.309 -15.395 1.00 10.24 C ATOM 176 O ARG A 12 -1.470 6.443 -14.902 1.00 52.02 O ATOM 177 CB ARG A 12 0.432 4.681 -16.945 1.00 43.44 C ATOM 178 CG ARG A 12 1.800 4.057 -17.165 1.00 12.21 C ATOM 179 CD ARG A 12 2.213 4.167 -18.614 1.00 1.04 C ATOM 180 NE ARG A 12 1.280 3.450 -19.498 1.00 2.55 N ATOM 181 CZ ARG A 12 1.175 3.627 -20.826 1.00 13.40 C ATOM 182 NH1 ARG A 12 1.922 4.542 -21.447 1.00 63.11 N ATOM 183 NH2 ARG A 12 0.315 2.886 -21.525 1.00 45.52 N ATOM 0 H ARG A 12 -1.027 2.719 -15.638 1.00 2.11 H new ATOM 0 HA ARG A 12 0.649 5.020 -14.851 1.00 54.50 H new ATOM 0 HB2 ARG A 12 -0.283 4.205 -17.616 1.00 43.44 H new ATOM 0 HB3 ARG A 12 0.478 5.734 -17.223 1.00 43.44 H new ATOM 0 HG2 ARG A 12 2.537 4.553 -16.533 1.00 12.21 H new ATOM 0 HG3 ARG A 12 1.779 3.009 -16.867 1.00 12.21 H new ATOM 0 HD2 ARG A 12 2.254 5.217 -18.903 1.00 1.04 H new ATOM 0 HD3 ARG A 12 3.217 3.762 -18.739 1.00 1.04 H new ATOM 0 HE ARG A 12 0.662 2.762 -19.067 1.00 2.55 H new ATOM 0 HH11 ARG A 12 2.578 5.112 -20.913 1.00 63.11 H new ATOM 0 HH12 ARG A 12 1.837 4.671 -22.455 1.00 63.11 H new ATOM 0 HH21 ARG A 12 -0.259 2.189 -21.052 1.00 45.52 H new ATOM 0 HH22 ARG A 12 0.231 3.016 -22.533 1.00 45.52 H new ATOM 197 N PHE A 13 -2.465 4.650 -15.843 1.00 35.10 N ATOM 198 CA PHE A 13 -3.801 5.206 -15.825 1.00 51.23 C ATOM 199 C PHE A 13 -4.537 4.689 -14.607 1.00 45.10 C ATOM 200 O PHE A 13 -4.310 3.555 -14.179 1.00 3.34 O ATOM 201 CB PHE A 13 -4.548 4.843 -17.116 1.00 74.13 C ATOM 202 CG PHE A 13 -3.878 5.362 -18.367 1.00 73.31 C ATOM 203 CD1 PHE A 13 -4.131 6.644 -18.823 1.00 14.43 C ATOM 204 CD2 PHE A 13 -2.989 4.567 -19.079 1.00 12.41 C ATOM 205 CE1 PHE A 13 -3.514 7.125 -19.963 1.00 32.12 C ATOM 206 CE2 PHE A 13 -2.370 5.043 -20.218 1.00 22.33 C ATOM 207 CZ PHE A 13 -2.632 6.323 -20.661 1.00 20.42 C ATOM 0 H PHE A 13 -2.415 3.708 -16.231 1.00 35.10 H new ATOM 0 HA PHE A 13 -3.745 6.293 -15.770 1.00 51.23 H new ATOM 0 HB2 PHE A 13 -4.635 3.759 -17.183 1.00 74.13 H new ATOM 0 HB3 PHE A 13 -5.561 5.241 -17.064 1.00 74.13 H new ATOM 0 HD1 PHE A 13 -4.819 7.277 -18.282 1.00 14.43 H new ATOM 0 HD2 PHE A 13 -2.779 3.564 -18.738 1.00 12.41 H new ATOM 0 HE1 PHE A 13 -3.722 8.127 -20.308 1.00 32.12 H new ATOM 0 HE2 PHE A 13 -1.681 4.414 -20.762 1.00 22.33 H new ATOM 0 HZ PHE A 13 -2.149 6.697 -21.551 1.00 20.42 H new ATOM 217 N PHE A 14 -5.414 5.487 -14.061 1.00 41.32 N ATOM 218 CA PHE A 14 -6.045 5.140 -12.817 1.00 0.24 C ATOM 219 C PHE A 14 -7.571 5.127 -12.949 1.00 2.22 C ATOM 220 O PHE A 14 -8.128 5.812 -13.807 1.00 61.12 O ATOM 221 CB PHE A 14 -5.615 6.115 -11.711 1.00 53.34 C ATOM 222 CG PHE A 14 -6.302 7.453 -11.731 1.00 62.23 C ATOM 223 CD1 PHE A 14 -5.889 8.476 -12.566 1.00 54.20 C ATOM 224 CD2 PHE A 14 -7.369 7.675 -10.889 1.00 54.53 C ATOM 225 CE1 PHE A 14 -6.542 9.695 -12.550 1.00 34.15 C ATOM 226 CE2 PHE A 14 -8.024 8.867 -10.863 1.00 71.12 C ATOM 227 CZ PHE A 14 -7.618 9.890 -11.694 1.00 52.41 C ATOM 0 H PHE A 14 -5.707 6.380 -14.457 1.00 41.32 H new ATOM 0 HA PHE A 14 -5.723 4.134 -12.549 1.00 0.24 H new ATOM 0 HB2 PHE A 14 -5.798 5.646 -10.744 1.00 53.34 H new ATOM 0 HB3 PHE A 14 -4.540 6.276 -11.789 1.00 53.34 H new ATOM 0 HD1 PHE A 14 -5.054 8.322 -13.233 1.00 54.20 H new ATOM 0 HD2 PHE A 14 -7.694 6.882 -10.232 1.00 54.53 H new ATOM 0 HE1 PHE A 14 -6.216 10.493 -13.201 1.00 34.15 H new ATOM 0 HE2 PHE A 14 -8.859 9.012 -10.194 1.00 71.12 H new ATOM 0 HZ PHE A 14 -8.134 10.838 -11.679 1.00 52.41 H new ATOM 237 N GLU A 15 -8.218 4.324 -12.127 1.00 54.33 N ATOM 238 CA GLU A 15 -9.660 4.228 -12.084 1.00 53.13 C ATOM 239 C GLU A 15 -10.254 5.547 -11.551 1.00 4.33 C ATOM 240 O GLU A 15 -9.818 6.051 -10.520 1.00 62.22 O ATOM 241 CB GLU A 15 -10.059 3.043 -11.205 1.00 1.34 C ATOM 242 CG GLU A 15 -11.547 2.812 -11.107 1.00 62.03 C ATOM 243 CD GLU A 15 -12.178 2.590 -12.456 1.00 74.24 C ATOM 244 OE1 GLU A 15 -12.173 1.446 -12.947 1.00 40.44 O ATOM 245 OE2 GLU A 15 -12.676 3.574 -13.059 1.00 75.00 O ATOM 0 H GLU A 15 -7.747 3.711 -11.461 1.00 54.33 H new ATOM 0 HA GLU A 15 -10.055 4.063 -13.086 1.00 53.13 H new ATOM 0 HB2 GLU A 15 -9.589 2.141 -11.597 1.00 1.34 H new ATOM 0 HB3 GLU A 15 -9.661 3.200 -10.202 1.00 1.34 H new ATOM 0 HG2 GLU A 15 -11.738 1.947 -10.472 1.00 62.03 H new ATOM 0 HG3 GLU A 15 -12.015 3.670 -10.626 1.00 62.03 H new ATOM 252 N SER A 16 -11.262 6.045 -12.255 1.00 71.01 N ATOM 253 CA SER A 16 -11.867 7.363 -12.049 1.00 14.31 C ATOM 254 C SER A 16 -12.209 7.692 -10.579 1.00 12.13 C ATOM 255 O SER A 16 -11.733 8.702 -10.030 1.00 32.25 O ATOM 256 CB SER A 16 -13.114 7.453 -12.914 1.00 54.31 C ATOM 257 OG SER A 16 -12.800 7.109 -14.257 1.00 71.43 O ATOM 0 H SER A 16 -11.701 5.525 -13.015 1.00 71.01 H new ATOM 0 HA SER A 16 -11.123 8.106 -12.336 1.00 14.31 H new ATOM 0 HB2 SER A 16 -13.883 6.783 -12.529 1.00 54.31 H new ATOM 0 HB3 SER A 16 -13.522 8.463 -12.874 1.00 54.31 H new ATOM 0 HG SER A 16 -13.609 7.168 -14.807 1.00 71.43 H new ATOM 263 N HIS A 17 -13.018 6.871 -9.945 1.00 51.21 N ATOM 264 CA HIS A 17 -13.411 7.142 -8.580 1.00 71.13 C ATOM 265 C HIS A 17 -13.371 5.892 -7.748 1.00 42.44 C ATOM 266 O HIS A 17 -13.708 4.804 -8.217 1.00 15.21 O ATOM 267 CB HIS A 17 -14.792 7.848 -8.479 1.00 54.23 C ATOM 268 CG HIS A 17 -15.969 7.073 -9.015 1.00 31.54 C ATOM 269 ND1 HIS A 17 -16.856 6.409 -8.208 1.00 20.44 N ATOM 270 CD2 HIS A 17 -16.415 6.892 -10.280 1.00 74.44 C ATOM 271 CE1 HIS A 17 -17.791 5.852 -8.939 1.00 60.22 C ATOM 272 NE2 HIS A 17 -17.552 6.126 -10.203 1.00 40.24 N ATOM 0 H HIS A 17 -13.412 6.020 -10.347 1.00 51.21 H new ATOM 0 HA HIS A 17 -12.680 7.843 -8.177 1.00 71.13 H new ATOM 0 HB2 HIS A 17 -14.983 8.082 -7.432 1.00 54.23 H new ATOM 0 HB3 HIS A 17 -14.733 8.797 -9.012 1.00 54.23 H new ATOM 0 HD2 HIS A 17 -15.962 7.278 -11.181 1.00 74.44 H new ATOM 0 HE1 HIS A 17 -18.618 5.267 -8.566 1.00 60.22 H new ATOM 0 HE2 HIS A 17 -18.118 5.820 -10.995 1.00 40.24 H new ATOM 281 N VAL A 18 -12.964 6.053 -6.529 1.00 41.23 N ATOM 282 CA VAL A 18 -12.815 4.970 -5.601 1.00 75.03 C ATOM 283 C VAL A 18 -13.147 5.491 -4.197 1.00 41.15 C ATOM 284 O VAL A 18 -12.819 6.635 -3.867 1.00 64.23 O ATOM 285 CB VAL A 18 -11.356 4.408 -5.667 1.00 41.51 C ATOM 286 CG1 VAL A 18 -10.331 5.481 -5.350 1.00 11.35 C ATOM 287 CG2 VAL A 18 -11.186 3.189 -4.782 1.00 54.13 C ATOM 0 H VAL A 18 -12.719 6.963 -6.139 1.00 41.23 H new ATOM 0 HA VAL A 18 -13.493 4.154 -5.851 1.00 75.03 H new ATOM 0 HB VAL A 18 -11.178 4.086 -6.693 1.00 41.51 H new ATOM 0 HG11 VAL A 18 -9.329 5.055 -5.405 1.00 11.35 H new ATOM 0 HG12 VAL A 18 -10.420 6.294 -6.071 1.00 11.35 H new ATOM 0 HG13 VAL A 18 -10.506 5.866 -4.346 1.00 11.35 H new ATOM 0 HG21 VAL A 18 -10.160 2.827 -4.854 1.00 54.13 H new ATOM 0 HG22 VAL A 18 -11.405 3.457 -3.748 1.00 54.13 H new ATOM 0 HG23 VAL A 18 -11.871 2.405 -5.106 1.00 54.13 H new ATOM 297 N ALA A 19 -13.811 4.687 -3.404 1.00 43.25 N ATOM 298 CA ALA A 19 -14.224 5.092 -2.072 1.00 63.31 C ATOM 299 C ALA A 19 -13.496 4.276 -1.021 1.00 53.41 C ATOM 300 O ALA A 19 -13.433 3.048 -1.118 1.00 32.42 O ATOM 301 CB ALA A 19 -15.730 4.908 -1.923 1.00 70.14 C ATOM 0 H ALA A 19 -14.082 3.737 -3.657 1.00 43.25 H new ATOM 0 HA ALA A 19 -13.973 6.143 -1.930 1.00 63.31 H new ATOM 0 HB1 ALA A 19 -16.037 5.213 -0.922 1.00 70.14 H new ATOM 0 HB2 ALA A 19 -16.246 5.520 -2.663 1.00 70.14 H new ATOM 0 HB3 ALA A 19 -15.985 3.860 -2.077 1.00 70.14 H new ATOM 307 N ARG A 20 -12.967 4.950 -0.001 1.00 21.12 N ATOM 308 CA ARG A 20 -12.226 4.280 1.077 1.00 44.21 C ATOM 309 C ARG A 20 -13.097 3.274 1.822 1.00 34.24 C ATOM 310 O ARG A 20 -12.605 2.289 2.353 1.00 13.32 O ATOM 311 CB ARG A 20 -11.648 5.294 2.061 1.00 2.41 C ATOM 312 CG ARG A 20 -10.894 4.655 3.207 1.00 51.11 C ATOM 313 CD ARG A 20 -10.282 5.672 4.125 1.00 62.43 C ATOM 314 NE ARG A 20 -9.655 5.012 5.271 1.00 63.31 N ATOM 315 CZ ARG A 20 -9.088 5.624 6.304 1.00 63.04 C ATOM 316 NH1 ARG A 20 -8.988 6.952 6.335 1.00 13.42 N ATOM 317 NH2 ARG A 20 -8.614 4.895 7.303 1.00 34.33 N ATOM 0 H ARG A 20 -13.036 5.962 0.105 1.00 21.12 H new ATOM 0 HA ARG A 20 -11.406 3.738 0.607 1.00 44.21 H new ATOM 0 HB2 ARG A 20 -10.979 5.968 1.526 1.00 2.41 H new ATOM 0 HB3 ARG A 20 -12.458 5.902 2.463 1.00 2.41 H new ATOM 0 HG2 ARG A 20 -11.572 4.018 3.775 1.00 51.11 H new ATOM 0 HG3 ARG A 20 -10.110 4.011 2.809 1.00 51.11 H new ATOM 0 HD2 ARG A 20 -9.540 6.259 3.584 1.00 62.43 H new ATOM 0 HD3 ARG A 20 -11.048 6.366 4.471 1.00 62.43 H new ATOM 0 HE ARG A 20 -9.653 3.992 5.277 1.00 63.31 H new ATOM 0 HH11 ARG A 20 -9.349 7.509 5.560 1.00 13.42 H new ATOM 0 HH12 ARG A 20 -8.551 7.412 7.133 1.00 13.42 H new ATOM 0 HH21 ARG A 20 -8.687 3.878 7.272 1.00 34.33 H new ATOM 0 HH22 ARG A 20 -8.176 5.350 8.104 1.00 34.33 H new ATOM 331 N ALA A 21 -14.385 3.520 1.832 1.00 61.43 N ATOM 332 CA ALA A 21 -15.321 2.645 2.505 1.00 30.30 C ATOM 333 C ALA A 21 -15.436 1.301 1.789 1.00 74.53 C ATOM 334 O ALA A 21 -15.875 0.312 2.374 1.00 32.51 O ATOM 335 CB ALA A 21 -16.680 3.311 2.602 1.00 60.23 C ATOM 0 H ALA A 21 -14.814 4.326 1.378 1.00 61.43 H new ATOM 0 HA ALA A 21 -14.946 2.456 3.511 1.00 30.30 H new ATOM 0 HB1 ALA A 21 -17.377 2.644 3.110 1.00 60.23 H new ATOM 0 HB2 ALA A 21 -16.591 4.240 3.165 1.00 60.23 H new ATOM 0 HB3 ALA A 21 -17.051 3.528 1.600 1.00 60.23 H new ATOM 341 N ASN A 22 -15.031 1.267 0.529 1.00 60.31 N ATOM 342 CA ASN A 22 -15.135 0.086 -0.264 1.00 63.22 C ATOM 343 C ASN A 22 -13.751 -0.576 -0.342 1.00 13.23 C ATOM 344 O ASN A 22 -13.637 -1.800 -0.435 1.00 15.25 O ATOM 345 CB ASN A 22 -15.618 0.490 -1.662 1.00 54.21 C ATOM 346 CG ASN A 22 -16.172 -0.652 -2.502 1.00 32.45 C ATOM 347 OD1 ASN A 22 -15.833 -1.828 -2.334 1.00 42.41 O ATOM 348 ND2 ASN A 22 -17.014 -0.296 -3.430 1.00 41.13 N ATOM 0 H ASN A 22 -14.623 2.065 0.042 1.00 60.31 H new ATOM 0 HA ASN A 22 -15.841 -0.621 0.171 1.00 63.22 H new ATOM 0 HB2 ASN A 22 -16.390 1.253 -1.558 1.00 54.21 H new ATOM 0 HB3 ASN A 22 -14.788 0.948 -2.199 1.00 54.21 H new ATOM 0 HD21 ASN A 22 -17.418 -0.999 -4.049 1.00 41.13 H new ATOM 0 HD22 ASN A 22 -17.269 0.686 -3.538 1.00 41.13 H new ATOM 355 N VAL A 23 -12.696 0.253 -0.286 1.00 24.40 N ATOM 356 CA VAL A 23 -11.318 -0.233 -0.361 1.00 42.03 C ATOM 357 C VAL A 23 -10.914 -1.011 0.891 1.00 44.13 C ATOM 358 O VAL A 23 -10.957 -0.497 2.011 1.00 14.34 O ATOM 359 CB VAL A 23 -10.287 0.904 -0.627 1.00 34.31 C ATOM 360 CG1 VAL A 23 -8.893 0.361 -0.766 1.00 74.14 C ATOM 361 CG2 VAL A 23 -10.659 1.685 -1.840 1.00 3.53 C ATOM 0 H VAL A 23 -12.777 1.265 -0.189 1.00 24.40 H new ATOM 0 HA VAL A 23 -11.299 -0.909 -1.216 1.00 42.03 H new ATOM 0 HB VAL A 23 -10.306 1.569 0.236 1.00 34.31 H new ATOM 0 HG11 VAL A 23 -8.200 1.182 -0.951 1.00 74.14 H new ATOM 0 HG12 VAL A 23 -8.610 -0.154 0.152 1.00 74.14 H new ATOM 0 HG13 VAL A 23 -8.857 -0.339 -1.600 1.00 74.14 H new ATOM 0 HG21 VAL A 23 -9.924 2.473 -2.005 1.00 3.53 H new ATOM 0 HG22 VAL A 23 -10.682 1.023 -2.706 1.00 3.53 H new ATOM 0 HG23 VAL A 23 -11.643 2.131 -1.698 1.00 3.53 H new ATOM 371 N LYS A 24 -10.528 -2.249 0.670 1.00 14.15 N ATOM 372 CA LYS A 24 -10.067 -3.143 1.718 1.00 20.21 C ATOM 373 C LYS A 24 -8.663 -2.754 2.122 1.00 53.34 C ATOM 374 O LYS A 24 -8.329 -2.653 3.299 1.00 14.42 O ATOM 375 CB LYS A 24 -9.999 -4.550 1.155 1.00 11.12 C ATOM 376 CG LYS A 24 -11.293 -5.071 0.609 1.00 52.52 C ATOM 377 CD LYS A 24 -11.083 -6.384 -0.127 1.00 33.23 C ATOM 378 CE LYS A 24 -10.467 -7.433 0.782 1.00 22.52 C ATOM 379 NZ LYS A 24 -10.421 -8.782 0.182 1.00 43.22 N ATOM 0 H LYS A 24 -10.524 -2.673 -0.258 1.00 14.15 H new ATOM 0 HA LYS A 24 -10.744 -3.086 2.570 1.00 20.21 H new ATOM 0 HB2 LYS A 24 -9.251 -4.574 0.363 1.00 11.12 H new ATOM 0 HB3 LYS A 24 -9.654 -5.224 1.939 1.00 11.12 H new ATOM 0 HG2 LYS A 24 -12.004 -5.216 1.423 1.00 52.52 H new ATOM 0 HG3 LYS A 24 -11.729 -4.336 -0.068 1.00 52.52 H new ATOM 0 HD2 LYS A 24 -12.037 -6.746 -0.509 1.00 33.23 H new ATOM 0 HD3 LYS A 24 -10.436 -6.221 -0.989 1.00 33.23 H new ATOM 0 HE2 LYS A 24 -9.454 -7.126 1.043 1.00 22.52 H new ATOM 0 HE3 LYS A 24 -11.036 -7.477 1.711 1.00 22.52 H new ATOM 0 HZ1 LYS A 24 -9.990 -9.447 0.855 1.00 43.22 H new ATOM 0 HZ2 LYS A 24 -11.387 -9.095 -0.043 1.00 43.22 H new ATOM 0 HZ3 LYS A 24 -9.854 -8.755 -0.689 1.00 43.22 H new ATOM 393 N HIS A 25 -7.833 -2.576 1.114 1.00 2.23 N ATOM 394 CA HIS A 25 -6.443 -2.211 1.305 1.00 3.23 C ATOM 395 C HIS A 25 -5.895 -1.574 0.040 1.00 3.32 C ATOM 396 O HIS A 25 -6.475 -1.747 -1.045 1.00 2.35 O ATOM 397 CB HIS A 25 -5.577 -3.445 1.716 1.00 35.12 C ATOM 398 CG HIS A 25 -5.526 -4.574 0.717 1.00 41.32 C ATOM 399 ND1 HIS A 25 -6.183 -5.772 0.906 1.00 74.13 N ATOM 400 CD2 HIS A 25 -4.863 -4.697 -0.464 1.00 1.43 C ATOM 401 CE1 HIS A 25 -5.929 -6.576 -0.107 1.00 21.21 C ATOM 402 NE2 HIS A 25 -5.137 -5.950 -0.953 1.00 25.53 N ATOM 0 H HIS A 25 -8.104 -2.681 0.136 1.00 2.23 H new ATOM 0 HA HIS A 25 -6.392 -1.489 2.120 1.00 3.23 H new ATOM 0 HB2 HIS A 25 -4.559 -3.104 1.903 1.00 35.12 H new ATOM 0 HB3 HIS A 25 -5.960 -3.836 2.658 1.00 35.12 H new ATOM 0 HD2 HIS A 25 -4.238 -3.949 -0.930 1.00 1.43 H new ATOM 0 HE1 HIS A 25 -6.307 -7.581 -0.224 1.00 21.21 H new ATOM 0 HE2 HIS A 25 -4.784 -6.334 -1.830 1.00 25.53 H new ATOM 411 N LEU A 26 -4.782 -0.900 0.172 1.00 50.41 N ATOM 412 CA LEU A 26 -4.117 -0.240 -0.940 1.00 75.32 C ATOM 413 C LEU A 26 -2.806 -0.934 -1.201 1.00 14.54 C ATOM 414 O LEU A 26 -2.227 -1.520 -0.299 1.00 71.11 O ATOM 415 CB LEU A 26 -3.815 1.236 -0.610 1.00 55.52 C ATOM 416 CG LEU A 26 -4.982 2.159 -0.353 1.00 65.12 C ATOM 417 CD1 LEU A 26 -4.469 3.540 -0.080 1.00 12.50 C ATOM 418 CD2 LEU A 26 -5.903 2.218 -1.530 1.00 42.31 C ATOM 0 H LEU A 26 -4.299 -0.788 1.064 1.00 50.41 H new ATOM 0 HA LEU A 26 -4.774 -0.286 -1.809 1.00 75.32 H new ATOM 0 HB2 LEU A 26 -3.173 1.256 0.271 1.00 55.52 H new ATOM 0 HB3 LEU A 26 -3.237 1.651 -1.436 1.00 55.52 H new ATOM 0 HG LEU A 26 -5.534 1.772 0.504 1.00 65.12 H new ATOM 0 HD11 LEU A 26 -5.309 4.210 0.106 1.00 12.50 H new ATOM 0 HD12 LEU A 26 -3.819 3.520 0.795 1.00 12.50 H new ATOM 0 HD13 LEU A 26 -3.905 3.896 -0.942 1.00 12.50 H new ATOM 0 HD21 LEU A 26 -6.732 2.891 -1.310 1.00 42.31 H new ATOM 0 HD22 LEU A 26 -5.358 2.585 -2.400 1.00 42.31 H new ATOM 0 HD23 LEU A 26 -6.291 1.221 -1.739 1.00 42.31 H new ATOM 430 N LYS A 27 -2.366 -0.901 -2.418 1.00 31.13 N ATOM 431 CA LYS A 27 -1.105 -1.477 -2.786 1.00 1.02 C ATOM 432 C LYS A 27 -0.272 -0.442 -3.517 1.00 10.21 C ATOM 433 O LYS A 27 -0.689 0.063 -4.543 1.00 71.41 O ATOM 434 CB LYS A 27 -1.319 -2.692 -3.671 1.00 1.24 C ATOM 435 CG LYS A 27 -0.034 -3.406 -3.995 1.00 53.00 C ATOM 436 CD LYS A 27 -0.256 -4.616 -4.864 1.00 21.12 C ATOM 437 CE LYS A 27 -0.764 -4.242 -6.250 1.00 3.42 C ATOM 438 NZ LYS A 27 -0.948 -5.425 -7.109 1.00 21.22 N ATOM 0 H LYS A 27 -2.872 -0.472 -3.192 1.00 31.13 H new ATOM 0 HA LYS A 27 -0.580 -1.794 -1.885 1.00 1.02 H new ATOM 0 HB2 LYS A 27 -1.999 -3.384 -3.174 1.00 1.24 H new ATOM 0 HB3 LYS A 27 -1.801 -2.381 -4.598 1.00 1.24 H new ATOM 0 HG2 LYS A 27 0.644 -2.718 -4.500 1.00 53.00 H new ATOM 0 HG3 LYS A 27 0.453 -3.711 -3.069 1.00 53.00 H new ATOM 0 HD2 LYS A 27 0.678 -5.170 -4.958 1.00 21.12 H new ATOM 0 HD3 LYS A 27 -0.974 -5.280 -4.383 1.00 21.12 H new ATOM 0 HE2 LYS A 27 -1.711 -3.710 -6.158 1.00 3.42 H new ATOM 0 HE3 LYS A 27 -0.059 -3.558 -6.722 1.00 3.42 H new ATOM 0 HZ1 LYS A 27 -1.295 -5.126 -8.043 1.00 21.22 H new ATOM 0 HZ2 LYS A 27 -0.039 -5.919 -7.219 1.00 21.22 H new ATOM 0 HZ3 LYS A 27 -1.640 -6.067 -6.672 1.00 21.22 H new ATOM 452 N ILE A 28 0.882 -0.136 -2.984 1.00 41.02 N ATOM 453 CA ILE A 28 1.772 0.848 -3.561 1.00 21.25 C ATOM 454 C ILE A 28 2.906 0.107 -4.260 1.00 70.33 C ATOM 455 O ILE A 28 3.674 -0.589 -3.604 1.00 65.44 O ATOM 456 CB ILE A 28 2.425 1.718 -2.472 1.00 42.02 C ATOM 457 CG1 ILE A 28 1.392 2.316 -1.516 1.00 65.42 C ATOM 458 CG2 ILE A 28 3.181 2.857 -3.149 1.00 54.05 C ATOM 459 CD1 ILE A 28 0.576 3.413 -2.112 1.00 14.13 C ATOM 0 H ILE A 28 1.237 -0.565 -2.129 1.00 41.02 H new ATOM 0 HA ILE A 28 1.194 1.476 -4.238 1.00 21.25 H new ATOM 0 HB ILE A 28 3.094 1.084 -1.890 1.00 42.02 H new ATOM 0 HG12 ILE A 28 0.724 1.524 -1.177 1.00 65.42 H new ATOM 0 HG13 ILE A 28 1.907 2.698 -0.634 1.00 65.42 H new ATOM 0 HG21 ILE A 28 3.650 3.484 -2.391 1.00 54.05 H new ATOM 0 HG22 ILE A 28 3.948 2.445 -3.805 1.00 54.05 H new ATOM 0 HG23 ILE A 28 2.486 3.457 -3.736 1.00 54.05 H new ATOM 0 HD11 ILE A 28 -0.132 3.783 -1.371 1.00 14.13 H new ATOM 0 HD12 ILE A 28 1.232 4.225 -2.425 1.00 14.13 H new ATOM 0 HD13 ILE A 28 0.031 3.033 -2.976 1.00 14.13 H new ATOM 471 N LEU A 29 3.006 0.238 -5.555 1.00 33.22 N ATOM 472 CA LEU A 29 4.050 -0.451 -6.322 1.00 14.02 C ATOM 473 C LEU A 29 5.371 0.306 -6.249 1.00 52.10 C ATOM 474 O LEU A 29 5.376 1.539 -6.212 1.00 2.24 O ATOM 475 CB LEU A 29 3.645 -0.659 -7.800 1.00 10.45 C ATOM 476 CG LEU A 29 2.465 -1.619 -8.117 1.00 73.02 C ATOM 477 CD1 LEU A 29 1.149 -1.170 -7.492 1.00 24.55 C ATOM 478 CD2 LEU A 29 2.310 -1.767 -9.615 1.00 53.03 C ATOM 0 H LEU A 29 2.381 0.815 -6.118 1.00 33.22 H new ATOM 0 HA LEU A 29 4.176 -1.433 -5.867 1.00 14.02 H new ATOM 0 HB2 LEU A 29 3.399 0.318 -8.217 1.00 10.45 H new ATOM 0 HB3 LEU A 29 4.522 -1.023 -8.336 1.00 10.45 H new ATOM 0 HG LEU A 29 2.709 -2.584 -7.672 1.00 73.02 H new ATOM 0 HD11 LEU A 29 0.363 -1.880 -7.749 1.00 24.55 H new ATOM 0 HD12 LEU A 29 1.257 -1.125 -6.408 1.00 24.55 H new ATOM 0 HD13 LEU A 29 0.884 -0.183 -7.871 1.00 24.55 H new ATOM 0 HD21 LEU A 29 1.481 -2.441 -9.830 1.00 53.03 H new ATOM 0 HD22 LEU A 29 2.109 -0.792 -10.058 1.00 53.03 H new ATOM 0 HD23 LEU A 29 3.228 -2.175 -10.037 1.00 53.03 H new ATOM 490 N ASN A 30 6.496 -0.419 -6.206 1.00 12.05 N ATOM 491 CA ASN A 30 7.797 0.243 -6.165 1.00 33.44 C ATOM 492 C ASN A 30 8.208 0.553 -7.576 1.00 32.01 C ATOM 493 O ASN A 30 8.528 -0.348 -8.358 1.00 70.51 O ATOM 494 CB ASN A 30 8.874 -0.682 -5.545 1.00 44.55 C ATOM 495 CG ASN A 30 10.201 0.025 -5.228 1.00 74.31 C ATOM 496 OD1 ASN A 30 10.563 1.037 -5.833 1.00 11.14 O ATOM 497 ND2 ASN A 30 10.947 -0.525 -4.286 1.00 41.21 N ATOM 0 H ASN A 30 6.529 -1.438 -6.199 1.00 12.05 H new ATOM 0 HA ASN A 30 7.714 1.145 -5.559 1.00 33.44 H new ATOM 0 HB2 ASN A 30 8.479 -1.118 -4.627 1.00 44.55 H new ATOM 0 HB3 ASN A 30 9.069 -1.506 -6.231 1.00 44.55 H new ATOM 0 HD21 ASN A 30 11.848 -0.112 -4.043 1.00 41.21 H new ATOM 0 HD22 ASN A 30 10.622 -1.362 -3.802 1.00 41.21 H new ATOM 504 N THR A 31 8.157 1.788 -7.918 1.00 60.05 N ATOM 505 CA THR A 31 8.598 2.214 -9.187 1.00 33.24 C ATOM 506 C THR A 31 9.727 3.234 -9.038 1.00 23.34 C ATOM 507 O THR A 31 9.529 4.288 -8.433 1.00 14.12 O ATOM 508 CB THR A 31 7.414 2.785 -9.982 1.00 45.33 C ATOM 509 OG1 THR A 31 6.695 3.733 -9.162 1.00 22.01 O ATOM 510 CG2 THR A 31 6.461 1.671 -10.422 1.00 72.52 C ATOM 0 H THR A 31 7.805 2.534 -7.318 1.00 60.05 H new ATOM 0 HA THR A 31 8.996 1.364 -9.741 1.00 33.24 H new ATOM 0 HB THR A 31 7.804 3.280 -10.872 1.00 45.33 H new ATOM 0 HG1 THR A 31 7.177 4.586 -9.150 1.00 22.01 H new ATOM 0 HG21 THR A 31 5.632 2.102 -10.983 1.00 72.52 H new ATOM 0 HG22 THR A 31 6.997 0.962 -11.054 1.00 72.52 H new ATOM 0 HG23 THR A 31 6.075 1.154 -9.543 1.00 72.52 H new ATOM 518 N PRO A 32 10.926 2.943 -9.567 1.00 53.03 N ATOM 519 CA PRO A 32 12.058 3.871 -9.491 1.00 72.11 C ATOM 520 C PRO A 32 11.824 5.194 -10.258 1.00 25.50 C ATOM 521 O PRO A 32 12.272 6.263 -9.819 1.00 44.24 O ATOM 522 CB PRO A 32 13.225 3.081 -10.114 1.00 33.51 C ATOM 523 CG PRO A 32 12.580 2.003 -10.918 1.00 50.42 C ATOM 524 CD PRO A 32 11.300 1.665 -10.212 1.00 0.00 C ATOM 0 HA PRO A 32 12.237 4.185 -8.463 1.00 72.11 H new ATOM 0 HB2 PRO A 32 13.845 3.722 -10.740 1.00 33.51 H new ATOM 0 HB3 PRO A 32 13.874 2.664 -9.344 1.00 33.51 H new ATOM 0 HG2 PRO A 32 12.386 2.340 -11.936 1.00 50.42 H new ATOM 0 HG3 PRO A 32 13.228 1.129 -10.989 1.00 50.42 H new ATOM 0 HD2 PRO A 32 10.533 1.325 -10.908 1.00 0.00 H new ATOM 0 HD3 PRO A 32 11.441 0.870 -9.480 1.00 0.00 H new ATOM 532 N ASN A 33 11.109 5.126 -11.374 1.00 43.13 N ATOM 533 CA ASN A 33 10.897 6.306 -12.235 1.00 44.13 C ATOM 534 C ASN A 33 9.449 6.768 -12.275 1.00 22.54 C ATOM 535 O ASN A 33 9.077 7.610 -13.085 1.00 60.32 O ATOM 536 CB ASN A 33 11.445 6.067 -13.649 1.00 34.11 C ATOM 537 CG ASN A 33 12.964 5.993 -13.676 1.00 71.40 C ATOM 538 OD1 ASN A 33 13.641 6.640 -12.878 1.00 22.44 O ATOM 539 ND2 ASN A 33 13.511 5.217 -14.575 1.00 61.55 N ATOM 0 H ASN A 33 10.663 4.273 -11.712 1.00 43.13 H new ATOM 0 HA ASN A 33 11.462 7.120 -11.780 1.00 44.13 H new ATOM 0 HB2 ASN A 33 11.031 5.139 -14.044 1.00 34.11 H new ATOM 0 HB3 ASN A 33 11.111 6.870 -14.306 1.00 34.11 H new ATOM 0 HD21 ASN A 33 14.526 5.135 -14.629 1.00 61.55 H new ATOM 0 HD22 ASN A 33 12.922 4.693 -15.223 1.00 61.55 H new ATOM 546 N CYS A 34 8.647 6.243 -11.398 1.00 40.33 N ATOM 547 CA CYS A 34 7.266 6.679 -11.265 1.00 52.42 C ATOM 548 C CYS A 34 7.009 6.992 -9.820 1.00 33.13 C ATOM 549 O CYS A 34 7.523 6.300 -8.933 1.00 2.21 O ATOM 550 CB CYS A 34 6.278 5.622 -11.775 1.00 20.42 C ATOM 551 SG CYS A 34 6.408 5.259 -13.549 1.00 73.12 S ATOM 0 H CYS A 34 8.918 5.502 -10.751 1.00 40.33 H new ATOM 0 HA CYS A 34 7.113 7.567 -11.878 1.00 52.42 H new ATOM 0 HB2 CYS A 34 6.433 4.699 -11.216 1.00 20.42 H new ATOM 0 HB3 CYS A 34 5.264 5.958 -11.560 1.00 20.42 H new ATOM 0 HG CYS A 34 5.532 4.354 -13.872 1.00 73.12 H new ATOM 556 N ALA A 35 6.256 8.016 -9.562 1.00 21.15 N ATOM 557 CA ALA A 35 6.020 8.419 -8.215 1.00 32.10 C ATOM 558 C ALA A 35 4.731 7.855 -7.681 1.00 40.45 C ATOM 559 O ALA A 35 3.653 8.435 -7.896 1.00 70.21 O ATOM 560 CB ALA A 35 6.055 9.930 -8.077 1.00 13.22 C ATOM 0 H ALA A 35 5.794 8.588 -10.270 1.00 21.15 H new ATOM 0 HA ALA A 35 6.829 8.009 -7.610 1.00 32.10 H new ATOM 0 HB1 ALA A 35 5.872 10.205 -7.038 1.00 13.22 H new ATOM 0 HB2 ALA A 35 7.033 10.301 -8.383 1.00 13.22 H new ATOM 0 HB3 ALA A 35 5.285 10.371 -8.710 1.00 13.22 H new ATOM 566 N CYS A 36 4.847 6.700 -7.033 1.00 22.43 N ATOM 567 CA CYS A 36 3.750 6.051 -6.318 1.00 32.33 C ATOM 568 C CYS A 36 2.611 5.527 -7.232 1.00 42.21 C ATOM 569 O CYS A 36 1.853 6.297 -7.825 1.00 24.51 O ATOM 570 CB CYS A 36 3.214 7.013 -5.248 1.00 74.35 C ATOM 571 SG CYS A 36 1.868 6.377 -4.227 1.00 44.00 S ATOM 0 H CYS A 36 5.722 6.178 -6.989 1.00 22.43 H new ATOM 0 HA CYS A 36 4.157 5.154 -5.851 1.00 32.33 H new ATOM 0 HB2 CYS A 36 4.039 7.296 -4.594 1.00 74.35 H new ATOM 0 HB3 CYS A 36 2.872 7.923 -5.742 1.00 74.35 H new ATOM 576 N GLN A 37 2.516 4.209 -7.357 1.00 60.02 N ATOM 577 CA GLN A 37 1.399 3.592 -8.068 1.00 62.54 C ATOM 578 C GLN A 37 0.526 2.892 -7.046 1.00 74.42 C ATOM 579 O GLN A 37 1.008 2.010 -6.339 1.00 61.43 O ATOM 580 CB GLN A 37 1.875 2.565 -9.089 1.00 32.45 C ATOM 581 CG GLN A 37 2.887 3.073 -10.112 1.00 34.05 C ATOM 582 CD GLN A 37 2.446 4.313 -10.895 1.00 24.42 C ATOM 583 OE1 GLN A 37 3.275 5.093 -11.310 1.00 54.31 O ATOM 584 NE2 GLN A 37 1.165 4.511 -11.079 1.00 34.31 N ATOM 0 H GLN A 37 3.194 3.548 -6.978 1.00 60.02 H new ATOM 0 HA GLN A 37 0.853 4.369 -8.603 1.00 62.54 H new ATOM 0 HB2 GLN A 37 2.317 1.725 -8.554 1.00 32.45 H new ATOM 0 HB3 GLN A 37 1.006 2.181 -9.624 1.00 32.45 H new ATOM 0 HG2 GLN A 37 3.820 3.300 -9.596 1.00 34.05 H new ATOM 0 HG3 GLN A 37 3.100 2.272 -10.819 1.00 34.05 H new ATOM 0 HE21 GLN A 37 0.488 3.838 -10.719 1.00 34.31 H new ATOM 0 HE22 GLN A 37 0.844 5.338 -11.582 1.00 34.31 H new ATOM 593 N ILE A 38 -0.730 3.269 -6.958 1.00 50.31 N ATOM 594 CA ILE A 38 -1.602 2.727 -5.933 1.00 62.21 C ATOM 595 C ILE A 38 -2.727 1.896 -6.516 1.00 1.34 C ATOM 596 O ILE A 38 -3.372 2.290 -7.459 1.00 4.54 O ATOM 597 CB ILE A 38 -2.226 3.853 -5.093 1.00 31.04 C ATOM 598 CG1 ILE A 38 -1.139 4.826 -4.686 1.00 21.52 C ATOM 599 CG2 ILE A 38 -2.939 3.282 -3.861 1.00 12.12 C ATOM 600 CD1 ILE A 38 -1.568 5.842 -3.695 1.00 72.04 C ATOM 0 H ILE A 38 -1.172 3.946 -7.580 1.00 50.31 H new ATOM 0 HA ILE A 38 -0.976 2.089 -5.310 1.00 62.21 H new ATOM 0 HB ILE A 38 -2.973 4.377 -5.689 1.00 31.04 H new ATOM 0 HG12 ILE A 38 -0.301 4.264 -4.273 1.00 21.52 H new ATOM 0 HG13 ILE A 38 -0.773 5.336 -5.577 1.00 21.52 H new ATOM 0 HG21 ILE A 38 -3.373 4.097 -3.282 1.00 12.12 H new ATOM 0 HG22 ILE A 38 -3.729 2.603 -4.180 1.00 12.12 H new ATOM 0 HG23 ILE A 38 -2.222 2.740 -3.244 1.00 12.12 H new ATOM 0 HD11 ILE A 38 -0.729 6.497 -3.459 1.00 72.04 H new ATOM 0 HD12 ILE A 38 -2.385 6.433 -4.110 1.00 72.04 H new ATOM 0 HD13 ILE A 38 -1.906 5.344 -2.786 1.00 72.04 H new ATOM 612 N VAL A 39 -2.941 0.762 -5.935 1.00 32.45 N ATOM 613 CA VAL A 39 -4.032 -0.111 -6.281 1.00 71.24 C ATOM 614 C VAL A 39 -5.024 -0.231 -5.129 1.00 22.13 C ATOM 615 O VAL A 39 -4.628 -0.387 -3.978 1.00 43.15 O ATOM 616 CB VAL A 39 -3.526 -1.518 -6.762 1.00 52.13 C ATOM 617 CG1 VAL A 39 -4.584 -2.585 -6.578 1.00 52.23 C ATOM 618 CG2 VAL A 39 -3.180 -1.461 -8.234 1.00 53.52 C ATOM 0 H VAL A 39 -2.351 0.400 -5.186 1.00 32.45 H new ATOM 0 HA VAL A 39 -4.557 0.339 -7.124 1.00 71.24 H new ATOM 0 HB VAL A 39 -2.652 -1.770 -6.161 1.00 52.13 H new ATOM 0 HG11 VAL A 39 -4.197 -3.544 -6.922 1.00 52.23 H new ATOM 0 HG12 VAL A 39 -4.848 -2.657 -5.523 1.00 52.23 H new ATOM 0 HG13 VAL A 39 -5.470 -2.323 -7.156 1.00 52.23 H new ATOM 0 HG21 VAL A 39 -2.829 -2.439 -8.563 1.00 53.52 H new ATOM 0 HG22 VAL A 39 -4.065 -1.181 -8.805 1.00 53.52 H new ATOM 0 HG23 VAL A 39 -2.396 -0.721 -8.395 1.00 53.52 H new ATOM 628 N ALA A 40 -6.299 -0.149 -5.453 1.00 74.53 N ATOM 629 CA ALA A 40 -7.352 -0.314 -4.496 1.00 71.45 C ATOM 630 C ALA A 40 -8.079 -1.600 -4.782 1.00 11.12 C ATOM 631 O ALA A 40 -8.484 -1.848 -5.924 1.00 52.10 O ATOM 632 CB ALA A 40 -8.334 0.826 -4.599 1.00 12.52 C ATOM 0 H ALA A 40 -6.627 0.036 -6.401 1.00 74.53 H new ATOM 0 HA ALA A 40 -6.921 -0.332 -3.495 1.00 71.45 H new ATOM 0 HB1 ALA A 40 -9.129 0.688 -3.866 1.00 12.52 H new ATOM 0 HB2 ALA A 40 -7.820 1.767 -4.405 1.00 12.52 H new ATOM 0 HB3 ALA A 40 -8.763 0.847 -5.601 1.00 12.52 H new ATOM 638 N ARG A 41 -8.220 -2.446 -3.789 1.00 60.51 N ATOM 639 CA ARG A 41 -8.971 -3.644 -3.988 1.00 4.02 C ATOM 640 C ARG A 41 -10.192 -3.502 -3.152 1.00 75.03 C ATOM 641 O ARG A 41 -10.101 -3.397 -1.919 1.00 54.43 O ATOM 642 CB ARG A 41 -8.174 -4.889 -3.592 1.00 32.53 C ATOM 643 CG ARG A 41 -8.575 -6.151 -4.370 1.00 45.12 C ATOM 644 CD ARG A 41 -9.989 -6.638 -4.102 1.00 32.33 C ATOM 645 NE ARG A 41 -10.282 -7.862 -4.858 1.00 53.22 N ATOM 646 CZ ARG A 41 -11.468 -8.488 -4.896 1.00 40.43 C ATOM 647 NH1 ARG A 41 -12.525 -7.972 -4.280 1.00 5.15 N ATOM 648 NH2 ARG A 41 -11.589 -9.624 -5.585 1.00 10.23 N ATOM 0 H ARG A 41 -7.829 -2.324 -2.855 1.00 60.51 H new ATOM 0 HA ARG A 41 -9.218 -3.777 -5.041 1.00 4.02 H new ATOM 0 HB2 ARG A 41 -7.113 -4.696 -3.751 1.00 32.53 H new ATOM 0 HB3 ARG A 41 -8.308 -5.072 -2.526 1.00 32.53 H new ATOM 0 HG2 ARG A 41 -8.469 -5.953 -5.437 1.00 45.12 H new ATOM 0 HG3 ARG A 41 -7.877 -6.951 -4.124 1.00 45.12 H new ATOM 0 HD2 ARG A 41 -10.115 -6.827 -3.036 1.00 32.33 H new ATOM 0 HD3 ARG A 41 -10.702 -5.860 -4.374 1.00 32.33 H new ATOM 0 HE ARG A 41 -9.520 -8.271 -5.400 1.00 53.22 H new ATOM 0 HH11 ARG A 41 -12.440 -7.092 -3.772 1.00 5.15 H new ATOM 0 HH12 ARG A 41 -13.422 -8.456 -4.315 1.00 5.15 H new ATOM 0 HH21 ARG A 41 -10.784 -10.010 -6.078 1.00 10.23 H new ATOM 0 HH22 ARG A 41 -12.487 -10.107 -5.619 1.00 10.23 H new ATOM 662 N LEU A 42 -11.301 -3.460 -3.794 1.00 2.32 N ATOM 663 CA LEU A 42 -12.537 -3.201 -3.150 1.00 4.43 C ATOM 664 C LEU A 42 -13.159 -4.474 -2.618 1.00 12.20 C ATOM 665 O LEU A 42 -12.816 -5.576 -3.055 1.00 60.14 O ATOM 666 CB LEU A 42 -13.495 -2.510 -4.117 1.00 52.42 C ATOM 667 CG LEU A 42 -13.035 -1.202 -4.764 1.00 24.45 C ATOM 668 CD1 LEU A 42 -12.584 -0.204 -3.749 1.00 44.51 C ATOM 669 CD2 LEU A 42 -12.008 -1.400 -5.834 1.00 52.34 C ATOM 0 H LEU A 42 -11.378 -3.607 -4.800 1.00 2.32 H new ATOM 0 HA LEU A 42 -12.345 -2.543 -2.302 1.00 4.43 H new ATOM 0 HB2 LEU A 42 -13.731 -3.214 -4.915 1.00 52.42 H new ATOM 0 HB3 LEU A 42 -14.424 -2.311 -3.583 1.00 52.42 H new ATOM 0 HG LEU A 42 -13.916 -0.794 -5.260 1.00 24.45 H new ATOM 0 HD11 LEU A 42 -12.266 0.709 -4.253 1.00 44.51 H new ATOM 0 HD12 LEU A 42 -13.407 0.023 -3.071 1.00 44.51 H new ATOM 0 HD13 LEU A 42 -11.749 -0.614 -3.181 1.00 44.51 H new ATOM 0 HD21 LEU A 42 -11.726 -0.433 -6.251 1.00 52.34 H new ATOM 0 HD22 LEU A 42 -11.128 -1.883 -5.409 1.00 52.34 H new ATOM 0 HD23 LEU A 42 -12.421 -2.029 -6.623 1.00 52.34 H new ATOM 681 N LYS A 43 -14.050 -4.318 -1.672 1.00 51.25 N ATOM 682 CA LYS A 43 -14.753 -5.439 -1.065 1.00 62.24 C ATOM 683 C LYS A 43 -15.968 -5.823 -1.900 1.00 61.02 C ATOM 684 O LYS A 43 -16.409 -6.970 -1.892 1.00 31.22 O ATOM 685 CB LYS A 43 -15.171 -5.094 0.377 1.00 30.23 C ATOM 686 CG LYS A 43 -16.093 -3.885 0.483 1.00 70.15 C ATOM 687 CD LYS A 43 -16.433 -3.556 1.923 1.00 10.42 C ATOM 688 CE LYS A 43 -17.339 -2.338 1.996 1.00 52.34 C ATOM 689 NZ LYS A 43 -17.643 -1.943 3.384 1.00 70.32 N ATOM 0 H LYS A 43 -14.315 -3.409 -1.294 1.00 51.25 H new ATOM 0 HA LYS A 43 -14.078 -6.294 -1.032 1.00 62.24 H new ATOM 0 HB2 LYS A 43 -15.670 -5.958 0.816 1.00 30.23 H new ATOM 0 HB3 LYS A 43 -14.275 -4.908 0.969 1.00 30.23 H new ATOM 0 HG2 LYS A 43 -15.616 -3.023 0.017 1.00 70.15 H new ATOM 0 HG3 LYS A 43 -17.011 -4.079 -0.071 1.00 70.15 H new ATOM 0 HD2 LYS A 43 -16.924 -4.410 2.390 1.00 10.42 H new ATOM 0 HD3 LYS A 43 -15.518 -3.369 2.484 1.00 10.42 H new ATOM 0 HE2 LYS A 43 -16.863 -1.504 1.480 1.00 52.34 H new ATOM 0 HE3 LYS A 43 -18.270 -2.549 1.470 1.00 52.34 H new ATOM 0 HZ1 LYS A 43 -18.672 -1.854 3.502 1.00 70.32 H new ATOM 0 HZ2 LYS A 43 -17.280 -2.666 4.038 1.00 70.32 H new ATOM 0 HZ3 LYS A 43 -17.191 -1.030 3.592 1.00 70.32 H new ATOM 745 N ARG A 47 -14.104 -4.809 -8.247 1.00 12.35 N ATOM 746 CA ARG A 47 -12.899 -5.491 -8.671 1.00 20.34 C ATOM 747 C ARG A 47 -11.651 -4.940 -7.963 1.00 43.14 C ATOM 748 O ARG A 47 -11.728 -4.373 -6.867 1.00 23.21 O ATOM 749 CB ARG A 47 -12.759 -5.315 -10.179 1.00 74.40 C ATOM 750 CG ARG A 47 -13.943 -5.781 -11.035 1.00 34.12 C ATOM 751 CD ARG A 47 -14.236 -7.271 -10.926 1.00 20.44 C ATOM 752 NE ARG A 47 -14.988 -7.622 -9.710 1.00 51.53 N ATOM 753 CZ ARG A 47 -14.951 -8.819 -9.111 1.00 3.42 C ATOM 754 NH1 ARG A 47 -14.084 -9.736 -9.516 1.00 32.04 N ATOM 755 NH2 ARG A 47 -15.779 -9.094 -8.099 1.00 21.44 N ATOM 0 HA ARG A 47 -12.979 -6.546 -8.408 1.00 20.34 H new ATOM 0 HB2 ARG A 47 -12.584 -4.259 -10.384 1.00 74.40 H new ATOM 0 HB3 ARG A 47 -11.870 -5.854 -10.504 1.00 74.40 H new ATOM 0 HG2 ARG A 47 -14.832 -5.224 -10.741 1.00 34.12 H new ATOM 0 HG3 ARG A 47 -13.743 -5.536 -12.078 1.00 34.12 H new ATOM 0 HD2 ARG A 47 -14.802 -7.589 -11.801 1.00 20.44 H new ATOM 0 HD3 ARG A 47 -13.296 -7.822 -10.937 1.00 20.44 H new ATOM 0 HE ARG A 47 -15.579 -6.902 -9.294 1.00 51.53 H new ATOM 0 HH11 ARG A 47 -13.445 -9.530 -10.284 1.00 32.04 H new ATOM 0 HH12 ARG A 47 -14.056 -10.648 -9.060 1.00 32.04 H new ATOM 0 HH21 ARG A 47 -16.444 -8.390 -7.779 1.00 21.44 H new ATOM 0 HH22 ARG A 47 -15.746 -10.008 -7.647 1.00 21.44 H new ATOM 769 N GLN A 48 -10.515 -5.185 -8.559 1.00 3.23 N ATOM 770 CA GLN A 48 -9.274 -4.609 -8.122 1.00 0.03 C ATOM 771 C GLN A 48 -8.913 -3.566 -9.160 1.00 12.12 C ATOM 772 O GLN A 48 -8.992 -3.844 -10.355 1.00 44.41 O ATOM 773 CB GLN A 48 -8.198 -5.686 -8.056 1.00 11.00 C ATOM 774 CG GLN A 48 -6.844 -5.192 -7.583 1.00 71.13 C ATOM 775 CD GLN A 48 -5.811 -6.282 -7.582 1.00 44.52 C ATOM 776 OE1 GLN A 48 -5.127 -6.502 -8.573 1.00 62.52 O ATOM 777 NE2 GLN A 48 -5.681 -6.967 -6.485 1.00 51.12 N ATOM 0 H GLN A 48 -10.425 -5.797 -9.370 1.00 3.23 H new ATOM 0 HA GLN A 48 -9.358 -4.169 -7.129 1.00 0.03 H new ATOM 0 HB2 GLN A 48 -8.535 -6.479 -7.388 1.00 11.00 H new ATOM 0 HB3 GLN A 48 -8.084 -6.129 -9.045 1.00 11.00 H new ATOM 0 HG2 GLN A 48 -6.511 -4.378 -8.227 1.00 71.13 H new ATOM 0 HG3 GLN A 48 -6.939 -4.783 -6.577 1.00 71.13 H new ATOM 0 HE21 GLN A 48 -6.269 -6.755 -5.679 1.00 51.12 H new ATOM 0 HE22 GLN A 48 -4.991 -7.716 -6.430 1.00 51.12 H new ATOM 786 N VAL A 49 -8.536 -2.395 -8.738 1.00 52.11 N ATOM 787 CA VAL A 49 -8.290 -1.308 -9.663 1.00 4.41 C ATOM 788 C VAL A 49 -7.072 -0.539 -9.259 1.00 74.01 C ATOM 789 O VAL A 49 -6.671 -0.571 -8.106 1.00 41.10 O ATOM 790 CB VAL A 49 -9.502 -0.324 -9.758 1.00 24.40 C ATOM 791 CG1 VAL A 49 -10.727 -1.002 -10.347 1.00 54.41 C ATOM 792 CG2 VAL A 49 -9.836 0.266 -8.391 1.00 41.52 C ATOM 0 H VAL A 49 -8.389 -2.159 -7.756 1.00 52.11 H new ATOM 0 HA VAL A 49 -8.139 -1.762 -10.643 1.00 4.41 H new ATOM 0 HB VAL A 49 -9.208 0.485 -10.426 1.00 24.40 H new ATOM 0 HG11 VAL A 49 -11.549 -0.288 -10.398 1.00 54.41 H new ATOM 0 HG12 VAL A 49 -10.497 -1.362 -11.350 1.00 54.41 H new ATOM 0 HG13 VAL A 49 -11.016 -1.843 -9.717 1.00 54.41 H new ATOM 0 HG21 VAL A 49 -10.682 0.947 -8.485 1.00 41.52 H new ATOM 0 HG22 VAL A 49 -10.092 -0.538 -7.701 1.00 41.52 H new ATOM 0 HG23 VAL A 49 -8.973 0.811 -8.009 1.00 41.52 H new ATOM 802 N CYS A 50 -6.488 0.144 -10.180 1.00 34.10 N ATOM 803 CA CYS A 50 -5.367 0.956 -9.871 1.00 15.25 C ATOM 804 C CYS A 50 -5.848 2.381 -9.830 1.00 21.00 C ATOM 805 O CYS A 50 -6.492 2.841 -10.749 1.00 24.44 O ATOM 806 CB CYS A 50 -4.250 0.769 -10.894 1.00 42.34 C ATOM 807 SG CYS A 50 -2.733 1.681 -10.499 1.00 15.34 S ATOM 0 H CYS A 50 -6.771 0.155 -11.160 1.00 34.10 H new ATOM 0 HA CYS A 50 -4.944 0.674 -8.907 1.00 15.25 H new ATOM 0 HB2 CYS A 50 -4.015 -0.293 -10.971 1.00 42.34 H new ATOM 0 HB3 CYS A 50 -4.610 1.087 -11.873 1.00 42.34 H new ATOM 812 N ILE A 51 -5.570 3.053 -8.757 1.00 65.43 N ATOM 813 CA ILE A 51 -6.063 4.379 -8.519 1.00 73.13 C ATOM 814 C ILE A 51 -4.939 5.394 -8.441 1.00 30.24 C ATOM 815 O ILE A 51 -3.776 5.062 -8.660 1.00 63.43 O ATOM 816 CB ILE A 51 -6.922 4.422 -7.262 1.00 5.52 C ATOM 817 CG1 ILE A 51 -6.195 3.817 -6.087 1.00 54.21 C ATOM 818 CG2 ILE A 51 -8.228 3.697 -7.513 1.00 42.34 C ATOM 819 CD1 ILE A 51 -6.951 3.944 -4.806 1.00 4.22 C ATOM 0 H ILE A 51 -4.983 2.691 -8.006 1.00 65.43 H new ATOM 0 HA ILE A 51 -6.687 4.651 -9.370 1.00 73.13 H new ATOM 0 HB ILE A 51 -7.133 5.463 -7.019 1.00 5.52 H new ATOM 0 HG12 ILE A 51 -6.005 2.763 -6.288 1.00 54.21 H new ATOM 0 HG13 ILE A 51 -5.224 4.301 -5.979 1.00 54.21 H new ATOM 0 HG21 ILE A 51 -8.841 3.729 -6.612 1.00 42.34 H new ATOM 0 HG22 ILE A 51 -8.761 4.180 -8.332 1.00 42.34 H new ATOM 0 HG23 ILE A 51 -8.023 2.659 -7.776 1.00 42.34 H new ATOM 0 HD11 ILE A 51 -6.377 3.490 -3.998 1.00 4.22 H new ATOM 0 HD12 ILE A 51 -7.118 4.998 -4.585 1.00 4.22 H new ATOM 0 HD13 ILE A 51 -7.911 3.436 -4.898 1.00 4.22 H new ATOM 831 N ASP A 52 -5.272 6.622 -8.142 1.00 72.02 N ATOM 832 CA ASP A 52 -4.283 7.688 -8.177 1.00 33.41 C ATOM 833 C ASP A 52 -3.919 8.181 -6.780 1.00 62.23 C ATOM 834 O ASP A 52 -4.784 8.405 -5.951 1.00 32.13 O ATOM 835 CB ASP A 52 -4.794 8.849 -9.017 1.00 64.43 C ATOM 836 CG ASP A 52 -3.738 9.871 -9.312 1.00 71.32 C ATOM 837 OD1 ASP A 52 -3.573 10.809 -8.547 1.00 34.41 O ATOM 838 OD2 ASP A 52 -3.070 9.749 -10.345 1.00 21.43 O ATOM 0 H ASP A 52 -6.211 6.916 -7.872 1.00 72.02 H new ATOM 0 HA ASP A 52 -3.380 7.277 -8.628 1.00 33.41 H new ATOM 0 HB2 ASP A 52 -5.190 8.463 -9.956 1.00 64.43 H new ATOM 0 HB3 ASP A 52 -5.621 9.330 -8.496 1.00 64.43 H new ATOM 843 N PRO A 53 -2.622 8.332 -6.508 1.00 33.03 N ATOM 844 CA PRO A 53 -2.120 8.839 -5.220 1.00 4.21 C ATOM 845 C PRO A 53 -2.544 10.253 -4.865 1.00 44.02 C ATOM 846 O PRO A 53 -2.495 10.627 -3.703 1.00 22.25 O ATOM 847 CB PRO A 53 -0.608 8.791 -5.348 1.00 35.52 C ATOM 848 CG PRO A 53 -0.282 8.390 -6.737 1.00 23.41 C ATOM 849 CD PRO A 53 -1.533 7.950 -7.416 1.00 64.31 C ATOM 0 HA PRO A 53 -2.535 8.226 -4.420 1.00 4.21 H new ATOM 0 HB2 PRO A 53 -0.175 9.765 -5.120 1.00 35.52 H new ATOM 0 HB3 PRO A 53 -0.187 8.080 -4.637 1.00 35.52 H new ATOM 0 HG2 PRO A 53 0.166 9.225 -7.276 1.00 23.41 H new ATOM 0 HG3 PRO A 53 0.450 7.583 -6.735 1.00 23.41 H new ATOM 0 HD2 PRO A 53 -1.644 8.432 -8.387 1.00 64.31 H new ATOM 0 HD3 PRO A 53 -1.527 6.874 -7.593 1.00 64.31 H new ATOM 857 N LYS A 54 -2.952 11.035 -5.835 1.00 52.35 N ATOM 858 CA LYS A 54 -3.314 12.398 -5.582 1.00 12.11 C ATOM 859 C LYS A 54 -4.724 12.557 -5.053 1.00 71.13 C ATOM 860 O LYS A 54 -5.172 13.667 -4.774 1.00 41.33 O ATOM 861 CB LYS A 54 -3.071 13.205 -6.793 1.00 31.20 C ATOM 862 CG LYS A 54 -1.608 13.150 -7.135 1.00 2.04 C ATOM 863 CD LYS A 54 -1.271 14.024 -8.240 1.00 13.35 C ATOM 864 CE LYS A 54 -1.885 13.572 -9.543 1.00 61.11 C ATOM 865 NZ LYS A 54 -1.488 12.182 -9.900 1.00 21.22 N ATOM 0 H LYS A 54 -3.040 10.744 -6.809 1.00 52.35 H new ATOM 0 HA LYS A 54 -2.677 12.769 -4.779 1.00 12.11 H new ATOM 0 HB2 LYS A 54 -3.666 12.825 -7.624 1.00 31.20 H new ATOM 0 HB3 LYS A 54 -3.380 14.237 -6.625 1.00 31.20 H new ATOM 0 HG2 LYS A 54 -1.021 13.431 -6.260 1.00 2.04 H new ATOM 0 HG3 LYS A 54 -1.334 12.126 -7.388 1.00 2.04 H new ATOM 0 HD2 LYS A 54 -1.608 15.036 -8.015 1.00 13.35 H new ATOM 0 HD3 LYS A 54 -0.187 14.066 -8.348 1.00 13.35 H new ATOM 0 HE2 LYS A 54 -2.971 13.630 -9.470 1.00 61.11 H new ATOM 0 HE3 LYS A 54 -1.582 14.251 -10.340 1.00 61.11 H new ATOM 0 HZ1 LYS A 54 -1.790 11.974 -10.873 1.00 21.22 H new ATOM 0 HZ2 LYS A 54 -0.455 12.087 -9.830 1.00 21.22 H new ATOM 0 HZ3 LYS A 54 -1.942 11.513 -9.246 1.00 21.22 H new ATOM 879 N LEU A 55 -5.422 11.441 -4.901 1.00 11.22 N ATOM 880 CA LEU A 55 -6.741 11.440 -4.315 1.00 25.10 C ATOM 881 C LEU A 55 -6.599 11.765 -2.838 1.00 23.31 C ATOM 882 O LEU A 55 -5.821 11.123 -2.133 1.00 14.41 O ATOM 883 CB LEU A 55 -7.380 10.071 -4.486 1.00 14.31 C ATOM 884 CG LEU A 55 -7.549 9.575 -5.922 1.00 51.41 C ATOM 885 CD1 LEU A 55 -8.073 8.158 -5.920 1.00 32.50 C ATOM 886 CD2 LEU A 55 -8.475 10.489 -6.710 1.00 54.21 C ATOM 0 H LEU A 55 -5.087 10.519 -5.181 1.00 11.22 H new ATOM 0 HA LEU A 55 -7.374 12.180 -4.805 1.00 25.10 H new ATOM 0 HB2 LEU A 55 -6.779 9.343 -3.941 1.00 14.31 H new ATOM 0 HB3 LEU A 55 -8.362 10.091 -4.013 1.00 14.31 H new ATOM 0 HG LEU A 55 -6.574 9.590 -6.410 1.00 51.41 H new ATOM 0 HD11 LEU A 55 -8.191 7.812 -6.947 1.00 32.50 H new ATOM 0 HD12 LEU A 55 -7.369 7.510 -5.397 1.00 32.50 H new ATOM 0 HD13 LEU A 55 -9.038 8.128 -5.414 1.00 32.50 H new ATOM 0 HD21 LEU A 55 -8.578 10.113 -7.728 1.00 54.21 H new ATOM 0 HD22 LEU A 55 -9.454 10.514 -6.232 1.00 54.21 H new ATOM 0 HD23 LEU A 55 -8.058 11.496 -6.735 1.00 54.21 H new ATOM 898 N LYS A 56 -7.349 12.741 -2.374 1.00 4.32 N ATOM 899 CA LYS A 56 -7.225 13.238 -1.016 1.00 51.05 C ATOM 900 C LYS A 56 -7.386 12.145 0.052 1.00 22.35 C ATOM 901 O LYS A 56 -6.597 12.100 1.001 1.00 73.54 O ATOM 902 CB LYS A 56 -8.195 14.394 -0.756 1.00 54.33 C ATOM 903 CG LYS A 56 -8.047 15.020 0.621 1.00 54.13 C ATOM 904 CD LYS A 56 -6.683 15.677 0.805 1.00 31.11 C ATOM 905 CE LYS A 56 -6.558 16.300 2.184 1.00 42.44 C ATOM 906 NZ LYS A 56 -5.219 16.881 2.413 1.00 4.21 N ATOM 0 H LYS A 56 -8.064 13.215 -2.927 1.00 4.32 H new ATOM 0 HA LYS A 56 -6.204 13.609 -0.928 1.00 51.05 H new ATOM 0 HB2 LYS A 56 -8.041 15.163 -1.513 1.00 54.33 H new ATOM 0 HB3 LYS A 56 -9.217 14.032 -0.873 1.00 54.33 H new ATOM 0 HG2 LYS A 56 -8.830 15.763 0.768 1.00 54.13 H new ATOM 0 HG3 LYS A 56 -8.187 14.255 1.384 1.00 54.13 H new ATOM 0 HD2 LYS A 56 -5.897 14.935 0.665 1.00 31.11 H new ATOM 0 HD3 LYS A 56 -6.539 16.442 0.042 1.00 31.11 H new ATOM 0 HE2 LYS A 56 -7.314 17.076 2.300 1.00 42.44 H new ATOM 0 HE3 LYS A 56 -6.759 15.543 2.943 1.00 42.44 H new ATOM 0 HZ1 LYS A 56 -5.179 17.295 3.366 1.00 4.21 H new ATOM 0 HZ2 LYS A 56 -4.498 16.136 2.328 1.00 4.21 H new ATOM 0 HZ3 LYS A 56 -5.036 17.622 1.706 1.00 4.21 H new ATOM 920 N TRP A 57 -8.370 11.247 -0.103 1.00 13.54 N ATOM 921 CA TRP A 57 -8.579 10.223 0.931 1.00 11.04 C ATOM 922 C TRP A 57 -7.409 9.243 0.958 1.00 74.43 C ATOM 923 O TRP A 57 -7.049 8.717 2.006 1.00 22.44 O ATOM 924 CB TRP A 57 -9.943 9.486 0.810 1.00 2.12 C ATOM 925 CG TRP A 57 -10.089 8.514 -0.329 1.00 44.35 C ATOM 926 CD1 TRP A 57 -10.730 8.711 -1.506 1.00 32.22 C ATOM 927 CD2 TRP A 57 -9.594 7.171 -0.360 1.00 21.24 C ATOM 928 NE1 TRP A 57 -10.662 7.571 -2.269 1.00 31.42 N ATOM 929 CE2 TRP A 57 -9.964 6.616 -1.582 1.00 23.31 C ATOM 930 CE3 TRP A 57 -8.864 6.394 0.537 1.00 43.20 C ATOM 931 CZ2 TRP A 57 -9.630 5.313 -1.929 1.00 74.05 C ATOM 932 CZ3 TRP A 57 -8.539 5.116 0.192 1.00 34.21 C ATOM 933 CH2 TRP A 57 -8.916 4.587 -1.020 1.00 30.53 C ATOM 0 H TRP A 57 -9.008 11.206 -0.897 1.00 13.54 H new ATOM 0 HA TRP A 57 -8.618 10.748 1.886 1.00 11.04 H new ATOM 0 HB2 TRP A 57 -10.123 8.948 1.741 1.00 2.12 H new ATOM 0 HB3 TRP A 57 -10.728 10.237 0.719 1.00 2.12 H new ATOM 0 HD1 TRP A 57 -11.221 9.627 -1.800 1.00 32.22 H new ATOM 0 HE1 TRP A 57 -11.067 7.455 -3.198 1.00 31.42 H new ATOM 0 HE3 TRP A 57 -8.560 6.798 1.491 1.00 43.20 H new ATOM 0 HZ2 TRP A 57 -9.923 4.892 -2.879 1.00 74.05 H new ATOM 0 HZ3 TRP A 57 -7.975 4.508 0.883 1.00 34.21 H new ATOM 0 HH2 TRP A 57 -8.640 3.571 -1.259 1.00 30.53 H new ATOM 944 N ILE A 58 -6.811 9.025 -0.209 1.00 61.41 N ATOM 945 CA ILE A 58 -5.633 8.187 -0.350 1.00 62.34 C ATOM 946 C ILE A 58 -4.515 8.742 0.473 1.00 12.43 C ATOM 947 O ILE A 58 -3.805 8.021 1.181 1.00 65.23 O ATOM 948 CB ILE A 58 -5.195 8.111 -1.838 1.00 31.42 C ATOM 949 CG1 ILE A 58 -6.056 7.131 -2.608 1.00 1.43 C ATOM 950 CG2 ILE A 58 -3.734 7.762 -1.977 1.00 50.44 C ATOM 951 CD1 ILE A 58 -5.796 5.711 -2.223 1.00 42.31 C ATOM 0 H ILE A 58 -7.135 9.429 -1.088 1.00 61.41 H new ATOM 0 HA ILE A 58 -5.877 7.183 -0.003 1.00 62.34 H new ATOM 0 HB ILE A 58 -5.336 9.103 -2.266 1.00 31.42 H new ATOM 0 HG12 ILE A 58 -7.107 7.363 -2.436 1.00 1.43 H new ATOM 0 HG13 ILE A 58 -5.873 7.253 -3.676 1.00 1.43 H new ATOM 0 HG21 ILE A 58 -3.469 7.719 -3.033 1.00 50.44 H new ATOM 0 HG22 ILE A 58 -3.130 8.522 -1.482 1.00 50.44 H new ATOM 0 HG23 ILE A 58 -3.546 6.792 -1.516 1.00 50.44 H new ATOM 0 HD11 ILE A 58 -6.440 5.052 -2.806 1.00 42.31 H new ATOM 0 HD12 ILE A 58 -4.752 5.466 -2.420 1.00 42.31 H new ATOM 0 HD13 ILE A 58 -6.006 5.578 -1.162 1.00 42.31 H new ATOM 963 N GLN A 59 -4.390 10.014 0.404 1.00 42.41 N ATOM 964 CA GLN A 59 -3.370 10.695 1.089 1.00 52.40 C ATOM 965 C GLN A 59 -3.598 10.649 2.589 1.00 13.23 C ATOM 966 O GLN A 59 -2.668 10.598 3.346 1.00 33.15 O ATOM 967 CB GLN A 59 -3.243 12.088 0.542 1.00 20.41 C ATOM 968 CG GLN A 59 -3.043 12.043 -0.949 1.00 24.24 C ATOM 969 CD GLN A 59 -2.606 13.311 -1.560 1.00 32.41 C ATOM 970 OE1 GLN A 59 -2.925 14.403 -1.096 1.00 24.24 O ATOM 971 NE2 GLN A 59 -1.866 13.183 -2.608 1.00 72.51 N ATOM 0 H GLN A 59 -5.006 10.617 -0.141 1.00 42.41 H new ATOM 0 HA GLN A 59 -2.414 10.197 0.924 1.00 52.40 H new ATOM 0 HB2 GLN A 59 -4.138 12.663 0.779 1.00 20.41 H new ATOM 0 HB3 GLN A 59 -2.403 12.597 1.014 1.00 20.41 H new ATOM 0 HG2 GLN A 59 -2.305 11.274 -1.178 1.00 24.24 H new ATOM 0 HG3 GLN A 59 -3.979 11.736 -1.416 1.00 24.24 H new ATOM 0 HE21 GLN A 59 -1.629 12.253 -2.954 1.00 72.51 H new ATOM 0 HE22 GLN A 59 -1.518 14.011 -3.091 1.00 72.51 H new ATOM 980 N GLU A 60 -4.851 10.609 2.996 1.00 2.45 N ATOM 981 CA GLU A 60 -5.200 10.506 4.414 1.00 63.42 C ATOM 982 C GLU A 60 -4.963 9.079 4.905 1.00 33.34 C ATOM 983 O GLU A 60 -4.691 8.859 6.086 1.00 24.13 O ATOM 984 CB GLU A 60 -6.657 10.844 4.634 1.00 73.40 C ATOM 985 CG GLU A 60 -7.091 12.187 4.125 1.00 71.21 C ATOM 986 CD GLU A 60 -8.556 12.407 4.354 1.00 54.40 C ATOM 987 OE1 GLU A 60 -9.377 11.804 3.643 1.00 34.22 O ATOM 988 OE2 GLU A 60 -8.924 13.189 5.244 1.00 21.53 O ATOM 0 H GLU A 60 -5.654 10.646 2.368 1.00 2.45 H new ATOM 0 HA GLU A 60 -4.574 11.209 4.965 1.00 63.42 H new ATOM 0 HB2 GLU A 60 -7.266 10.078 4.154 1.00 73.40 H new ATOM 0 HB3 GLU A 60 -6.866 10.794 5.703 1.00 73.40 H new ATOM 0 HG2 GLU A 60 -6.521 12.970 4.625 1.00 71.21 H new ATOM 0 HG3 GLU A 60 -6.871 12.263 3.060 1.00 71.21 H new ATOM 995 N TYR A 61 -5.108 8.120 3.992 1.00 34.32 N ATOM 996 CA TYR A 61 -4.906 6.693 4.281 1.00 0.24 C ATOM 997 C TYR A 61 -3.460 6.546 4.723 1.00 42.42 C ATOM 998 O TYR A 61 -3.161 6.001 5.777 1.00 22.31 O ATOM 999 CB TYR A 61 -5.101 5.913 2.972 1.00 63.23 C ATOM 1000 CG TYR A 61 -5.627 4.500 3.045 1.00 52.52 C ATOM 1001 CD1 TYR A 61 -6.981 4.232 2.958 1.00 32.51 C ATOM 1002 CD2 TYR A 61 -4.764 3.444 3.080 1.00 53.21 C ATOM 1003 CE1 TYR A 61 -7.441 2.931 2.901 1.00 65.51 C ATOM 1004 CE2 TYR A 61 -5.220 2.147 3.044 1.00 33.42 C ATOM 1005 CZ TYR A 61 -6.543 1.898 2.944 1.00 43.44 C ATOM 1006 OH TYR A 61 -6.974 0.606 2.846 1.00 51.31 O ATOM 0 H TYR A 61 -5.370 8.308 3.024 1.00 34.32 H new ATOM 0 HA TYR A 61 -5.596 6.326 5.041 1.00 0.24 H new ATOM 0 HB2 TYR A 61 -5.781 6.487 2.343 1.00 63.23 H new ATOM 0 HB3 TYR A 61 -4.140 5.882 2.458 1.00 63.23 H new ATOM 0 HD1 TYR A 61 -7.687 5.049 2.934 1.00 32.51 H new ATOM 0 HD2 TYR A 61 -3.702 3.630 3.137 1.00 53.21 H new ATOM 0 HE1 TYR A 61 -8.499 2.730 2.823 1.00 65.51 H new ATOM 0 HE2 TYR A 61 -4.519 1.327 3.096 1.00 33.42 H new ATOM 0 HH TYR A 61 -7.436 0.479 1.991 1.00 51.31 H new ATOM 1016 N LEU A 62 -2.578 7.095 3.903 1.00 2.01 N ATOM 1017 CA LEU A 62 -1.172 7.083 4.149 1.00 51.00 C ATOM 1018 C LEU A 62 -0.742 8.063 5.251 1.00 4.42 C ATOM 1019 O LEU A 62 0.279 7.861 5.898 1.00 72.04 O ATOM 1020 CB LEU A 62 -0.353 7.114 2.846 1.00 52.34 C ATOM 1021 CG LEU A 62 -0.610 8.238 1.860 1.00 62.15 C ATOM 1022 CD1 LEU A 62 0.076 9.489 2.277 1.00 1.02 C ATOM 1023 CD2 LEU A 62 -0.239 7.840 0.436 1.00 23.42 C ATOM 0 H LEU A 62 -2.839 7.566 3.037 1.00 2.01 H new ATOM 0 HA LEU A 62 -0.921 6.117 4.586 1.00 51.00 H new ATOM 0 HB2 LEU A 62 0.702 7.145 3.118 1.00 52.34 H new ATOM 0 HB3 LEU A 62 -0.521 6.171 2.326 1.00 52.34 H new ATOM 0 HG LEU A 62 -1.682 8.435 1.865 1.00 62.15 H new ATOM 0 HD11 LEU A 62 -0.128 10.275 1.550 1.00 1.02 H new ATOM 0 HD12 LEU A 62 -0.291 9.796 3.256 1.00 1.02 H new ATOM 0 HD13 LEU A 62 1.151 9.314 2.331 1.00 1.02 H new ATOM 0 HD21 LEU A 62 -0.438 8.673 -0.238 1.00 23.42 H new ATOM 0 HD22 LEU A 62 0.820 7.584 0.394 1.00 23.42 H new ATOM 0 HD23 LEU A 62 -0.833 6.978 0.133 1.00 23.42 H new ATOM 1035 N GLU A 63 -1.505 9.150 5.449 1.00 31.01 N ATOM 1036 CA GLU A 63 -1.255 10.037 6.598 1.00 15.32 C ATOM 1037 C GLU A 63 -1.381 9.299 7.918 1.00 30.11 C ATOM 1038 O GLU A 63 -0.770 9.681 8.905 1.00 73.44 O ATOM 1039 CB GLU A 63 -2.079 11.325 6.622 1.00 34.04 C ATOM 1040 CG GLU A 63 -1.705 12.337 5.561 1.00 43.42 C ATOM 1041 CD GLU A 63 -2.417 13.644 5.752 1.00 34.32 C ATOM 1042 OE1 GLU A 63 -3.610 13.744 5.392 1.00 33.43 O ATOM 1043 OE2 GLU A 63 -1.801 14.596 6.289 1.00 72.13 O ATOM 0 H GLU A 63 -2.279 9.431 4.848 1.00 31.01 H new ATOM 0 HA GLU A 63 -0.223 10.358 6.460 1.00 15.32 H new ATOM 0 HB2 GLU A 63 -3.132 11.068 6.504 1.00 34.04 H new ATOM 0 HB3 GLU A 63 -1.972 11.790 7.602 1.00 34.04 H new ATOM 0 HG2 GLU A 63 -0.628 12.505 5.584 1.00 43.42 H new ATOM 0 HG3 GLU A 63 -1.944 11.935 4.577 1.00 43.42 H new ATOM 1050 N LYS A 64 -2.168 8.227 7.930 1.00 3.32 N ATOM 1051 CA LYS A 64 -2.309 7.397 9.120 1.00 72.31 C ATOM 1052 C LYS A 64 -1.021 6.612 9.386 1.00 53.11 C ATOM 1053 O LYS A 64 -0.865 5.977 10.434 1.00 22.41 O ATOM 1054 CB LYS A 64 -3.496 6.426 8.986 1.00 4.12 C ATOM 1055 CG LYS A 64 -4.859 7.099 8.814 1.00 64.11 C ATOM 1056 CD LYS A 64 -5.199 8.021 9.984 1.00 72.43 C ATOM 1057 CE LYS A 64 -5.265 7.265 11.305 1.00 25.35 C ATOM 1058 NZ LYS A 64 -5.564 8.155 12.440 1.00 53.13 N ATOM 0 H LYS A 64 -2.717 7.914 7.129 1.00 3.32 H new ATOM 0 HA LYS A 64 -2.502 8.060 9.963 1.00 72.31 H new ATOM 0 HB2 LYS A 64 -3.318 5.773 8.131 1.00 4.12 H new ATOM 0 HB3 LYS A 64 -3.529 5.791 9.871 1.00 4.12 H new ATOM 0 HG2 LYS A 64 -4.864 7.673 7.888 1.00 64.11 H new ATOM 0 HG3 LYS A 64 -5.630 6.335 8.720 1.00 64.11 H new ATOM 0 HD2 LYS A 64 -4.449 8.809 10.054 1.00 72.43 H new ATOM 0 HD3 LYS A 64 -6.156 8.507 9.796 1.00 72.43 H new ATOM 0 HE2 LYS A 64 -6.030 6.491 11.241 1.00 25.35 H new ATOM 0 HE3 LYS A 64 -4.315 6.761 11.481 1.00 25.35 H new ATOM 0 HZ1 LYS A 64 -5.599 7.598 13.318 1.00 53.13 H new ATOM 0 HZ2 LYS A 64 -4.821 8.879 12.519 1.00 53.13 H new ATOM 0 HZ3 LYS A 64 -6.483 8.617 12.286 1.00 53.13 H new ATOM 1072 N CYS A 65 -0.119 6.640 8.426 1.00 24.52 N ATOM 1073 CA CYS A 65 1.154 5.974 8.546 1.00 62.24 C ATOM 1074 C CYS A 65 2.200 7.017 8.925 1.00 22.43 C ATOM 1075 O CYS A 65 3.275 6.699 9.427 1.00 53.30 O ATOM 1076 CB CYS A 65 1.535 5.394 7.194 1.00 24.21 C ATOM 1077 SG CYS A 65 0.124 4.682 6.240 1.00 54.53 S ATOM 0 H CYS A 65 -0.252 7.128 7.540 1.00 24.52 H new ATOM 0 HA CYS A 65 1.099 5.184 9.295 1.00 62.24 H new ATOM 0 HB2 CYS A 65 2.003 6.176 6.596 1.00 24.21 H new ATOM 0 HB3 CYS A 65 2.284 4.617 7.345 1.00 24.21 H new ATOM 1082 N LEU A 66 1.855 8.266 8.696 1.00 53.12 N ATOM 1083 CA LEU A 66 2.732 9.371 8.914 1.00 20.34 C ATOM 1084 C LEU A 66 2.548 9.943 10.288 1.00 34.05 C ATOM 1085 O LEU A 66 1.490 10.479 10.622 1.00 51.33 O ATOM 1086 CB LEU A 66 2.480 10.454 7.864 1.00 44.14 C ATOM 1087 CG LEU A 66 2.878 10.112 6.428 1.00 54.20 C ATOM 1088 CD1 LEU A 66 2.307 11.125 5.452 1.00 53.32 C ATOM 1089 CD2 LEU A 66 4.403 10.086 6.302 1.00 52.12 C ATOM 0 H LEU A 66 0.936 8.536 8.346 1.00 53.12 H new ATOM 0 HA LEU A 66 3.758 9.012 8.827 1.00 20.34 H new ATOM 0 HB2 LEU A 66 1.418 10.701 7.875 1.00 44.14 H new ATOM 0 HB3 LEU A 66 3.019 11.353 8.163 1.00 44.14 H new ATOM 0 HG LEU A 66 2.473 9.129 6.187 1.00 54.20 H new ATOM 0 HD11 LEU A 66 2.604 10.860 4.437 1.00 53.32 H new ATOM 0 HD12 LEU A 66 1.219 11.126 5.523 1.00 53.32 H new ATOM 0 HD13 LEU A 66 2.687 12.118 5.694 1.00 53.32 H new ATOM 0 HD21 LEU A 66 4.679 9.842 5.276 1.00 52.12 H new ATOM 0 HD22 LEU A 66 4.806 11.064 6.563 1.00 52.12 H new ATOM 0 HD23 LEU A 66 4.811 9.333 6.977 1.00 52.12 H new ATOM 1101 N ASN A 67 3.582 9.785 11.091 1.00 22.30 N ATOM 1102 CA ASN A 67 3.694 10.363 12.418 1.00 13.44 C ATOM 1103 C ASN A 67 2.684 9.743 13.373 1.00 13.33 C ATOM 1104 O ASN A 67 2.395 10.288 14.448 1.00 34.35 O ATOM 1105 CB ASN A 67 3.550 11.894 12.372 1.00 64.13 C ATOM 1106 CG ASN A 67 4.624 12.631 11.534 1.00 1.53 C ATOM 1107 OD1 ASN A 67 4.976 13.777 11.827 1.00 74.42 O ATOM 1108 ND2 ASN A 67 5.126 11.998 10.491 1.00 33.43 N ATOM 0 H ASN A 67 4.397 9.231 10.829 1.00 22.30 H new ATOM 0 HA ASN A 67 4.691 10.136 12.796 1.00 13.44 H new ATOM 0 HB2 ASN A 67 2.567 12.139 11.970 1.00 64.13 H new ATOM 0 HB3 ASN A 67 3.582 12.277 13.392 1.00 64.13 H new ATOM 0 HD21 ASN A 67 5.823 12.456 9.904 1.00 33.43 H new ATOM 0 HD22 ASN A 67 4.817 11.051 10.272 1.00 33.43 H new ATOM 1300 N CYS C 211 -3.299 -7.367 11.373 1.00 13.34 N ATOM 1301 CA CYS C 211 -1.890 -7.220 11.646 1.00 34.31 C ATOM 1302 C CYS C 211 -1.701 -6.384 12.880 1.00 73.22 C ATOM 1303 O CYS C 211 -2.309 -5.322 13.012 1.00 30.34 O ATOM 1304 CB CYS C 211 -1.124 -6.591 10.460 1.00 75.03 C ATOM 1305 SG CYS C 211 0.627 -6.214 10.839 1.00 62.24 S ATOM 0 HA CYS C 211 -1.479 -8.217 11.803 1.00 34.31 H new ATOM 0 HB2 CYS C 211 -1.165 -7.271 9.609 1.00 75.03 H new ATOM 0 HB3 CYS C 211 -1.628 -5.673 10.158 1.00 75.03 H new ATOM 1310 N ARG C 212 -0.943 -6.898 13.815 1.00 21.32 N ATOM 1311 CA ARG C 212 -0.577 -6.153 15.004 1.00 62.03 C ATOM 1312 C ARG C 212 0.929 -6.152 15.198 1.00 31.14 C ATOM 1313 O ARG C 212 1.520 -5.157 15.627 1.00 50.24 O ATOM 1314 CB ARG C 212 -1.294 -6.675 16.253 1.00 13.25 C ATOM 1315 CG ARG C 212 -2.802 -6.482 16.224 1.00 51.30 C ATOM 1316 CD ARG C 212 -3.446 -6.987 17.498 1.00 4.11 C ATOM 1317 NE ARG C 212 -3.235 -8.424 17.687 1.00 70.52 N ATOM 1318 CZ ARG C 212 -3.479 -9.093 18.820 1.00 61.14 C ATOM 1319 NH1 ARG C 212 -3.934 -8.446 19.895 1.00 11.03 N ATOM 1320 NH2 ARG C 212 -3.275 -10.401 18.870 1.00 25.14 N ATOM 0 H ARG C 212 -0.560 -7.843 13.779 1.00 21.32 H new ATOM 0 HA ARG C 212 -0.904 -5.124 14.856 1.00 62.03 H new ATOM 0 HB2 ARG C 212 -1.076 -7.737 16.368 1.00 13.25 H new ATOM 0 HB3 ARG C 212 -0.890 -6.169 17.130 1.00 13.25 H new ATOM 0 HG2 ARG C 212 -3.033 -5.425 16.091 1.00 51.30 H new ATOM 0 HG3 ARG C 212 -3.222 -7.010 15.368 1.00 51.30 H new ATOM 0 HD2 ARG C 212 -3.037 -6.445 18.351 1.00 4.11 H new ATOM 0 HD3 ARG C 212 -4.515 -6.778 17.471 1.00 4.11 H new ATOM 0 HE ARG C 212 -2.875 -8.955 16.894 1.00 70.52 H new ATOM 0 HH11 ARG C 212 -4.096 -7.440 19.854 1.00 11.03 H new ATOM 0 HH12 ARG C 212 -4.119 -8.958 20.758 1.00 11.03 H new ATOM 0 HH21 ARG C 212 -2.933 -10.896 18.046 1.00 25.14 H new ATOM 0 HH22 ARG C 212 -3.460 -10.913 19.732 1.00 25.14 H new ATOM 1334 N PHE C 213 1.549 -7.258 14.864 1.00 10.02 N ATOM 1335 CA PHE C 213 2.974 -7.423 15.031 1.00 35.21 C ATOM 1336 C PHE C 213 3.661 -7.173 13.706 1.00 12.42 C ATOM 1337 O PHE C 213 3.161 -7.588 12.665 1.00 51.32 O ATOM 1338 CB PHE C 213 3.276 -8.827 15.546 1.00 53.52 C ATOM 1339 CG PHE C 213 2.550 -9.153 16.827 1.00 4.42 C ATOM 1340 CD1 PHE C 213 2.935 -8.572 18.024 1.00 33.04 C ATOM 1341 CD2 PHE C 213 1.469 -10.023 16.828 1.00 3.13 C ATOM 1342 CE1 PHE C 213 2.261 -8.855 19.197 1.00 50.35 C ATOM 1343 CE2 PHE C 213 0.790 -10.306 17.996 1.00 33.43 C ATOM 1344 CZ PHE C 213 1.188 -9.723 19.183 1.00 65.30 C ATOM 0 H PHE C 213 1.079 -8.072 14.468 1.00 10.02 H new ATOM 0 HA PHE C 213 3.348 -6.706 15.762 1.00 35.21 H new ATOM 0 HB2 PHE C 213 3.000 -9.555 14.783 1.00 53.52 H new ATOM 0 HB3 PHE C 213 4.349 -8.926 15.708 1.00 53.52 H new ATOM 0 HD1 PHE C 213 3.772 -7.890 18.041 1.00 33.04 H new ATOM 0 HD2 PHE C 213 1.155 -10.484 15.903 1.00 3.13 H new ATOM 0 HE1 PHE C 213 2.574 -8.397 20.124 1.00 50.35 H new ATOM 0 HE2 PHE C 213 -0.052 -10.983 17.982 1.00 33.43 H new ATOM 0 HZ PHE C 213 0.661 -9.946 20.099 1.00 65.30 H new ATOM 1354 N PHE C 214 4.790 -6.514 13.727 1.00 73.35 N ATOM 1355 CA PHE C 214 5.420 -6.146 12.490 1.00 70.04 C ATOM 1356 C PHE C 214 6.822 -6.742 12.366 1.00 32.12 C ATOM 1357 O PHE C 214 7.502 -7.002 13.374 1.00 55.50 O ATOM 1358 CB PHE C 214 5.466 -4.616 12.317 1.00 54.34 C ATOM 1359 CG PHE C 214 6.560 -3.911 13.069 1.00 25.44 C ATOM 1360 CD1 PHE C 214 6.408 -3.518 14.386 1.00 13.13 C ATOM 1361 CD2 PHE C 214 7.752 -3.638 12.428 1.00 61.41 C ATOM 1362 CE1 PHE C 214 7.439 -2.865 15.041 1.00 33.13 C ATOM 1363 CE2 PHE C 214 8.773 -2.996 13.056 1.00 20.11 C ATOM 1364 CZ PHE C 214 8.628 -2.602 14.374 1.00 15.35 C ATOM 0 H PHE C 214 5.284 -6.226 14.572 1.00 73.35 H new ATOM 0 HA PHE C 214 4.810 -6.562 11.689 1.00 70.04 H new ATOM 0 HB2 PHE C 214 5.575 -4.391 11.256 1.00 54.34 H new ATOM 0 HB3 PHE C 214 4.508 -4.203 12.633 1.00 54.34 H new ATOM 0 HD1 PHE C 214 5.483 -3.721 14.905 1.00 13.13 H new ATOM 0 HD2 PHE C 214 7.877 -3.943 11.399 1.00 61.41 H new ATOM 0 HE1 PHE C 214 7.318 -2.561 16.070 1.00 33.13 H new ATOM 0 HE2 PHE C 214 9.693 -2.795 12.528 1.00 20.11 H new ATOM 0 HZ PHE C 214 9.434 -2.093 14.881 1.00 15.35 H new ATOM 1374 N GLU C 215 7.228 -6.969 11.143 1.00 12.22 N ATOM 1375 CA GLU C 215 8.533 -7.477 10.820 1.00 13.11 C ATOM 1376 C GLU C 215 9.553 -6.360 10.962 1.00 54.43 C ATOM 1377 O GLU C 215 9.366 -5.268 10.428 1.00 2.53 O ATOM 1378 CB GLU C 215 8.514 -8.006 9.381 1.00 35.24 C ATOM 1379 CG GLU C 215 9.851 -8.497 8.853 1.00 43.44 C ATOM 1380 CD GLU C 215 10.448 -9.586 9.693 1.00 73.44 C ATOM 1381 OE1 GLU C 215 10.102 -10.779 9.486 1.00 23.33 O ATOM 1382 OE2 GLU C 215 11.269 -9.265 10.583 1.00 13.44 O ATOM 0 H GLU C 215 6.643 -6.801 10.324 1.00 12.22 H new ATOM 0 HA GLU C 215 8.805 -8.288 11.496 1.00 13.11 H new ATOM 0 HB2 GLU C 215 7.796 -8.824 9.321 1.00 35.24 H new ATOM 0 HB3 GLU C 215 8.151 -7.215 8.725 1.00 35.24 H new ATOM 0 HG2 GLU C 215 9.721 -8.861 7.834 1.00 43.44 H new ATOM 0 HG3 GLU C 215 10.547 -7.659 8.806 1.00 43.44 H new ATOM 1389 N SER C 216 10.623 -6.639 11.657 1.00 2.44 N ATOM 1390 CA SER C 216 11.632 -5.648 11.897 1.00 73.24 C ATOM 1391 C SER C 216 12.628 -5.601 10.745 1.00 44.13 C ATOM 1392 O SER C 216 13.121 -4.527 10.380 1.00 52.30 O ATOM 1393 CB SER C 216 12.348 -5.931 13.218 1.00 23.44 C ATOM 1394 OG SER C 216 11.425 -5.952 14.300 1.00 24.43 O ATOM 0 H SER C 216 10.817 -7.552 12.069 1.00 2.44 H new ATOM 0 HA SER C 216 11.149 -4.673 11.966 1.00 73.24 H new ATOM 0 HB2 SER C 216 12.866 -6.888 13.158 1.00 23.44 H new ATOM 0 HB3 SER C 216 13.106 -5.169 13.396 1.00 23.44 H new ATOM 0 HG SER C 216 11.904 -6.136 15.135 1.00 24.43 H new ATOM 1400 N HIS C 217 12.903 -6.749 10.145 1.00 52.03 N ATOM 1401 CA HIS C 217 13.873 -6.779 9.076 1.00 13.54 C ATOM 1402 C HIS C 217 13.252 -6.724 7.700 1.00 3.44 C ATOM 1403 O HIS C 217 12.850 -7.737 7.129 1.00 12.45 O ATOM 1404 CB HIS C 217 14.967 -7.877 9.218 1.00 11.44 C ATOM 1405 CG HIS C 217 14.500 -9.301 9.370 1.00 75.43 C ATOM 1406 ND1 HIS C 217 14.340 -10.167 8.316 1.00 54.42 N ATOM 1407 CD2 HIS C 217 14.226 -10.022 10.482 1.00 61.33 C ATOM 1408 CE1 HIS C 217 13.998 -11.349 8.773 1.00 43.14 C ATOM 1409 NE2 HIS C 217 13.922 -11.291 10.081 1.00 70.32 N ATOM 0 H HIS C 217 12.478 -7.647 10.376 1.00 52.03 H new ATOM 0 HA HIS C 217 14.421 -5.844 9.190 1.00 13.54 H new ATOM 0 HB2 HIS C 217 15.613 -7.825 8.341 1.00 11.44 H new ATOM 0 HB3 HIS C 217 15.583 -7.630 10.083 1.00 11.44 H new ATOM 0 HD2 HIS C 217 14.244 -9.660 11.499 1.00 61.33 H new ATOM 0 HE1 HIS C 217 13.810 -12.226 8.171 1.00 43.14 H new ATOM 0 HE2 HIS C 217 13.676 -12.066 10.697 1.00 70.32 H new ATOM 1418 N VAL C 218 13.157 -5.516 7.202 1.00 22.43 N ATOM 1419 CA VAL C 218 12.649 -5.235 5.891 1.00 0.34 C ATOM 1420 C VAL C 218 13.539 -4.138 5.280 1.00 20.41 C ATOM 1421 O VAL C 218 14.189 -3.384 6.017 1.00 30.44 O ATOM 1422 CB VAL C 218 11.154 -4.749 5.937 1.00 2.32 C ATOM 1423 CG1 VAL C 218 11.012 -3.414 6.650 1.00 21.52 C ATOM 1424 CG2 VAL C 218 10.551 -4.704 4.541 1.00 5.41 C ATOM 0 H VAL C 218 13.440 -4.681 7.715 1.00 22.43 H new ATOM 0 HA VAL C 218 12.669 -6.144 5.289 1.00 0.34 H new ATOM 0 HB VAL C 218 10.592 -5.479 6.520 1.00 2.32 H new ATOM 0 HG11 VAL C 218 9.964 -3.116 6.659 1.00 21.52 H new ATOM 0 HG12 VAL C 218 11.371 -3.509 7.675 1.00 21.52 H new ATOM 0 HG13 VAL C 218 11.600 -2.659 6.128 1.00 21.52 H new ATOM 0 HG21 VAL C 218 9.517 -4.365 4.602 1.00 5.41 H new ATOM 0 HG22 VAL C 218 11.123 -4.015 3.920 1.00 5.41 H new ATOM 0 HG23 VAL C 218 10.581 -5.700 4.100 1.00 5.41 H new ATOM 1434 N ALA C 219 13.592 -4.072 3.980 1.00 64.45 N ATOM 1435 CA ALA C 219 14.374 -3.075 3.280 1.00 61.23 C ATOM 1436 C ALA C 219 13.654 -2.746 1.996 1.00 61.21 C ATOM 1437 O ALA C 219 13.157 -3.658 1.333 1.00 42.44 O ATOM 1438 CB ALA C 219 15.752 -3.642 2.970 1.00 14.33 C ATOM 0 H ALA C 219 13.091 -4.712 3.364 1.00 64.45 H new ATOM 0 HA ALA C 219 14.493 -2.178 3.888 1.00 61.23 H new ATOM 0 HB1 ALA C 219 16.343 -2.893 2.443 1.00 14.33 H new ATOM 0 HB2 ALA C 219 16.253 -3.911 3.900 1.00 14.33 H new ATOM 0 HB3 ALA C 219 15.648 -4.529 2.345 1.00 14.33 H new ATOM 1444 N ARG C 220 13.596 -1.469 1.630 1.00 24.30 N ATOM 1445 CA ARG C 220 12.875 -1.048 0.420 1.00 41.02 C ATOM 1446 C ARG C 220 13.435 -1.711 -0.842 1.00 21.32 C ATOM 1447 O ARG C 220 12.698 -1.997 -1.782 1.00 62.33 O ATOM 1448 CB ARG C 220 12.871 0.471 0.247 1.00 32.22 C ATOM 1449 CG ARG C 220 12.086 0.896 -0.978 1.00 62.31 C ATOM 1450 CD ARG C 220 12.072 2.377 -1.193 1.00 3.21 C ATOM 1451 NE ARG C 220 11.444 2.687 -2.484 1.00 61.13 N ATOM 1452 CZ ARG C 220 11.059 3.890 -2.891 1.00 2.51 C ATOM 1453 NH1 ARG C 220 11.241 4.940 -2.110 1.00 12.31 N ATOM 1454 NH2 ARG C 220 10.511 4.034 -4.098 1.00 0.22 N ATOM 0 H ARG C 220 14.035 -0.707 2.147 1.00 24.30 H new ATOM 0 HA ARG C 220 11.846 -1.379 0.558 1.00 41.02 H new ATOM 0 HB2 ARG C 220 12.441 0.937 1.134 1.00 32.22 H new ATOM 0 HB3 ARG C 220 13.897 0.830 0.164 1.00 32.22 H new ATOM 0 HG2 ARG C 220 12.511 0.413 -1.858 1.00 62.31 H new ATOM 0 HG3 ARG C 220 11.060 0.541 -0.884 1.00 62.31 H new ATOM 0 HD2 ARG C 220 11.526 2.866 -0.386 1.00 3.21 H new ATOM 0 HD3 ARG C 220 13.090 2.766 -1.171 1.00 3.21 H new ATOM 0 HE ARG C 220 11.290 1.908 -3.125 1.00 61.13 H new ATOM 0 HH11 ARG C 220 11.677 4.826 -1.195 1.00 12.31 H new ATOM 0 HH12 ARG C 220 10.945 5.865 -2.422 1.00 12.31 H new ATOM 0 HH21 ARG C 220 10.390 3.222 -4.703 1.00 0.22 H new ATOM 0 HH22 ARG C 220 10.213 4.956 -4.416 1.00 0.22 H new ATOM 1468 N ALA C 221 14.727 -1.973 -0.841 1.00 53.02 N ATOM 1469 CA ALA C 221 15.386 -2.626 -1.962 1.00 25.43 C ATOM 1470 C ALA C 221 14.842 -4.040 -2.167 1.00 14.44 C ATOM 1471 O ALA C 221 14.887 -4.581 -3.270 1.00 1.11 O ATOM 1472 CB ALA C 221 16.888 -2.669 -1.733 1.00 33.10 C ATOM 0 H ALA C 221 15.350 -1.741 -0.068 1.00 53.02 H new ATOM 0 HA ALA C 221 15.180 -2.048 -2.863 1.00 25.43 H new ATOM 0 HB1 ALA C 221 17.371 -3.160 -2.578 1.00 33.10 H new ATOM 0 HB2 ALA C 221 17.271 -1.653 -1.636 1.00 33.10 H new ATOM 0 HB3 ALA C 221 17.101 -3.225 -0.820 1.00 33.10 H new ATOM 1478 N ASN C 222 14.306 -4.614 -1.113 1.00 24.31 N ATOM 1479 CA ASN C 222 13.794 -5.941 -1.143 1.00 41.34 C ATOM 1480 C ASN C 222 12.265 -5.907 -1.315 1.00 52.45 C ATOM 1481 O ASN C 222 11.661 -6.855 -1.827 1.00 54.24 O ATOM 1482 CB ASN C 222 14.221 -6.637 0.157 1.00 73.01 C ATOM 1483 CG ASN C 222 13.829 -8.083 0.254 1.00 34.11 C ATOM 1484 OD1 ASN C 222 13.666 -8.774 -0.747 1.00 34.14 O ATOM 1485 ND2 ASN C 222 13.730 -8.564 1.460 1.00 13.20 N ATOM 0 H ASN C 222 14.218 -4.156 -0.206 1.00 24.31 H new ATOM 0 HA ASN C 222 14.192 -6.502 -1.989 1.00 41.34 H new ATOM 0 HB2 ASN C 222 15.304 -6.561 0.255 1.00 73.01 H new ATOM 0 HB3 ASN C 222 13.787 -6.100 1.000 1.00 73.01 H new ATOM 0 HD21 ASN C 222 13.509 -9.550 1.599 1.00 13.20 H new ATOM 0 HD22 ASN C 222 13.873 -7.955 2.265 1.00 13.20 H new ATOM 1492 N VAL C 223 11.651 -4.797 -0.895 1.00 23.35 N ATOM 1493 CA VAL C 223 10.211 -4.603 -1.036 1.00 44.11 C ATOM 1494 C VAL C 223 9.813 -4.361 -2.501 1.00 21.22 C ATOM 1495 O VAL C 223 10.280 -3.416 -3.150 1.00 20.25 O ATOM 1496 CB VAL C 223 9.663 -3.456 -0.129 1.00 51.31 C ATOM 1497 CG1 VAL C 223 8.171 -3.338 -0.232 1.00 44.44 C ATOM 1498 CG2 VAL C 223 10.067 -3.669 1.290 1.00 42.33 C ATOM 0 H VAL C 223 12.136 -4.016 -0.452 1.00 23.35 H new ATOM 0 HA VAL C 223 9.750 -5.532 -0.699 1.00 44.11 H new ATOM 0 HB VAL C 223 10.099 -2.522 -0.483 1.00 51.31 H new ATOM 0 HG11 VAL C 223 7.825 -2.530 0.412 1.00 44.44 H new ATOM 0 HG12 VAL C 223 7.893 -3.124 -1.264 1.00 44.44 H new ATOM 0 HG13 VAL C 223 7.709 -4.275 0.081 1.00 44.44 H new ATOM 0 HG21 VAL C 223 9.675 -2.859 1.905 1.00 42.33 H new ATOM 0 HG22 VAL C 223 9.667 -4.619 1.643 1.00 42.33 H new ATOM 0 HG23 VAL C 223 11.155 -3.685 1.360 1.00 42.33 H new ATOM 1508 N LYS C 224 8.962 -5.242 -3.003 1.00 41.25 N ATOM 1509 CA LYS C 224 8.448 -5.171 -4.369 1.00 32.32 C ATOM 1510 C LYS C 224 7.346 -4.138 -4.431 1.00 51.41 C ATOM 1511 O LYS C 224 7.176 -3.424 -5.426 1.00 51.50 O ATOM 1512 CB LYS C 224 7.828 -6.504 -4.728 1.00 70.41 C ATOM 1513 CG LYS C 224 8.739 -7.681 -4.580 1.00 52.12 C ATOM 1514 CD LYS C 224 7.947 -8.965 -4.654 1.00 2.11 C ATOM 1515 CE LYS C 224 7.349 -9.224 -6.034 1.00 30.43 C ATOM 1516 NZ LYS C 224 8.389 -9.465 -7.062 1.00 34.23 N ATOM 0 H LYS C 224 8.603 -6.035 -2.472 1.00 41.25 H new ATOM 0 HA LYS C 224 9.262 -4.916 -5.048 1.00 32.32 H new ATOM 0 HB2 LYS C 224 6.950 -6.661 -4.101 1.00 70.41 H new ATOM 0 HB3 LYS C 224 7.479 -6.460 -5.760 1.00 70.41 H new ATOM 0 HG2 LYS C 224 9.495 -7.666 -5.365 1.00 52.12 H new ATOM 0 HG3 LYS C 224 9.266 -7.625 -3.628 1.00 52.12 H new ATOM 0 HD2 LYS C 224 8.594 -9.799 -4.383 1.00 2.11 H new ATOM 0 HD3 LYS C 224 7.144 -8.932 -3.918 1.00 2.11 H new ATOM 0 HE2 LYS C 224 6.685 -10.087 -5.983 1.00 30.43 H new ATOM 0 HE3 LYS C 224 6.740 -8.370 -6.330 1.00 30.43 H new ATOM 0 HZ1 LYS C 224 7.940 -9.801 -7.938 1.00 34.23 H new ATOM 0 HZ2 LYS C 224 8.901 -8.580 -7.253 1.00 34.23 H new ATOM 0 HZ3 LYS C 224 9.057 -10.184 -6.718 1.00 34.23 H new ATOM 1530 N HIS C 225 6.556 -4.123 -3.380 1.00 20.01 N ATOM 1531 CA HIS C 225 5.455 -3.194 -3.230 1.00 15.35 C ATOM 1532 C HIS C 225 4.948 -3.230 -1.805 1.00 75.43 C ATOM 1533 O HIS C 225 5.209 -4.200 -1.074 1.00 32.04 O ATOM 1534 CB HIS C 225 4.297 -3.487 -4.238 1.00 21.15 C ATOM 1535 CG HIS C 225 3.674 -4.852 -4.147 1.00 75.00 C ATOM 1536 ND1 HIS C 225 3.896 -5.838 -5.077 1.00 54.54 N ATOM 1537 CD2 HIS C 225 2.809 -5.377 -3.253 1.00 55.12 C ATOM 1538 CE1 HIS C 225 3.202 -6.906 -4.760 1.00 45.23 C ATOM 1539 NE2 HIS C 225 2.534 -6.657 -3.658 1.00 35.03 N ATOM 0 H HIS C 225 6.661 -4.764 -2.594 1.00 20.01 H new ATOM 0 HA HIS C 225 5.825 -2.194 -3.457 1.00 15.35 H new ATOM 0 HB2 HIS C 225 3.515 -2.742 -4.089 1.00 21.15 H new ATOM 0 HB3 HIS C 225 4.679 -3.351 -5.250 1.00 21.15 H new ATOM 0 HD2 HIS C 225 2.409 -4.881 -2.381 1.00 55.12 H new ATOM 0 HE1 HIS C 225 3.184 -7.834 -5.313 1.00 45.23 H new ATOM 0 HE2 HIS C 225 1.912 -7.310 -3.181 1.00 35.03 H new ATOM 1548 N LEU C 226 4.184 -2.232 -1.447 1.00 73.30 N ATOM 1549 CA LEU C 226 3.636 -2.099 -0.114 1.00 60.23 C ATOM 1550 C LEU C 226 2.154 -2.274 -0.180 1.00 41.35 C ATOM 1551 O LEU C 226 1.539 -2.008 -1.200 1.00 14.11 O ATOM 1552 CB LEU C 226 3.930 -0.700 0.470 1.00 63.22 C ATOM 1553 CG LEU C 226 5.374 -0.343 0.730 1.00 61.42 C ATOM 1554 CD1 LEU C 226 5.452 1.048 1.288 1.00 51.20 C ATOM 1555 CD2 LEU C 226 5.984 -1.288 1.715 1.00 1.34 C ATOM 0 H LEU C 226 3.919 -1.476 -2.078 1.00 73.30 H new ATOM 0 HA LEU C 226 4.095 -2.855 0.523 1.00 60.23 H new ATOM 0 HB2 LEU C 226 3.517 0.043 -0.212 1.00 63.22 H new ATOM 0 HB3 LEU C 226 3.386 -0.607 1.410 1.00 63.22 H new ATOM 0 HG LEU C 226 5.919 -0.407 -0.212 1.00 61.42 H new ATOM 0 HD11 LEU C 226 6.494 1.307 1.476 1.00 51.20 H new ATOM 0 HD12 LEU C 226 5.027 1.752 0.572 1.00 51.20 H new ATOM 0 HD13 LEU C 226 4.892 1.097 2.222 1.00 51.20 H new ATOM 0 HD21 LEU C 226 7.024 -1.012 1.888 1.00 1.34 H new ATOM 0 HD22 LEU C 226 5.435 -1.238 2.655 1.00 1.34 H new ATOM 0 HD23 LEU C 226 5.938 -2.303 1.321 1.00 1.34 H new ATOM 1567 N LYS C 227 1.598 -2.746 0.871 1.00 74.30 N ATOM 1568 CA LYS C 227 0.196 -2.940 0.971 1.00 34.10 C ATOM 1569 C LYS C 227 -0.287 -2.346 2.277 1.00 52.51 C ATOM 1570 O LYS C 227 0.136 -2.759 3.334 1.00 4.03 O ATOM 1571 CB LYS C 227 -0.104 -4.425 0.885 1.00 72.11 C ATOM 1572 CG LYS C 227 -1.567 -4.763 0.894 1.00 74.43 C ATOM 1573 CD LYS C 227 -1.783 -6.245 0.707 1.00 42.43 C ATOM 1574 CE LYS C 227 -1.210 -7.058 1.865 1.00 34.43 C ATOM 1575 NZ LYS C 227 -1.342 -8.521 1.662 1.00 22.12 N ATOM 0 H LYS C 227 2.115 -3.016 1.708 1.00 74.30 H new ATOM 0 HA LYS C 227 -0.327 -2.441 0.155 1.00 34.10 H new ATOM 0 HB2 LYS C 227 0.343 -4.821 -0.027 1.00 72.11 H new ATOM 0 HB3 LYS C 227 0.378 -4.930 1.722 1.00 72.11 H new ATOM 0 HG2 LYS C 227 -2.011 -4.444 1.837 1.00 74.43 H new ATOM 0 HG3 LYS C 227 -2.075 -4.215 0.100 1.00 74.43 H new ATOM 0 HD2 LYS C 227 -2.850 -6.447 0.616 1.00 42.43 H new ATOM 0 HD3 LYS C 227 -1.317 -6.564 -0.225 1.00 42.43 H new ATOM 0 HE2 LYS C 227 -0.157 -6.807 1.993 1.00 34.43 H new ATOM 0 HE3 LYS C 227 -1.719 -6.777 2.787 1.00 34.43 H new ATOM 0 HZ1 LYS C 227 -0.937 -9.023 2.478 1.00 22.12 H new ATOM 0 HZ2 LYS C 227 -2.348 -8.769 1.568 1.00 22.12 H new ATOM 0 HZ3 LYS C 227 -0.834 -8.799 0.798 1.00 22.12 H new ATOM 1589 N ILE C 228 -1.148 -1.383 2.186 1.00 43.55 N ATOM 1590 CA ILE C 228 -1.652 -0.665 3.341 1.00 51.11 C ATOM 1591 C ILE C 228 -3.052 -1.172 3.641 1.00 64.43 C ATOM 1592 O ILE C 228 -3.903 -1.161 2.762 1.00 22.24 O ATOM 1593 CB ILE C 228 -1.758 0.845 3.027 1.00 54.32 C ATOM 1594 CG1 ILE C 228 -0.406 1.434 2.604 1.00 65.32 C ATOM 1595 CG2 ILE C 228 -2.258 1.583 4.260 1.00 2.10 C ATOM 1596 CD1 ILE C 228 0.539 1.640 3.739 1.00 25.13 C ATOM 0 H ILE C 228 -1.534 -1.059 1.299 1.00 43.55 H new ATOM 0 HA ILE C 228 -0.977 -0.820 4.183 1.00 51.11 H new ATOM 0 HB ILE C 228 -2.456 0.966 2.198 1.00 54.32 H new ATOM 0 HG12 ILE C 228 0.057 0.771 1.873 1.00 65.32 H new ATOM 0 HG13 ILE C 228 -0.575 2.389 2.106 1.00 65.32 H new ATOM 0 HG21 ILE C 228 -2.333 2.648 4.041 1.00 2.10 H new ATOM 0 HG22 ILE C 228 -3.239 1.200 4.540 1.00 2.10 H new ATOM 0 HG23 ILE C 228 -1.560 1.431 5.083 1.00 2.10 H new ATOM 0 HD11 ILE C 228 1.473 2.059 3.364 1.00 25.13 H new ATOM 0 HD12 ILE C 228 0.097 2.327 4.460 1.00 25.13 H new ATOM 0 HD13 ILE C 228 0.739 0.685 4.224 1.00 25.13 H new ATOM 1608 N LEU C 229 -3.282 -1.621 4.850 1.00 63.12 N ATOM 1609 CA LEU C 229 -4.578 -2.158 5.237 1.00 62.43 C ATOM 1610 C LEU C 229 -5.445 -1.075 5.879 1.00 63.55 C ATOM 1611 O LEU C 229 -4.955 -0.285 6.697 1.00 41.34 O ATOM 1612 CB LEU C 229 -4.445 -3.381 6.182 1.00 2.22 C ATOM 1613 CG LEU C 229 -3.780 -4.684 5.627 1.00 12.10 C ATOM 1614 CD1 LEU C 229 -2.344 -4.472 5.163 1.00 71.33 C ATOM 1615 CD2 LEU C 229 -3.821 -5.778 6.678 1.00 73.33 C ATOM 0 H LEU C 229 -2.585 -1.628 5.595 1.00 63.12 H new ATOM 0 HA LEU C 229 -5.066 -2.503 4.326 1.00 62.43 H new ATOM 0 HB2 LEU C 229 -3.876 -3.064 7.056 1.00 2.22 H new ATOM 0 HB3 LEU C 229 -5.445 -3.641 6.530 1.00 2.22 H new ATOM 0 HG LEU C 229 -4.358 -4.980 4.751 1.00 12.10 H new ATOM 0 HD11 LEU C 229 -1.940 -5.413 4.790 1.00 71.33 H new ATOM 0 HD12 LEU C 229 -2.325 -3.727 4.367 1.00 71.33 H new ATOM 0 HD13 LEU C 229 -1.739 -4.124 6.000 1.00 71.33 H new ATOM 0 HD21 LEU C 229 -3.356 -6.681 6.282 1.00 73.33 H new ATOM 0 HD22 LEU C 229 -3.280 -5.450 7.566 1.00 73.33 H new ATOM 0 HD23 LEU C 229 -4.857 -5.990 6.942 1.00 73.33 H new ATOM 1627 N ASN C 230 -6.726 -1.047 5.519 1.00 51.12 N ATOM 1628 CA ASN C 230 -7.645 -0.021 6.022 1.00 41.24 C ATOM 1629 C ASN C 230 -8.168 -0.419 7.374 1.00 2.24 C ATOM 1630 O ASN C 230 -8.952 -1.365 7.504 1.00 53.44 O ATOM 1631 CB ASN C 230 -8.815 0.149 5.034 1.00 70.12 C ATOM 1632 CG ASN C 230 -9.797 1.251 5.382 1.00 72.55 C ATOM 1633 OD1 ASN C 230 -9.458 2.245 6.046 1.00 25.42 O ATOM 1634 ND2 ASN C 230 -10.998 1.128 4.865 1.00 30.11 N ATOM 0 H ASN C 230 -7.153 -1.720 4.883 1.00 51.12 H new ATOM 0 HA ASN C 230 -7.113 0.925 6.116 1.00 41.24 H new ATOM 0 HB2 ASN C 230 -8.407 0.347 4.043 1.00 70.12 H new ATOM 0 HB3 ASN C 230 -9.358 -0.794 4.973 1.00 70.12 H new ATOM 0 HD21 ASN C 230 -11.690 1.864 5.003 1.00 30.11 H new ATOM 0 HD22 ASN C 230 -11.238 0.296 4.326 1.00 30.11 H new ATOM 1641 N THR C 231 -7.718 0.276 8.378 1.00 13.40 N ATOM 1642 CA THR C 231 -8.118 0.005 9.709 1.00 32.35 C ATOM 1643 C THR C 231 -8.816 1.232 10.328 1.00 2.00 C ATOM 1644 O THR C 231 -8.399 2.380 10.085 1.00 22.34 O ATOM 1645 CB THR C 231 -6.907 -0.418 10.561 1.00 62.25 C ATOM 1646 OG1 THR C 231 -5.926 0.638 10.575 1.00 22.45 O ATOM 1647 CG2 THR C 231 -6.269 -1.695 10.004 1.00 23.05 C ATOM 0 H THR C 231 -7.059 1.049 8.285 1.00 13.40 H new ATOM 0 HA THR C 231 -8.831 -0.820 9.692 1.00 32.35 H new ATOM 0 HB THR C 231 -7.254 -0.613 11.576 1.00 62.25 H new ATOM 0 HG1 THR C 231 -5.052 0.270 10.823 1.00 22.45 H new ATOM 0 HG21 THR C 231 -5.416 -1.975 10.622 1.00 23.05 H new ATOM 0 HG22 THR C 231 -7.002 -2.501 10.012 1.00 23.05 H new ATOM 0 HG23 THR C 231 -5.934 -1.519 8.982 1.00 23.05 H new ATOM 1655 N PRO C 232 -9.900 1.029 11.103 1.00 3.41 N ATOM 1656 CA PRO C 232 -10.608 2.130 11.762 1.00 35.35 C ATOM 1657 C PRO C 232 -9.873 2.651 13.010 1.00 2.21 C ATOM 1658 O PRO C 232 -9.620 3.841 13.142 1.00 43.23 O ATOM 1659 CB PRO C 232 -11.960 1.509 12.170 1.00 40.11 C ATOM 1660 CG PRO C 232 -11.980 0.140 11.565 1.00 74.44 C ATOM 1661 CD PRO C 232 -10.550 -0.254 11.357 1.00 62.02 C ATOM 0 HA PRO C 232 -10.697 2.992 11.101 1.00 35.35 H new ATOM 0 HB2 PRO C 232 -12.055 1.458 13.255 1.00 40.11 H new ATOM 0 HB3 PRO C 232 -12.792 2.110 11.804 1.00 40.11 H new ATOM 0 HG2 PRO C 232 -12.486 -0.567 12.222 1.00 74.44 H new ATOM 0 HG3 PRO C 232 -12.523 0.141 10.620 1.00 74.44 H new ATOM 0 HD2 PRO C 232 -10.135 -0.752 12.233 1.00 62.02 H new ATOM 0 HD3 PRO C 232 -10.436 -0.939 10.517 1.00 62.02 H new ATOM 1669 N ASN C 233 -9.521 1.748 13.909 1.00 62.15 N ATOM 1670 CA ASN C 233 -8.898 2.132 15.185 1.00 4.24 C ATOM 1671 C ASN C 233 -7.558 1.482 15.392 1.00 23.14 C ATOM 1672 O ASN C 233 -7.102 1.301 16.518 1.00 52.43 O ATOM 1673 CB ASN C 233 -9.834 1.858 16.372 1.00 63.41 C ATOM 1674 CG ASN C 233 -10.945 2.892 16.501 1.00 71.04 C ATOM 1675 OD1 ASN C 233 -10.792 3.894 17.198 1.00 41.01 O ATOM 1676 ND2 ASN C 233 -12.054 2.669 15.844 1.00 40.23 N ATOM 0 H ASN C 233 -9.651 0.744 13.789 1.00 62.15 H new ATOM 0 HA ASN C 233 -8.723 3.207 15.132 1.00 4.24 H new ATOM 0 HB2 ASN C 233 -10.277 0.868 16.258 1.00 63.41 H new ATOM 0 HB3 ASN C 233 -9.250 1.842 17.292 1.00 63.41 H new ATOM 0 HD21 ASN C 233 -12.824 3.336 15.901 1.00 40.23 H new ATOM 0 HD22 ASN C 233 -12.149 1.828 15.275 1.00 40.23 H new ATOM 1683 N CYS C 234 -6.896 1.206 14.318 1.00 5.24 N ATOM 1684 CA CYS C 234 -5.570 0.641 14.375 1.00 71.55 C ATOM 1685 C CYS C 234 -4.649 1.543 13.621 1.00 22.35 C ATOM 1686 O CYS C 234 -5.105 2.448 12.897 1.00 34.13 O ATOM 1687 CB CYS C 234 -5.525 -0.756 13.763 1.00 41.12 C ATOM 1688 SG CYS C 234 -6.628 -1.971 14.546 1.00 11.30 S ATOM 0 H CYS C 234 -7.249 1.362 13.374 1.00 5.24 H new ATOM 0 HA CYS C 234 -5.269 0.553 15.419 1.00 71.55 H new ATOM 0 HB2 CYS C 234 -5.782 -0.682 12.706 1.00 41.12 H new ATOM 0 HB3 CYS C 234 -4.502 -1.128 13.817 1.00 41.12 H new ATOM 0 HG CYS C 234 -6.508 -3.117 13.944 1.00 11.30 H new ATOM 1693 N ALA C 235 -3.375 1.348 13.795 1.00 61.22 N ATOM 1694 CA ALA C 235 -2.411 2.113 13.072 1.00 2.32 C ATOM 1695 C ALA C 235 -2.388 1.662 11.615 1.00 60.23 C ATOM 1696 O ALA C 235 -3.071 0.691 11.233 1.00 32.10 O ATOM 1697 CB ALA C 235 -1.035 1.964 13.707 1.00 42.13 C ATOM 0 H ALA C 235 -2.981 0.660 14.437 1.00 61.22 H new ATOM 0 HA ALA C 235 -2.687 3.167 13.108 1.00 2.32 H new ATOM 0 HB1 ALA C 235 -0.309 2.553 13.146 1.00 42.13 H new ATOM 0 HB2 ALA C 235 -1.070 2.318 14.737 1.00 42.13 H new ATOM 0 HB3 ALA C 235 -0.740 0.915 13.693 1.00 42.13 H new ATOM 1703 N CYS C 236 -1.644 2.367 10.815 1.00 10.14 N ATOM 1704 CA CYS C 236 -1.479 2.032 9.428 1.00 25.35 C ATOM 1705 C CYS C 236 -0.756 0.699 9.312 1.00 61.52 C ATOM 1706 O CYS C 236 0.425 0.599 9.622 1.00 60.42 O ATOM 1707 CB CYS C 236 -0.683 3.142 8.740 1.00 3.12 C ATOM 1708 SG CYS C 236 -0.236 2.839 7.014 1.00 30.23 S ATOM 0 H CYS C 236 -1.130 3.198 11.107 1.00 10.14 H new ATOM 0 HA CYS C 236 -2.451 1.941 8.943 1.00 25.35 H new ATOM 0 HB2 CYS C 236 -1.264 4.063 8.788 1.00 3.12 H new ATOM 0 HB3 CYS C 236 0.232 3.312 9.308 1.00 3.12 H new ATOM 1713 N GLN C 237 -1.475 -0.333 8.939 1.00 41.22 N ATOM 1714 CA GLN C 237 -0.862 -1.624 8.791 1.00 55.31 C ATOM 1715 C GLN C 237 -0.289 -1.710 7.409 1.00 44.20 C ATOM 1716 O GLN C 237 -1.015 -1.589 6.425 1.00 44.10 O ATOM 1717 CB GLN C 237 -1.882 -2.735 9.002 1.00 62.15 C ATOM 1718 CG GLN C 237 -2.651 -2.642 10.322 1.00 43.32 C ATOM 1719 CD GLN C 237 -1.763 -2.594 11.568 1.00 61.52 C ATOM 1720 OE1 GLN C 237 -2.137 -1.994 12.576 1.00 2.31 O ATOM 1721 NE2 GLN C 237 -0.608 -3.224 11.520 1.00 21.22 N ATOM 0 H GLN C 237 -2.474 -0.302 8.735 1.00 41.22 H new ATOM 0 HA GLN C 237 -0.078 -1.747 9.538 1.00 55.31 H new ATOM 0 HB2 GLN C 237 -2.595 -2.719 8.178 1.00 62.15 H new ATOM 0 HB3 GLN C 237 -1.369 -3.696 8.961 1.00 62.15 H new ATOM 0 HG2 GLN C 237 -3.277 -1.750 10.302 1.00 43.32 H new ATOM 0 HG3 GLN C 237 -3.320 -3.499 10.400 1.00 43.32 H new ATOM 0 HE21 GLN C 237 -0.328 -3.712 10.669 1.00 21.22 H new ATOM 0 HE22 GLN C 237 0.007 -3.224 12.334 1.00 21.22 H new ATOM 1730 N ILE C 238 0.989 -1.905 7.326 1.00 11.11 N ATOM 1731 CA ILE C 238 1.656 -1.922 6.073 1.00 73.34 C ATOM 1732 C ILE C 238 2.297 -3.260 5.865 1.00 4.34 C ATOM 1733 O ILE C 238 2.872 -3.809 6.762 1.00 11.23 O ATOM 1734 CB ILE C 238 2.746 -0.842 6.040 1.00 22.11 C ATOM 1735 CG1 ILE C 238 2.170 0.469 6.571 1.00 43.32 C ATOM 1736 CG2 ILE C 238 3.294 -0.668 4.617 1.00 35.23 C ATOM 1737 CD1 ILE C 238 3.081 1.629 6.457 1.00 54.32 C ATOM 0 H ILE C 238 1.597 -2.057 8.131 1.00 11.11 H new ATOM 0 HA ILE C 238 0.928 -1.729 5.286 1.00 73.34 H new ATOM 0 HB ILE C 238 3.577 -1.147 6.675 1.00 22.11 H new ATOM 0 HG12 ILE C 238 1.249 0.692 6.032 1.00 43.32 H new ATOM 0 HG13 ILE C 238 1.901 0.335 7.619 1.00 43.32 H new ATOM 0 HG21 ILE C 238 4.065 0.102 4.616 1.00 35.23 H new ATOM 0 HG22 ILE C 238 3.721 -1.610 4.274 1.00 35.23 H new ATOM 0 HG23 ILE C 238 2.485 -0.372 3.949 1.00 35.23 H new ATOM 0 HD11 ILE C 238 2.592 2.517 6.857 1.00 54.32 H new ATOM 0 HD12 ILE C 238 3.993 1.432 7.021 1.00 54.32 H new ATOM 0 HD13 ILE C 238 3.331 1.794 5.409 1.00 54.32 H new ATOM 1749 N VAL C 239 2.175 -3.765 4.708 1.00 70.41 N ATOM 1750 CA VAL C 239 2.767 -5.005 4.343 1.00 60.01 C ATOM 1751 C VAL C 239 3.808 -4.818 3.267 1.00 21.43 C ATOM 1752 O VAL C 239 3.600 -4.068 2.312 1.00 14.34 O ATOM 1753 CB VAL C 239 1.688 -6.053 3.915 1.00 63.14 C ATOM 1754 CG1 VAL C 239 2.277 -7.136 3.043 1.00 41.34 C ATOM 1755 CG2 VAL C 239 1.082 -6.705 5.145 1.00 53.10 C ATOM 0 H VAL C 239 1.646 -3.323 3.956 1.00 70.41 H new ATOM 0 HA VAL C 239 3.270 -5.399 5.226 1.00 60.01 H new ATOM 0 HB VAL C 239 0.925 -5.519 3.348 1.00 63.14 H new ATOM 0 HG11 VAL C 239 1.497 -7.845 2.766 1.00 41.34 H new ATOM 0 HG12 VAL C 239 2.697 -6.689 2.142 1.00 41.34 H new ATOM 0 HG13 VAL C 239 3.063 -7.657 3.590 1.00 41.34 H new ATOM 0 HG21 VAL C 239 0.331 -7.434 4.838 1.00 53.10 H new ATOM 0 HG22 VAL C 239 1.865 -7.208 5.713 1.00 53.10 H new ATOM 0 HG23 VAL C 239 0.614 -5.943 5.768 1.00 53.10 H new ATOM 1765 N ALA C 240 4.921 -5.484 3.436 1.00 70.14 N ATOM 1766 CA ALA C 240 5.946 -5.500 2.464 1.00 50.10 C ATOM 1767 C ALA C 240 6.027 -6.888 1.868 1.00 43.02 C ATOM 1768 O ALA C 240 6.137 -7.880 2.597 1.00 41.33 O ATOM 1769 CB ALA C 240 7.265 -5.163 3.106 1.00 55.35 C ATOM 0 H ALA C 240 5.129 -6.033 4.270 1.00 70.14 H new ATOM 0 HA ALA C 240 5.726 -4.766 1.689 1.00 50.10 H new ATOM 0 HB1 ALA C 240 8.051 -5.177 2.351 1.00 55.35 H new ATOM 0 HB2 ALA C 240 7.209 -4.171 3.553 1.00 55.35 H new ATOM 0 HB3 ALA C 240 7.491 -5.897 3.879 1.00 55.35 H new ATOM 1775 N ARG C 241 5.940 -6.983 0.567 1.00 63.14 N ATOM 1776 CA ARG C 241 6.123 -8.263 -0.072 1.00 65.44 C ATOM 1777 C ARG C 241 7.516 -8.213 -0.603 1.00 31.34 C ATOM 1778 O ARG C 241 7.834 -7.359 -1.444 1.00 34.45 O ATOM 1779 CB ARG C 241 5.122 -8.490 -1.223 1.00 22.33 C ATOM 1780 CG ARG C 241 4.847 -9.982 -1.582 1.00 0.15 C ATOM 1781 CD ARG C 241 6.090 -10.795 -1.964 1.00 33.12 C ATOM 1782 NE ARG C 241 5.733 -12.169 -2.380 1.00 3.44 N ATOM 1783 CZ ARG C 241 6.604 -13.147 -2.694 1.00 60.44 C ATOM 1784 NH1 ARG C 241 7.908 -12.980 -2.545 1.00 21.23 N ATOM 1785 NH2 ARG C 241 6.148 -14.308 -3.135 1.00 62.02 N ATOM 0 H ARG C 241 5.747 -6.205 -0.063 1.00 63.14 H new ATOM 0 HA ARG C 241 5.956 -9.083 0.627 1.00 65.44 H new ATOM 0 HB2 ARG C 241 4.176 -8.017 -0.959 1.00 22.33 H new ATOM 0 HB3 ARG C 241 5.495 -7.982 -2.112 1.00 22.33 H new ATOM 0 HG2 ARG C 241 4.364 -10.462 -0.731 1.00 0.15 H new ATOM 0 HG3 ARG C 241 4.140 -10.017 -2.411 1.00 0.15 H new ATOM 0 HD2 ARG C 241 6.618 -10.294 -2.775 1.00 33.12 H new ATOM 0 HD3 ARG C 241 6.774 -10.837 -1.116 1.00 33.12 H new ATOM 0 HE ARG C 241 4.740 -12.396 -2.434 1.00 3.44 H new ATOM 0 HH11 ARG C 241 8.271 -12.097 -2.186 1.00 21.23 H new ATOM 0 HH12 ARG C 241 8.550 -13.734 -2.789 1.00 21.23 H new ATOM 0 HH21 ARG C 241 5.144 -14.457 -3.235 1.00 62.02 H new ATOM 0 HH22 ARG C 241 6.801 -15.054 -3.375 1.00 62.02 H new ATOM 1799 N LEU C 242 8.333 -9.067 -0.127 1.00 63.40 N ATOM 1800 CA LEU C 242 9.728 -9.000 -0.437 1.00 53.43 C ATOM 1801 C LEU C 242 10.080 -9.971 -1.518 1.00 44.30 C ATOM 1802 O LEU C 242 9.480 -11.038 -1.617 1.00 64.21 O ATOM 1803 CB LEU C 242 10.523 -9.245 0.824 1.00 72.10 C ATOM 1804 CG LEU C 242 10.120 -8.337 1.983 1.00 33.41 C ATOM 1805 CD1 LEU C 242 10.884 -8.648 3.214 1.00 53.21 C ATOM 1806 CD2 LEU C 242 10.303 -6.910 1.616 1.00 61.52 C ATOM 0 H LEU C 242 8.068 -9.836 0.489 1.00 63.40 H new ATOM 0 HA LEU C 242 9.975 -8.008 -0.816 1.00 53.43 H new ATOM 0 HB2 LEU C 242 10.398 -10.285 1.127 1.00 72.10 H new ATOM 0 HB3 LEU C 242 11.582 -9.100 0.610 1.00 72.10 H new ATOM 0 HG LEU C 242 9.065 -8.520 2.188 1.00 33.41 H new ATOM 0 HD11 LEU C 242 10.569 -7.981 4.016 1.00 53.21 H new ATOM 0 HD12 LEU C 242 10.697 -9.681 3.507 1.00 53.21 H new ATOM 0 HD13 LEU C 242 11.949 -8.511 3.026 1.00 53.21 H new ATOM 0 HD21 LEU C 242 10.011 -6.278 2.455 1.00 61.52 H new ATOM 0 HD22 LEU C 242 11.350 -6.728 1.373 1.00 61.52 H new ATOM 0 HD23 LEU C 242 9.683 -6.674 0.751 1.00 61.52 H new ATOM 1818 N LYS C 243 11.022 -9.600 -2.337 1.00 52.11 N ATOM 1819 CA LYS C 243 11.408 -10.426 -3.456 1.00 11.22 C ATOM 1820 C LYS C 243 12.452 -11.457 -3.067 1.00 21.13 C ATOM 1821 O LYS C 243 12.434 -12.580 -3.569 1.00 23.01 O ATOM 1822 CB LYS C 243 11.864 -9.575 -4.669 1.00 71.11 C ATOM 1823 CG LYS C 243 13.052 -8.647 -4.417 1.00 31.12 C ATOM 1824 CD LYS C 243 13.384 -7.819 -5.657 1.00 61.50 C ATOM 1825 CE LYS C 243 14.601 -6.927 -5.434 1.00 33.43 C ATOM 1826 NZ LYS C 243 14.898 -6.080 -6.617 1.00 10.51 N ATOM 0 H LYS C 243 11.542 -8.727 -2.254 1.00 52.11 H new ATOM 0 HA LYS C 243 10.519 -10.976 -3.766 1.00 11.22 H new ATOM 0 HB2 LYS C 243 12.120 -10.249 -5.487 1.00 71.11 H new ATOM 0 HB3 LYS C 243 11.020 -8.972 -5.005 1.00 71.11 H new ATOM 0 HG2 LYS C 243 12.826 -7.982 -3.583 1.00 31.12 H new ATOM 0 HG3 LYS C 243 13.922 -9.237 -4.128 1.00 31.12 H new ATOM 0 HD2 LYS C 243 13.571 -8.485 -6.499 1.00 61.50 H new ATOM 0 HD3 LYS C 243 12.525 -7.202 -5.923 1.00 61.50 H new ATOM 0 HE2 LYS C 243 14.429 -6.290 -4.567 1.00 33.43 H new ATOM 0 HE3 LYS C 243 15.468 -7.548 -5.206 1.00 33.43 H new ATOM 0 HZ1 LYS C 243 15.732 -5.490 -6.421 1.00 10.51 H new ATOM 0 HZ2 LYS C 243 15.088 -6.687 -7.440 1.00 10.51 H new ATOM 0 HZ3 LYS C 243 14.082 -5.468 -6.820 1.00 10.51 H new ATOM 1882 N ARG C 247 9.525 -13.608 2.168 1.00 25.43 N ATOM 1883 CA ARG C 247 8.077 -13.746 1.995 1.00 22.53 C ATOM 1884 C ARG C 247 7.328 -12.384 2.019 1.00 21.41 C ATOM 1885 O ARG C 247 7.868 -11.330 1.640 1.00 41.54 O ATOM 1886 CB ARG C 247 7.499 -14.654 3.105 1.00 41.24 C ATOM 1887 CG ARG C 247 8.115 -16.049 3.268 1.00 44.20 C ATOM 1888 CD ARG C 247 9.440 -16.048 4.026 1.00 10.31 C ATOM 1889 NE ARG C 247 9.896 -17.409 4.340 1.00 1.21 N ATOM 1890 CZ ARG C 247 11.074 -17.722 4.917 1.00 44.23 C ATOM 1891 NH1 ARG C 247 11.967 -16.772 5.178 1.00 40.43 N ATOM 1892 NH2 ARG C 247 11.352 -18.985 5.223 1.00 32.12 N ATOM 0 HA ARG C 247 7.923 -14.189 1.011 1.00 22.53 H new ATOM 0 HB2 ARG C 247 7.598 -14.129 4.055 1.00 41.24 H new ATOM 0 HB3 ARG C 247 6.432 -14.777 2.918 1.00 41.24 H new ATOM 0 HG2 ARG C 247 7.407 -16.691 3.792 1.00 44.20 H new ATOM 0 HG3 ARG C 247 8.271 -16.486 2.281 1.00 44.20 H new ATOM 0 HD2 ARG C 247 10.198 -15.540 3.430 1.00 10.31 H new ATOM 0 HD3 ARG C 247 9.328 -15.481 4.950 1.00 10.31 H new ATOM 0 HE ARG C 247 9.271 -18.179 4.102 1.00 1.21 H new ATOM 0 HH11 ARG C 247 11.763 -15.801 4.942 1.00 40.43 H new ATOM 0 HH12 ARG C 247 12.856 -17.014 5.615 1.00 40.43 H new ATOM 0 HH21 ARG C 247 10.674 -19.720 5.021 1.00 32.12 H new ATOM 0 HH22 ARG C 247 12.244 -19.220 5.659 1.00 32.12 H new ATOM 1906 N GLN C 248 6.061 -12.456 2.403 1.00 61.42 N ATOM 1907 CA GLN C 248 5.220 -11.311 2.629 1.00 60.22 C ATOM 1908 C GLN C 248 5.209 -11.080 4.126 1.00 52.31 C ATOM 1909 O GLN C 248 5.028 -12.025 4.899 1.00 54.15 O ATOM 1910 CB GLN C 248 3.789 -11.626 2.057 1.00 10.23 C ATOM 1911 CG GLN C 248 2.645 -10.608 2.319 1.00 54.34 C ATOM 1912 CD GLN C 248 2.065 -10.652 3.738 1.00 44.34 C ATOM 1913 OE1 GLN C 248 2.502 -9.954 4.627 1.00 62.24 O ATOM 1914 NE2 GLN C 248 1.076 -11.483 3.941 1.00 25.21 N ATOM 0 H GLN C 248 5.585 -13.343 2.568 1.00 61.42 H new ATOM 0 HA GLN C 248 5.575 -10.410 2.130 1.00 60.22 H new ATOM 0 HB2 GLN C 248 3.883 -11.748 0.978 1.00 10.23 H new ATOM 0 HB3 GLN C 248 3.475 -12.589 2.461 1.00 10.23 H new ATOM 0 HG2 GLN C 248 3.019 -9.603 2.124 1.00 54.34 H new ATOM 0 HG3 GLN C 248 1.841 -10.793 1.606 1.00 54.34 H new ATOM 0 HE21 GLN C 248 0.728 -12.059 3.174 1.00 25.21 H new ATOM 0 HE22 GLN C 248 0.653 -11.555 4.866 1.00 25.21 H new ATOM 1923 N VAL C 249 5.410 -9.860 4.534 1.00 32.11 N ATOM 1924 CA VAL C 249 5.478 -9.526 5.936 1.00 21.05 C ATOM 1925 C VAL C 249 4.752 -8.237 6.198 1.00 11.12 C ATOM 1926 O VAL C 249 4.610 -7.411 5.307 1.00 22.12 O ATOM 1927 CB VAL C 249 6.951 -9.391 6.440 1.00 33.41 C ATOM 1928 CG1 VAL C 249 7.677 -10.722 6.394 1.00 43.42 C ATOM 1929 CG2 VAL C 249 7.716 -8.350 5.621 1.00 72.23 C ATOM 0 H VAL C 249 5.532 -9.065 3.907 1.00 32.11 H new ATOM 0 HA VAL C 249 5.005 -10.343 6.480 1.00 21.05 H new ATOM 0 HB VAL C 249 6.909 -9.060 7.478 1.00 33.41 H new ATOM 0 HG11 VAL C 249 8.699 -10.592 6.751 1.00 43.42 H new ATOM 0 HG12 VAL C 249 7.159 -11.441 7.029 1.00 43.42 H new ATOM 0 HG13 VAL C 249 7.696 -11.091 5.369 1.00 43.42 H new ATOM 0 HG21 VAL C 249 8.738 -8.275 5.992 1.00 72.23 H new ATOM 0 HG22 VAL C 249 7.731 -8.651 4.573 1.00 72.23 H new ATOM 0 HG23 VAL C 249 7.225 -7.381 5.714 1.00 72.23 H new ATOM 1939 N CYS C 250 4.313 -8.051 7.395 1.00 25.45 N ATOM 1940 CA CYS C 250 3.662 -6.835 7.751 1.00 53.15 C ATOM 1941 C CYS C 250 4.657 -6.028 8.526 1.00 22.31 C ATOM 1942 O CYS C 250 5.246 -6.513 9.469 1.00 51.41 O ATOM 1943 CB CYS C 250 2.392 -7.119 8.567 1.00 14.12 C ATOM 1944 SG CYS C 250 1.431 -5.648 9.071 1.00 14.10 S ATOM 0 H CYS C 250 4.393 -8.731 8.151 1.00 25.45 H new ATOM 0 HA CYS C 250 3.337 -6.283 6.869 1.00 53.15 H new ATOM 0 HB2 CYS C 250 1.744 -7.771 7.981 1.00 14.12 H new ATOM 0 HB3 CYS C 250 2.674 -7.671 9.463 1.00 14.12 H new ATOM 1949 N ILE C 251 4.870 -4.827 8.097 1.00 50.40 N ATOM 1950 CA ILE C 251 5.857 -3.958 8.646 1.00 1.52 C ATOM 1951 C ILE C 251 5.226 -2.754 9.330 1.00 45.51 C ATOM 1952 O ILE C 251 4.000 -2.692 9.499 1.00 60.54 O ATOM 1953 CB ILE C 251 6.873 -3.533 7.570 1.00 34.30 C ATOM 1954 CG1 ILE C 251 6.183 -2.965 6.339 1.00 72.25 C ATOM 1955 CG2 ILE C 251 7.739 -4.712 7.191 1.00 55.24 C ATOM 1956 CD1 ILE C 251 7.144 -2.443 5.306 1.00 22.11 C ATOM 0 H ILE C 251 4.344 -4.411 7.329 1.00 50.40 H new ATOM 0 HA ILE C 251 6.398 -4.511 9.414 1.00 1.52 H new ATOM 0 HB ILE C 251 7.498 -2.743 7.988 1.00 34.30 H new ATOM 0 HG12 ILE C 251 5.562 -3.740 5.889 1.00 72.25 H new ATOM 0 HG13 ILE C 251 5.516 -2.159 6.644 1.00 72.25 H new ATOM 0 HG21 ILE C 251 8.456 -4.407 6.429 1.00 55.24 H new ATOM 0 HG22 ILE C 251 8.274 -5.068 8.071 1.00 55.24 H new ATOM 0 HG23 ILE C 251 7.112 -5.513 6.799 1.00 55.24 H new ATOM 0 HD11 ILE C 251 6.586 -2.053 4.455 1.00 22.11 H new ATOM 0 HD12 ILE C 251 7.748 -1.646 5.740 1.00 22.11 H new ATOM 0 HD13 ILE C 251 7.795 -3.251 4.973 1.00 22.11 H new ATOM 1968 N ASP C 252 6.040 -1.817 9.740 1.00 61.14 N ATOM 1969 CA ASP C 252 5.541 -0.704 10.530 1.00 13.42 C ATOM 1970 C ASP C 252 5.684 0.640 9.818 1.00 30.30 C ATOM 1971 O ASP C 252 6.682 0.901 9.178 1.00 31.43 O ATOM 1972 CB ASP C 252 6.269 -0.668 11.857 1.00 70.22 C ATOM 1973 CG ASP C 252 5.642 0.268 12.839 1.00 43.32 C ATOM 1974 OD1 ASP C 252 4.654 -0.124 13.497 1.00 10.04 O ATOM 1975 OD2 ASP C 252 6.113 1.388 12.974 1.00 3.44 O ATOM 0 H ASP C 252 7.041 -1.794 9.547 1.00 61.14 H new ATOM 0 HA ASP C 252 4.474 -0.864 10.685 1.00 13.42 H new ATOM 0 HB2 ASP C 252 6.290 -1.672 12.282 1.00 70.22 H new ATOM 0 HB3 ASP C 252 7.304 -0.371 11.690 1.00 70.22 H new ATOM 1980 N PRO C 253 4.663 1.501 9.920 1.00 22.12 N ATOM 1981 CA PRO C 253 4.678 2.842 9.323 1.00 1.43 C ATOM 1982 C PRO C 253 5.745 3.782 9.879 1.00 3.43 C ATOM 1983 O PRO C 253 6.065 4.781 9.248 1.00 4.21 O ATOM 1984 CB PRO C 253 3.301 3.409 9.614 1.00 42.01 C ATOM 1985 CG PRO C 253 2.658 2.506 10.592 1.00 20.23 C ATOM 1986 CD PRO C 253 3.385 1.203 10.565 1.00 74.05 C ATOM 0 HA PRO C 253 4.919 2.759 8.263 1.00 1.43 H new ATOM 0 HB2 PRO C 253 3.377 4.420 10.015 1.00 42.01 H new ATOM 0 HB3 PRO C 253 2.709 3.472 8.701 1.00 42.01 H new ATOM 0 HG2 PRO C 253 2.692 2.940 11.591 1.00 20.23 H new ATOM 0 HG3 PRO C 253 1.607 2.361 10.343 1.00 20.23 H new ATOM 0 HD2 PRO C 253 3.532 0.811 11.571 1.00 74.05 H new ATOM 0 HD3 PRO C 253 2.827 0.450 10.008 1.00 74.05 H new ATOM 1994 N LYS C 254 6.286 3.484 11.055 1.00 40.23 N ATOM 1995 CA LYS C 254 7.320 4.308 11.625 1.00 50.13 C ATOM 1996 C LYS C 254 8.662 4.163 10.931 1.00 42.30 C ATOM 1997 O LYS C 254 9.626 4.864 11.259 1.00 35.23 O ATOM 1998 CB LYS C 254 7.428 4.078 13.081 1.00 12.04 C ATOM 1999 CG LYS C 254 6.188 4.555 13.783 1.00 55.02 C ATOM 2000 CD LYS C 254 6.345 4.503 15.239 1.00 22.21 C ATOM 2001 CE LYS C 254 6.119 3.114 15.856 1.00 0.33 C ATOM 2002 NZ LYS C 254 7.026 2.056 15.355 1.00 5.32 N ATOM 0 H LYS C 254 6.020 2.679 11.623 1.00 40.23 H new ATOM 0 HA LYS C 254 7.020 5.343 11.459 1.00 50.13 H new ATOM 0 HB2 LYS C 254 7.578 3.016 13.277 1.00 12.04 H new ATOM 0 HB3 LYS C 254 8.300 4.601 13.474 1.00 12.04 H new ATOM 0 HG2 LYS C 254 5.964 5.577 13.476 1.00 55.02 H new ATOM 0 HG3 LYS C 254 5.339 3.939 13.485 1.00 55.02 H new ATOM 0 HD2 LYS C 254 7.349 4.841 15.496 1.00 22.21 H new ATOM 0 HD3 LYS C 254 5.646 5.206 15.692 1.00 22.21 H new ATOM 0 HE2 LYS C 254 6.234 3.189 16.937 1.00 0.33 H new ATOM 0 HE3 LYS C 254 5.090 2.811 15.665 1.00 0.33 H new ATOM 0 HZ1 LYS C 254 7.087 1.290 16.056 1.00 5.32 H new ATOM 0 HZ2 LYS C 254 6.656 1.677 14.460 1.00 5.32 H new ATOM 0 HZ3 LYS C 254 7.973 2.457 15.197 1.00 5.32 H new ATOM 2016 N LEU C 255 8.736 3.248 9.982 1.00 51.52 N ATOM 2017 CA LEU C 255 9.902 3.111 9.157 1.00 51.21 C ATOM 2018 C LEU C 255 9.956 4.343 8.264 1.00 55.11 C ATOM 2019 O LEU C 255 8.995 4.643 7.554 1.00 40.11 O ATOM 2020 CB LEU C 255 9.783 1.849 8.308 1.00 73.55 C ATOM 2021 CG LEU C 255 9.623 0.533 9.075 1.00 13.14 C ATOM 2022 CD1 LEU C 255 9.352 -0.610 8.121 1.00 65.32 C ATOM 2023 CD2 LEU C 255 10.851 0.238 9.918 1.00 42.51 C ATOM 0 H LEU C 255 7.989 2.587 9.769 1.00 51.52 H new ATOM 0 HA LEU C 255 10.807 3.029 9.758 1.00 51.21 H new ATOM 0 HB2 LEU C 255 8.928 1.963 7.641 1.00 73.55 H new ATOM 0 HB3 LEU C 255 10.670 1.774 7.679 1.00 73.55 H new ATOM 0 HG LEU C 255 8.769 0.638 9.745 1.00 13.14 H new ATOM 0 HD11 LEU C 255 9.241 -1.536 8.685 1.00 65.32 H new ATOM 0 HD12 LEU C 255 8.435 -0.411 7.566 1.00 65.32 H new ATOM 0 HD13 LEU C 255 10.184 -0.707 7.424 1.00 65.32 H new ATOM 0 HD21 LEU C 255 10.709 -0.702 10.451 1.00 42.51 H new ATOM 0 HD22 LEU C 255 11.726 0.160 9.272 1.00 42.51 H new ATOM 0 HD23 LEU C 255 11.001 1.044 10.637 1.00 42.51 H new ATOM 2035 N LYS C 256 11.056 5.043 8.288 1.00 53.53 N ATOM 2036 CA LYS C 256 11.146 6.308 7.599 1.00 33.52 C ATOM 2037 C LYS C 256 11.126 6.133 6.084 1.00 23.45 C ATOM 2038 O LYS C 256 10.560 6.966 5.371 1.00 2.32 O ATOM 2039 CB LYS C 256 12.371 7.111 8.052 1.00 74.11 C ATOM 2040 CG LYS C 256 12.426 8.519 7.475 1.00 33.11 C ATOM 2041 CD LYS C 256 11.222 9.344 7.919 1.00 32.51 C ATOM 2042 CE LYS C 256 11.254 10.736 7.327 1.00 25.43 C ATOM 2043 NZ LYS C 256 10.085 11.534 7.742 1.00 14.25 N ATOM 0 H LYS C 256 11.906 4.762 8.777 1.00 53.53 H new ATOM 0 HA LYS C 256 10.259 6.881 7.869 1.00 33.52 H new ATOM 0 HB2 LYS C 256 12.372 7.173 9.140 1.00 74.11 H new ATOM 0 HB3 LYS C 256 13.274 6.574 7.763 1.00 74.11 H new ATOM 0 HG2 LYS C 256 13.345 9.010 7.795 1.00 33.11 H new ATOM 0 HG3 LYS C 256 12.454 8.468 6.387 1.00 33.11 H new ATOM 0 HD2 LYS C 256 10.304 8.840 7.617 1.00 32.51 H new ATOM 0 HD3 LYS C 256 11.207 9.411 9.007 1.00 32.51 H new ATOM 0 HE2 LYS C 256 12.168 11.242 7.637 1.00 25.43 H new ATOM 0 HE3 LYS C 256 11.280 10.668 6.239 1.00 25.43 H new ATOM 0 HZ1 LYS C 256 10.143 12.481 7.316 1.00 14.25 H new ATOM 0 HZ2 LYS C 256 9.213 11.064 7.424 1.00 14.25 H new ATOM 0 HZ3 LYS C 256 10.074 11.620 8.778 1.00 14.25 H new ATOM 2057 N TRP C 257 11.704 5.038 5.586 1.00 4.15 N ATOM 2058 CA TRP C 257 11.705 4.806 4.144 1.00 35.23 C ATOM 2059 C TRP C 257 10.268 4.571 3.662 1.00 20.31 C ATOM 2060 O TRP C 257 9.917 4.905 2.520 1.00 41.34 O ATOM 2061 CB TRP C 257 12.663 3.645 3.716 1.00 41.12 C ATOM 2062 CG TRP C 257 12.248 2.242 4.096 1.00 61.01 C ATOM 2063 CD1 TRP C 257 12.734 1.476 5.109 1.00 53.11 C ATOM 2064 CD2 TRP C 257 11.272 1.440 3.427 1.00 51.03 C ATOM 2065 NE1 TRP C 257 12.114 0.252 5.118 1.00 74.44 N ATOM 2066 CE2 TRP C 257 11.207 0.208 4.090 1.00 22.33 C ATOM 2067 CE3 TRP C 257 10.439 1.658 2.329 1.00 45.11 C ATOM 2068 CZ2 TRP C 257 10.342 -0.801 3.682 1.00 64.20 C ATOM 2069 CZ3 TRP C 257 9.592 0.667 1.935 1.00 53.33 C ATOM 2070 CH2 TRP C 257 9.548 -0.541 2.603 1.00 24.31 C ATOM 0 H TRP C 257 12.164 4.318 6.143 1.00 4.15 H new ATOM 0 HA TRP C 257 12.100 5.699 3.659 1.00 35.23 H new ATOM 0 HB2 TRP C 257 12.779 3.683 2.633 1.00 41.12 H new ATOM 0 HB3 TRP C 257 13.645 3.838 4.149 1.00 41.12 H new ATOM 0 HD1 TRP C 257 13.498 1.786 5.806 1.00 53.11 H new ATOM 0 HE1 TRP C 257 12.297 -0.502 5.780 1.00 74.44 H new ATOM 0 HE3 TRP C 257 10.466 2.599 1.799 1.00 45.11 H new ATOM 0 HZ2 TRP C 257 10.300 -1.750 4.197 1.00 64.20 H new ATOM 0 HZ3 TRP C 257 8.944 0.828 1.086 1.00 53.33 H new ATOM 0 HH2 TRP C 257 8.864 -1.304 2.261 1.00 24.31 H new ATOM 2081 N ILE C 258 9.447 4.001 4.556 1.00 63.14 N ATOM 2082 CA ILE C 258 8.024 3.790 4.321 1.00 12.43 C ATOM 2083 C ILE C 258 7.341 5.102 4.084 1.00 10.14 C ATOM 2084 O ILE C 258 6.572 5.265 3.133 1.00 44.54 O ATOM 2085 CB ILE C 258 7.364 3.083 5.544 1.00 10.12 C ATOM 2086 CG1 ILE C 258 7.592 1.585 5.513 1.00 30.44 C ATOM 2087 CG2 ILE C 258 5.880 3.401 5.664 1.00 14.11 C ATOM 2088 CD1 ILE C 258 6.810 0.901 4.433 1.00 14.51 C ATOM 0 H ILE C 258 9.762 3.673 5.469 1.00 63.14 H new ATOM 0 HA ILE C 258 7.916 3.156 3.441 1.00 12.43 H new ATOM 0 HB ILE C 258 7.854 3.482 6.432 1.00 10.12 H new ATOM 0 HG12 ILE C 258 8.654 1.387 5.368 1.00 30.44 H new ATOM 0 HG13 ILE C 258 7.318 1.160 6.479 1.00 30.44 H new ATOM 0 HG21 ILE C 258 5.466 2.885 6.531 1.00 14.11 H new ATOM 0 HG22 ILE C 258 5.747 4.476 5.784 1.00 14.11 H new ATOM 0 HG23 ILE C 258 5.363 3.070 4.764 1.00 14.11 H new ATOM 0 HD11 ILE C 258 7.013 -0.170 4.459 1.00 14.51 H new ATOM 0 HD12 ILE C 258 5.745 1.072 4.591 1.00 14.51 H new ATOM 0 HD13 ILE C 258 7.102 1.302 3.463 1.00 14.51 H new ATOM 2100 N GLN C 259 7.640 6.039 4.933 1.00 20.12 N ATOM 2101 CA GLN C 259 7.040 7.317 4.863 1.00 62.04 C ATOM 2102 C GLN C 259 7.431 8.047 3.609 1.00 30.44 C ATOM 2103 O GLN C 259 6.653 8.773 3.083 1.00 52.25 O ATOM 2104 CB GLN C 259 7.322 8.104 6.111 1.00 5.31 C ATOM 2105 CG GLN C 259 6.828 7.355 7.314 1.00 11.55 C ATOM 2106 CD GLN C 259 6.838 8.121 8.570 1.00 4.13 C ATOM 2107 OE1 GLN C 259 7.657 9.017 8.787 1.00 34.33 O ATOM 2108 NE2 GLN C 259 5.927 7.771 9.413 1.00 64.23 N ATOM 0 H GLN C 259 8.311 5.928 5.693 1.00 20.12 H new ATOM 0 HA GLN C 259 5.959 7.186 4.806 1.00 62.04 H new ATOM 0 HB2 GLN C 259 8.393 8.287 6.201 1.00 5.31 H new ATOM 0 HB3 GLN C 259 6.836 9.078 6.054 1.00 5.31 H new ATOM 0 HG2 GLN C 259 5.810 7.017 7.120 1.00 11.55 H new ATOM 0 HG3 GLN C 259 7.441 6.463 7.445 1.00 11.55 H new ATOM 0 HE21 GLN C 259 5.276 7.022 9.178 1.00 64.23 H new ATOM 0 HE22 GLN C 259 5.858 8.243 10.314 1.00 64.23 H new ATOM 2117 N GLU C 260 8.630 7.797 3.117 1.00 0.15 N ATOM 2118 CA GLU C 260 9.092 8.415 1.871 1.00 32.13 C ATOM 2119 C GLU C 260 8.391 7.781 0.674 1.00 12.54 C ATOM 2120 O GLU C 260 8.185 8.430 -0.357 1.00 13.40 O ATOM 2121 CB GLU C 260 10.577 8.210 1.693 1.00 60.25 C ATOM 2122 CG GLU C 260 11.434 8.709 2.812 1.00 72.32 C ATOM 2123 CD GLU C 260 12.892 8.537 2.503 1.00 52.14 C ATOM 2124 OE1 GLU C 260 13.299 7.417 2.097 1.00 33.12 O ATOM 2125 OE2 GLU C 260 13.654 9.511 2.626 1.00 0.41 O ATOM 0 H GLU C 260 9.307 7.172 3.555 1.00 0.15 H new ATOM 0 HA GLU C 260 8.864 9.479 1.928 1.00 32.13 H new ATOM 0 HB2 GLU C 260 10.766 7.145 1.561 1.00 60.25 H new ATOM 0 HB3 GLU C 260 10.887 8.705 0.773 1.00 60.25 H new ATOM 0 HG2 GLU C 260 11.221 9.762 2.994 1.00 72.32 H new ATOM 0 HG3 GLU C 260 11.189 8.171 3.728 1.00 72.32 H new ATOM 2132 N TYR C 261 8.045 6.510 0.821 1.00 3.15 N ATOM 2133 CA TYR C 261 7.404 5.734 -0.235 1.00 13.20 C ATOM 2134 C TYR C 261 6.064 6.407 -0.530 1.00 52.04 C ATOM 2135 O TYR C 261 5.765 6.776 -1.663 1.00 14.24 O ATOM 2136 CB TYR C 261 7.162 4.307 0.298 1.00 32.03 C ATOM 2137 CG TYR C 261 7.205 3.172 -0.691 1.00 32.40 C ATOM 2138 CD1 TYR C 261 6.084 2.814 -1.376 1.00 34.42 C ATOM 2139 CD2 TYR C 261 8.357 2.402 -0.872 1.00 63.40 C ATOM 2140 CE1 TYR C 261 6.082 1.736 -2.221 1.00 71.45 C ATOM 2141 CE2 TYR C 261 8.346 1.312 -1.709 1.00 63.51 C ATOM 2142 CZ TYR C 261 7.199 0.993 -2.379 1.00 34.34 C ATOM 2143 OH TYR C 261 7.161 -0.091 -3.189 1.00 61.41 O ATOM 0 H TYR C 261 8.201 5.984 1.681 1.00 3.15 H new ATOM 0 HA TYR C 261 8.015 5.686 -1.136 1.00 13.20 H new ATOM 0 HB2 TYR C 261 7.905 4.107 1.070 1.00 32.03 H new ATOM 0 HB3 TYR C 261 6.186 4.292 0.783 1.00 32.03 H new ATOM 0 HD1 TYR C 261 5.180 3.391 -1.251 1.00 34.42 H new ATOM 0 HD2 TYR C 261 9.264 2.666 -0.349 1.00 63.40 H new ATOM 0 HE1 TYR C 261 5.184 1.479 -2.763 1.00 71.45 H new ATOM 0 HE2 TYR C 261 9.236 0.713 -1.836 1.00 63.51 H new ATOM 0 HH TYR C 261 7.647 -0.831 -2.768 1.00 61.41 H new ATOM 2153 N LEU C 262 5.296 6.598 0.535 1.00 32.31 N ATOM 2154 CA LEU C 262 4.006 7.221 0.494 1.00 45.03 C ATOM 2155 C LEU C 262 4.084 8.737 0.326 1.00 42.34 C ATOM 2156 O LEU C 262 3.167 9.356 -0.195 1.00 43.54 O ATOM 2157 CB LEU C 262 3.140 6.751 1.680 1.00 42.35 C ATOM 2158 CG LEU C 262 3.695 6.923 3.087 1.00 51.53 C ATOM 2159 CD1 LEU C 262 3.518 8.317 3.570 1.00 52.13 C ATOM 2160 CD2 LEU C 262 3.086 5.918 4.047 1.00 43.12 C ATOM 0 H LEU C 262 5.574 6.310 1.473 1.00 32.31 H new ATOM 0 HA LEU C 262 3.494 6.889 -0.409 1.00 45.03 H new ATOM 0 HB2 LEU C 262 2.189 7.282 1.630 1.00 42.35 H new ATOM 0 HB3 LEU C 262 2.922 5.693 1.535 1.00 42.35 H new ATOM 0 HG LEU C 262 4.766 6.726 3.047 1.00 51.53 H new ATOM 0 HD11 LEU C 262 3.924 8.407 4.577 1.00 52.13 H new ATOM 0 HD12 LEU C 262 4.043 9.002 2.904 1.00 52.13 H new ATOM 0 HD13 LEU C 262 2.457 8.565 3.583 1.00 52.13 H new ATOM 0 HD21 LEU C 262 3.503 6.067 5.043 1.00 43.12 H new ATOM 0 HD22 LEU C 262 2.005 6.057 4.082 1.00 43.12 H new ATOM 0 HD23 LEU C 262 3.311 4.907 3.707 1.00 43.12 H new ATOM 2172 N GLU C 263 5.173 9.334 0.796 1.00 13.11 N ATOM 2173 CA GLU C 263 5.383 10.746 0.702 1.00 53.43 C ATOM 2174 C GLU C 263 5.354 11.193 -0.758 1.00 45.12 C ATOM 2175 O GLU C 263 4.864 12.260 -1.080 1.00 31.50 O ATOM 2176 CB GLU C 263 6.699 11.085 1.382 1.00 72.13 C ATOM 2177 CG GLU C 263 6.800 12.472 1.953 1.00 70.33 C ATOM 2178 CD GLU C 263 7.267 13.552 0.990 1.00 33.33 C ATOM 2179 OE1 GLU C 263 6.463 14.081 0.223 1.00 51.40 O ATOM 2180 OE2 GLU C 263 8.459 13.915 1.027 1.00 63.41 O ATOM 0 H GLU C 263 5.934 8.833 1.255 1.00 13.11 H new ATOM 0 HA GLU C 263 4.582 11.285 1.208 1.00 53.43 H new ATOM 0 HB2 GLU C 263 6.867 10.368 2.186 1.00 72.13 H new ATOM 0 HB3 GLU C 263 7.505 10.949 0.661 1.00 72.13 H new ATOM 0 HG2 GLU C 263 5.822 12.756 2.342 1.00 70.33 H new ATOM 0 HG3 GLU C 263 7.485 12.447 2.801 1.00 70.33 H new ATOM 2187 N LYS C 264 5.809 10.336 -1.652 1.00 53.22 N ATOM 2188 CA LYS C 264 5.818 10.699 -3.055 1.00 73.00 C ATOM 2189 C LYS C 264 4.441 10.536 -3.702 1.00 62.12 C ATOM 2190 O LYS C 264 4.254 10.852 -4.880 1.00 31.11 O ATOM 2191 CB LYS C 264 6.912 9.967 -3.831 1.00 60.41 C ATOM 2192 CG LYS C 264 8.303 10.132 -3.215 1.00 11.11 C ATOM 2193 CD LYS C 264 8.653 11.594 -2.917 1.00 2.43 C ATOM 2194 CE LYS C 264 8.673 12.464 -4.157 1.00 2.32 C ATOM 2195 NZ LYS C 264 8.975 13.872 -3.823 1.00 2.12 N ATOM 0 H LYS C 264 6.169 9.406 -1.439 1.00 53.22 H new ATOM 0 HA LYS C 264 6.060 11.761 -3.103 1.00 73.00 H new ATOM 0 HB2 LYS C 264 6.667 8.906 -3.879 1.00 60.41 H new ATOM 0 HB3 LYS C 264 6.930 10.336 -4.856 1.00 60.41 H new ATOM 0 HG2 LYS C 264 8.357 9.555 -2.292 1.00 11.11 H new ATOM 0 HG3 LYS C 264 9.047 9.717 -3.894 1.00 11.11 H new ATOM 0 HD2 LYS C 264 7.929 11.998 -2.209 1.00 2.43 H new ATOM 0 HD3 LYS C 264 9.629 11.637 -2.434 1.00 2.43 H new ATOM 0 HE2 LYS C 264 9.419 12.086 -4.856 1.00 2.32 H new ATOM 0 HE3 LYS C 264 7.707 12.407 -4.659 1.00 2.32 H new ATOM 0 HZ1 LYS C 264 8.981 14.442 -4.693 1.00 2.12 H new ATOM 0 HZ2 LYS C 264 8.249 14.238 -3.175 1.00 2.12 H new ATOM 0 HZ3 LYS C 264 9.907 13.928 -3.366 1.00 2.12 H new ATOM 2209 N CYS C 265 3.483 10.050 -2.931 1.00 20.03 N ATOM 2210 CA CYS C 265 2.100 9.983 -3.370 1.00 12.13 C ATOM 2211 C CYS C 265 1.466 11.326 -3.063 1.00 72.32 C ATOM 2212 O CYS C 265 0.426 11.696 -3.610 1.00 65.35 O ATOM 2213 CB CYS C 265 1.348 8.923 -2.567 1.00 52.33 C ATOM 2214 SG CYS C 265 2.171 7.280 -2.441 1.00 61.34 S ATOM 0 H CYS C 265 3.641 9.693 -1.989 1.00 20.03 H new ATOM 0 HA CYS C 265 2.057 9.738 -4.431 1.00 12.13 H new ATOM 0 HB2 CYS C 265 1.185 9.305 -1.559 1.00 52.33 H new ATOM 0 HB3 CYS C 265 0.365 8.783 -3.017 1.00 52.33 H new ATOM 2219 N LEU C 266 2.129 12.057 -2.193 1.00 71.12 N ATOM 2220 CA LEU C 266 1.655 13.302 -1.700 1.00 33.24 C ATOM 2221 C LEU C 266 2.250 14.433 -2.487 1.00 72.21 C ATOM 2222 O LEU C 266 3.462 14.690 -2.419 1.00 14.15 O ATOM 2223 CB LEU C 266 2.084 13.435 -0.244 1.00 71.14 C ATOM 2224 CG LEU C 266 1.563 12.358 0.690 1.00 12.14 C ATOM 2225 CD1 LEU C 266 2.328 12.350 2.000 1.00 51.41 C ATOM 2226 CD2 LEU C 266 0.101 12.622 0.959 1.00 51.42 C ATOM 0 H LEU C 266 3.033 11.782 -1.809 1.00 71.12 H new ATOM 0 HA LEU C 266 0.569 13.340 -1.790 1.00 33.24 H new ATOM 0 HB2 LEU C 266 3.173 13.432 -0.202 1.00 71.14 H new ATOM 0 HB3 LEU C 266 1.753 14.405 0.127 1.00 71.14 H new ATOM 0 HG LEU C 266 1.697 11.385 0.218 1.00 12.14 H new ATOM 0 HD11 LEU C 266 1.932 11.568 2.648 1.00 51.41 H new ATOM 0 HD12 LEU C 266 3.383 12.159 1.804 1.00 51.41 H new ATOM 0 HD13 LEU C 266 2.219 13.317 2.491 1.00 51.41 H new ATOM 0 HD21 LEU C 266 -0.290 11.856 1.629 1.00 51.42 H new ATOM 0 HD22 LEU C 266 -0.013 13.602 1.422 1.00 51.42 H new ATOM 0 HD23 LEU C 266 -0.452 12.598 0.020 1.00 51.42 H new ATOM 2238 N ASN C 267 1.394 15.091 -3.221 1.00 2.33 N ATOM 2239 CA ASN C 267 1.706 16.282 -3.957 1.00 12.14 C ATOM 2240 C ASN C 267 2.778 16.061 -5.004 1.00 10.15 C ATOM 2241 O ASN C 267 3.952 16.420 -4.817 1.00 44.04 O ATOM 2242 CB ASN C 267 2.031 17.469 -3.037 1.00 51.20 C ATOM 2243 CG ASN C 267 0.879 17.911 -2.103 1.00 24.11 C ATOM 2244 OD1 ASN C 267 0.778 19.091 -1.747 1.00 41.43 O ATOM 2245 ND2 ASN C 267 0.015 16.986 -1.704 1.00 73.22 N ATOM 0 H ASN C 267 0.422 14.799 -3.325 1.00 2.33 H new ATOM 0 HA ASN C 267 0.799 16.545 -4.501 1.00 12.14 H new ATOM 0 HB2 ASN C 267 2.894 17.208 -2.425 1.00 51.20 H new ATOM 0 HB3 ASN C 267 2.323 18.318 -3.655 1.00 51.20 H new ATOM 0 HD21 ASN C 267 -0.757 17.241 -1.088 1.00 73.22 H new ATOM 0 HD22 ASN C 267 0.123 16.020 -2.014 1.00 73.22 H new ATOM 2252 N LYS C 268 2.400 15.409 -6.066 1.00 51.34 N ATOM 2253 CA LYS C 268 3.286 15.177 -7.159 1.00 41.53 C ATOM 2254 C LYS C 268 2.484 15.372 -8.428 1.00 2.23 C ATOM 2255 O LYS C 268 1.862 14.417 -8.900 1.00 38.10 O ATOM 2256 CB LYS C 268 3.883 13.747 -7.065 1.00 20.12 C ATOM 2257 CG LYS C 268 5.096 13.455 -7.969 1.00 10.13 C ATOM 2258 CD LYS C 268 4.793 13.492 -9.461 1.00 55.04 C ATOM 2259 CE LYS C 268 6.043 13.253 -10.281 1.00 11.12 C ATOM 2260 NZ LYS C 268 7.083 14.269 -10.013 1.00 12.22 N ATOM 2261 OXT LYS C 268 2.451 16.501 -8.945 1.00 38.10 O ATOM 0 H LYS C 268 1.464 15.024 -6.194 1.00 51.34 H new ATOM 0 HA LYS C 268 4.128 15.869 -7.147 1.00 41.53 H new ATOM 0 HB2 LYS C 268 4.175 13.565 -6.031 1.00 20.12 H new ATOM 0 HB3 LYS C 268 3.097 13.031 -7.305 1.00 20.12 H new ATOM 0 HG2 LYS C 268 5.879 14.182 -7.752 1.00 10.13 H new ATOM 0 HG3 LYS C 268 5.494 12.472 -7.716 1.00 10.13 H new ATOM 0 HD2 LYS C 268 4.047 12.735 -9.702 1.00 55.04 H new ATOM 0 HD3 LYS C 268 4.362 14.458 -9.723 1.00 55.04 H new ATOM 0 HE2 LYS C 268 6.438 12.262 -10.059 1.00 11.12 H new ATOM 0 HE3 LYS C 268 5.789 13.265 -11.341 1.00 11.12 H new ATOM 0 HZ1 LYS C 268 7.780 14.264 -10.784 1.00 12.22 H new ATOM 0 HZ2 LYS C 268 6.642 15.209 -9.951 1.00 12.22 H new ATOM 0 HZ3 LYS C 268 7.559 14.050 -9.115 1.00 12.22 H new