USER MOD reduce.3.24.130724 H: found=0, std=0, add=1021, rem=0, adj=28 USER MOD reduce.3.24.130724 removed 1022 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 530 GLN : amide:sc= -0.834 X(o=-0.53,f=-0.23) USER MOD Set 1.2: A 531 SER OG : rot -8:sc= 0.306 USER MOD Set 2.1: A 497 CYS SG : rot -50:sc= -2.18! USER MOD Set 2.2: A 499 HIS : no HE2:sc= -0.325 X(o=-2.5,f=-2.3) USER MOD Set 3.1: A 430 GLN : amide:sc= 0.718 K(o=1.5,f=0.56) USER MOD Set 3.2: A 474 HIS : no HE2:sc= 0.819 K(o=1.5,f=-4.6!) USER MOD Single : A 398 LYS NZ :NH3+ 158:sc= 0.0557 (180deg=0.0287) USER MOD Single : A 403 SER OG : rot 180:sc= 0 USER MOD Single : A 426 SER OG : rot 180:sc= 0 USER MOD Single : A 429 CYS SG : rot -19:sc= -0.905! USER MOD Single : A 432 TYR OH : rot 180:sc= 0 USER MOD Single : A 434 ASN : amide:sc= 1.54 K(o=1.5,f=-2.7!) USER MOD Single : A 435 HIS : no HD1:sc= -1.12 K(o=-1.1,f=-1.6) USER MOD Single : A 438 ASN : amide:sc= -0.0677 X(o=-0.068,f=0) USER MOD Single : A 440 LYS NZ :NH3+ -142:sc= 1.14 (180deg=0.608) USER MOD Single : A 441 THR OG1 : rot 177:sc= 1.33 USER MOD Single : A 443 GLN : amide:sc= 0 K(o=0,f=-0.5) USER MOD Single : A 446 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 447 LYS NZ :NH3+ -169:sc= 0.901 (180deg=0.545) USER MOD Single : A 450 MET CE :methyl -134:sc= -0.0541 (180deg=-0.566) USER MOD Single : A 451 GLN : amide:sc= 0.282 K(o=0.28,f=-0.28) USER MOD Single : A 455 GLN : amide:sc= 0 K(o=0,f=-0.86) USER MOD Single : A 456 GLN : amide:sc= 0 K(o=0,f=-0.94) USER MOD Single : A 459 THR OG1 : rot 98:sc= 0.915 USER MOD Single : A 460 THR OG1 : rot 97:sc= 1.22 USER MOD Single : A 467 ASN : amide:sc= 0.322 X(o=0.32,f=-0.13) USER MOD Single : A 468 SER OG : rot 180:sc= -0.0986 USER MOD Single : A 470 MET CE :methyl 139:sc= -0.559 (180deg=-3.4!) USER MOD Single : A 472 GLN : amide:sc= -1.16 K(o=-1.2,f=-3.3!) USER MOD Single : A 482 SER OG : rot 180:sc= 0 USER MOD Single : A 484 LYS NZ :NH3+ 177:sc= 0.51 (180deg=0.423) USER MOD Single : A 487 TYR OH : rot 180:sc= 0 USER MOD Single : A 490 MET CE :methyl 145:sc= -0.885 (180deg=-2.91!) USER MOD Single : A 492 ASN : amide:sc= -0.768 K(o=-0.77,f=-0.18) USER MOD Single : A 512 MET CE :methyl 158:sc= -1.17 (180deg=-2) USER MOD Single : A 515 TYR OH : rot 83:sc= 0.00128 USER MOD Single : A 516 SER OG : rot 4:sc= 1.21 USER MOD Single : A 517 SER OG : rot -51:sc= 0.326 USER MOD Single : A 518 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 519 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 520 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 523 MET CE :methyl -170:sc= 0 (180deg=-0.106) USER MOD Single : A 528 TYR OH : rot 150:sc= 0 USER MOD Single : A 535 ASN : amide:sc= 0 X(o=0,f=-0.05) USER MOD Single : A 539 GLN : amide:sc= -0.0684 K(o=-0.068,f=-3.4!) USER MOD Single : A 542 THR OG1 : rot 180:sc= 0 USER MOD Single : A 543 ASN : amide:sc= -0.262 X(o=-0.26,f=0) USER MOD ----------------------------------------------------------------- ATOM 72 N LYS A 398 18.060 3.485 3.783 1.00 0.00 N ATOM 73 CA LYS A 398 17.048 2.986 2.900 1.00 0.00 C ATOM 74 C LYS A 398 17.562 2.978 1.489 1.00 0.00 C ATOM 75 O LYS A 398 18.221 3.918 1.067 1.00 0.00 O ATOM 76 CB LYS A 398 15.695 3.718 3.081 1.00 0.00 C ATOM 77 CG LYS A 398 15.758 5.240 3.170 1.00 0.00 C ATOM 78 CD LYS A 398 16.040 5.923 1.852 1.00 0.00 C ATOM 79 CE LYS A 398 16.171 7.392 2.086 1.00 0.00 C ATOM 80 NZ LYS A 398 16.385 8.173 0.842 1.00 0.00 N ATOM 0 HA LYS A 398 16.826 1.951 3.162 1.00 0.00 H new ATOM 0 HB2 LYS A 398 15.047 3.450 2.247 1.00 0.00 H new ATOM 0 HB3 LYS A 398 15.220 3.341 3.987 1.00 0.00 H new ATOM 0 HG2 LYS A 398 14.811 5.610 3.564 1.00 0.00 H new ATOM 0 HG3 LYS A 398 16.532 5.520 3.885 1.00 0.00 H new ATOM 0 HD2 LYS A 398 16.956 5.528 1.411 1.00 0.00 H new ATOM 0 HD3 LYS A 398 15.235 5.724 1.145 1.00 0.00 H new ATOM 0 HE2 LYS A 398 15.271 7.754 2.583 1.00 0.00 H new ATOM 0 HE3 LYS A 398 17.004 7.571 2.766 1.00 0.00 H new ATOM 0 HZ1 LYS A 398 16.102 9.161 0.999 1.00 0.00 H new ATOM 0 HZ2 LYS A 398 17.391 8.139 0.579 1.00 0.00 H new ATOM 0 HZ3 LYS A 398 15.813 7.767 0.074 1.00 0.00 H new ATOM 94 N LEU A 399 17.314 1.912 0.791 1.00 0.00 N ATOM 95 CA LEU A 399 17.847 1.724 -0.544 1.00 0.00 C ATOM 96 C LEU A 399 16.767 2.010 -1.550 1.00 0.00 C ATOM 97 O LEU A 399 15.656 1.546 -1.386 1.00 0.00 O ATOM 98 CB LEU A 399 18.331 0.268 -0.755 1.00 0.00 C ATOM 99 CG LEU A 399 19.388 -0.313 0.214 1.00 0.00 C ATOM 100 CD1 LEU A 399 18.819 -0.580 1.601 1.00 0.00 C ATOM 101 CD2 LEU A 399 19.968 -1.579 -0.358 1.00 0.00 C ATOM 0 H LEU A 399 16.736 1.140 1.123 1.00 0.00 H new ATOM 0 HA LEU A 399 18.692 2.401 -0.670 1.00 0.00 H new ATOM 0 HB2 LEU A 399 17.455 -0.380 -0.716 1.00 0.00 H new ATOM 0 HB3 LEU A 399 18.735 0.197 -1.765 1.00 0.00 H new ATOM 0 HG LEU A 399 20.172 0.436 0.325 1.00 0.00 H new ATOM 0 HD11 LEU A 399 19.600 -0.987 2.243 1.00 0.00 H new ATOM 0 HD12 LEU A 399 18.448 0.352 2.028 1.00 0.00 H new ATOM 0 HD13 LEU A 399 18.001 -1.296 1.527 1.00 0.00 H new ATOM 0 HD21 LEU A 399 20.711 -1.982 0.330 1.00 0.00 H new ATOM 0 HD22 LEU A 399 19.173 -2.311 -0.503 1.00 0.00 H new ATOM 0 HD23 LEU A 399 20.440 -1.362 -1.316 1.00 0.00 H new ATOM 113 N LEU A 400 17.074 2.755 -2.584 1.00 0.00 N ATOM 114 CA LEU A 400 16.084 3.047 -3.592 1.00 0.00 C ATOM 115 C LEU A 400 15.924 1.798 -4.436 1.00 0.00 C ATOM 116 O LEU A 400 16.907 1.247 -4.957 1.00 0.00 O ATOM 117 CB LEU A 400 16.506 4.274 -4.420 1.00 0.00 C ATOM 118 CG LEU A 400 15.390 5.043 -5.160 1.00 0.00 C ATOM 119 CD1 LEU A 400 15.949 6.309 -5.750 1.00 0.00 C ATOM 120 CD2 LEU A 400 14.744 4.213 -6.252 1.00 0.00 C ATOM 0 H LEU A 400 17.992 3.167 -2.749 1.00 0.00 H new ATOM 0 HA LEU A 400 15.123 3.305 -3.147 1.00 0.00 H new ATOM 0 HB2 LEU A 400 17.014 4.972 -3.755 1.00 0.00 H new ATOM 0 HB3 LEU A 400 17.238 3.948 -5.158 1.00 0.00 H new ATOM 0 HG LEU A 400 14.618 5.279 -4.428 1.00 0.00 H new ATOM 0 HD11 LEU A 400 15.158 6.848 -6.271 1.00 0.00 H new ATOM 0 HD12 LEU A 400 16.351 6.935 -4.953 1.00 0.00 H new ATOM 0 HD13 LEU A 400 16.744 6.062 -6.454 1.00 0.00 H new ATOM 0 HD21 LEU A 400 13.966 4.799 -6.742 1.00 0.00 H new ATOM 0 HD22 LEU A 400 15.498 3.926 -6.985 1.00 0.00 H new ATOM 0 HD23 LEU A 400 14.303 3.317 -5.815 1.00 0.00 H new ATOM 132 N ALA A 401 14.719 1.328 -4.537 1.00 0.00 N ATOM 133 CA ALA A 401 14.481 0.083 -5.191 1.00 0.00 C ATOM 134 C ALA A 401 13.581 0.205 -6.404 1.00 0.00 C ATOM 135 O ALA A 401 13.848 -0.411 -7.436 1.00 0.00 O ATOM 136 CB ALA A 401 13.900 -0.888 -4.194 1.00 0.00 C ATOM 0 H ALA A 401 13.885 1.790 -4.174 1.00 0.00 H new ATOM 0 HA ALA A 401 15.437 -0.281 -5.567 1.00 0.00 H new ATOM 0 HB1 ALA A 401 13.714 -1.844 -4.683 1.00 0.00 H new ATOM 0 HB2 ALA A 401 14.603 -1.031 -3.373 1.00 0.00 H new ATOM 0 HB3 ALA A 401 12.963 -0.492 -3.804 1.00 0.00 H new ATOM 142 N TRP A 402 12.544 0.998 -6.310 1.00 0.00 N ATOM 143 CA TRP A 402 11.565 1.054 -7.362 1.00 0.00 C ATOM 144 C TRP A 402 10.979 2.434 -7.426 1.00 0.00 C ATOM 145 O TRP A 402 10.986 3.159 -6.446 1.00 0.00 O ATOM 146 CB TRP A 402 10.464 -0.002 -7.097 1.00 0.00 C ATOM 147 CG TRP A 402 9.400 -0.104 -8.154 1.00 0.00 C ATOM 148 CD1 TRP A 402 9.530 -0.624 -9.403 1.00 0.00 C ATOM 149 CD2 TRP A 402 8.034 0.295 -8.029 1.00 0.00 C ATOM 150 NE1 TRP A 402 8.337 -0.547 -10.071 1.00 0.00 N ATOM 151 CE2 TRP A 402 7.399 0.009 -9.245 1.00 0.00 C ATOM 152 CE3 TRP A 402 7.295 0.870 -7.007 1.00 0.00 C ATOM 153 CZ2 TRP A 402 6.054 0.285 -9.462 1.00 0.00 C ATOM 154 CZ3 TRP A 402 5.963 1.140 -7.216 1.00 0.00 C ATOM 155 CH2 TRP A 402 5.352 0.847 -8.436 1.00 0.00 C ATOM 0 H TRP A 402 12.357 1.612 -5.517 1.00 0.00 H new ATOM 0 HA TRP A 402 12.034 0.833 -8.321 1.00 0.00 H new ATOM 0 HB2 TRP A 402 10.939 -0.977 -6.988 1.00 0.00 H new ATOM 0 HB3 TRP A 402 9.986 0.228 -6.145 1.00 0.00 H new ATOM 0 HD1 TRP A 402 10.441 -1.038 -9.809 1.00 0.00 H new ATOM 0 HE1 TRP A 402 8.174 -0.855 -11.030 1.00 0.00 H new ATOM 0 HE3 TRP A 402 7.759 1.103 -6.060 1.00 0.00 H new ATOM 0 HZ2 TRP A 402 5.582 0.063 -10.408 1.00 0.00 H new ATOM 0 HZ3 TRP A 402 5.380 1.586 -6.423 1.00 0.00 H new ATOM 0 HH2 TRP A 402 4.304 1.069 -8.570 1.00 0.00 H new ATOM 166 N SER A 403 10.591 2.834 -8.573 1.00 0.00 N ATOM 167 CA SER A 403 9.910 4.067 -8.762 1.00 0.00 C ATOM 168 C SER A 403 8.797 3.823 -9.769 1.00 0.00 C ATOM 169 O SER A 403 9.060 3.421 -10.906 1.00 0.00 O ATOM 170 CB SER A 403 10.903 5.125 -9.227 1.00 0.00 C ATOM 171 OG SER A 403 11.952 5.266 -8.267 1.00 0.00 O ATOM 0 H SER A 403 10.738 2.305 -9.433 1.00 0.00 H new ATOM 0 HA SER A 403 9.468 4.437 -7.837 1.00 0.00 H new ATOM 0 HB2 SER A 403 11.319 4.844 -10.194 1.00 0.00 H new ATOM 0 HB3 SER A 403 10.393 6.079 -9.364 1.00 0.00 H new ATOM 0 HG SER A 403 12.587 5.947 -8.574 1.00 0.00 H new ATOM 177 N GLY A 404 7.579 4.012 -9.344 1.00 0.00 N ATOM 178 CA GLY A 404 6.455 3.698 -10.174 1.00 0.00 C ATOM 179 C GLY A 404 5.223 4.402 -9.708 1.00 0.00 C ATOM 180 O GLY A 404 5.282 5.222 -8.778 1.00 0.00 O ATOM 0 H GLY A 404 7.341 4.383 -8.424 1.00 0.00 H new ATOM 0 HA2 GLY A 404 6.671 3.981 -11.204 1.00 0.00 H new ATOM 0 HA3 GLY A 404 6.285 2.621 -10.168 1.00 0.00 H new ATOM 184 N VAL A 405 4.115 4.072 -10.295 1.00 0.00 N ATOM 185 CA VAL A 405 2.879 4.733 -10.004 1.00 0.00 C ATOM 186 C VAL A 405 1.972 3.787 -9.226 1.00 0.00 C ATOM 187 O VAL A 405 1.940 2.587 -9.486 1.00 0.00 O ATOM 188 CB VAL A 405 2.175 5.193 -11.328 1.00 0.00 C ATOM 189 CG1 VAL A 405 0.889 5.956 -11.052 1.00 0.00 C ATOM 190 CG2 VAL A 405 3.115 6.039 -12.181 1.00 0.00 C ATOM 0 H VAL A 405 4.041 3.332 -10.994 1.00 0.00 H new ATOM 0 HA VAL A 405 3.082 5.618 -9.402 1.00 0.00 H new ATOM 0 HB VAL A 405 1.915 4.290 -11.880 1.00 0.00 H new ATOM 0 HG11 VAL A 405 0.434 6.256 -11.996 1.00 0.00 H new ATOM 0 HG12 VAL A 405 0.198 5.317 -10.503 1.00 0.00 H new ATOM 0 HG13 VAL A 405 1.112 6.843 -10.459 1.00 0.00 H new ATOM 0 HG21 VAL A 405 2.602 6.345 -13.093 1.00 0.00 H new ATOM 0 HG22 VAL A 405 3.418 6.924 -11.621 1.00 0.00 H new ATOM 0 HG23 VAL A 405 3.997 5.454 -12.440 1.00 0.00 H new ATOM 200 N LEU A 406 1.256 4.313 -8.288 1.00 0.00 N ATOM 201 CA LEU A 406 0.339 3.521 -7.521 1.00 0.00 C ATOM 202 C LEU A 406 -1.030 3.975 -7.848 1.00 0.00 C ATOM 203 O LEU A 406 -1.258 5.174 -8.078 1.00 0.00 O ATOM 204 CB LEU A 406 0.550 3.718 -6.016 1.00 0.00 C ATOM 205 CG LEU A 406 1.925 3.399 -5.444 1.00 0.00 C ATOM 206 CD1 LEU A 406 1.938 3.690 -3.957 1.00 0.00 C ATOM 207 CD2 LEU A 406 2.298 1.950 -5.696 1.00 0.00 C ATOM 0 H LEU A 406 1.286 5.299 -8.029 1.00 0.00 H new ATOM 0 HA LEU A 406 0.497 2.470 -7.762 1.00 0.00 H new ATOM 0 HB2 LEU A 406 0.321 4.757 -5.779 1.00 0.00 H new ATOM 0 HB3 LEU A 406 -0.182 3.103 -5.492 1.00 0.00 H new ATOM 0 HG LEU A 406 2.662 4.028 -5.944 1.00 0.00 H new ATOM 0 HD11 LEU A 406 2.923 3.461 -3.550 1.00 0.00 H new ATOM 0 HD12 LEU A 406 1.713 4.743 -3.790 1.00 0.00 H new ATOM 0 HD13 LEU A 406 1.188 3.075 -3.459 1.00 0.00 H new ATOM 0 HD21 LEU A 406 3.284 1.750 -5.277 1.00 0.00 H new ATOM 0 HD22 LEU A 406 1.564 1.298 -5.223 1.00 0.00 H new ATOM 0 HD23 LEU A 406 2.314 1.760 -6.769 1.00 0.00 H new ATOM 219 N GLU A 407 -1.925 3.050 -7.936 1.00 0.00 N ATOM 220 CA GLU A 407 -3.278 3.372 -8.137 1.00 0.00 C ATOM 221 C GLU A 407 -4.064 2.925 -6.937 1.00 0.00 C ATOM 222 O GLU A 407 -3.999 1.756 -6.521 1.00 0.00 O ATOM 223 CB GLU A 407 -3.801 2.822 -9.472 1.00 0.00 C ATOM 224 CG GLU A 407 -3.396 3.700 -10.660 1.00 0.00 C ATOM 225 CD GLU A 407 -3.903 3.233 -12.001 1.00 0.00 C ATOM 226 OE1 GLU A 407 -5.119 3.182 -12.194 1.00 0.00 O ATOM 227 OE2 GLU A 407 -3.080 2.989 -12.929 1.00 0.00 O ATOM 0 H GLU A 407 -1.729 2.051 -7.869 1.00 0.00 H new ATOM 0 HA GLU A 407 -3.399 4.452 -8.225 1.00 0.00 H new ATOM 0 HB2 GLU A 407 -3.418 1.813 -9.622 1.00 0.00 H new ATOM 0 HB3 GLU A 407 -4.888 2.748 -9.431 1.00 0.00 H new ATOM 0 HG2 GLU A 407 -3.759 4.713 -10.484 1.00 0.00 H new ATOM 0 HG3 GLU A 407 -2.308 3.753 -10.699 1.00 0.00 H new ATOM 234 N TRP A 408 -4.780 3.849 -6.368 1.00 0.00 N ATOM 235 CA TRP A 408 -5.474 3.612 -5.146 1.00 0.00 C ATOM 236 C TRP A 408 -6.957 3.740 -5.297 1.00 0.00 C ATOM 237 O TRP A 408 -7.473 4.631 -6.022 1.00 0.00 O ATOM 238 CB TRP A 408 -4.942 4.509 -3.997 1.00 0.00 C ATOM 239 CG TRP A 408 -4.989 5.996 -4.236 1.00 0.00 C ATOM 240 CD1 TRP A 408 -4.041 6.752 -4.861 1.00 0.00 C ATOM 241 CD2 TRP A 408 -6.012 6.908 -3.808 1.00 0.00 C ATOM 242 NE1 TRP A 408 -4.420 8.070 -4.872 1.00 0.00 N ATOM 243 CE2 TRP A 408 -5.624 8.194 -4.228 1.00 0.00 C ATOM 244 CE3 TRP A 408 -7.220 6.759 -3.119 1.00 0.00 C ATOM 245 CZ2 TRP A 408 -6.401 9.325 -3.981 1.00 0.00 C ATOM 246 CZ3 TRP A 408 -7.988 7.879 -2.873 1.00 0.00 C ATOM 247 CH2 TRP A 408 -7.576 9.147 -3.302 1.00 0.00 C ATOM 0 H TRP A 408 -4.897 4.790 -6.743 1.00 0.00 H new ATOM 0 HA TRP A 408 -5.273 2.576 -4.874 1.00 0.00 H new ATOM 0 HB2 TRP A 408 -5.516 4.289 -3.097 1.00 0.00 H new ATOM 0 HB3 TRP A 408 -3.909 4.227 -3.793 1.00 0.00 H new ATOM 0 HD1 TRP A 408 -3.125 6.368 -5.286 1.00 0.00 H new ATOM 0 HE1 TRP A 408 -3.891 8.835 -5.292 1.00 0.00 H new ATOM 0 HE3 TRP A 408 -7.546 5.785 -2.785 1.00 0.00 H new ATOM 0 HZ2 TRP A 408 -6.088 10.304 -4.313 1.00 0.00 H new ATOM 0 HZ3 TRP A 408 -8.922 7.776 -2.341 1.00 0.00 H new ATOM 0 HH2 TRP A 408 -8.199 10.004 -3.092 1.00 0.00 H new ATOM 504 N ARG A 425 -7.427 6.334 -8.509 1.00 0.00 N ATOM 505 CA ARG A 425 -6.560 7.463 -8.726 1.00 0.00 C ATOM 506 C ARG A 425 -5.128 7.020 -8.712 1.00 0.00 C ATOM 507 O ARG A 425 -4.773 6.093 -7.996 1.00 0.00 O ATOM 508 CB ARG A 425 -6.815 8.570 -7.699 1.00 0.00 C ATOM 509 CG ARG A 425 -8.200 9.203 -7.800 1.00 0.00 C ATOM 510 CD ARG A 425 -8.397 9.888 -9.146 1.00 0.00 C ATOM 511 NE ARG A 425 -9.716 10.524 -9.275 1.00 0.00 N ATOM 512 CZ ARG A 425 -10.293 10.851 -10.447 1.00 0.00 C ATOM 513 NH1 ARG A 425 -9.664 10.611 -11.601 1.00 0.00 N ATOM 514 NH2 ARG A 425 -11.495 11.420 -10.463 1.00 0.00 N ATOM 0 HA ARG A 425 -6.780 7.884 -9.707 1.00 0.00 H new ATOM 0 HB2 ARG A 425 -6.687 8.159 -6.698 1.00 0.00 H new ATOM 0 HB3 ARG A 425 -6.061 9.348 -7.823 1.00 0.00 H new ATOM 0 HG2 ARG A 425 -8.963 8.437 -7.664 1.00 0.00 H new ATOM 0 HG3 ARG A 425 -8.330 9.929 -6.997 1.00 0.00 H new ATOM 0 HD2 ARG A 425 -7.621 10.641 -9.282 1.00 0.00 H new ATOM 0 HD3 ARG A 425 -8.273 9.155 -9.943 1.00 0.00 H new ATOM 0 HE ARG A 425 -10.229 10.732 -8.418 1.00 0.00 H new ATOM 0 HH11 ARG A 425 -8.741 10.177 -11.598 1.00 0.00 H new ATOM 0 HH12 ARG A 425 -10.107 10.861 -12.485 1.00 0.00 H new ATOM 0 HH21 ARG A 425 -11.981 11.609 -9.587 1.00 0.00 H new ATOM 0 HH22 ARG A 425 -11.931 11.667 -11.352 1.00 0.00 H new ATOM 528 N SER A 426 -4.325 7.666 -9.505 1.00 0.00 N ATOM 529 CA SER A 426 -2.938 7.329 -9.629 1.00 0.00 C ATOM 530 C SER A 426 -2.064 8.387 -8.991 1.00 0.00 C ATOM 531 O SER A 426 -2.403 9.581 -9.013 1.00 0.00 O ATOM 532 CB SER A 426 -2.581 7.134 -11.107 1.00 0.00 C ATOM 533 OG SER A 426 -2.994 8.247 -11.908 1.00 0.00 O ATOM 0 H SER A 426 -4.617 8.449 -10.089 1.00 0.00 H new ATOM 0 HA SER A 426 -2.755 6.393 -9.100 1.00 0.00 H new ATOM 0 HB2 SER A 426 -1.504 6.996 -11.205 1.00 0.00 H new ATOM 0 HB3 SER A 426 -3.054 6.225 -11.478 1.00 0.00 H new ATOM 0 HG SER A 426 -2.748 8.086 -12.843 1.00 0.00 H new ATOM 539 N LEU A 427 -0.979 7.961 -8.405 1.00 0.00 N ATOM 540 CA LEU A 427 -0.046 8.854 -7.786 1.00 0.00 C ATOM 541 C LEU A 427 1.366 8.264 -7.949 1.00 0.00 C ATOM 542 O LEU A 427 1.573 7.080 -7.663 1.00 0.00 O ATOM 543 CB LEU A 427 -0.421 9.010 -6.300 1.00 0.00 C ATOM 544 CG LEU A 427 0.229 10.161 -5.531 1.00 0.00 C ATOM 545 CD1 LEU A 427 -0.170 11.501 -6.140 1.00 0.00 C ATOM 546 CD2 LEU A 427 -0.190 10.107 -4.071 1.00 0.00 C ATOM 0 H LEU A 427 -0.718 6.977 -8.345 1.00 0.00 H new ATOM 0 HA LEU A 427 -0.071 9.840 -8.250 1.00 0.00 H new ATOM 0 HB2 LEU A 427 -1.503 9.129 -6.236 1.00 0.00 H new ATOM 0 HB3 LEU A 427 -0.172 8.080 -5.790 1.00 0.00 H new ATOM 0 HG LEU A 427 1.312 10.059 -5.597 1.00 0.00 H new ATOM 0 HD11 LEU A 427 0.301 12.309 -5.581 1.00 0.00 H new ATOM 0 HD12 LEU A 427 0.157 11.540 -7.179 1.00 0.00 H new ATOM 0 HD13 LEU A 427 -1.253 11.613 -6.096 1.00 0.00 H new ATOM 0 HD21 LEU A 427 0.276 10.929 -3.528 1.00 0.00 H new ATOM 0 HD22 LEU A 427 -1.274 10.194 -4.000 1.00 0.00 H new ATOM 0 HD23 LEU A 427 0.127 9.159 -3.636 1.00 0.00 H new ATOM 558 N PRO A 428 2.323 9.038 -8.487 1.00 0.00 N ATOM 559 CA PRO A 428 3.702 8.569 -8.673 1.00 0.00 C ATOM 560 C PRO A 428 4.490 8.546 -7.353 1.00 0.00 C ATOM 561 O PRO A 428 4.347 9.443 -6.504 1.00 0.00 O ATOM 562 CB PRO A 428 4.298 9.593 -9.640 1.00 0.00 C ATOM 563 CG PRO A 428 3.517 10.845 -9.408 1.00 0.00 C ATOM 564 CD PRO A 428 2.140 10.422 -8.973 1.00 0.00 C ATOM 0 HA PRO A 428 3.741 7.545 -9.044 1.00 0.00 H new ATOM 0 HB2 PRO A 428 5.359 9.748 -9.446 1.00 0.00 H new ATOM 0 HB3 PRO A 428 4.209 9.258 -10.673 1.00 0.00 H new ATOM 0 HG2 PRO A 428 3.992 11.461 -8.644 1.00 0.00 H new ATOM 0 HG3 PRO A 428 3.468 11.445 -10.317 1.00 0.00 H new ATOM 0 HD2 PRO A 428 1.753 11.072 -8.188 1.00 0.00 H new ATOM 0 HD3 PRO A 428 1.431 10.463 -9.800 1.00 0.00 H new ATOM 572 N CYS A 429 5.318 7.550 -7.181 1.00 0.00 N ATOM 573 CA CYS A 429 6.068 7.413 -5.962 1.00 0.00 C ATOM 574 C CYS A 429 7.457 6.857 -6.215 1.00 0.00 C ATOM 575 O CYS A 429 7.748 6.304 -7.293 1.00 0.00 O ATOM 576 CB CYS A 429 5.324 6.485 -5.011 1.00 0.00 C ATOM 577 SG CYS A 429 5.022 4.843 -5.698 1.00 0.00 S ATOM 0 H CYS A 429 5.490 6.820 -7.872 1.00 0.00 H new ATOM 0 HA CYS A 429 6.175 8.405 -5.523 1.00 0.00 H new ATOM 0 HB2 CYS A 429 5.898 6.385 -4.090 1.00 0.00 H new ATOM 0 HB3 CYS A 429 4.370 6.940 -4.744 1.00 0.00 H new ATOM 0 HG CYS A 429 5.127 4.888 -6.993 1.00 0.00 H new ATOM 583 N GLN A 430 8.298 7.017 -5.237 1.00 0.00 N ATOM 584 CA GLN A 430 9.610 6.466 -5.216 1.00 0.00 C ATOM 585 C GLN A 430 9.602 5.518 -4.033 1.00 0.00 C ATOM 586 O GLN A 430 9.186 5.900 -2.928 1.00 0.00 O ATOM 587 CB GLN A 430 10.651 7.573 -4.976 1.00 0.00 C ATOM 588 CG GLN A 430 10.461 8.810 -5.847 1.00 0.00 C ATOM 589 CD GLN A 430 11.524 9.862 -5.616 1.00 0.00 C ATOM 590 OE1 GLN A 430 11.399 10.716 -4.732 1.00 0.00 O ATOM 591 NE2 GLN A 430 12.547 9.847 -6.423 1.00 0.00 N ATOM 0 H GLN A 430 8.075 7.557 -4.401 1.00 0.00 H new ATOM 0 HA GLN A 430 9.865 5.975 -6.155 1.00 0.00 H new ATOM 0 HB2 GLN A 430 10.613 7.871 -3.928 1.00 0.00 H new ATOM 0 HB3 GLN A 430 11.646 7.166 -5.155 1.00 0.00 H new ATOM 0 HG2 GLN A 430 10.471 8.514 -6.896 1.00 0.00 H new ATOM 0 HG3 GLN A 430 9.480 9.242 -5.647 1.00 0.00 H new ATOM 0 HE21 GLN A 430 12.619 9.127 -7.142 1.00 0.00 H new ATOM 0 HE22 GLN A 430 13.276 10.555 -6.336 1.00 0.00 H new ATOM 600 N VAL A 431 10.022 4.316 -4.244 1.00 0.00 N ATOM 601 CA VAL A 431 9.962 3.315 -3.222 1.00 0.00 C ATOM 602 C VAL A 431 11.347 2.852 -2.860 1.00 0.00 C ATOM 603 O VAL A 431 12.159 2.446 -3.731 1.00 0.00 O ATOM 604 CB VAL A 431 9.080 2.107 -3.649 1.00 0.00 C ATOM 605 CG1 VAL A 431 8.960 1.074 -2.532 1.00 0.00 C ATOM 606 CG2 VAL A 431 7.710 2.591 -4.068 1.00 0.00 C ATOM 0 H VAL A 431 10.417 3.996 -5.128 1.00 0.00 H new ATOM 0 HA VAL A 431 9.498 3.767 -2.345 1.00 0.00 H new ATOM 0 HB VAL A 431 9.564 1.620 -4.495 1.00 0.00 H new ATOM 0 HG11 VAL A 431 8.337 0.245 -2.868 1.00 0.00 H new ATOM 0 HG12 VAL A 431 9.951 0.701 -2.274 1.00 0.00 H new ATOM 0 HG13 VAL A 431 8.507 1.537 -1.655 1.00 0.00 H new ATOM 0 HG21 VAL A 431 7.098 1.739 -4.366 1.00 0.00 H new ATOM 0 HG22 VAL A 431 7.234 3.105 -3.233 1.00 0.00 H new ATOM 0 HG23 VAL A 431 7.808 3.278 -4.908 1.00 0.00 H new ATOM 616 N TYR A 432 11.622 2.943 -1.611 1.00 0.00 N ATOM 617 CA TYR A 432 12.857 2.527 -1.052 1.00 0.00 C ATOM 618 C TYR A 432 12.593 1.273 -0.270 1.00 0.00 C ATOM 619 O TYR A 432 11.448 1.003 0.078 1.00 0.00 O ATOM 620 CB TYR A 432 13.395 3.582 -0.091 1.00 0.00 C ATOM 621 CG TYR A 432 13.501 4.972 -0.657 1.00 0.00 C ATOM 622 CD1 TYR A 432 14.538 5.326 -1.498 1.00 0.00 C ATOM 623 CD2 TYR A 432 12.573 5.941 -0.315 1.00 0.00 C ATOM 624 CE1 TYR A 432 14.651 6.610 -1.985 1.00 0.00 C ATOM 625 CE2 TYR A 432 12.674 7.221 -0.804 1.00 0.00 C ATOM 626 CZ TYR A 432 13.714 7.552 -1.634 1.00 0.00 C ATOM 627 OH TYR A 432 13.826 8.831 -2.099 1.00 0.00 O ATOM 0 H TYR A 432 10.971 3.323 -0.924 1.00 0.00 H new ATOM 0 HA TYR A 432 13.586 2.370 -1.847 1.00 0.00 H new ATOM 0 HB2 TYR A 432 12.750 3.613 0.787 1.00 0.00 H new ATOM 0 HB3 TYR A 432 14.382 3.270 0.250 1.00 0.00 H new ATOM 0 HD1 TYR A 432 15.272 4.585 -1.778 1.00 0.00 H new ATOM 0 HD2 TYR A 432 11.758 5.687 0.346 1.00 0.00 H new ATOM 0 HE1 TYR A 432 15.470 6.874 -2.638 1.00 0.00 H new ATOM 0 HE2 TYR A 432 11.937 7.964 -0.536 1.00 0.00 H new ATOM 0 HH TYR A 432 13.082 9.369 -1.758 1.00 0.00 H new ATOM 637 N VAL A 433 13.607 0.521 0.006 1.00 0.00 N ATOM 638 CA VAL A 433 13.455 -0.631 0.831 1.00 0.00 C ATOM 639 C VAL A 433 14.342 -0.510 2.021 1.00 0.00 C ATOM 640 O VAL A 433 15.457 0.041 1.936 1.00 0.00 O ATOM 641 CB VAL A 433 13.716 -2.007 0.112 1.00 0.00 C ATOM 642 CG1 VAL A 433 12.787 -2.209 -1.060 1.00 0.00 C ATOM 643 CG2 VAL A 433 15.173 -2.198 -0.300 1.00 0.00 C ATOM 0 H VAL A 433 14.556 0.685 -0.330 1.00 0.00 H new ATOM 0 HA VAL A 433 12.403 -0.650 1.117 1.00 0.00 H new ATOM 0 HB VAL A 433 13.499 -2.778 0.851 1.00 0.00 H new ATOM 0 HG11 VAL A 433 12.998 -3.169 -1.530 1.00 0.00 H new ATOM 0 HG12 VAL A 433 11.754 -2.194 -0.712 1.00 0.00 H new ATOM 0 HG13 VAL A 433 12.937 -1.409 -1.785 1.00 0.00 H new ATOM 0 HG21 VAL A 433 15.289 -3.165 -0.790 1.00 0.00 H new ATOM 0 HG22 VAL A 433 15.463 -1.405 -0.989 1.00 0.00 H new ATOM 0 HG23 VAL A 433 15.809 -2.161 0.584 1.00 0.00 H new ATOM 653 N ASN A 434 13.842 -0.940 3.139 1.00 0.00 N ATOM 654 CA ASN A 434 14.639 -0.988 4.289 1.00 0.00 C ATOM 655 C ASN A 434 15.224 -2.376 4.388 1.00 0.00 C ATOM 656 O ASN A 434 14.430 -3.478 4.336 1.00 0.00 O ATOM 657 CB ASN A 434 13.955 -0.481 5.576 1.00 0.00 C ATOM 658 CG ASN A 434 14.892 -0.474 6.774 1.00 0.00 C ATOM 659 OD1 ASN A 434 16.093 -0.261 6.642 1.00 0.00 O ATOM 660 ND2 ASN A 434 14.364 -0.733 7.935 1.00 0.00 N ATOM 0 H ASN A 434 12.881 -1.260 3.263 1.00 0.00 H new ATOM 0 HA ASN A 434 15.449 -0.266 4.188 1.00 0.00 H new ATOM 0 HB2 ASN A 434 13.578 0.528 5.409 1.00 0.00 H new ATOM 0 HB3 ASN A 434 13.093 -1.111 5.797 1.00 0.00 H new ATOM 0 HD21 ASN A 434 14.952 -0.763 8.768 1.00 0.00 H new ATOM 0 HD22 ASN A 434 13.362 -0.906 8.012 1.00 0.00 H new ATOM 667 N HIS A 435 16.562 -2.251 4.614 1.00 0.00 N ATOM 668 CA HIS A 435 17.709 -3.167 4.471 1.00 0.00 C ATOM 669 C HIS A 435 17.536 -4.612 4.838 1.00 0.00 C ATOM 670 O HIS A 435 16.814 -4.971 5.764 1.00 0.00 O ATOM 671 CB HIS A 435 18.912 -2.594 5.252 1.00 0.00 C ATOM 672 CG HIS A 435 20.163 -2.410 4.429 1.00 0.00 C ATOM 673 ND1 HIS A 435 20.871 -1.227 4.354 1.00 0.00 N ATOM 674 CD2 HIS A 435 20.833 -3.291 3.640 1.00 0.00 C ATOM 675 CE1 HIS A 435 21.914 -1.418 3.541 1.00 0.00 C ATOM 676 NE2 HIS A 435 21.939 -2.657 3.079 1.00 0.00 N ATOM 0 H HIS A 435 16.903 -1.353 4.957 1.00 0.00 H new ATOM 0 HA HIS A 435 17.854 -3.204 3.391 1.00 0.00 H new ATOM 0 HB2 HIS A 435 18.628 -1.632 5.677 1.00 0.00 H new ATOM 0 HB3 HIS A 435 19.136 -3.258 6.087 1.00 0.00 H new ATOM 0 HD2 HIS A 435 20.552 -4.321 3.474 1.00 0.00 H new ATOM 0 HE1 HIS A 435 22.642 -0.659 3.293 1.00 0.00 H new ATOM 0 HE2 HIS A 435 22.626 -3.064 2.444 1.00 0.00 H new ATOM 684 N GLY A 436 18.295 -5.426 4.091 1.00 0.00 N ATOM 685 CA GLY A 436 18.404 -6.851 4.301 1.00 0.00 C ATOM 686 C GLY A 436 17.684 -7.603 3.230 1.00 0.00 C ATOM 687 O GLY A 436 17.955 -8.782 2.958 1.00 0.00 O ATOM 0 H GLY A 436 18.858 -5.090 3.309 1.00 0.00 H new ATOM 0 HA2 GLY A 436 19.454 -7.142 4.312 1.00 0.00 H new ATOM 0 HA3 GLY A 436 17.991 -7.112 5.275 1.00 0.00 H new ATOM 691 N GLU A 437 16.825 -6.903 2.577 1.00 0.00 N ATOM 692 CA GLU A 437 15.901 -7.478 1.663 1.00 0.00 C ATOM 693 C GLU A 437 16.401 -7.350 0.242 1.00 0.00 C ATOM 694 O GLU A 437 16.601 -6.238 -0.251 1.00 0.00 O ATOM 695 CB GLU A 437 14.584 -6.741 1.810 1.00 0.00 C ATOM 696 CG GLU A 437 14.209 -6.440 3.266 1.00 0.00 C ATOM 697 CD GLU A 437 14.193 -7.676 4.172 1.00 0.00 C ATOM 698 OE1 GLU A 437 15.146 -7.913 4.907 1.00 0.00 O ATOM 699 OE2 GLU A 437 13.240 -8.433 4.128 1.00 0.00 O ATOM 0 H GLU A 437 16.743 -5.890 2.665 1.00 0.00 H new ATOM 0 HA GLU A 437 15.779 -8.539 1.880 1.00 0.00 H new ATOM 0 HB2 GLU A 437 14.638 -5.804 1.256 1.00 0.00 H new ATOM 0 HB3 GLU A 437 13.792 -7.335 1.355 1.00 0.00 H new ATOM 0 HG2 GLU A 437 14.915 -5.715 3.670 1.00 0.00 H new ATOM 0 HG3 GLU A 437 13.224 -5.973 3.288 1.00 0.00 H new ATOM 706 N ASN A 438 16.624 -8.465 -0.403 1.00 0.00 N ATOM 707 CA ASN A 438 17.051 -8.455 -1.791 1.00 0.00 C ATOM 708 C ASN A 438 15.921 -8.937 -2.672 1.00 0.00 C ATOM 709 O ASN A 438 15.550 -10.106 -2.628 1.00 0.00 O ATOM 710 CB ASN A 438 18.289 -9.344 -2.016 1.00 0.00 C ATOM 711 CG ASN A 438 18.784 -9.296 -3.462 1.00 0.00 C ATOM 712 OD1 ASN A 438 19.618 -8.460 -3.812 1.00 0.00 O ATOM 713 ND2 ASN A 438 18.295 -10.187 -4.302 1.00 0.00 N ATOM 0 H ASN A 438 16.519 -9.394 0.004 1.00 0.00 H new ATOM 0 HA ASN A 438 17.321 -7.431 -2.048 1.00 0.00 H new ATOM 0 HB2 ASN A 438 19.090 -9.023 -1.350 1.00 0.00 H new ATOM 0 HB3 ASN A 438 18.047 -10.373 -1.751 1.00 0.00 H new ATOM 0 HD21 ASN A 438 18.607 -10.197 -5.273 1.00 0.00 H new ATOM 0 HD22 ASN A 438 17.605 -10.866 -3.981 1.00 0.00 H new ATOM 720 N LEU A 439 15.337 -8.041 -3.412 1.00 0.00 N ATOM 721 CA LEU A 439 14.287 -8.380 -4.347 1.00 0.00 C ATOM 722 C LEU A 439 14.507 -7.604 -5.631 1.00 0.00 C ATOM 723 O LEU A 439 15.183 -6.566 -5.615 1.00 0.00 O ATOM 724 CB LEU A 439 12.863 -8.116 -3.772 1.00 0.00 C ATOM 725 CG LEU A 439 12.428 -6.652 -3.496 1.00 0.00 C ATOM 726 CD1 LEU A 439 10.967 -6.620 -3.120 1.00 0.00 C ATOM 727 CD2 LEU A 439 13.233 -6.010 -2.376 1.00 0.00 C ATOM 0 H LEU A 439 15.571 -7.049 -3.389 1.00 0.00 H new ATOM 0 HA LEU A 439 14.337 -9.451 -4.544 1.00 0.00 H new ATOM 0 HB2 LEU A 439 12.142 -8.550 -4.465 1.00 0.00 H new ATOM 0 HB3 LEU A 439 12.777 -8.668 -2.836 1.00 0.00 H new ATOM 0 HG LEU A 439 12.608 -6.086 -4.410 1.00 0.00 H new ATOM 0 HD11 LEU A 439 10.664 -5.591 -2.927 1.00 0.00 H new ATOM 0 HD12 LEU A 439 10.372 -7.026 -3.938 1.00 0.00 H new ATOM 0 HD13 LEU A 439 10.809 -7.220 -2.224 1.00 0.00 H new ATOM 0 HD21 LEU A 439 12.890 -4.987 -2.222 1.00 0.00 H new ATOM 0 HD22 LEU A 439 13.097 -6.580 -1.457 1.00 0.00 H new ATOM 0 HD23 LEU A 439 14.289 -6.002 -2.645 1.00 0.00 H new ATOM 739 N LYS A 440 13.992 -8.098 -6.724 1.00 0.00 N ATOM 740 CA LYS A 440 14.122 -7.418 -7.986 1.00 0.00 C ATOM 741 C LYS A 440 12.836 -6.700 -8.353 1.00 0.00 C ATOM 742 O LYS A 440 11.772 -7.314 -8.481 1.00 0.00 O ATOM 743 CB LYS A 440 14.610 -8.358 -9.093 1.00 0.00 C ATOM 744 CG LYS A 440 14.697 -7.688 -10.453 1.00 0.00 C ATOM 745 CD LYS A 440 15.515 -8.483 -11.454 1.00 0.00 C ATOM 746 CE LYS A 440 17.004 -8.490 -11.090 1.00 0.00 C ATOM 747 NZ LYS A 440 17.551 -7.116 -10.942 1.00 0.00 N ATOM 0 H LYS A 440 13.474 -8.976 -6.767 1.00 0.00 H new ATOM 0 HA LYS A 440 14.893 -6.655 -7.877 1.00 0.00 H new ATOM 0 HB2 LYS A 440 15.592 -8.747 -8.824 1.00 0.00 H new ATOM 0 HB3 LYS A 440 13.936 -9.212 -9.159 1.00 0.00 H new ATOM 0 HG2 LYS A 440 13.691 -7.545 -10.846 1.00 0.00 H new ATOM 0 HG3 LYS A 440 15.138 -6.698 -10.337 1.00 0.00 H new ATOM 0 HD2 LYS A 440 15.145 -9.508 -11.494 1.00 0.00 H new ATOM 0 HD3 LYS A 440 15.386 -8.058 -12.449 1.00 0.00 H new ATOM 0 HE2 LYS A 440 17.146 -9.038 -10.159 1.00 0.00 H new ATOM 0 HE3 LYS A 440 17.563 -9.021 -11.861 1.00 0.00 H new ATOM 0 HZ1 LYS A 440 18.517 -7.083 -11.327 1.00 0.00 H new ATOM 0 HZ2 LYS A 440 16.949 -6.445 -11.460 1.00 0.00 H new ATOM 0 HZ3 LYS A 440 17.571 -6.857 -9.935 1.00 0.00 H new ATOM 761 N THR A 441 12.945 -5.414 -8.530 1.00 0.00 N ATOM 762 CA THR A 441 11.821 -4.562 -8.773 1.00 0.00 C ATOM 763 C THR A 441 11.461 -4.421 -10.257 1.00 0.00 C ATOM 764 O THR A 441 10.378 -3.945 -10.591 1.00 0.00 O ATOM 765 CB THR A 441 12.095 -3.223 -8.134 1.00 0.00 C ATOM 766 OG1 THR A 441 13.474 -2.889 -8.384 1.00 0.00 O ATOM 767 CG2 THR A 441 11.844 -3.302 -6.630 1.00 0.00 C ATOM 0 H THR A 441 13.837 -4.920 -8.509 1.00 0.00 H new ATOM 0 HA THR A 441 10.942 -5.023 -8.323 1.00 0.00 H new ATOM 0 HB THR A 441 11.437 -2.461 -8.552 1.00 0.00 H new ATOM 0 HG1 THR A 441 13.665 -1.997 -8.025 1.00 0.00 H new ATOM 0 HG21 THR A 441 12.044 -2.331 -6.176 1.00 0.00 H new ATOM 0 HG22 THR A 441 10.806 -3.580 -6.448 1.00 0.00 H new ATOM 0 HG23 THR A 441 12.503 -4.051 -6.190 1.00 0.00 H new ATOM 775 N GLU A 442 12.354 -4.847 -11.160 1.00 0.00 N ATOM 776 CA GLU A 442 12.020 -4.860 -12.596 1.00 0.00 C ATOM 777 C GLU A 442 10.908 -5.875 -12.855 1.00 0.00 C ATOM 778 O GLU A 442 10.209 -5.821 -13.867 1.00 0.00 O ATOM 779 CB GLU A 442 13.224 -5.193 -13.507 1.00 0.00 C ATOM 780 CG GLU A 442 14.438 -4.287 -13.361 1.00 0.00 C ATOM 781 CD GLU A 442 15.367 -4.720 -12.258 1.00 0.00 C ATOM 782 OE1 GLU A 442 16.406 -5.346 -12.561 1.00 0.00 O ATOM 783 OE2 GLU A 442 15.082 -4.461 -11.074 1.00 0.00 O ATOM 0 H GLU A 442 13.291 -5.180 -10.933 1.00 0.00 H new ATOM 0 HA GLU A 442 11.698 -3.849 -12.846 1.00 0.00 H new ATOM 0 HB2 GLU A 442 13.534 -6.219 -13.307 1.00 0.00 H new ATOM 0 HB3 GLU A 442 12.891 -5.158 -14.544 1.00 0.00 H new ATOM 0 HG2 GLU A 442 14.986 -4.268 -14.303 1.00 0.00 H new ATOM 0 HG3 GLU A 442 14.103 -3.268 -13.167 1.00 0.00 H new ATOM 790 N GLN A 443 10.743 -6.783 -11.911 1.00 0.00 N ATOM 791 CA GLN A 443 9.732 -7.818 -11.985 1.00 0.00 C ATOM 792 C GLN A 443 8.376 -7.275 -11.526 1.00 0.00 C ATOM 793 O GLN A 443 7.343 -7.910 -11.725 1.00 0.00 O ATOM 794 CB GLN A 443 10.158 -9.026 -11.143 1.00 0.00 C ATOM 795 CG GLN A 443 11.467 -9.643 -11.616 1.00 0.00 C ATOM 796 CD GLN A 443 11.964 -10.779 -10.747 1.00 0.00 C ATOM 797 OE1 GLN A 443 11.714 -10.825 -9.542 1.00 0.00 O ATOM 798 NE2 GLN A 443 12.664 -11.705 -11.340 1.00 0.00 N ATOM 0 H GLN A 443 11.312 -6.822 -11.065 1.00 0.00 H new ATOM 0 HA GLN A 443 9.628 -8.141 -13.021 1.00 0.00 H new ATOM 0 HB2 GLN A 443 10.261 -8.719 -10.102 1.00 0.00 H new ATOM 0 HB3 GLN A 443 9.373 -9.781 -11.176 1.00 0.00 H new ATOM 0 HG2 GLN A 443 11.337 -10.009 -12.634 1.00 0.00 H new ATOM 0 HG3 GLN A 443 12.231 -8.866 -11.652 1.00 0.00 H new ATOM 0 HE21 GLN A 443 12.854 -11.639 -12.340 1.00 0.00 H new ATOM 0 HE22 GLN A 443 13.021 -12.496 -10.804 1.00 0.00 H new ATOM 807 N TRP A 444 8.389 -6.090 -10.949 1.00 0.00 N ATOM 808 CA TRP A 444 7.177 -5.439 -10.497 1.00 0.00 C ATOM 809 C TRP A 444 6.530 -4.707 -11.655 1.00 0.00 C ATOM 810 O TRP A 444 7.241 -4.173 -12.527 1.00 0.00 O ATOM 811 CB TRP A 444 7.471 -4.411 -9.391 1.00 0.00 C ATOM 812 CG TRP A 444 7.861 -4.971 -8.057 1.00 0.00 C ATOM 813 CD1 TRP A 444 8.295 -6.231 -7.770 1.00 0.00 C ATOM 814 CD2 TRP A 444 7.856 -4.258 -6.818 1.00 0.00 C ATOM 815 NE1 TRP A 444 8.544 -6.347 -6.428 1.00 0.00 N ATOM 816 CE2 TRP A 444 8.285 -5.145 -5.821 1.00 0.00 C ATOM 817 CE3 TRP A 444 7.524 -2.948 -6.458 1.00 0.00 C ATOM 818 CZ2 TRP A 444 8.390 -4.767 -4.485 1.00 0.00 C ATOM 819 CZ3 TRP A 444 7.632 -2.571 -5.135 1.00 0.00 C ATOM 820 CH2 TRP A 444 8.062 -3.480 -4.160 1.00 0.00 C ATOM 0 H TRP A 444 9.239 -5.552 -10.781 1.00 0.00 H new ATOM 0 HA TRP A 444 6.516 -6.211 -10.104 1.00 0.00 H new ATOM 0 HB2 TRP A 444 8.271 -3.756 -9.735 1.00 0.00 H new ATOM 0 HB3 TRP A 444 6.586 -3.789 -9.257 1.00 0.00 H new ATOM 0 HD1 TRP A 444 8.424 -7.022 -8.494 1.00 0.00 H new ATOM 0 HE1 TRP A 444 8.869 -7.191 -5.957 1.00 0.00 H new ATOM 0 HE3 TRP A 444 7.188 -2.243 -7.204 1.00 0.00 H new ATOM 0 HZ2 TRP A 444 8.719 -5.467 -3.731 1.00 0.00 H new ATOM 0 HZ3 TRP A 444 7.381 -1.561 -4.847 1.00 0.00 H new ATOM 0 HH2 TRP A 444 8.136 -3.158 -3.132 1.00 0.00 H new ATOM 831 N PRO A 445 5.195 -4.721 -11.739 1.00 0.00 N ATOM 832 CA PRO A 445 4.456 -3.902 -12.706 1.00 0.00 C ATOM 833 C PRO A 445 4.608 -2.418 -12.353 1.00 0.00 C ATOM 834 O PRO A 445 5.005 -2.087 -11.236 1.00 0.00 O ATOM 835 CB PRO A 445 3.000 -4.355 -12.520 1.00 0.00 C ATOM 836 CG PRO A 445 3.097 -5.664 -11.824 1.00 0.00 C ATOM 837 CD PRO A 445 4.285 -5.547 -10.930 1.00 0.00 C ATOM 0 HA PRO A 445 4.806 -4.019 -13.732 1.00 0.00 H new ATOM 0 HB2 PRO A 445 2.434 -3.634 -11.930 1.00 0.00 H new ATOM 0 HB3 PRO A 445 2.491 -4.453 -13.479 1.00 0.00 H new ATOM 0 HG2 PRO A 445 2.193 -5.873 -11.252 1.00 0.00 H new ATOM 0 HG3 PRO A 445 3.219 -6.480 -12.536 1.00 0.00 H new ATOM 0 HD2 PRO A 445 4.037 -5.071 -9.981 1.00 0.00 H new ATOM 0 HD3 PRO A 445 4.717 -6.520 -10.695 1.00 0.00 H new ATOM 845 N GLN A 446 4.306 -1.536 -13.282 1.00 0.00 N ATOM 846 CA GLN A 446 4.481 -0.111 -13.040 1.00 0.00 C ATOM 847 C GLN A 446 3.319 0.500 -12.264 1.00 0.00 C ATOM 848 O GLN A 446 3.385 1.667 -11.852 1.00 0.00 O ATOM 849 CB GLN A 446 4.777 0.652 -14.326 1.00 0.00 C ATOM 850 CG GLN A 446 6.116 0.271 -14.944 1.00 0.00 C ATOM 851 CD GLN A 446 6.457 1.075 -16.178 1.00 0.00 C ATOM 852 OE1 GLN A 446 5.574 1.506 -16.928 1.00 0.00 O ATOM 853 NE2 GLN A 446 7.727 1.287 -16.401 1.00 0.00 N ATOM 0 H GLN A 446 3.941 -1.772 -14.205 1.00 0.00 H new ATOM 0 HA GLN A 446 5.358 -0.012 -12.401 1.00 0.00 H new ATOM 0 HB2 GLN A 446 3.982 0.462 -15.047 1.00 0.00 H new ATOM 0 HB3 GLN A 446 4.769 1.722 -14.118 1.00 0.00 H new ATOM 0 HG2 GLN A 446 6.902 0.407 -14.202 1.00 0.00 H new ATOM 0 HG3 GLN A 446 6.101 -0.788 -15.202 1.00 0.00 H new ATOM 0 HE21 GLN A 446 8.427 0.915 -15.759 1.00 0.00 H new ATOM 0 HE22 GLN A 446 8.019 1.825 -17.217 1.00 0.00 H new ATOM 862 N LYS A 447 2.257 -0.268 -12.106 1.00 0.00 N ATOM 863 CA LYS A 447 1.139 0.103 -11.267 1.00 0.00 C ATOM 864 C LYS A 447 0.888 -0.966 -10.250 1.00 0.00 C ATOM 865 O LYS A 447 0.922 -2.161 -10.564 1.00 0.00 O ATOM 866 CB LYS A 447 -0.171 0.347 -12.033 1.00 0.00 C ATOM 867 CG LYS A 447 -0.320 1.693 -12.711 1.00 0.00 C ATOM 868 CD LYS A 447 0.522 1.856 -13.948 1.00 0.00 C ATOM 869 CE LYS A 447 0.229 3.195 -14.591 1.00 0.00 C ATOM 870 NZ LYS A 447 -1.205 3.325 -14.978 1.00 0.00 N ATOM 0 H LYS A 447 2.148 -1.174 -12.561 1.00 0.00 H new ATOM 0 HA LYS A 447 1.426 1.047 -10.803 1.00 0.00 H new ATOM 0 HB2 LYS A 447 -0.272 -0.429 -12.791 1.00 0.00 H new ATOM 0 HB3 LYS A 447 -1.001 0.222 -11.337 1.00 0.00 H new ATOM 0 HG2 LYS A 447 -1.367 1.840 -12.976 1.00 0.00 H new ATOM 0 HG3 LYS A 447 -0.057 2.477 -12.000 1.00 0.00 H new ATOM 0 HD2 LYS A 447 1.579 1.788 -13.692 1.00 0.00 H new ATOM 0 HD3 LYS A 447 0.312 1.050 -14.651 1.00 0.00 H new ATOM 0 HE2 LYS A 447 0.492 3.995 -13.899 1.00 0.00 H new ATOM 0 HE3 LYS A 447 0.856 3.318 -15.474 1.00 0.00 H new ATOM 0 HZ1 LYS A 447 -1.328 4.167 -15.576 1.00 0.00 H new ATOM 0 HZ2 LYS A 447 -1.500 2.479 -15.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 447 -1.788 3.420 -14.122 1.00 0.00 H new ATOM 884 N LEU A 448 0.662 -0.550 -9.042 1.00 0.00 N ATOM 885 CA LEU A 448 0.320 -1.450 -7.976 1.00 0.00 C ATOM 886 C LEU A 448 -1.059 -1.067 -7.477 1.00 0.00 C ATOM 887 O LEU A 448 -1.414 0.129 -7.496 1.00 0.00 O ATOM 888 CB LEU A 448 1.348 -1.379 -6.846 1.00 0.00 C ATOM 889 CG LEU A 448 2.815 -1.619 -7.236 1.00 0.00 C ATOM 890 CD1 LEU A 448 3.713 -1.617 -6.013 1.00 0.00 C ATOM 891 CD2 LEU A 448 2.971 -2.906 -8.025 1.00 0.00 C ATOM 0 H LEU A 448 0.709 0.430 -8.763 1.00 0.00 H new ATOM 0 HA LEU A 448 0.319 -2.478 -8.338 1.00 0.00 H new ATOM 0 HB2 LEU A 448 1.275 -0.396 -6.380 1.00 0.00 H new ATOM 0 HB3 LEU A 448 1.072 -2.112 -6.088 1.00 0.00 H new ATOM 0 HG LEU A 448 3.125 -0.796 -7.880 1.00 0.00 H new ATOM 0 HD11 LEU A 448 4.745 -1.789 -6.319 1.00 0.00 H new ATOM 0 HD12 LEU A 448 3.640 -0.653 -5.509 1.00 0.00 H new ATOM 0 HD13 LEU A 448 3.400 -2.407 -5.331 1.00 0.00 H new ATOM 0 HD21 LEU A 448 4.020 -3.048 -8.286 1.00 0.00 H new ATOM 0 HD22 LEU A 448 2.631 -3.747 -7.421 1.00 0.00 H new ATOM 0 HD23 LEU A 448 2.375 -2.849 -8.936 1.00 0.00 H new ATOM 903 N ILE A 449 -1.836 -2.044 -7.043 1.00 0.00 N ATOM 904 CA ILE A 449 -3.211 -1.792 -6.644 1.00 0.00 C ATOM 905 C ILE A 449 -3.277 -1.672 -5.139 1.00 0.00 C ATOM 906 O ILE A 449 -2.970 -2.624 -4.427 1.00 0.00 O ATOM 907 CB ILE A 449 -4.151 -2.953 -7.081 1.00 0.00 C ATOM 908 CG1 ILE A 449 -4.028 -3.221 -8.589 1.00 0.00 C ATOM 909 CG2 ILE A 449 -5.607 -2.633 -6.714 1.00 0.00 C ATOM 910 CD1 ILE A 449 -4.846 -4.407 -9.069 1.00 0.00 C ATOM 0 H ILE A 449 -1.540 -3.016 -6.958 1.00 0.00 H new ATOM 0 HA ILE A 449 -3.538 -0.871 -7.127 1.00 0.00 H new ATOM 0 HB ILE A 449 -3.846 -3.854 -6.548 1.00 0.00 H new ATOM 0 HG12 ILE A 449 -4.342 -2.331 -9.134 1.00 0.00 H new ATOM 0 HG13 ILE A 449 -2.980 -3.391 -8.834 1.00 0.00 H new ATOM 0 HG21 ILE A 449 -6.250 -3.455 -7.027 1.00 0.00 H new ATOM 0 HG22 ILE A 449 -5.689 -2.498 -5.636 1.00 0.00 H new ATOM 0 HG23 ILE A 449 -5.917 -1.718 -7.219 1.00 0.00 H new ATOM 0 HD11 ILE A 449 -4.708 -4.533 -10.143 1.00 0.00 H new ATOM 0 HD12 ILE A 449 -4.517 -5.309 -8.552 1.00 0.00 H new ATOM 0 HD13 ILE A 449 -5.901 -4.231 -8.857 1.00 0.00 H new ATOM 922 N MET A 450 -3.655 -0.527 -4.654 1.00 0.00 N ATOM 923 CA MET A 450 -3.741 -0.326 -3.228 1.00 0.00 C ATOM 924 C MET A 450 -5.129 0.108 -2.793 1.00 0.00 C ATOM 925 O MET A 450 -5.757 0.974 -3.412 1.00 0.00 O ATOM 926 CB MET A 450 -2.671 0.650 -2.718 1.00 0.00 C ATOM 927 CG MET A 450 -2.661 1.987 -3.426 1.00 0.00 C ATOM 928 SD MET A 450 -1.547 3.195 -2.681 1.00 0.00 S ATOM 929 CE MET A 450 -2.381 3.528 -1.127 1.00 0.00 C ATOM 0 H MET A 450 -3.909 0.284 -5.218 1.00 0.00 H new ATOM 0 HA MET A 450 -3.545 -1.295 -2.770 1.00 0.00 H new ATOM 0 HB2 MET A 450 -2.827 0.817 -1.652 1.00 0.00 H new ATOM 0 HB3 MET A 450 -1.691 0.186 -2.828 1.00 0.00 H new ATOM 0 HG2 MET A 450 -2.374 1.835 -4.466 1.00 0.00 H new ATOM 0 HG3 MET A 450 -3.672 2.393 -3.430 1.00 0.00 H new ATOM 0 HE1 MET A 450 -2.414 4.604 -0.955 1.00 0.00 H new ATOM 0 HE2 MET A 450 -3.397 3.136 -1.168 1.00 0.00 H new ATOM 0 HE3 MET A 450 -1.839 3.047 -0.313 1.00 0.00 H new ATOM 939 N GLN A 451 -5.601 -0.514 -1.751 1.00 0.00 N ATOM 940 CA GLN A 451 -6.882 -0.197 -1.165 1.00 0.00 C ATOM 941 C GLN A 451 -6.681 0.311 0.243 1.00 0.00 C ATOM 942 O GLN A 451 -5.903 -0.267 1.012 1.00 0.00 O ATOM 943 CB GLN A 451 -7.822 -1.420 -1.151 1.00 0.00 C ATOM 944 CG GLN A 451 -9.103 -1.200 -0.333 1.00 0.00 C ATOM 945 CD GLN A 451 -9.972 -0.061 -0.853 1.00 0.00 C ATOM 946 OE1 GLN A 451 -10.029 0.194 -2.040 1.00 0.00 O ATOM 947 NE2 GLN A 451 -10.601 0.658 0.047 1.00 0.00 N ATOM 0 H GLN A 451 -5.104 -1.267 -1.274 1.00 0.00 H new ATOM 0 HA GLN A 451 -7.351 0.574 -1.776 1.00 0.00 H new ATOM 0 HB2 GLN A 451 -8.094 -1.671 -2.176 1.00 0.00 H new ATOM 0 HB3 GLN A 451 -7.284 -2.277 -0.745 1.00 0.00 H new ATOM 0 HG2 GLN A 451 -9.687 -2.120 -0.334 1.00 0.00 H new ATOM 0 HG3 GLN A 451 -8.832 -0.995 0.703 1.00 0.00 H new ATOM 0 HE21 GLN A 451 -10.530 0.414 1.035 1.00 0.00 H new ATOM 0 HE22 GLN A 451 -11.161 1.461 -0.241 1.00 0.00 H new ATOM 956 N LEU A 452 -7.347 1.388 0.564 1.00 0.00 N ATOM 957 CA LEU A 452 -7.293 1.945 1.885 1.00 0.00 C ATOM 958 C LEU A 452 -8.251 1.195 2.808 1.00 0.00 C ATOM 959 O LEU A 452 -9.477 1.260 2.652 1.00 0.00 O ATOM 960 CB LEU A 452 -7.606 3.461 1.883 1.00 0.00 C ATOM 961 CG LEU A 452 -6.586 4.406 1.194 1.00 0.00 C ATOM 962 CD1 LEU A 452 -5.189 4.208 1.743 1.00 0.00 C ATOM 963 CD2 LEU A 452 -6.601 4.280 -0.327 1.00 0.00 C ATOM 0 H LEU A 452 -7.942 1.903 -0.085 1.00 0.00 H new ATOM 0 HA LEU A 452 -6.275 1.828 2.258 1.00 0.00 H new ATOM 0 HB2 LEU A 452 -8.574 3.603 1.402 1.00 0.00 H new ATOM 0 HB3 LEU A 452 -7.715 3.783 2.919 1.00 0.00 H new ATOM 0 HG LEU A 452 -6.902 5.422 1.429 1.00 0.00 H new ATOM 0 HD11 LEU A 452 -4.500 4.886 1.238 1.00 0.00 H new ATOM 0 HD12 LEU A 452 -5.185 4.417 2.813 1.00 0.00 H new ATOM 0 HD13 LEU A 452 -4.874 3.178 1.574 1.00 0.00 H new ATOM 0 HD21 LEU A 452 -5.868 4.964 -0.756 1.00 0.00 H new ATOM 0 HD22 LEU A 452 -6.352 3.257 -0.610 1.00 0.00 H new ATOM 0 HD23 LEU A 452 -7.593 4.529 -0.703 1.00 0.00 H new ATOM 975 N ILE A 453 -7.683 0.460 3.719 1.00 0.00 N ATOM 976 CA ILE A 453 -8.415 -0.297 4.704 1.00 0.00 C ATOM 977 C ILE A 453 -8.061 0.198 6.099 1.00 0.00 C ATOM 978 O ILE A 453 -6.993 0.758 6.276 1.00 0.00 O ATOM 979 CB ILE A 453 -8.202 -1.830 4.543 1.00 0.00 C ATOM 980 CG1 ILE A 453 -6.753 -2.209 4.296 1.00 0.00 C ATOM 981 CG2 ILE A 453 -9.084 -2.392 3.445 1.00 0.00 C ATOM 982 CD1 ILE A 453 -5.857 -2.227 5.517 1.00 0.00 C ATOM 0 H ILE A 453 -6.671 0.365 3.803 1.00 0.00 H new ATOM 0 HA ILE A 453 -9.481 -0.133 4.546 1.00 0.00 H new ATOM 0 HB ILE A 453 -8.489 -2.274 5.496 1.00 0.00 H new ATOM 0 HG12 ILE A 453 -6.729 -3.197 3.837 1.00 0.00 H new ATOM 0 HG13 ILE A 453 -6.333 -1.511 3.571 1.00 0.00 H new ATOM 0 HG21 ILE A 453 -8.914 -3.465 3.355 1.00 0.00 H new ATOM 0 HG22 ILE A 453 -10.130 -2.210 3.690 1.00 0.00 H new ATOM 0 HG23 ILE A 453 -8.843 -1.906 2.500 1.00 0.00 H new ATOM 0 HD11 ILE A 453 -4.847 -2.511 5.223 1.00 0.00 H new ATOM 0 HD12 ILE A 453 -5.838 -1.235 5.969 1.00 0.00 H new ATOM 0 HD13 ILE A 453 -6.240 -2.948 6.239 1.00 0.00 H new ATOM 994 N PRO A 454 -8.943 0.069 7.100 1.00 0.00 N ATOM 995 CA PRO A 454 -8.646 0.582 8.438 1.00 0.00 C ATOM 996 C PRO A 454 -7.480 -0.157 9.126 1.00 0.00 C ATOM 997 O PRO A 454 -7.483 -1.390 9.266 1.00 0.00 O ATOM 998 CB PRO A 454 -9.957 0.365 9.209 1.00 0.00 C ATOM 999 CG PRO A 454 -10.674 -0.705 8.454 1.00 0.00 C ATOM 1000 CD PRO A 454 -10.281 -0.534 7.016 1.00 0.00 C ATOM 0 HA PRO A 454 -8.324 1.623 8.402 1.00 0.00 H new ATOM 0 HB2 PRO A 454 -9.765 0.061 10.238 1.00 0.00 H new ATOM 0 HB3 PRO A 454 -10.546 1.281 9.252 1.00 0.00 H new ATOM 0 HG2 PRO A 454 -10.395 -1.693 8.819 1.00 0.00 H new ATOM 0 HG3 PRO A 454 -11.753 -0.612 8.577 1.00 0.00 H new ATOM 0 HD2 PRO A 454 -10.260 -1.488 6.489 1.00 0.00 H new ATOM 0 HD3 PRO A 454 -10.980 0.110 6.482 1.00 0.00 H new ATOM 1008 N GLN A 455 -6.532 0.632 9.607 1.00 0.00 N ATOM 1009 CA GLN A 455 -5.328 0.175 10.301 1.00 0.00 C ATOM 1010 C GLN A 455 -5.696 -0.541 11.603 1.00 0.00 C ATOM 1011 O GLN A 455 -4.972 -1.408 12.086 1.00 0.00 O ATOM 1012 CB GLN A 455 -4.398 1.378 10.536 1.00 0.00 C ATOM 1013 CG GLN A 455 -3.053 1.075 11.164 1.00 0.00 C ATOM 1014 CD GLN A 455 -2.156 2.306 11.215 1.00 0.00 C ATOM 1015 OE1 GLN A 455 -2.228 3.193 10.352 1.00 0.00 O ATOM 1016 NE2 GLN A 455 -1.329 2.384 12.209 1.00 0.00 N ATOM 0 H GLN A 455 -6.578 1.648 9.524 1.00 0.00 H new ATOM 0 HA GLN A 455 -4.796 -0.552 9.687 1.00 0.00 H new ATOM 0 HB2 GLN A 455 -4.225 1.869 9.578 1.00 0.00 H new ATOM 0 HB3 GLN A 455 -4.919 2.094 11.172 1.00 0.00 H new ATOM 0 HG2 GLN A 455 -3.202 0.693 12.174 1.00 0.00 H new ATOM 0 HG3 GLN A 455 -2.557 0.288 10.596 1.00 0.00 H new ATOM 0 HE21 GLN A 455 -1.294 1.637 12.903 1.00 0.00 H new ATOM 0 HE22 GLN A 455 -0.713 3.192 12.298 1.00 0.00 H new ATOM 1025 N GLN A 456 -6.852 -0.180 12.138 1.00 0.00 N ATOM 1026 CA GLN A 456 -7.381 -0.753 13.370 1.00 0.00 C ATOM 1027 C GLN A 456 -7.522 -2.275 13.265 1.00 0.00 C ATOM 1028 O GLN A 456 -7.165 -3.012 14.190 1.00 0.00 O ATOM 1029 CB GLN A 456 -8.747 -0.158 13.672 1.00 0.00 C ATOM 1030 CG GLN A 456 -8.757 1.344 13.856 1.00 0.00 C ATOM 1031 CD GLN A 456 -10.154 1.874 14.092 1.00 0.00 C ATOM 1032 OE1 GLN A 456 -11.135 1.309 13.608 1.00 0.00 O ATOM 1033 NE2 GLN A 456 -10.263 2.941 14.835 1.00 0.00 N ATOM 0 H GLN A 456 -7.459 0.528 11.725 1.00 0.00 H new ATOM 0 HA GLN A 456 -6.679 -0.519 14.170 1.00 0.00 H new ATOM 0 HB2 GLN A 456 -9.428 -0.415 12.860 1.00 0.00 H new ATOM 0 HB3 GLN A 456 -9.139 -0.624 14.576 1.00 0.00 H new ATOM 0 HG2 GLN A 456 -8.120 1.611 14.700 1.00 0.00 H new ATOM 0 HG3 GLN A 456 -8.332 1.821 12.973 1.00 0.00 H new ATOM 0 HE21 GLN A 456 -9.428 3.382 15.219 1.00 0.00 H new ATOM 0 HE22 GLN A 456 -11.184 3.334 15.032 1.00 0.00 H new ATOM 1042 N LEU A 457 -7.986 -2.747 12.121 1.00 0.00 N ATOM 1043 CA LEU A 457 -8.209 -4.175 11.928 1.00 0.00 C ATOM 1044 C LEU A 457 -6.943 -4.871 11.474 1.00 0.00 C ATOM 1045 O LEU A 457 -6.864 -6.103 11.463 1.00 0.00 O ATOM 1046 CB LEU A 457 -9.366 -4.469 10.949 1.00 0.00 C ATOM 1047 CG LEU A 457 -10.810 -4.236 11.453 1.00 0.00 C ATOM 1048 CD1 LEU A 457 -11.096 -2.772 11.751 1.00 0.00 C ATOM 1049 CD2 LEU A 457 -11.810 -4.784 10.452 1.00 0.00 C ATOM 0 H LEU A 457 -8.216 -2.168 11.313 1.00 0.00 H new ATOM 0 HA LEU A 457 -8.499 -4.574 12.900 1.00 0.00 H new ATOM 0 HB2 LEU A 457 -9.218 -3.856 10.060 1.00 0.00 H new ATOM 0 HB3 LEU A 457 -9.284 -5.510 10.635 1.00 0.00 H new ATOM 0 HG LEU A 457 -10.913 -4.774 12.395 1.00 0.00 H new ATOM 0 HD11 LEU A 457 -12.123 -2.666 12.101 1.00 0.00 H new ATOM 0 HD12 LEU A 457 -10.411 -2.417 12.521 1.00 0.00 H new ATOM 0 HD13 LEU A 457 -10.959 -2.183 10.844 1.00 0.00 H new ATOM 0 HD21 LEU A 457 -12.822 -4.614 10.819 1.00 0.00 H new ATOM 0 HD22 LEU A 457 -11.681 -4.279 9.495 1.00 0.00 H new ATOM 0 HD23 LEU A 457 -11.646 -5.854 10.323 1.00 0.00 H new ATOM 1061 N LEU A 458 -5.939 -4.084 11.158 1.00 0.00 N ATOM 1062 CA LEU A 458 -4.675 -4.603 10.679 1.00 0.00 C ATOM 1063 C LEU A 458 -3.855 -5.152 11.844 1.00 0.00 C ATOM 1064 O LEU A 458 -2.979 -5.996 11.659 1.00 0.00 O ATOM 1065 CB LEU A 458 -3.902 -3.505 9.944 1.00 0.00 C ATOM 1066 CG LEU A 458 -2.586 -3.923 9.309 1.00 0.00 C ATOM 1067 CD1 LEU A 458 -2.829 -4.976 8.234 1.00 0.00 C ATOM 1068 CD2 LEU A 458 -1.863 -2.708 8.745 1.00 0.00 C ATOM 0 H LEU A 458 -5.974 -3.067 11.225 1.00 0.00 H new ATOM 0 HA LEU A 458 -4.867 -5.418 9.981 1.00 0.00 H new ATOM 0 HB2 LEU A 458 -4.545 -3.097 9.164 1.00 0.00 H new ATOM 0 HB3 LEU A 458 -3.702 -2.697 10.648 1.00 0.00 H new ATOM 0 HG LEU A 458 -1.947 -4.367 10.073 1.00 0.00 H new ATOM 0 HD11 LEU A 458 -1.878 -5.266 7.787 1.00 0.00 H new ATOM 0 HD12 LEU A 458 -3.302 -5.850 8.681 1.00 0.00 H new ATOM 0 HD13 LEU A 458 -3.481 -4.565 7.463 1.00 0.00 H new ATOM 0 HD21 LEU A 458 -0.922 -3.022 8.293 1.00 0.00 H new ATOM 0 HD22 LEU A 458 -2.487 -2.232 7.989 1.00 0.00 H new ATOM 0 HD23 LEU A 458 -1.661 -1.999 9.548 1.00 0.00 H new ATOM 1080 N THR A 459 -4.201 -4.708 13.049 1.00 0.00 N ATOM 1081 CA THR A 459 -3.545 -5.112 14.286 1.00 0.00 C ATOM 1082 C THR A 459 -3.609 -6.647 14.456 1.00 0.00 C ATOM 1083 O THR A 459 -2.704 -7.274 15.025 1.00 0.00 O ATOM 1084 CB THR A 459 -4.287 -4.447 15.463 1.00 0.00 C ATOM 1085 OG1 THR A 459 -4.491 -3.048 15.164 1.00 0.00 O ATOM 1086 CG2 THR A 459 -3.503 -4.571 16.761 1.00 0.00 C ATOM 0 H THR A 459 -4.961 -4.044 13.194 1.00 0.00 H new ATOM 0 HA THR A 459 -2.499 -4.806 14.260 1.00 0.00 H new ATOM 0 HB THR A 459 -5.242 -4.956 15.594 1.00 0.00 H new ATOM 0 HG1 THR A 459 -5.397 -2.917 14.813 1.00 0.00 H new ATOM 0 HG21 THR A 459 -4.057 -4.091 17.568 1.00 0.00 H new ATOM 0 HG22 THR A 459 -3.356 -5.625 16.998 1.00 0.00 H new ATOM 0 HG23 THR A 459 -2.533 -4.086 16.648 1.00 0.00 H new ATOM 1094 N THR A 460 -4.645 -7.236 13.896 1.00 0.00 N ATOM 1095 CA THR A 460 -4.892 -8.646 13.987 1.00 0.00 C ATOM 1096 C THR A 460 -3.813 -9.455 13.210 1.00 0.00 C ATOM 1097 O THR A 460 -3.553 -10.624 13.516 1.00 0.00 O ATOM 1098 CB THR A 460 -6.276 -8.934 13.396 1.00 0.00 C ATOM 1099 OG1 THR A 460 -7.119 -7.774 13.602 1.00 0.00 O ATOM 1100 CG2 THR A 460 -6.903 -10.110 14.109 1.00 0.00 C ATOM 0 H THR A 460 -5.348 -6.732 13.356 1.00 0.00 H new ATOM 0 HA THR A 460 -4.850 -8.950 15.033 1.00 0.00 H new ATOM 0 HB THR A 460 -6.177 -9.158 12.334 1.00 0.00 H new ATOM 0 HG1 THR A 460 -7.119 -7.222 12.792 1.00 0.00 H new ATOM 0 HG21 THR A 460 -7.887 -10.310 13.685 1.00 0.00 H new ATOM 0 HG22 THR A 460 -6.270 -10.989 13.988 1.00 0.00 H new ATOM 0 HG23 THR A 460 -7.005 -9.880 15.170 1.00 0.00 H new ATOM 1108 N LEU A 461 -3.158 -8.798 12.248 1.00 0.00 N ATOM 1109 CA LEU A 461 -2.144 -9.435 11.405 1.00 0.00 C ATOM 1110 C LEU A 461 -0.745 -9.123 11.919 1.00 0.00 C ATOM 1111 O LEU A 461 0.244 -9.449 11.272 1.00 0.00 O ATOM 1112 CB LEU A 461 -2.254 -8.980 9.924 1.00 0.00 C ATOM 1113 CG LEU A 461 -3.473 -9.465 9.098 1.00 0.00 C ATOM 1114 CD1 LEU A 461 -4.786 -8.880 9.597 1.00 0.00 C ATOM 1115 CD2 LEU A 461 -3.277 -9.148 7.626 1.00 0.00 C ATOM 0 H LEU A 461 -3.315 -7.813 12.033 1.00 0.00 H new ATOM 0 HA LEU A 461 -2.323 -10.509 11.451 1.00 0.00 H new ATOM 0 HB2 LEU A 461 -2.254 -7.890 9.910 1.00 0.00 H new ATOM 0 HB3 LEU A 461 -1.351 -9.305 9.408 1.00 0.00 H new ATOM 0 HG LEU A 461 -3.536 -10.545 9.228 1.00 0.00 H new ATOM 0 HD11 LEU A 461 -5.607 -9.252 8.984 1.00 0.00 H new ATOM 0 HD12 LEU A 461 -4.945 -9.175 10.634 1.00 0.00 H new ATOM 0 HD13 LEU A 461 -4.748 -7.793 9.531 1.00 0.00 H new ATOM 0 HD21 LEU A 461 -4.142 -9.495 7.061 1.00 0.00 H new ATOM 0 HD22 LEU A 461 -3.168 -8.071 7.497 1.00 0.00 H new ATOM 0 HD23 LEU A 461 -2.380 -9.650 7.262 1.00 0.00 H new ATOM 1127 N GLY A 462 -0.691 -8.529 13.105 1.00 0.00 N ATOM 1128 CA GLY A 462 0.559 -8.096 13.746 1.00 0.00 C ATOM 1129 C GLY A 462 1.746 -9.079 13.664 1.00 0.00 C ATOM 1130 O GLY A 462 2.810 -8.698 13.159 1.00 0.00 O ATOM 0 H GLY A 462 -1.522 -8.329 13.662 1.00 0.00 H new ATOM 0 HA2 GLY A 462 0.865 -7.152 13.296 1.00 0.00 H new ATOM 0 HA3 GLY A 462 0.353 -7.896 14.797 1.00 0.00 H new ATOM 1134 N PRO A 463 1.611 -10.354 14.125 1.00 0.00 N ATOM 1135 CA PRO A 463 2.729 -11.318 14.107 1.00 0.00 C ATOM 1136 C PRO A 463 3.178 -11.698 12.685 1.00 0.00 C ATOM 1137 O PRO A 463 4.309 -12.134 12.476 1.00 0.00 O ATOM 1138 CB PRO A 463 2.160 -12.547 14.833 1.00 0.00 C ATOM 1139 CG PRO A 463 0.683 -12.423 14.687 1.00 0.00 C ATOM 1140 CD PRO A 463 0.393 -10.953 14.717 1.00 0.00 C ATOM 0 HA PRO A 463 3.619 -10.898 14.575 1.00 0.00 H new ATOM 0 HB2 PRO A 463 2.525 -13.473 14.389 1.00 0.00 H new ATOM 0 HB3 PRO A 463 2.455 -12.558 15.882 1.00 0.00 H new ATOM 0 HG2 PRO A 463 0.343 -12.870 13.753 1.00 0.00 H new ATOM 0 HG3 PRO A 463 0.165 -12.941 15.495 1.00 0.00 H new ATOM 0 HD2 PRO A 463 -0.498 -10.707 14.139 1.00 0.00 H new ATOM 0 HD3 PRO A 463 0.223 -10.597 15.733 1.00 0.00 H new ATOM 1148 N LEU A 464 2.313 -11.475 11.713 1.00 0.00 N ATOM 1149 CA LEU A 464 2.589 -11.844 10.331 1.00 0.00 C ATOM 1150 C LEU A 464 3.568 -10.842 9.706 1.00 0.00 C ATOM 1151 O LEU A 464 4.293 -11.158 8.769 1.00 0.00 O ATOM 1152 CB LEU A 464 1.269 -11.932 9.538 1.00 0.00 C ATOM 1153 CG LEU A 464 1.349 -12.412 8.083 1.00 0.00 C ATOM 1154 CD1 LEU A 464 1.969 -13.802 8.005 1.00 0.00 C ATOM 1155 CD2 LEU A 464 -0.039 -12.429 7.471 1.00 0.00 C ATOM 0 H LEU A 464 1.403 -11.036 11.855 1.00 0.00 H new ATOM 0 HA LEU A 464 3.060 -12.827 10.300 1.00 0.00 H new ATOM 0 HB2 LEU A 464 0.597 -12.600 10.076 1.00 0.00 H new ATOM 0 HB3 LEU A 464 0.808 -10.945 9.542 1.00 0.00 H new ATOM 0 HG LEU A 464 1.982 -11.722 7.525 1.00 0.00 H new ATOM 0 HD11 LEU A 464 2.016 -14.122 6.964 1.00 0.00 H new ATOM 0 HD12 LEU A 464 2.976 -13.775 8.422 1.00 0.00 H new ATOM 0 HD13 LEU A 464 1.360 -14.505 8.573 1.00 0.00 H new ATOM 0 HD21 LEU A 464 0.023 -12.771 6.438 1.00 0.00 H new ATOM 0 HD22 LEU A 464 -0.679 -13.105 8.039 1.00 0.00 H new ATOM 0 HD23 LEU A 464 -0.460 -11.424 7.496 1.00 0.00 H new ATOM 1167 N PHE A 465 3.622 -9.655 10.279 1.00 0.00 N ATOM 1168 CA PHE A 465 4.546 -8.616 9.835 1.00 0.00 C ATOM 1169 C PHE A 465 5.988 -8.936 10.213 1.00 0.00 C ATOM 1170 O PHE A 465 6.917 -8.315 9.719 1.00 0.00 O ATOM 1171 CB PHE A 465 4.142 -7.232 10.349 1.00 0.00 C ATOM 1172 CG PHE A 465 2.972 -6.622 9.624 1.00 0.00 C ATOM 1173 CD1 PHE A 465 1.673 -6.781 10.079 1.00 0.00 C ATOM 1174 CD2 PHE A 465 3.184 -5.874 8.482 1.00 0.00 C ATOM 1175 CE1 PHE A 465 0.620 -6.202 9.405 1.00 0.00 C ATOM 1176 CE2 PHE A 465 2.139 -5.299 7.808 1.00 0.00 C ATOM 1177 CZ PHE A 465 0.858 -5.460 8.268 1.00 0.00 C ATOM 0 H PHE A 465 3.031 -9.379 11.063 1.00 0.00 H new ATOM 0 HA PHE A 465 4.486 -8.595 8.747 1.00 0.00 H new ATOM 0 HB2 PHE A 465 3.899 -7.307 11.409 1.00 0.00 H new ATOM 0 HB3 PHE A 465 4.997 -6.561 10.265 1.00 0.00 H new ATOM 0 HD1 PHE A 465 1.484 -7.363 10.969 1.00 0.00 H new ATOM 0 HD2 PHE A 465 4.191 -5.740 8.114 1.00 0.00 H new ATOM 0 HE1 PHE A 465 -0.390 -6.329 9.767 1.00 0.00 H new ATOM 0 HE2 PHE A 465 2.324 -4.720 6.916 1.00 0.00 H new ATOM 0 HZ PHE A 465 0.034 -5.005 7.739 1.00 0.00 H new ATOM 1187 N ARG A 466 6.176 -9.914 11.099 1.00 0.00 N ATOM 1188 CA ARG A 466 7.516 -10.294 11.525 1.00 0.00 C ATOM 1189 C ARG A 466 8.280 -11.048 10.437 1.00 0.00 C ATOM 1190 O ARG A 466 9.476 -11.309 10.572 1.00 0.00 O ATOM 1191 CB ARG A 466 7.513 -11.075 12.841 1.00 0.00 C ATOM 1192 CG ARG A 466 7.062 -10.269 14.064 1.00 0.00 C ATOM 1193 CD ARG A 466 7.851 -8.959 14.213 1.00 0.00 C ATOM 1194 NE ARG A 466 9.313 -9.159 14.153 1.00 0.00 N ATOM 1195 CZ ARG A 466 10.228 -8.165 14.173 1.00 0.00 C ATOM 1196 NH1 ARG A 466 9.858 -6.904 14.401 1.00 0.00 N ATOM 1197 NH2 ARG A 466 11.510 -8.439 13.977 1.00 0.00 N ATOM 0 H ARG A 466 5.423 -10.451 11.530 1.00 0.00 H new ATOM 0 HA ARG A 466 8.047 -9.360 11.707 1.00 0.00 H new ATOM 0 HB2 ARG A 466 6.859 -11.941 12.732 1.00 0.00 H new ATOM 0 HB3 ARG A 466 8.518 -11.455 13.024 1.00 0.00 H new ATOM 0 HG2 ARG A 466 5.999 -10.044 13.978 1.00 0.00 H new ATOM 0 HG3 ARG A 466 7.188 -10.873 14.963 1.00 0.00 H new ATOM 0 HD2 ARG A 466 7.551 -8.268 13.425 1.00 0.00 H new ATOM 0 HD3 ARG A 466 7.592 -8.491 15.163 1.00 0.00 H new ATOM 0 HE ARG A 466 9.657 -10.117 14.092 1.00 0.00 H new ATOM 0 HH11 ARG A 466 8.876 -6.682 14.563 1.00 0.00 H new ATOM 0 HH12 ARG A 466 10.557 -6.162 14.414 1.00 0.00 H new ATOM 0 HH21 ARG A 466 11.806 -9.401 13.811 1.00 0.00 H new ATOM 0 HH22 ARG A 466 12.200 -7.688 13.992 1.00 0.00 H new ATOM 1211 N ASN A 467 7.591 -11.421 9.385 1.00 0.00 N ATOM 1212 CA ASN A 467 8.232 -12.014 8.234 1.00 0.00 C ATOM 1213 C ASN A 467 7.910 -11.219 6.992 1.00 0.00 C ATOM 1214 O ASN A 467 6.965 -11.513 6.248 1.00 0.00 O ATOM 1215 CB ASN A 467 8.013 -13.563 8.095 1.00 0.00 C ATOM 1216 CG ASN A 467 6.563 -14.088 8.167 1.00 0.00 C ATOM 1217 OD1 ASN A 467 6.326 -15.164 8.702 1.00 0.00 O ATOM 1218 ND2 ASN A 467 5.620 -13.408 7.595 1.00 0.00 N ATOM 0 H ASN A 467 6.579 -11.324 9.302 1.00 0.00 H new ATOM 0 HA ASN A 467 9.309 -11.948 8.389 1.00 0.00 H new ATOM 0 HB2 ASN A 467 8.438 -13.878 7.142 1.00 0.00 H new ATOM 0 HB3 ASN A 467 8.588 -14.056 8.879 1.00 0.00 H new ATOM 0 HD21 ASN A 467 4.665 -13.767 7.586 1.00 0.00 H new ATOM 0 HD22 ASN A 467 5.832 -12.513 7.153 1.00 0.00 H new ATOM 1225 N SER A 468 8.641 -10.144 6.818 1.00 0.00 N ATOM 1226 CA SER A 468 8.411 -9.211 5.742 1.00 0.00 C ATOM 1227 C SER A 468 9.695 -8.431 5.395 1.00 0.00 C ATOM 1228 O SER A 468 10.668 -8.444 6.152 1.00 0.00 O ATOM 1229 CB SER A 468 7.294 -8.232 6.133 1.00 0.00 C ATOM 1230 OG SER A 468 6.075 -8.906 6.405 1.00 0.00 O ATOM 0 H SER A 468 9.420 -9.890 7.426 1.00 0.00 H new ATOM 0 HA SER A 468 8.110 -9.776 4.860 1.00 0.00 H new ATOM 0 HB2 SER A 468 7.599 -7.664 7.012 1.00 0.00 H new ATOM 0 HB3 SER A 468 7.141 -7.514 5.327 1.00 0.00 H new ATOM 0 HG SER A 468 5.388 -8.252 6.652 1.00 0.00 H new ATOM 1236 N ARG A 469 9.640 -7.720 4.292 1.00 0.00 N ATOM 1237 CA ARG A 469 10.761 -6.950 3.732 1.00 0.00 C ATOM 1238 C ARG A 469 10.400 -5.497 3.926 1.00 0.00 C ATOM 1239 O ARG A 469 9.200 -5.187 3.793 1.00 0.00 O ATOM 1240 CB ARG A 469 10.889 -7.226 2.214 1.00 0.00 C ATOM 1241 CG ARG A 469 10.508 -8.649 1.769 1.00 0.00 C ATOM 1242 CD ARG A 469 11.626 -9.349 1.015 1.00 0.00 C ATOM 1243 NE ARG A 469 12.724 -9.648 1.903 1.00 0.00 N ATOM 1244 CZ ARG A 469 13.640 -10.591 1.762 1.00 0.00 C ATOM 1245 NH1 ARG A 469 13.705 -11.331 0.659 1.00 0.00 N ATOM 1246 NH2 ARG A 469 14.512 -10.765 2.735 1.00 0.00 N ATOM 0 H ARG A 469 8.791 -7.650 3.731 1.00 0.00 H new ATOM 0 HA ARG A 469 11.701 -7.217 4.214 1.00 0.00 H new ATOM 0 HB2 ARG A 469 10.260 -6.515 1.678 1.00 0.00 H new ATOM 0 HB3 ARG A 469 11.918 -7.032 1.912 1.00 0.00 H new ATOM 0 HG2 ARG A 469 10.242 -9.240 2.645 1.00 0.00 H new ATOM 0 HG3 ARG A 469 9.622 -8.602 1.135 1.00 0.00 H new ATOM 0 HD2 ARG A 469 11.251 -10.270 0.568 1.00 0.00 H new ATOM 0 HD3 ARG A 469 11.973 -8.717 0.198 1.00 0.00 H new ATOM 0 HE ARG A 469 12.802 -9.064 2.736 1.00 0.00 H new ATOM 0 HH11 ARG A 469 13.040 -11.176 -0.099 1.00 0.00 H new ATOM 0 HH12 ARG A 469 14.420 -12.053 0.571 1.00 0.00 H new ATOM 0 HH21 ARG A 469 14.469 -10.180 3.569 1.00 0.00 H new ATOM 0 HH22 ARG A 469 15.230 -11.485 2.654 1.00 0.00 H new ATOM 1260 N MET A 470 11.332 -4.556 4.267 1.00 0.00 N ATOM 1261 CA MET A 470 10.774 -3.282 4.557 1.00 0.00 C ATOM 1262 C MET A 470 10.856 -2.373 3.379 1.00 0.00 C ATOM 1263 O MET A 470 11.733 -2.505 2.559 1.00 0.00 O ATOM 1264 CB MET A 470 11.452 -2.645 5.713 1.00 0.00 C ATOM 1265 CG MET A 470 11.280 -3.328 7.032 1.00 0.00 C ATOM 1266 SD MET A 470 11.633 -2.198 8.397 1.00 0.00 S ATOM 1267 CE MET A 470 10.428 -0.885 8.080 1.00 0.00 C ATOM 0 H MET A 470 12.344 -4.667 4.333 1.00 0.00 H new ATOM 0 HA MET A 470 9.726 -3.447 4.807 1.00 0.00 H new ATOM 0 HB2 MET A 470 12.518 -2.583 5.495 1.00 0.00 H new ATOM 0 HB3 MET A 470 11.086 -1.623 5.805 1.00 0.00 H new ATOM 0 HG2 MET A 470 10.261 -3.704 7.121 1.00 0.00 H new ATOM 0 HG3 MET A 470 11.944 -4.191 7.088 1.00 0.00 H new ATOM 0 HE1 MET A 470 9.989 -0.558 9.023 1.00 0.00 H new ATOM 0 HE2 MET A 470 10.926 -0.042 7.600 1.00 0.00 H new ATOM 0 HE3 MET A 470 9.642 -1.262 7.426 1.00 0.00 H new ATOM 1277 N VAL A 471 9.894 -1.487 3.276 1.00 0.00 N ATOM 1278 CA VAL A 471 9.835 -0.511 2.221 1.00 0.00 C ATOM 1279 C VAL A 471 9.486 0.842 2.807 1.00 0.00 C ATOM 1280 O VAL A 471 8.987 0.933 3.946 1.00 0.00 O ATOM 1281 CB VAL A 471 8.785 -0.860 1.114 1.00 0.00 C ATOM 1282 CG1 VAL A 471 8.969 -2.267 0.562 1.00 0.00 C ATOM 1283 CG2 VAL A 471 7.373 -0.647 1.610 1.00 0.00 C ATOM 0 H VAL A 471 9.118 -1.425 3.936 1.00 0.00 H new ATOM 0 HA VAL A 471 10.818 -0.501 1.749 1.00 0.00 H new ATOM 0 HB VAL A 471 8.960 -0.172 0.287 1.00 0.00 H new ATOM 0 HG11 VAL A 471 8.216 -2.459 -0.202 1.00 0.00 H new ATOM 0 HG12 VAL A 471 9.963 -2.359 0.124 1.00 0.00 H new ATOM 0 HG13 VAL A 471 8.860 -2.992 1.369 1.00 0.00 H new ATOM 0 HG21 VAL A 471 6.667 -0.898 0.818 1.00 0.00 H new ATOM 0 HG22 VAL A 471 7.191 -1.286 2.474 1.00 0.00 H new ATOM 0 HG23 VAL A 471 7.241 0.397 1.896 1.00 0.00 H new ATOM 1293 N GLN A 472 9.777 1.869 2.064 1.00 0.00 N ATOM 1294 CA GLN A 472 9.420 3.215 2.410 1.00 0.00 C ATOM 1295 C GLN A 472 8.968 3.928 1.157 1.00 0.00 C ATOM 1296 O GLN A 472 9.612 3.828 0.108 1.00 0.00 O ATOM 1297 CB GLN A 472 10.571 3.980 3.075 1.00 0.00 C ATOM 1298 CG GLN A 472 11.031 3.397 4.406 1.00 0.00 C ATOM 1299 CD GLN A 472 12.122 4.212 5.043 1.00 0.00 C ATOM 1300 OE1 GLN A 472 12.900 4.856 4.363 1.00 0.00 O ATOM 1301 NE2 GLN A 472 12.193 4.192 6.344 1.00 0.00 N ATOM 0 H GLN A 472 10.281 1.793 1.180 1.00 0.00 H new ATOM 0 HA GLN A 472 8.614 3.177 3.143 1.00 0.00 H new ATOM 0 HB2 GLN A 472 11.419 4.003 2.390 1.00 0.00 H new ATOM 0 HB3 GLN A 472 10.261 5.013 3.233 1.00 0.00 H new ATOM 0 HG2 GLN A 472 10.181 3.338 5.086 1.00 0.00 H new ATOM 0 HG3 GLN A 472 11.386 2.378 4.250 1.00 0.00 H new ATOM 0 HE21 GLN A 472 11.525 3.641 6.883 1.00 0.00 H new ATOM 0 HE22 GLN A 472 12.917 4.727 6.824 1.00 0.00 H new ATOM 1310 N PHE A 473 7.877 4.613 1.264 1.00 0.00 N ATOM 1311 CA PHE A 473 7.300 5.325 0.168 1.00 0.00 C ATOM 1312 C PHE A 473 7.476 6.817 0.346 1.00 0.00 C ATOM 1313 O PHE A 473 7.115 7.405 1.404 1.00 0.00 O ATOM 1314 CB PHE A 473 5.801 5.005 -0.002 1.00 0.00 C ATOM 1315 CG PHE A 473 5.467 3.651 -0.535 1.00 0.00 C ATOM 1316 CD1 PHE A 473 5.154 3.492 -1.867 1.00 0.00 C ATOM 1317 CD2 PHE A 473 5.441 2.542 0.291 1.00 0.00 C ATOM 1318 CE1 PHE A 473 4.820 2.257 -2.372 1.00 0.00 C ATOM 1319 CE2 PHE A 473 5.111 1.304 -0.212 1.00 0.00 C ATOM 1320 CZ PHE A 473 4.798 1.165 -1.547 1.00 0.00 C ATOM 0 H PHE A 473 7.350 4.696 2.133 1.00 0.00 H new ATOM 0 HA PHE A 473 7.824 5.000 -0.731 1.00 0.00 H new ATOM 0 HB2 PHE A 473 5.315 5.120 0.967 1.00 0.00 H new ATOM 0 HB3 PHE A 473 5.366 5.751 -0.667 1.00 0.00 H new ATOM 0 HD1 PHE A 473 5.171 4.349 -2.524 1.00 0.00 H new ATOM 0 HD2 PHE A 473 5.681 2.648 1.339 1.00 0.00 H new ATOM 0 HE1 PHE A 473 4.575 2.149 -3.418 1.00 0.00 H new ATOM 0 HE2 PHE A 473 5.097 0.442 0.439 1.00 0.00 H new ATOM 0 HZ PHE A 473 4.535 0.195 -1.942 1.00 0.00 H new ATOM 1330 N HIS A 474 8.053 7.408 -0.651 1.00 0.00 N ATOM 1331 CA HIS A 474 8.195 8.826 -0.762 1.00 0.00 C ATOM 1332 C HIS A 474 7.498 9.181 -2.048 1.00 0.00 C ATOM 1333 O HIS A 474 7.822 8.636 -3.083 1.00 0.00 O ATOM 1334 CB HIS A 474 9.688 9.199 -0.825 1.00 0.00 C ATOM 1335 CG HIS A 474 9.979 10.670 -0.950 1.00 0.00 C ATOM 1336 ND1 HIS A 474 10.497 11.261 -2.084 1.00 0.00 N ATOM 1337 CD2 HIS A 474 9.849 11.666 -0.040 1.00 0.00 C ATOM 1338 CE1 HIS A 474 10.664 12.556 -1.838 1.00 0.00 C ATOM 1339 NE2 HIS A 474 10.285 12.860 -0.607 1.00 0.00 N ATOM 0 H HIS A 474 8.453 6.899 -1.439 1.00 0.00 H new ATOM 0 HA HIS A 474 7.772 9.361 0.088 1.00 0.00 H new ATOM 0 HB2 HIS A 474 10.177 8.824 0.074 1.00 0.00 H new ATOM 0 HB3 HIS A 474 10.139 8.683 -1.673 1.00 0.00 H new ATOM 0 HD1 HIS A 474 10.714 10.786 -2.960 1.00 0.00 H new ATOM 0 HD2 HIS A 474 9.468 11.552 0.964 1.00 0.00 H new ATOM 0 HE1 HIS A 474 11.057 13.267 -2.549 1.00 0.00 H new ATOM 1347 N PHE A 475 6.543 10.042 -1.998 1.00 0.00 N ATOM 1348 CA PHE A 475 5.776 10.320 -3.183 1.00 0.00 C ATOM 1349 C PHE A 475 6.346 11.432 -4.002 1.00 0.00 C ATOM 1350 O PHE A 475 6.891 12.413 -3.472 1.00 0.00 O ATOM 1351 CB PHE A 475 4.308 10.573 -2.868 1.00 0.00 C ATOM 1352 CG PHE A 475 3.551 9.337 -2.481 1.00 0.00 C ATOM 1353 CD1 PHE A 475 2.960 8.553 -3.452 1.00 0.00 C ATOM 1354 CD2 PHE A 475 3.427 8.959 -1.161 1.00 0.00 C ATOM 1355 CE1 PHE A 475 2.257 7.418 -3.117 1.00 0.00 C ATOM 1356 CE2 PHE A 475 2.724 7.822 -0.817 1.00 0.00 C ATOM 1357 CZ PHE A 475 2.139 7.050 -1.796 1.00 0.00 C ATOM 0 H PHE A 475 6.269 10.565 -1.166 1.00 0.00 H new ATOM 0 HA PHE A 475 5.838 9.417 -3.790 1.00 0.00 H new ATOM 0 HB2 PHE A 475 4.240 11.299 -2.057 1.00 0.00 H new ATOM 0 HB3 PHE A 475 3.831 11.022 -3.739 1.00 0.00 H new ATOM 0 HD1 PHE A 475 3.051 8.835 -4.491 1.00 0.00 H new ATOM 0 HD2 PHE A 475 3.885 9.559 -0.388 1.00 0.00 H new ATOM 0 HE1 PHE A 475 1.799 6.818 -3.889 1.00 0.00 H new ATOM 0 HE2 PHE A 475 2.633 7.538 0.221 1.00 0.00 H new ATOM 0 HZ PHE A 475 1.590 6.159 -1.528 1.00 0.00 H new ATOM 1429 N LEU A 480 -0.044 17.864 -4.888 1.00 0.00 N ATOM 1430 CA LEU A 480 -0.088 18.017 -3.442 1.00 0.00 C ATOM 1431 C LEU A 480 -1.502 17.919 -2.901 1.00 0.00 C ATOM 1432 O LEU A 480 -1.693 17.506 -1.779 1.00 0.00 O ATOM 1433 CB LEU A 480 0.596 19.307 -2.983 1.00 0.00 C ATOM 1434 CG LEU A 480 2.123 19.340 -3.117 1.00 0.00 C ATOM 1435 CD1 LEU A 480 2.658 20.717 -2.783 1.00 0.00 C ATOM 1436 CD2 LEU A 480 2.753 18.306 -2.195 1.00 0.00 C ATOM 0 HA LEU A 480 0.476 17.183 -3.024 1.00 0.00 H new ATOM 0 HB2 LEU A 480 0.183 20.138 -3.555 1.00 0.00 H new ATOM 0 HB3 LEU A 480 0.339 19.480 -1.938 1.00 0.00 H new ATOM 0 HG LEU A 480 2.381 19.105 -4.149 1.00 0.00 H new ATOM 0 HD11 LEU A 480 3.743 20.720 -2.884 1.00 0.00 H new ATOM 0 HD12 LEU A 480 2.228 21.450 -3.466 1.00 0.00 H new ATOM 0 HD13 LEU A 480 2.388 20.974 -1.759 1.00 0.00 H new ATOM 0 HD21 LEU A 480 3.838 18.339 -2.299 1.00 0.00 H new ATOM 0 HD22 LEU A 480 2.481 18.525 -1.163 1.00 0.00 H new ATOM 0 HD23 LEU A 480 2.393 17.313 -2.462 1.00 0.00 H new ATOM 1448 N GLU A 481 -2.490 18.262 -3.716 1.00 0.00 N ATOM 1449 CA GLU A 481 -3.884 18.124 -3.309 1.00 0.00 C ATOM 1450 C GLU A 481 -4.245 16.655 -3.119 1.00 0.00 C ATOM 1451 O GLU A 481 -4.931 16.296 -2.156 1.00 0.00 O ATOM 1452 CB GLU A 481 -4.822 18.786 -4.310 1.00 0.00 C ATOM 1453 CG GLU A 481 -4.727 20.294 -4.329 1.00 0.00 C ATOM 1454 CD GLU A 481 -5.178 20.913 -3.031 1.00 0.00 C ATOM 1455 OE1 GLU A 481 -4.343 21.165 -2.146 1.00 0.00 O ATOM 1456 OE2 GLU A 481 -6.397 21.162 -2.866 1.00 0.00 O ATOM 0 H GLU A 481 -2.356 18.635 -4.656 1.00 0.00 H new ATOM 0 HA GLU A 481 -4.005 18.635 -2.354 1.00 0.00 H new ATOM 0 HB2 GLU A 481 -4.602 18.405 -5.307 1.00 0.00 H new ATOM 0 HB3 GLU A 481 -5.848 18.499 -4.078 1.00 0.00 H new ATOM 0 HG2 GLU A 481 -3.697 20.588 -4.530 1.00 0.00 H new ATOM 0 HG3 GLU A 481 -5.335 20.684 -5.145 1.00 0.00 H new ATOM 1463 N SER A 482 -3.755 15.810 -4.017 1.00 0.00 N ATOM 1464 CA SER A 482 -3.969 14.387 -3.915 1.00 0.00 C ATOM 1465 C SER A 482 -3.240 13.841 -2.684 1.00 0.00 C ATOM 1466 O SER A 482 -3.792 13.030 -1.942 1.00 0.00 O ATOM 1467 CB SER A 482 -3.511 13.683 -5.195 1.00 0.00 C ATOM 1468 OG SER A 482 -4.208 14.191 -6.335 1.00 0.00 O ATOM 0 H SER A 482 -3.204 16.096 -4.826 1.00 0.00 H new ATOM 0 HA SER A 482 -5.035 14.191 -3.796 1.00 0.00 H new ATOM 0 HB2 SER A 482 -2.438 13.823 -5.328 1.00 0.00 H new ATOM 0 HB3 SER A 482 -3.684 12.610 -5.106 1.00 0.00 H new ATOM 0 HG SER A 482 -3.898 13.728 -7.141 1.00 0.00 H new ATOM 1474 N LEU A 483 -2.010 14.328 -2.452 1.00 0.00 N ATOM 1475 CA LEU A 483 -1.256 13.938 -1.258 1.00 0.00 C ATOM 1476 C LEU A 483 -1.976 14.373 -0.004 1.00 0.00 C ATOM 1477 O LEU A 483 -2.158 13.588 0.886 1.00 0.00 O ATOM 1478 CB LEU A 483 0.199 14.473 -1.237 1.00 0.00 C ATOM 1479 CG LEU A 483 1.282 13.666 -1.986 1.00 0.00 C ATOM 1480 CD1 LEU A 483 1.364 12.236 -1.466 1.00 0.00 C ATOM 1481 CD2 LEU A 483 1.083 13.692 -3.485 1.00 0.00 C ATOM 0 H LEU A 483 -1.526 14.982 -3.067 1.00 0.00 H new ATOM 0 HA LEU A 483 -1.192 12.850 -1.293 1.00 0.00 H new ATOM 0 HB2 LEU A 483 0.189 15.482 -1.650 1.00 0.00 H new ATOM 0 HB3 LEU A 483 0.508 14.558 -0.195 1.00 0.00 H new ATOM 0 HG LEU A 483 2.236 14.154 -1.784 1.00 0.00 H new ATOM 0 HD11 LEU A 483 2.135 11.694 -2.013 1.00 0.00 H new ATOM 0 HD12 LEU A 483 1.613 12.248 -0.405 1.00 0.00 H new ATOM 0 HD13 LEU A 483 0.403 11.742 -1.608 1.00 0.00 H new ATOM 0 HD21 LEU A 483 1.869 13.111 -3.967 1.00 0.00 H new ATOM 0 HD22 LEU A 483 0.112 13.262 -3.731 1.00 0.00 H new ATOM 0 HD23 LEU A 483 1.124 14.722 -3.840 1.00 0.00 H new ATOM 1493 N LYS A 484 -2.402 15.617 0.026 1.00 0.00 N ATOM 1494 CA LYS A 484 -3.104 16.201 1.164 1.00 0.00 C ATOM 1495 C LYS A 484 -4.338 15.371 1.528 1.00 0.00 C ATOM 1496 O LYS A 484 -4.551 15.046 2.697 1.00 0.00 O ATOM 1497 CB LYS A 484 -3.526 17.620 0.814 1.00 0.00 C ATOM 1498 CG LYS A 484 -4.137 18.413 1.955 1.00 0.00 C ATOM 1499 CD LYS A 484 -4.620 19.769 1.471 1.00 0.00 C ATOM 1500 CE LYS A 484 -5.826 19.636 0.549 1.00 0.00 C ATOM 1501 NZ LYS A 484 -6.228 20.927 -0.027 1.00 0.00 N ATOM 0 H LYS A 484 -2.272 16.267 -0.749 1.00 0.00 H new ATOM 0 HA LYS A 484 -2.434 16.212 2.023 1.00 0.00 H new ATOM 0 HB2 LYS A 484 -2.655 18.160 0.443 1.00 0.00 H new ATOM 0 HB3 LYS A 484 -4.246 17.577 -0.003 1.00 0.00 H new ATOM 0 HG2 LYS A 484 -4.970 17.857 2.385 1.00 0.00 H new ATOM 0 HG3 LYS A 484 -3.400 18.546 2.747 1.00 0.00 H new ATOM 0 HD2 LYS A 484 -4.882 20.390 2.328 1.00 0.00 H new ATOM 0 HD3 LYS A 484 -3.812 20.277 0.944 1.00 0.00 H new ATOM 0 HE2 LYS A 484 -5.592 18.938 -0.255 1.00 0.00 H new ATOM 0 HE3 LYS A 484 -6.662 19.212 1.105 1.00 0.00 H new ATOM 0 HZ1 LYS A 484 -7.019 20.782 -0.686 1.00 0.00 H new ATOM 0 HZ2 LYS A 484 -6.526 21.569 0.735 1.00 0.00 H new ATOM 0 HZ3 LYS A 484 -5.424 21.345 -0.538 1.00 0.00 H new ATOM 1515 N GLY A 485 -5.126 15.017 0.516 1.00 0.00 N ATOM 1516 CA GLY A 485 -6.308 14.209 0.735 1.00 0.00 C ATOM 1517 C GLY A 485 -5.955 12.836 1.275 1.00 0.00 C ATOM 1518 O GLY A 485 -6.590 12.339 2.219 1.00 0.00 O ATOM 0 H GLY A 485 -4.963 15.278 -0.456 1.00 0.00 H new ATOM 0 HA2 GLY A 485 -6.971 14.716 1.435 1.00 0.00 H new ATOM 0 HA3 GLY A 485 -6.855 14.102 -0.202 1.00 0.00 H new ATOM 1522 N LEU A 486 -4.927 12.242 0.699 1.00 0.00 N ATOM 1523 CA LEU A 486 -4.443 10.950 1.095 1.00 0.00 C ATOM 1524 C LEU A 486 -3.851 10.996 2.527 1.00 0.00 C ATOM 1525 O LEU A 486 -4.054 10.066 3.312 1.00 0.00 O ATOM 1526 CB LEU A 486 -3.445 10.440 0.025 1.00 0.00 C ATOM 1527 CG LEU A 486 -2.894 9.026 0.187 1.00 0.00 C ATOM 1528 CD1 LEU A 486 -2.438 8.480 -1.156 1.00 0.00 C ATOM 1529 CD2 LEU A 486 -1.723 9.013 1.138 1.00 0.00 C ATOM 0 H LEU A 486 -4.401 12.658 -0.070 1.00 0.00 H new ATOM 0 HA LEU A 486 -5.264 10.234 1.146 1.00 0.00 H new ATOM 0 HB2 LEU A 486 -3.935 10.500 -0.947 1.00 0.00 H new ATOM 0 HB3 LEU A 486 -2.600 11.128 -0.001 1.00 0.00 H new ATOM 0 HG LEU A 486 -3.693 8.402 0.588 1.00 0.00 H new ATOM 0 HD11 LEU A 486 -2.047 7.471 -1.025 1.00 0.00 H new ATOM 0 HD12 LEU A 486 -3.283 8.456 -1.845 1.00 0.00 H new ATOM 0 HD13 LEU A 486 -1.656 9.121 -1.563 1.00 0.00 H new ATOM 0 HD21 LEU A 486 -1.347 7.995 1.238 1.00 0.00 H new ATOM 0 HD22 LEU A 486 -0.932 9.656 0.750 1.00 0.00 H new ATOM 0 HD23 LEU A 486 -2.043 9.379 2.114 1.00 0.00 H new ATOM 1541 N TYR A 487 -3.150 12.090 2.859 1.00 0.00 N ATOM 1542 CA TYR A 487 -2.592 12.314 4.209 1.00 0.00 C ATOM 1543 C TYR A 487 -3.679 12.254 5.252 1.00 0.00 C ATOM 1544 O TYR A 487 -3.489 11.674 6.315 1.00 0.00 O ATOM 1545 CB TYR A 487 -1.890 13.681 4.332 1.00 0.00 C ATOM 1546 CG TYR A 487 -0.459 13.782 3.817 1.00 0.00 C ATOM 1547 CD1 TYR A 487 0.404 14.718 4.370 1.00 0.00 C ATOM 1548 CD2 TYR A 487 0.027 12.971 2.801 1.00 0.00 C ATOM 1549 CE1 TYR A 487 1.701 14.852 3.928 1.00 0.00 C ATOM 1550 CE2 TYR A 487 1.328 13.096 2.352 1.00 0.00 C ATOM 1551 CZ TYR A 487 2.160 14.043 2.920 1.00 0.00 C ATOM 1552 OH TYR A 487 3.458 14.183 2.475 1.00 0.00 O ATOM 0 H TYR A 487 -2.952 12.846 2.203 1.00 0.00 H new ATOM 0 HA TYR A 487 -1.860 11.523 4.370 1.00 0.00 H new ATOM 0 HB2 TYR A 487 -2.492 14.418 3.801 1.00 0.00 H new ATOM 0 HB3 TYR A 487 -1.891 13.967 5.384 1.00 0.00 H new ATOM 0 HD1 TYR A 487 0.050 15.356 5.166 1.00 0.00 H new ATOM 0 HD2 TYR A 487 -0.621 12.231 2.355 1.00 0.00 H new ATOM 0 HE1 TYR A 487 2.353 15.590 4.372 1.00 0.00 H new ATOM 0 HE2 TYR A 487 1.693 12.457 1.561 1.00 0.00 H new ATOM 0 HH TYR A 487 3.630 13.537 1.759 1.00 0.00 H new ATOM 1562 N ARG A 488 -4.825 12.849 4.935 1.00 0.00 N ATOM 1563 CA ARG A 488 -5.967 12.856 5.844 1.00 0.00 C ATOM 1564 C ARG A 488 -6.402 11.425 6.108 1.00 0.00 C ATOM 1565 O ARG A 488 -6.591 11.021 7.247 1.00 0.00 O ATOM 1566 CB ARG A 488 -7.170 13.614 5.250 1.00 0.00 C ATOM 1567 CG ARG A 488 -6.907 15.035 4.768 1.00 0.00 C ATOM 1568 CD ARG A 488 -6.345 15.930 5.853 1.00 0.00 C ATOM 1569 NE ARG A 488 -6.202 17.315 5.382 1.00 0.00 N ATOM 1570 CZ ARG A 488 -5.206 18.149 5.712 1.00 0.00 C ATOM 1571 NH1 ARG A 488 -4.202 17.727 6.484 1.00 0.00 N ATOM 1572 NH2 ARG A 488 -5.208 19.402 5.247 1.00 0.00 N ATOM 0 H ARG A 488 -4.988 13.334 4.053 1.00 0.00 H new ATOM 0 HA ARG A 488 -5.654 13.356 6.761 1.00 0.00 H new ATOM 0 HB2 ARG A 488 -7.558 13.035 4.411 1.00 0.00 H new ATOM 0 HB3 ARG A 488 -7.957 13.649 6.003 1.00 0.00 H new ATOM 0 HG2 ARG A 488 -6.210 15.006 3.930 1.00 0.00 H new ATOM 0 HG3 ARG A 488 -7.837 15.465 4.395 1.00 0.00 H new ATOM 0 HD2 ARG A 488 -7.001 15.906 6.723 1.00 0.00 H new ATOM 0 HD3 ARG A 488 -5.375 15.551 6.174 1.00 0.00 H new ATOM 0 HE ARG A 488 -6.920 17.671 4.752 1.00 0.00 H new ATOM 0 HH11 ARG A 488 -4.190 16.766 6.826 1.00 0.00 H new ATOM 0 HH12 ARG A 488 -3.446 18.366 6.732 1.00 0.00 H new ATOM 0 HH21 ARG A 488 -5.966 19.721 4.643 1.00 0.00 H new ATOM 0 HH22 ARG A 488 -4.452 20.040 5.496 1.00 0.00 H new ATOM 1586 N ILE A 489 -6.518 10.664 5.032 1.00 0.00 N ATOM 1587 CA ILE A 489 -6.991 9.299 5.088 1.00 0.00 C ATOM 1588 C ILE A 489 -5.988 8.370 5.797 1.00 0.00 C ATOM 1589 O ILE A 489 -6.325 7.725 6.790 1.00 0.00 O ATOM 1590 CB ILE A 489 -7.272 8.784 3.638 1.00 0.00 C ATOM 1591 CG1 ILE A 489 -8.396 9.606 2.986 1.00 0.00 C ATOM 1592 CG2 ILE A 489 -7.595 7.293 3.606 1.00 0.00 C ATOM 1593 CD1 ILE A 489 -8.703 9.213 1.554 1.00 0.00 C ATOM 0 H ILE A 489 -6.284 10.982 4.092 1.00 0.00 H new ATOM 0 HA ILE A 489 -7.912 9.286 5.671 1.00 0.00 H new ATOM 0 HB ILE A 489 -6.358 8.920 3.060 1.00 0.00 H new ATOM 0 HG12 ILE A 489 -9.302 9.499 3.582 1.00 0.00 H new ATOM 0 HG13 ILE A 489 -8.121 10.660 3.011 1.00 0.00 H new ATOM 0 HG21 ILE A 489 -7.782 6.983 2.578 1.00 0.00 H new ATOM 0 HG22 ILE A 489 -6.752 6.730 4.007 1.00 0.00 H new ATOM 0 HG23 ILE A 489 -8.481 7.100 4.210 1.00 0.00 H new ATOM 0 HD11 ILE A 489 -9.507 9.841 1.169 1.00 0.00 H new ATOM 0 HD12 ILE A 489 -7.812 9.347 0.941 1.00 0.00 H new ATOM 0 HD13 ILE A 489 -9.011 8.168 1.522 1.00 0.00 H new ATOM 1605 N MET A 490 -4.746 8.375 5.363 1.00 0.00 N ATOM 1606 CA MET A 490 -3.769 7.451 5.932 1.00 0.00 C ATOM 1607 C MET A 490 -3.296 7.891 7.302 1.00 0.00 C ATOM 1608 O MET A 490 -2.882 7.075 8.115 1.00 0.00 O ATOM 1609 CB MET A 490 -2.615 7.133 4.962 1.00 0.00 C ATOM 1610 CG MET A 490 -3.108 6.469 3.677 1.00 0.00 C ATOM 1611 SD MET A 490 -1.805 5.918 2.542 1.00 0.00 S ATOM 1612 CE MET A 490 -1.078 4.547 3.424 1.00 0.00 C ATOM 0 H MET A 490 -4.387 8.992 4.634 1.00 0.00 H new ATOM 0 HA MET A 490 -4.287 6.504 6.084 1.00 0.00 H new ATOM 0 HB2 MET A 490 -2.087 8.054 4.714 1.00 0.00 H new ATOM 0 HB3 MET A 490 -1.898 6.477 5.456 1.00 0.00 H new ATOM 0 HG2 MET A 490 -3.722 5.609 3.944 1.00 0.00 H new ATOM 0 HG3 MET A 490 -3.754 7.171 3.149 1.00 0.00 H new ATOM 0 HE1 MET A 490 -0.767 3.781 2.714 1.00 0.00 H new ATOM 0 HE2 MET A 490 -0.211 4.894 3.985 1.00 0.00 H new ATOM 0 HE3 MET A 490 -1.811 4.127 4.112 1.00 0.00 H new ATOM 1622 N GLY A 491 -3.417 9.173 7.578 1.00 0.00 N ATOM 1623 CA GLY A 491 -3.055 9.694 8.876 1.00 0.00 C ATOM 1624 C GLY A 491 -4.162 9.483 9.896 1.00 0.00 C ATOM 1625 O GLY A 491 -3.946 9.637 11.098 1.00 0.00 O ATOM 0 H GLY A 491 -3.763 9.871 6.920 1.00 0.00 H new ATOM 0 HA2 GLY A 491 -2.144 9.207 9.222 1.00 0.00 H new ATOM 0 HA3 GLY A 491 -2.835 10.758 8.792 1.00 0.00 H new ATOM 1629 N ASN A 492 -5.343 9.106 9.421 1.00 0.00 N ATOM 1630 CA ASN A 492 -6.499 8.878 10.294 1.00 0.00 C ATOM 1631 C ASN A 492 -6.569 7.399 10.697 1.00 0.00 C ATOM 1632 O ASN A 492 -7.472 6.966 11.418 1.00 0.00 O ATOM 1633 CB ASN A 492 -7.809 9.294 9.582 1.00 0.00 C ATOM 1634 CG ASN A 492 -9.052 9.261 10.481 1.00 0.00 C ATOM 1635 OD1 ASN A 492 -10.147 8.932 10.030 1.00 0.00 O ATOM 1636 ND2 ASN A 492 -8.905 9.629 11.737 1.00 0.00 N ATOM 0 H ASN A 492 -5.531 8.950 8.431 1.00 0.00 H new ATOM 0 HA ASN A 492 -6.382 9.488 11.190 1.00 0.00 H new ATOM 0 HB2 ASN A 492 -7.689 10.302 9.184 1.00 0.00 H new ATOM 0 HB3 ASN A 492 -7.972 8.633 8.731 1.00 0.00 H new ATOM 0 HD21 ASN A 492 -9.711 9.646 12.361 1.00 0.00 H new ATOM 0 HD22 ASN A 492 -7.985 9.897 12.085 1.00 0.00 H new ATOM 1643 N GLY A 493 -5.589 6.642 10.281 1.00 0.00 N ATOM 1644 CA GLY A 493 -5.591 5.242 10.596 1.00 0.00 C ATOM 1645 C GLY A 493 -6.073 4.379 9.458 1.00 0.00 C ATOM 1646 O GLY A 493 -6.691 3.340 9.670 1.00 0.00 O ATOM 0 H GLY A 493 -4.792 6.965 9.732 1.00 0.00 H new ATOM 0 HA2 GLY A 493 -4.582 4.937 10.873 1.00 0.00 H new ATOM 0 HA3 GLY A 493 -6.225 5.073 11.466 1.00 0.00 H new ATOM 1650 N PHE A 494 -5.847 4.822 8.258 1.00 0.00 N ATOM 1651 CA PHE A 494 -6.082 3.992 7.113 1.00 0.00 C ATOM 1652 C PHE A 494 -4.761 3.512 6.578 1.00 0.00 C ATOM 1653 O PHE A 494 -3.767 4.254 6.577 1.00 0.00 O ATOM 1654 CB PHE A 494 -6.889 4.688 6.023 1.00 0.00 C ATOM 1655 CG PHE A 494 -8.351 4.789 6.337 1.00 0.00 C ATOM 1656 CD1 PHE A 494 -8.922 5.984 6.739 1.00 0.00 C ATOM 1657 CD2 PHE A 494 -9.152 3.672 6.231 1.00 0.00 C ATOM 1658 CE1 PHE A 494 -10.267 6.059 7.025 1.00 0.00 C ATOM 1659 CE2 PHE A 494 -10.493 3.734 6.514 1.00 0.00 C ATOM 1660 CZ PHE A 494 -11.057 4.930 6.912 1.00 0.00 C ATOM 0 H PHE A 494 -5.499 5.757 8.045 1.00 0.00 H new ATOM 0 HA PHE A 494 -6.688 3.145 7.435 1.00 0.00 H new ATOM 0 HB2 PHE A 494 -6.488 5.690 5.868 1.00 0.00 H new ATOM 0 HB3 PHE A 494 -6.763 4.146 5.086 1.00 0.00 H new ATOM 0 HD1 PHE A 494 -8.306 6.867 6.829 1.00 0.00 H new ATOM 0 HD2 PHE A 494 -8.717 2.734 5.920 1.00 0.00 H new ATOM 0 HE1 PHE A 494 -10.703 6.997 7.337 1.00 0.00 H new ATOM 0 HE2 PHE A 494 -11.106 2.849 6.426 1.00 0.00 H new ATOM 0 HZ PHE A 494 -12.113 4.983 7.134 1.00 0.00 H new ATOM 1670 N ALA A 495 -4.741 2.296 6.163 1.00 0.00 N ATOM 1671 CA ALA A 495 -3.574 1.663 5.651 1.00 0.00 C ATOM 1672 C ALA A 495 -3.833 1.267 4.223 1.00 0.00 C ATOM 1673 O ALA A 495 -4.969 0.958 3.857 1.00 0.00 O ATOM 1674 CB ALA A 495 -3.259 0.438 6.482 1.00 0.00 C ATOM 0 H ALA A 495 -5.563 1.692 6.170 1.00 0.00 H new ATOM 0 HA ALA A 495 -2.724 2.344 5.695 1.00 0.00 H new ATOM 0 HB1 ALA A 495 -2.365 -0.047 6.090 1.00 0.00 H new ATOM 0 HB2 ALA A 495 -3.087 0.735 7.517 1.00 0.00 H new ATOM 0 HB3 ALA A 495 -4.098 -0.257 6.438 1.00 0.00 H new ATOM 1680 N GLY A 496 -2.821 1.286 3.428 1.00 0.00 N ATOM 1681 CA GLY A 496 -2.979 0.961 2.054 1.00 0.00 C ATOM 1682 C GLY A 496 -2.462 -0.407 1.772 1.00 0.00 C ATOM 1683 O GLY A 496 -1.265 -0.622 1.754 1.00 0.00 O ATOM 0 H GLY A 496 -1.870 1.525 3.708 1.00 0.00 H new ATOM 0 HA2 GLY A 496 -4.032 1.020 1.780 1.00 0.00 H new ATOM 0 HA3 GLY A 496 -2.449 1.689 1.440 1.00 0.00 H new ATOM 1687 N CYS A 497 -3.335 -1.342 1.592 1.00 0.00 N ATOM 1688 CA CYS A 497 -2.900 -2.666 1.283 1.00 0.00 C ATOM 1689 C CYS A 497 -2.632 -2.741 -0.199 1.00 0.00 C ATOM 1690 O CYS A 497 -3.532 -2.504 -1.022 1.00 0.00 O ATOM 1691 CB CYS A 497 -3.914 -3.719 1.723 1.00 0.00 C ATOM 1692 SG CYS A 497 -3.356 -5.417 1.451 1.00 0.00 S ATOM 0 H CYS A 497 -4.346 -1.217 1.652 1.00 0.00 H new ATOM 0 HA CYS A 497 -1.986 -2.883 1.835 1.00 0.00 H new ATOM 0 HB2 CYS A 497 -4.132 -3.582 2.782 1.00 0.00 H new ATOM 0 HB3 CYS A 497 -4.847 -3.561 1.183 1.00 0.00 H new ATOM 0 HG CYS A 497 -2.931 -5.543 0.229 1.00 0.00 H new ATOM 1698 N VAL A 498 -1.412 -3.050 -0.528 1.00 0.00 N ATOM 1699 CA VAL A 498 -0.947 -3.075 -1.878 1.00 0.00 C ATOM 1700 C VAL A 498 -0.897 -4.503 -2.372 1.00 0.00 C ATOM 1701 O VAL A 498 -0.217 -5.357 -1.794 1.00 0.00 O ATOM 1702 CB VAL A 498 0.485 -2.475 -1.981 1.00 0.00 C ATOM 1703 CG1 VAL A 498 0.989 -2.461 -3.421 1.00 0.00 C ATOM 1704 CG2 VAL A 498 0.554 -1.083 -1.371 1.00 0.00 C ATOM 0 H VAL A 498 -0.696 -3.298 0.155 1.00 0.00 H new ATOM 0 HA VAL A 498 -1.634 -2.483 -2.482 1.00 0.00 H new ATOM 0 HB VAL A 498 1.143 -3.126 -1.405 1.00 0.00 H new ATOM 0 HG11 VAL A 498 1.992 -2.035 -3.451 1.00 0.00 H new ATOM 0 HG12 VAL A 498 1.016 -3.480 -3.807 1.00 0.00 H new ATOM 0 HG13 VAL A 498 0.320 -1.858 -4.035 1.00 0.00 H new ATOM 0 HG21 VAL A 498 1.569 -0.696 -1.461 1.00 0.00 H new ATOM 0 HG22 VAL A 498 -0.135 -0.421 -1.896 1.00 0.00 H new ATOM 0 HG23 VAL A 498 0.277 -1.133 -0.318 1.00 0.00 H new ATOM 1714 N HIS A 499 -1.617 -4.745 -3.410 1.00 0.00 N ATOM 1715 CA HIS A 499 -1.629 -6.008 -4.072 1.00 0.00 C ATOM 1716 C HIS A 499 -0.921 -5.826 -5.398 1.00 0.00 C ATOM 1717 O HIS A 499 -1.096 -4.776 -6.077 1.00 0.00 O ATOM 1718 CB HIS A 499 -3.074 -6.514 -4.298 1.00 0.00 C ATOM 1719 CG HIS A 499 -3.818 -6.957 -3.052 1.00 0.00 C ATOM 1720 ND1 HIS A 499 -4.402 -6.099 -2.138 1.00 0.00 N ATOM 1721 CD2 HIS A 499 -4.094 -8.212 -2.602 1.00 0.00 C ATOM 1722 CE1 HIS A 499 -4.998 -6.847 -1.192 1.00 0.00 C ATOM 1723 NE2 HIS A 499 -4.843 -8.131 -1.432 1.00 0.00 N ATOM 0 H HIS A 499 -2.232 -4.052 -3.837 1.00 0.00 H new ATOM 0 HA HIS A 499 -1.125 -6.755 -3.459 1.00 0.00 H new ATOM 0 HB2 HIS A 499 -3.646 -5.720 -4.778 1.00 0.00 H new ATOM 0 HB3 HIS A 499 -3.042 -7.350 -4.996 1.00 0.00 H new ATOM 0 HD1 HIS A 499 -4.384 -5.080 -2.175 1.00 0.00 H new ATOM 0 HD2 HIS A 499 -3.780 -9.129 -3.079 1.00 0.00 H new ATOM 0 HE1 HIS A 499 -5.534 -6.445 -0.345 1.00 0.00 H new ATOM 1731 N PHE A 500 -0.106 -6.772 -5.752 1.00 0.00 N ATOM 1732 CA PHE A 500 0.615 -6.708 -6.989 1.00 0.00 C ATOM 1733 C PHE A 500 -0.177 -7.414 -8.060 1.00 0.00 C ATOM 1734 O PHE A 500 -0.740 -8.485 -7.807 1.00 0.00 O ATOM 1735 CB PHE A 500 2.006 -7.362 -6.868 1.00 0.00 C ATOM 1736 CG PHE A 500 2.915 -6.724 -5.856 1.00 0.00 C ATOM 1737 CD1 PHE A 500 3.677 -5.626 -6.183 1.00 0.00 C ATOM 1738 CD2 PHE A 500 3.001 -7.223 -4.583 1.00 0.00 C ATOM 1739 CE1 PHE A 500 4.506 -5.035 -5.255 1.00 0.00 C ATOM 1740 CE2 PHE A 500 3.826 -6.643 -3.648 1.00 0.00 C ATOM 1741 CZ PHE A 500 4.578 -5.542 -3.985 1.00 0.00 C ATOM 0 H PHE A 500 0.079 -7.607 -5.196 1.00 0.00 H new ATOM 0 HA PHE A 500 0.756 -5.659 -7.248 1.00 0.00 H new ATOM 0 HB2 PHE A 500 1.877 -8.413 -6.609 1.00 0.00 H new ATOM 0 HB3 PHE A 500 2.492 -7.332 -7.843 1.00 0.00 H new ATOM 0 HD1 PHE A 500 3.624 -5.221 -7.183 1.00 0.00 H new ATOM 0 HD2 PHE A 500 2.412 -8.086 -4.309 1.00 0.00 H new ATOM 0 HE1 PHE A 500 5.098 -4.174 -5.528 1.00 0.00 H new ATOM 0 HE2 PHE A 500 3.883 -7.052 -2.650 1.00 0.00 H new ATOM 0 HZ PHE A 500 5.222 -5.080 -3.252 1.00 0.00 H new ATOM 1751 N PRO A 501 -0.312 -6.797 -9.245 1.00 0.00 N ATOM 1752 CA PRO A 501 -0.915 -7.454 -10.397 1.00 0.00 C ATOM 1753 C PRO A 501 -0.169 -8.760 -10.728 1.00 0.00 C ATOM 1754 O PRO A 501 1.014 -8.939 -10.367 1.00 0.00 O ATOM 1755 CB PRO A 501 -0.741 -6.434 -11.526 1.00 0.00 C ATOM 1756 CG PRO A 501 -0.651 -5.124 -10.833 1.00 0.00 C ATOM 1757 CD PRO A 501 0.052 -5.397 -9.535 1.00 0.00 C ATOM 0 HA PRO A 501 -1.956 -7.731 -10.231 1.00 0.00 H new ATOM 0 HB2 PRO A 501 0.157 -6.637 -12.109 1.00 0.00 H new ATOM 0 HB3 PRO A 501 -1.583 -6.460 -12.218 1.00 0.00 H new ATOM 0 HG2 PRO A 501 -0.098 -4.401 -11.433 1.00 0.00 H new ATOM 0 HG3 PRO A 501 -1.642 -4.704 -10.661 1.00 0.00 H new ATOM 0 HD2 PRO A 501 1.131 -5.272 -9.627 1.00 0.00 H new ATOM 0 HD3 PRO A 501 -0.281 -4.722 -8.746 1.00 0.00 H new ATOM 1846 N VAL A 508 2.639 -12.950 -6.745 1.00 0.00 N ATOM 1847 CA VAL A 508 3.831 -12.293 -6.228 1.00 0.00 C ATOM 1848 C VAL A 508 3.933 -12.489 -4.706 1.00 0.00 C ATOM 1849 O VAL A 508 4.295 -13.574 -4.240 1.00 0.00 O ATOM 1850 CB VAL A 508 3.948 -10.762 -6.624 1.00 0.00 C ATOM 1851 CG1 VAL A 508 5.286 -10.161 -6.183 1.00 0.00 C ATOM 1852 CG2 VAL A 508 3.754 -10.559 -8.124 1.00 0.00 C ATOM 0 HA VAL A 508 4.680 -12.777 -6.710 1.00 0.00 H new ATOM 0 HB VAL A 508 3.150 -10.240 -6.096 1.00 0.00 H new ATOM 0 HG11 VAL A 508 5.326 -9.111 -6.473 1.00 0.00 H new ATOM 0 HG12 VAL A 508 5.382 -10.242 -5.100 1.00 0.00 H new ATOM 0 HG13 VAL A 508 6.103 -10.701 -6.661 1.00 0.00 H new ATOM 0 HG21 VAL A 508 3.840 -9.499 -8.362 1.00 0.00 H new ATOM 0 HG22 VAL A 508 4.517 -11.116 -8.668 1.00 0.00 H new ATOM 0 HG23 VAL A 508 2.766 -10.917 -8.415 1.00 0.00 H new ATOM 1862 N ARG A 509 3.492 -11.500 -3.976 1.00 0.00 N ATOM 1863 CA ARG A 509 3.560 -11.366 -2.527 1.00 0.00 C ATOM 1864 C ARG A 509 2.678 -10.180 -2.277 1.00 0.00 C ATOM 1865 O ARG A 509 2.118 -9.678 -3.245 1.00 0.00 O ATOM 1866 CB ARG A 509 5.022 -11.065 -2.052 1.00 0.00 C ATOM 1867 CG ARG A 509 5.994 -12.232 -2.225 1.00 0.00 C ATOM 1868 CD ARG A 509 7.428 -11.880 -1.903 1.00 0.00 C ATOM 1869 NE ARG A 509 8.305 -13.054 -2.070 1.00 0.00 N ATOM 1870 CZ ARG A 509 9.637 -13.016 -2.277 1.00 0.00 C ATOM 1871 NH1 ARG A 509 10.280 -11.855 -2.305 1.00 0.00 N ATOM 1872 NH2 ARG A 509 10.311 -14.142 -2.460 1.00 0.00 N ATOM 0 H ARG A 509 3.036 -10.695 -4.406 1.00 0.00 H new ATOM 0 HA ARG A 509 3.258 -12.269 -1.996 1.00 0.00 H new ATOM 0 HB2 ARG A 509 5.402 -10.206 -2.606 1.00 0.00 H new ATOM 0 HB3 ARG A 509 4.998 -10.781 -1.000 1.00 0.00 H new ATOM 0 HG2 ARG A 509 5.678 -13.055 -1.584 1.00 0.00 H new ATOM 0 HG3 ARG A 509 5.939 -12.590 -3.253 1.00 0.00 H new ATOM 0 HD2 ARG A 509 7.764 -11.073 -2.554 1.00 0.00 H new ATOM 0 HD3 ARG A 509 7.496 -11.512 -0.879 1.00 0.00 H new ATOM 0 HE ARG A 509 7.866 -13.974 -2.025 1.00 0.00 H new ATOM 0 HH11 ARG A 509 9.766 -10.984 -2.169 1.00 0.00 H new ATOM 0 HH12 ARG A 509 11.288 -11.834 -2.462 1.00 0.00 H new ATOM 0 HH21 ARG A 509 9.822 -15.037 -2.444 1.00 0.00 H new ATOM 0 HH22 ARG A 509 11.319 -14.114 -2.617 1.00 0.00 H new ATOM 1886 N VAL A 510 2.527 -9.700 -1.071 1.00 0.00 N ATOM 1887 CA VAL A 510 1.686 -8.505 -0.907 1.00 0.00 C ATOM 1888 C VAL A 510 2.333 -7.510 -0.012 1.00 0.00 C ATOM 1889 O VAL A 510 3.146 -7.869 0.788 1.00 0.00 O ATOM 1890 CB VAL A 510 0.216 -8.779 -0.485 1.00 0.00 C ATOM 1891 CG1 VAL A 510 -0.597 -9.343 -1.641 1.00 0.00 C ATOM 1892 CG2 VAL A 510 0.153 -9.722 0.677 1.00 0.00 C ATOM 0 H VAL A 510 2.942 -10.079 -0.220 1.00 0.00 H new ATOM 0 HA VAL A 510 1.606 -8.085 -1.909 1.00 0.00 H new ATOM 0 HB VAL A 510 -0.213 -7.822 -0.188 1.00 0.00 H new ATOM 0 HG11 VAL A 510 -1.620 -9.523 -1.312 1.00 0.00 H new ATOM 0 HG12 VAL A 510 -0.601 -8.630 -2.465 1.00 0.00 H new ATOM 0 HG13 VAL A 510 -0.153 -10.281 -1.975 1.00 0.00 H new ATOM 0 HG21 VAL A 510 -0.888 -9.895 0.950 1.00 0.00 H new ATOM 0 HG22 VAL A 510 0.618 -10.669 0.403 1.00 0.00 H new ATOM 0 HG23 VAL A 510 0.683 -9.290 1.526 1.00 0.00 H new ATOM 1902 N LEU A 511 1.973 -6.270 -0.149 1.00 0.00 N ATOM 1903 CA LEU A 511 2.643 -5.202 0.555 1.00 0.00 C ATOM 1904 C LEU A 511 1.659 -4.354 1.359 1.00 0.00 C ATOM 1905 O LEU A 511 0.491 -4.241 1.006 1.00 0.00 O ATOM 1906 CB LEU A 511 3.422 -4.361 -0.484 1.00 0.00 C ATOM 1907 CG LEU A 511 4.027 -3.026 -0.038 1.00 0.00 C ATOM 1908 CD1 LEU A 511 5.053 -3.216 1.053 1.00 0.00 C ATOM 1909 CD2 LEU A 511 4.652 -2.331 -1.227 1.00 0.00 C ATOM 0 H LEU A 511 1.208 -5.963 -0.750 1.00 0.00 H new ATOM 0 HA LEU A 511 3.340 -5.616 1.284 1.00 0.00 H new ATOM 0 HB2 LEU A 511 4.232 -4.979 -0.871 1.00 0.00 H new ATOM 0 HB3 LEU A 511 2.750 -4.158 -1.318 1.00 0.00 H new ATOM 0 HG LEU A 511 3.226 -2.409 0.369 1.00 0.00 H new ATOM 0 HD11 LEU A 511 5.460 -2.247 1.343 1.00 0.00 H new ATOM 0 HD12 LEU A 511 4.583 -3.685 1.917 1.00 0.00 H new ATOM 0 HD13 LEU A 511 5.859 -3.853 0.688 1.00 0.00 H new ATOM 0 HD21 LEU A 511 5.082 -1.381 -0.909 1.00 0.00 H new ATOM 0 HD22 LEU A 511 5.436 -2.962 -1.647 1.00 0.00 H new ATOM 0 HD23 LEU A 511 3.889 -2.148 -1.984 1.00 0.00 H new ATOM 1921 N MET A 512 2.117 -3.816 2.463 1.00 0.00 N ATOM 1922 CA MET A 512 1.322 -2.914 3.263 1.00 0.00 C ATOM 1923 C MET A 512 1.935 -1.521 3.237 1.00 0.00 C ATOM 1924 O MET A 512 3.142 -1.387 3.295 1.00 0.00 O ATOM 1925 CB MET A 512 1.226 -3.425 4.701 1.00 0.00 C ATOM 1926 CG MET A 512 0.501 -2.481 5.650 1.00 0.00 C ATOM 1927 SD MET A 512 -1.154 -2.039 5.082 1.00 0.00 S ATOM 1928 CE MET A 512 -1.932 -3.639 5.025 1.00 0.00 C ATOM 0 H MET A 512 3.051 -3.991 2.833 1.00 0.00 H new ATOM 0 HA MET A 512 0.316 -2.865 2.846 1.00 0.00 H new ATOM 0 HB2 MET A 512 0.713 -4.386 4.700 1.00 0.00 H new ATOM 0 HB3 MET A 512 2.233 -3.602 5.080 1.00 0.00 H new ATOM 0 HG2 MET A 512 0.429 -2.948 6.632 1.00 0.00 H new ATOM 0 HG3 MET A 512 1.092 -1.573 5.771 1.00 0.00 H new ATOM 0 HE1 MET A 512 -3.014 -3.520 5.079 1.00 0.00 H new ATOM 0 HE2 MET A 512 -1.668 -4.139 4.093 1.00 0.00 H new ATOM 0 HE3 MET A 512 -1.591 -4.240 5.868 1.00 0.00 H new ATOM 1938 N LEU A 513 1.104 -0.510 3.131 1.00 0.00 N ATOM 1939 CA LEU A 513 1.547 0.866 3.114 1.00 0.00 C ATOM 1940 C LEU A 513 0.947 1.557 4.334 1.00 0.00 C ATOM 1941 O LEU A 513 -0.268 1.545 4.534 1.00 0.00 O ATOM 1942 CB LEU A 513 1.046 1.556 1.826 1.00 0.00 C ATOM 1943 CG LEU A 513 1.867 2.725 1.248 1.00 0.00 C ATOM 1944 CD1 LEU A 513 1.158 3.408 0.104 1.00 0.00 C ATOM 1945 CD2 LEU A 513 2.325 3.720 2.277 1.00 0.00 C ATOM 0 H LEU A 513 0.093 -0.620 3.053 1.00 0.00 H new ATOM 0 HA LEU A 513 2.635 0.921 3.137 1.00 0.00 H new ATOM 0 HB2 LEU A 513 0.966 0.793 1.052 1.00 0.00 H new ATOM 0 HB3 LEU A 513 0.038 1.923 2.018 1.00 0.00 H new ATOM 0 HG LEU A 513 2.773 2.263 0.856 1.00 0.00 H new ATOM 0 HD11 LEU A 513 1.775 4.225 -0.271 1.00 0.00 H new ATOM 0 HD12 LEU A 513 0.983 2.689 -0.696 1.00 0.00 H new ATOM 0 HD13 LEU A 513 0.204 3.804 0.452 1.00 0.00 H new ATOM 0 HD21 LEU A 513 2.896 4.511 1.790 1.00 0.00 H new ATOM 0 HD22 LEU A 513 1.458 4.153 2.776 1.00 0.00 H new ATOM 0 HD23 LEU A 513 2.954 3.219 3.013 1.00 0.00 H new ATOM 1957 N LEU A 514 1.789 2.140 5.123 1.00 0.00 N ATOM 1958 CA LEU A 514 1.406 2.837 6.320 1.00 0.00 C ATOM 1959 C LEU A 514 2.056 4.210 6.340 1.00 0.00 C ATOM 1960 O LEU A 514 3.213 4.360 5.954 1.00 0.00 O ATOM 1961 CB LEU A 514 1.861 2.032 7.534 1.00 0.00 C ATOM 1962 CG LEU A 514 1.135 0.716 7.789 1.00 0.00 C ATOM 1963 CD1 LEU A 514 1.839 -0.064 8.866 1.00 0.00 C ATOM 1964 CD2 LEU A 514 -0.293 0.981 8.214 1.00 0.00 C ATOM 0 H LEU A 514 2.795 2.148 4.952 1.00 0.00 H new ATOM 0 HA LEU A 514 0.323 2.956 6.346 1.00 0.00 H new ATOM 0 HB2 LEU A 514 2.924 1.819 7.423 1.00 0.00 H new ATOM 0 HB3 LEU A 514 1.752 2.659 8.419 1.00 0.00 H new ATOM 0 HG LEU A 514 1.134 0.137 6.865 1.00 0.00 H new ATOM 0 HD11 LEU A 514 1.312 -1.002 9.040 1.00 0.00 H new ATOM 0 HD12 LEU A 514 2.862 -0.275 8.553 1.00 0.00 H new ATOM 0 HD13 LEU A 514 1.855 0.519 9.787 1.00 0.00 H new ATOM 0 HD21 LEU A 514 -0.801 0.033 8.393 1.00 0.00 H new ATOM 0 HD22 LEU A 514 -0.296 1.573 9.129 1.00 0.00 H new ATOM 0 HD23 LEU A 514 -0.812 1.527 7.426 1.00 0.00 H new ATOM 1976 N TYR A 515 1.338 5.201 6.768 1.00 0.00 N ATOM 1977 CA TYR A 515 1.893 6.530 6.839 1.00 0.00 C ATOM 1978 C TYR A 515 2.435 6.786 8.218 1.00 0.00 C ATOM 1979 O TYR A 515 1.710 6.637 9.215 1.00 0.00 O ATOM 1980 CB TYR A 515 0.849 7.604 6.456 1.00 0.00 C ATOM 1981 CG TYR A 515 1.341 9.053 6.591 1.00 0.00 C ATOM 1982 CD1 TYR A 515 2.542 9.467 6.015 1.00 0.00 C ATOM 1983 CD2 TYR A 515 0.595 10.000 7.287 1.00 0.00 C ATOM 1984 CE1 TYR A 515 2.983 10.773 6.132 1.00 0.00 C ATOM 1985 CE2 TYR A 515 1.032 11.312 7.405 1.00 0.00 C ATOM 1986 CZ TYR A 515 2.226 11.690 6.827 1.00 0.00 C ATOM 1987 OH TYR A 515 2.668 12.997 6.942 1.00 0.00 O ATOM 0 H TYR A 515 0.368 5.123 7.074 1.00 0.00 H new ATOM 0 HA TYR A 515 2.707 6.596 6.117 1.00 0.00 H new ATOM 0 HB2 TYR A 515 0.535 7.435 5.426 1.00 0.00 H new ATOM 0 HB3 TYR A 515 -0.033 7.474 7.083 1.00 0.00 H new ATOM 0 HD1 TYR A 515 3.140 8.754 5.467 1.00 0.00 H new ATOM 0 HD2 TYR A 515 -0.340 9.709 7.743 1.00 0.00 H new ATOM 0 HE1 TYR A 515 3.917 11.072 5.680 1.00 0.00 H new ATOM 0 HE2 TYR A 515 0.440 12.034 7.947 1.00 0.00 H new ATOM 0 HH TYR A 515 2.415 13.500 6.140 1.00 0.00 H new ATOM 1997 N SER A 516 3.703 7.121 8.293 1.00 0.00 N ATOM 1998 CA SER A 516 4.270 7.496 9.538 1.00 0.00 C ATOM 1999 C SER A 516 4.474 8.998 9.538 1.00 0.00 C ATOM 2000 O SER A 516 5.326 9.542 8.795 1.00 0.00 O ATOM 2001 CB SER A 516 5.583 6.730 9.809 1.00 0.00 C ATOM 2002 OG SER A 516 6.523 6.867 8.741 1.00 0.00 O ATOM 0 H SER A 516 4.347 7.137 7.502 1.00 0.00 H new ATOM 0 HA SER A 516 3.593 7.230 10.350 1.00 0.00 H new ATOM 0 HB2 SER A 516 6.031 7.097 10.733 1.00 0.00 H new ATOM 0 HB3 SER A 516 5.360 5.674 9.960 1.00 0.00 H new ATOM 0 HG SER A 516 6.165 7.481 8.067 1.00 0.00 H new ATOM 2008 N SER A 517 3.689 9.651 10.344 1.00 0.00 N ATOM 2009 CA SER A 517 3.694 11.075 10.496 1.00 0.00 C ATOM 2010 C SER A 517 4.990 11.535 11.167 1.00 0.00 C ATOM 2011 O SER A 517 5.526 12.604 10.861 1.00 0.00 O ATOM 2012 CB SER A 517 2.478 11.458 11.321 1.00 0.00 C ATOM 2013 OG SER A 517 1.310 10.835 10.792 1.00 0.00 O ATOM 0 H SER A 517 3.001 9.187 10.937 1.00 0.00 H new ATOM 0 HA SER A 517 3.647 11.565 9.524 1.00 0.00 H new ATOM 0 HB2 SER A 517 2.623 11.155 12.358 1.00 0.00 H new ATOM 0 HB3 SER A 517 2.354 12.541 11.319 1.00 0.00 H new ATOM 0 HG SER A 517 1.255 11.007 9.829 1.00 0.00 H new ATOM 2019 N LYS A 518 5.513 10.682 12.039 1.00 0.00 N ATOM 2020 CA LYS A 518 6.727 10.959 12.787 1.00 0.00 C ATOM 2021 C LYS A 518 7.924 11.109 11.846 1.00 0.00 C ATOM 2022 O LYS A 518 8.756 12.005 12.008 1.00 0.00 O ATOM 2023 CB LYS A 518 6.986 9.838 13.805 1.00 0.00 C ATOM 2024 CG LYS A 518 8.211 10.055 14.682 1.00 0.00 C ATOM 2025 CD LYS A 518 8.063 11.299 15.532 1.00 0.00 C ATOM 2026 CE LYS A 518 9.311 11.577 16.343 1.00 0.00 C ATOM 2027 NZ LYS A 518 9.148 12.774 17.180 1.00 0.00 N ATOM 0 H LYS A 518 5.101 9.772 12.247 1.00 0.00 H new ATOM 0 HA LYS A 518 6.595 11.900 13.322 1.00 0.00 H new ATOM 0 HB2 LYS A 518 6.110 9.736 14.445 1.00 0.00 H new ATOM 0 HB3 LYS A 518 7.101 8.896 13.269 1.00 0.00 H new ATOM 0 HG2 LYS A 518 8.359 9.188 15.325 1.00 0.00 H new ATOM 0 HG3 LYS A 518 9.099 10.143 14.056 1.00 0.00 H new ATOM 0 HD2 LYS A 518 7.848 12.154 14.891 1.00 0.00 H new ATOM 0 HD3 LYS A 518 7.212 11.182 16.203 1.00 0.00 H new ATOM 0 HE2 LYS A 518 9.536 10.717 16.974 1.00 0.00 H new ATOM 0 HE3 LYS A 518 10.160 11.712 15.673 1.00 0.00 H new ATOM 0 HZ1 LYS A 518 10.019 12.939 17.724 1.00 0.00 H new ATOM 0 HZ2 LYS A 518 8.957 13.598 16.574 1.00 0.00 H new ATOM 0 HZ3 LYS A 518 8.352 12.634 17.835 1.00 0.00 H new ATOM 2041 N LYS A 519 7.995 10.260 10.858 1.00 0.00 N ATOM 2042 CA LYS A 519 9.084 10.318 9.903 1.00 0.00 C ATOM 2043 C LYS A 519 8.654 11.153 8.694 1.00 0.00 C ATOM 2044 O LYS A 519 9.450 11.428 7.795 1.00 0.00 O ATOM 2045 CB LYS A 519 9.485 8.906 9.465 1.00 0.00 C ATOM 2046 CG LYS A 519 9.880 7.954 10.599 1.00 0.00 C ATOM 2047 CD LYS A 519 11.101 8.430 11.380 1.00 0.00 C ATOM 2048 CE LYS A 519 11.508 7.395 12.427 1.00 0.00 C ATOM 2049 NZ LYS A 519 12.677 7.823 13.225 1.00 0.00 N ATOM 0 H LYS A 519 7.316 9.518 10.687 1.00 0.00 H new ATOM 0 HA LYS A 519 9.950 10.786 10.371 1.00 0.00 H new ATOM 0 HB2 LYS A 519 8.654 8.464 8.916 1.00 0.00 H new ATOM 0 HB3 LYS A 519 10.321 8.983 8.770 1.00 0.00 H new ATOM 0 HG2 LYS A 519 9.039 7.844 11.283 1.00 0.00 H new ATOM 0 HG3 LYS A 519 10.084 6.967 10.183 1.00 0.00 H new ATOM 0 HD2 LYS A 519 11.930 8.608 10.695 1.00 0.00 H new ATOM 0 HD3 LYS A 519 10.880 9.380 11.867 1.00 0.00 H new ATOM 0 HE2 LYS A 519 10.666 7.208 13.094 1.00 0.00 H new ATOM 0 HE3 LYS A 519 11.737 6.452 11.931 1.00 0.00 H new ATOM 0 HZ1 LYS A 519 12.912 7.086 13.920 1.00 0.00 H new ATOM 0 HZ2 LYS A 519 13.490 7.976 12.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 519 12.453 8.708 13.722 1.00 0.00 H new ATOM 2063 N LYS A 520 7.363 11.539 8.703 1.00 0.00 N ATOM 2064 CA LYS A 520 6.707 12.341 7.661 1.00 0.00 C ATOM 2065 C LYS A 520 6.712 11.588 6.317 1.00 0.00 C ATOM 2066 O LYS A 520 6.494 12.163 5.255 1.00 0.00 O ATOM 2067 CB LYS A 520 7.400 13.708 7.536 1.00 0.00 C ATOM 2068 CG LYS A 520 6.612 14.763 6.781 1.00 0.00 C ATOM 2069 CD LYS A 520 5.362 15.153 7.539 1.00 0.00 C ATOM 2070 CE LYS A 520 4.587 16.225 6.799 1.00 0.00 C ATOM 2071 NZ LYS A 520 3.430 16.702 7.576 1.00 0.00 N ATOM 0 H LYS A 520 6.730 11.291 9.463 1.00 0.00 H new ATOM 0 HA LYS A 520 5.668 12.509 7.943 1.00 0.00 H new ATOM 0 HB2 LYS A 520 7.613 14.083 8.537 1.00 0.00 H new ATOM 0 HB3 LYS A 520 8.359 13.567 7.038 1.00 0.00 H new ATOM 0 HG2 LYS A 520 7.235 15.643 6.623 1.00 0.00 H new ATOM 0 HG3 LYS A 520 6.341 14.383 5.796 1.00 0.00 H new ATOM 0 HD2 LYS A 520 4.731 14.276 7.681 1.00 0.00 H new ATOM 0 HD3 LYS A 520 5.633 15.515 8.531 1.00 0.00 H new ATOM 0 HE2 LYS A 520 5.247 17.064 6.579 1.00 0.00 H new ATOM 0 HE3 LYS A 520 4.244 15.830 5.843 1.00 0.00 H new ATOM 0 HZ1 LYS A 520 2.927 17.434 7.035 1.00 0.00 H new ATOM 0 HZ2 LYS A 520 2.787 15.907 7.764 1.00 0.00 H new ATOM 0 HZ3 LYS A 520 3.759 17.102 8.478 1.00 0.00 H new ATOM 2085 N ILE A 521 6.861 10.291 6.390 1.00 0.00 N ATOM 2086 CA ILE A 521 7.013 9.479 5.201 1.00 0.00 C ATOM 2087 C ILE A 521 6.218 8.225 5.310 1.00 0.00 C ATOM 2088 O ILE A 521 5.705 7.883 6.392 1.00 0.00 O ATOM 2089 CB ILE A 521 8.516 9.187 4.769 1.00 0.00 C ATOM 2090 CG1 ILE A 521 9.400 8.582 5.893 1.00 0.00 C ATOM 2091 CG2 ILE A 521 9.179 10.420 4.172 1.00 0.00 C ATOM 2092 CD1 ILE A 521 9.127 7.125 6.237 1.00 0.00 C ATOM 0 H ILE A 521 6.881 9.767 7.265 1.00 0.00 H new ATOM 0 HA ILE A 521 6.614 10.086 4.388 1.00 0.00 H new ATOM 0 HB ILE A 521 8.439 8.418 4.001 1.00 0.00 H new ATOM 0 HG12 ILE A 521 10.445 8.677 5.598 1.00 0.00 H new ATOM 0 HG13 ILE A 521 9.268 9.180 6.795 1.00 0.00 H new ATOM 0 HG21 ILE A 521 10.204 10.181 3.889 1.00 0.00 H new ATOM 0 HG22 ILE A 521 8.625 10.740 3.290 1.00 0.00 H new ATOM 0 HG23 ILE A 521 9.184 11.223 4.909 1.00 0.00 H new ATOM 0 HD11 ILE A 521 9.800 6.807 7.033 1.00 0.00 H new ATOM 0 HD12 ILE A 521 8.095 7.017 6.570 1.00 0.00 H new ATOM 0 HD13 ILE A 521 9.290 6.506 5.355 1.00 0.00 H new ATOM 2104 N PHE A 522 6.084 7.554 4.232 1.00 0.00 N ATOM 2105 CA PHE A 522 5.314 6.379 4.202 1.00 0.00 C ATOM 2106 C PHE A 522 6.224 5.176 4.367 1.00 0.00 C ATOM 2107 O PHE A 522 7.327 5.158 3.855 1.00 0.00 O ATOM 2108 CB PHE A 522 4.530 6.337 2.918 1.00 0.00 C ATOM 2109 CG PHE A 522 3.487 7.420 2.785 1.00 0.00 C ATOM 2110 CD1 PHE A 522 3.847 8.720 2.446 1.00 0.00 C ATOM 2111 CD2 PHE A 522 2.153 7.137 2.988 1.00 0.00 C ATOM 2112 CE1 PHE A 522 2.897 9.707 2.321 1.00 0.00 C ATOM 2113 CE2 PHE A 522 1.198 8.120 2.863 1.00 0.00 C ATOM 2114 CZ PHE A 522 1.569 9.407 2.530 1.00 0.00 C ATOM 0 H PHE A 522 6.509 7.808 3.340 1.00 0.00 H new ATOM 0 HA PHE A 522 4.600 6.361 5.026 1.00 0.00 H new ATOM 0 HB2 PHE A 522 5.224 6.414 2.081 1.00 0.00 H new ATOM 0 HB3 PHE A 522 4.040 5.367 2.838 1.00 0.00 H new ATOM 0 HD1 PHE A 522 4.887 8.958 2.279 1.00 0.00 H new ATOM 0 HD2 PHE A 522 1.854 6.132 3.248 1.00 0.00 H new ATOM 0 HE1 PHE A 522 3.191 10.713 2.060 1.00 0.00 H new ATOM 0 HE2 PHE A 522 0.157 7.884 3.026 1.00 0.00 H new ATOM 0 HZ PHE A 522 0.819 10.178 2.433 1.00 0.00 H new ATOM 2124 N MET A 523 5.788 4.226 5.121 1.00 0.00 N ATOM 2125 CA MET A 523 6.559 3.033 5.413 1.00 0.00 C ATOM 2126 C MET A 523 5.704 1.831 5.117 1.00 0.00 C ATOM 2127 O MET A 523 4.507 1.974 4.928 1.00 0.00 O ATOM 2128 CB MET A 523 6.973 3.013 6.897 1.00 0.00 C ATOM 2129 CG MET A 523 5.800 2.982 7.878 1.00 0.00 C ATOM 2130 SD MET A 523 6.326 2.946 9.605 1.00 0.00 S ATOM 2131 CE MET A 523 4.731 2.917 10.438 1.00 0.00 C ATOM 0 H MET A 523 4.871 4.242 5.567 1.00 0.00 H new ATOM 0 HA MET A 523 7.460 3.021 4.800 1.00 0.00 H new ATOM 0 HB2 MET A 523 7.603 2.141 7.075 1.00 0.00 H new ATOM 0 HB3 MET A 523 7.581 3.893 7.104 1.00 0.00 H new ATOM 0 HG2 MET A 523 5.172 3.858 7.713 1.00 0.00 H new ATOM 0 HG3 MET A 523 5.185 2.106 7.673 1.00 0.00 H new ATOM 0 HE1 MET A 523 4.876 3.072 11.507 1.00 0.00 H new ATOM 0 HE2 MET A 523 4.098 3.709 10.039 1.00 0.00 H new ATOM 0 HE3 MET A 523 4.252 1.952 10.273 1.00 0.00 H new ATOM 2141 N GLY A 524 6.288 0.676 5.044 1.00 0.00 N ATOM 2142 CA GLY A 524 5.498 -0.496 4.856 1.00 0.00 C ATOM 2143 C GLY A 524 6.320 -1.743 4.832 1.00 0.00 C ATOM 2144 O GLY A 524 7.518 -1.694 4.596 1.00 0.00 O ATOM 0 H GLY A 524 7.294 0.522 5.111 1.00 0.00 H new ATOM 0 HA2 GLY A 524 4.761 -0.566 5.656 1.00 0.00 H new ATOM 0 HA3 GLY A 524 4.945 -0.411 3.920 1.00 0.00 H new ATOM 2148 N LEU A 525 5.719 -2.828 5.190 1.00 0.00 N ATOM 2149 CA LEU A 525 6.351 -4.120 5.114 1.00 0.00 C ATOM 2150 C LEU A 525 5.638 -4.998 4.111 1.00 0.00 C ATOM 2151 O LEU A 525 4.400 -4.922 3.979 1.00 0.00 O ATOM 2152 CB LEU A 525 6.499 -4.813 6.483 1.00 0.00 C ATOM 2153 CG LEU A 525 7.610 -4.284 7.417 1.00 0.00 C ATOM 2154 CD1 LEU A 525 7.284 -2.908 7.975 1.00 0.00 C ATOM 2155 CD2 LEU A 525 7.885 -5.260 8.548 1.00 0.00 C ATOM 0 H LEU A 525 4.764 -2.852 5.549 1.00 0.00 H new ATOM 0 HA LEU A 525 7.371 -3.953 4.767 1.00 0.00 H new ATOM 0 HB2 LEU A 525 5.547 -4.733 7.008 1.00 0.00 H new ATOM 0 HB3 LEU A 525 6.679 -5.874 6.309 1.00 0.00 H new ATOM 0 HG LEU A 525 8.511 -4.188 6.810 1.00 0.00 H new ATOM 0 HD11 LEU A 525 8.094 -2.578 8.626 1.00 0.00 H new ATOM 0 HD12 LEU A 525 7.167 -2.201 7.154 1.00 0.00 H new ATOM 0 HD13 LEU A 525 6.357 -2.957 8.546 1.00 0.00 H new ATOM 0 HD21 LEU A 525 8.671 -4.862 9.189 1.00 0.00 H new ATOM 0 HD22 LEU A 525 6.977 -5.404 9.134 1.00 0.00 H new ATOM 0 HD23 LEU A 525 8.205 -6.216 8.134 1.00 0.00 H new ATOM 2167 N ILE A 526 6.394 -5.752 3.347 1.00 0.00 N ATOM 2168 CA ILE A 526 5.806 -6.681 2.391 1.00 0.00 C ATOM 2169 C ILE A 526 5.995 -8.145 2.823 1.00 0.00 C ATOM 2170 O ILE A 526 7.128 -8.672 2.826 1.00 0.00 O ATOM 2171 CB ILE A 526 6.354 -6.438 0.931 1.00 0.00 C ATOM 2172 CG1 ILE A 526 6.037 -7.608 -0.021 1.00 0.00 C ATOM 2173 CG2 ILE A 526 7.832 -6.112 0.925 1.00 0.00 C ATOM 2174 CD1 ILE A 526 6.464 -7.368 -1.450 1.00 0.00 C ATOM 0 H ILE A 526 7.414 -5.746 3.363 1.00 0.00 H new ATOM 0 HA ILE A 526 4.734 -6.484 2.376 1.00 0.00 H new ATOM 0 HB ILE A 526 5.824 -5.565 0.551 1.00 0.00 H new ATOM 0 HG12 ILE A 526 6.529 -8.508 0.349 1.00 0.00 H new ATOM 0 HG13 ILE A 526 4.964 -7.800 -0.000 1.00 0.00 H new ATOM 0 HG21 ILE A 526 8.165 -5.953 -0.100 1.00 0.00 H new ATOM 0 HG22 ILE A 526 8.008 -5.208 1.508 1.00 0.00 H new ATOM 0 HG23 ILE A 526 8.389 -6.940 1.363 1.00 0.00 H new ATOM 0 HD11 ILE A 526 6.207 -8.236 -2.057 1.00 0.00 H new ATOM 0 HD12 ILE A 526 5.952 -6.488 -1.840 1.00 0.00 H new ATOM 0 HD13 ILE A 526 7.541 -7.207 -1.486 1.00 0.00 H new ATOM 2186 N PRO A 527 4.895 -8.795 3.257 1.00 0.00 N ATOM 2187 CA PRO A 527 4.860 -10.222 3.536 1.00 0.00 C ATOM 2188 C PRO A 527 4.959 -11.078 2.266 1.00 0.00 C ATOM 2189 O PRO A 527 4.342 -10.769 1.184 1.00 0.00 O ATOM 2190 CB PRO A 527 3.500 -10.442 4.215 1.00 0.00 C ATOM 2191 CG PRO A 527 3.095 -9.095 4.675 1.00 0.00 C ATOM 2192 CD PRO A 527 3.628 -8.155 3.650 1.00 0.00 C ATOM 0 HA PRO A 527 5.709 -10.520 4.151 1.00 0.00 H new ATOM 0 HB2 PRO A 527 2.772 -10.860 3.520 1.00 0.00 H new ATOM 0 HB3 PRO A 527 3.581 -11.139 5.049 1.00 0.00 H new ATOM 0 HG2 PRO A 527 2.011 -9.016 4.756 1.00 0.00 H new ATOM 0 HG3 PRO A 527 3.505 -8.876 5.661 1.00 0.00 H new ATOM 0 HD2 PRO A 527 2.948 -8.049 2.805 1.00 0.00 H new ATOM 0 HD3 PRO A 527 3.787 -7.157 4.059 1.00 0.00 H new ATOM 2200 N TYR A 528 5.718 -12.159 2.412 1.00 0.00 N ATOM 2201 CA TYR A 528 5.993 -13.103 1.350 1.00 0.00 C ATOM 2202 C TYR A 528 4.744 -13.905 1.020 1.00 0.00 C ATOM 2203 O TYR A 528 4.409 -14.118 -0.150 1.00 0.00 O ATOM 2204 CB TYR A 528 7.069 -14.102 1.793 1.00 0.00 C ATOM 2205 CG TYR A 528 8.306 -13.512 2.427 1.00 0.00 C ATOM 2206 CD1 TYR A 528 8.415 -13.438 3.809 1.00 0.00 C ATOM 2207 CD2 TYR A 528 9.373 -13.065 1.661 1.00 0.00 C ATOM 2208 CE1 TYR A 528 9.544 -12.939 4.409 1.00 0.00 C ATOM 2209 CE2 TYR A 528 10.509 -12.555 2.263 1.00 0.00 C ATOM 2210 CZ TYR A 528 10.585 -12.500 3.640 1.00 0.00 C ATOM 2211 OH TYR A 528 11.711 -12.015 4.248 1.00 0.00 O ATOM 0 H TYR A 528 6.167 -12.403 3.295 1.00 0.00 H new ATOM 0 HA TYR A 528 6.327 -12.535 0.481 1.00 0.00 H new ATOM 0 HB2 TYR A 528 6.620 -14.798 2.501 1.00 0.00 H new ATOM 0 HB3 TYR A 528 7.374 -14.685 0.924 1.00 0.00 H new ATOM 0 HD1 TYR A 528 7.596 -13.780 4.424 1.00 0.00 H new ATOM 0 HD2 TYR A 528 9.316 -13.116 0.584 1.00 0.00 H new ATOM 0 HE1 TYR A 528 9.610 -12.893 5.486 1.00 0.00 H new ATOM 0 HE2 TYR A 528 11.332 -12.202 1.659 1.00 0.00 H new ATOM 0 HH TYR A 528 12.490 -12.190 3.680 1.00 0.00 H new ATOM 2221 N ASP A 529 4.068 -14.358 2.047 1.00 0.00 N ATOM 2222 CA ASP A 529 2.918 -15.205 1.864 1.00 0.00 C ATOM 2223 C ASP A 529 1.687 -14.380 1.635 1.00 0.00 C ATOM 2224 O ASP A 529 1.135 -13.774 2.564 1.00 0.00 O ATOM 2225 CB ASP A 529 2.710 -16.140 3.046 1.00 0.00 C ATOM 2226 CG ASP A 529 1.624 -17.156 2.773 1.00 0.00 C ATOM 2227 OD1 ASP A 529 0.444 -16.867 2.991 1.00 0.00 O ATOM 2228 OD2 ASP A 529 1.955 -18.280 2.323 1.00 0.00 O ATOM 0 H ASP A 529 4.296 -14.153 3.020 1.00 0.00 H new ATOM 0 HA ASP A 529 3.104 -15.819 0.983 1.00 0.00 H new ATOM 0 HB2 ASP A 529 3.643 -16.657 3.270 1.00 0.00 H new ATOM 0 HB3 ASP A 529 2.449 -15.557 3.929 1.00 0.00 H new ATOM 2233 N GLN A 530 1.300 -14.301 0.399 1.00 0.00 N ATOM 2234 CA GLN A 530 0.128 -13.569 0.019 1.00 0.00 C ATOM 2235 C GLN A 530 -1.149 -14.221 0.547 1.00 0.00 C ATOM 2236 O GLN A 530 -2.064 -13.532 0.923 1.00 0.00 O ATOM 2237 CB GLN A 530 0.103 -13.283 -1.514 1.00 0.00 C ATOM 2238 CG GLN A 530 0.243 -14.510 -2.419 1.00 0.00 C ATOM 2239 CD GLN A 530 -1.020 -15.354 -2.529 1.00 0.00 C ATOM 2240 OE1 GLN A 530 -0.947 -16.560 -2.648 1.00 0.00 O ATOM 2241 NE2 GLN A 530 -2.162 -14.727 -2.602 1.00 0.00 N ATOM 0 H GLN A 530 1.789 -14.744 -0.379 1.00 0.00 H new ATOM 0 HA GLN A 530 0.172 -12.592 0.501 1.00 0.00 H new ATOM 0 HB2 GLN A 530 -0.833 -12.780 -1.756 1.00 0.00 H new ATOM 0 HB3 GLN A 530 0.908 -12.587 -1.749 1.00 0.00 H new ATOM 0 HG2 GLN A 530 0.534 -14.180 -3.416 1.00 0.00 H new ATOM 0 HG3 GLN A 530 1.052 -15.135 -2.041 1.00 0.00 H new ATOM 0 HE21 GLN A 530 -2.195 -13.713 -2.498 1.00 0.00 H new ATOM 0 HE22 GLN A 530 -3.022 -15.251 -2.763 1.00 0.00 H new ATOM 2250 N SER A 531 -1.150 -15.541 0.658 1.00 0.00 N ATOM 2251 CA SER A 531 -2.337 -16.297 1.036 1.00 0.00 C ATOM 2252 C SER A 531 -2.878 -15.886 2.409 1.00 0.00 C ATOM 2253 O SER A 531 -4.063 -15.586 2.548 1.00 0.00 O ATOM 2254 CB SER A 531 -1.989 -17.779 1.042 1.00 0.00 C ATOM 2255 OG SER A 531 -1.410 -18.163 -0.199 1.00 0.00 O ATOM 0 H SER A 531 -0.327 -16.120 0.489 1.00 0.00 H new ATOM 0 HA SER A 531 -3.121 -16.085 0.308 1.00 0.00 H new ATOM 0 HB2 SER A 531 -1.294 -17.992 1.855 1.00 0.00 H new ATOM 0 HB3 SER A 531 -2.887 -18.368 1.228 1.00 0.00 H new ATOM 0 HG SER A 531 -1.475 -17.420 -0.834 1.00 0.00 H new ATOM 2261 N GLY A 532 -2.003 -15.809 3.387 1.00 0.00 N ATOM 2262 CA GLY A 532 -2.419 -15.468 4.720 1.00 0.00 C ATOM 2263 C GLY A 532 -2.737 -14.009 4.858 1.00 0.00 C ATOM 2264 O GLY A 532 -3.732 -13.633 5.492 1.00 0.00 O ATOM 0 H GLY A 532 -1.003 -15.978 3.280 1.00 0.00 H new ATOM 0 HA2 GLY A 532 -3.297 -16.056 4.987 1.00 0.00 H new ATOM 0 HA3 GLY A 532 -1.631 -15.735 5.424 1.00 0.00 H new ATOM 2268 N PHE A 533 -1.928 -13.179 4.234 1.00 0.00 N ATOM 2269 CA PHE A 533 -2.096 -11.752 4.356 1.00 0.00 C ATOM 2270 C PHE A 533 -3.353 -11.292 3.617 1.00 0.00 C ATOM 2271 O PHE A 533 -4.163 -10.557 4.178 1.00 0.00 O ATOM 2272 CB PHE A 533 -0.858 -11.011 3.868 1.00 0.00 C ATOM 2273 CG PHE A 533 -0.813 -9.570 4.293 1.00 0.00 C ATOM 2274 CD1 PHE A 533 -1.318 -8.563 3.489 1.00 0.00 C ATOM 2275 CD2 PHE A 533 -0.254 -9.229 5.508 1.00 0.00 C ATOM 2276 CE1 PHE A 533 -1.263 -7.250 3.892 1.00 0.00 C ATOM 2277 CE2 PHE A 533 -0.199 -7.921 5.917 1.00 0.00 C ATOM 2278 CZ PHE A 533 -0.703 -6.929 5.111 1.00 0.00 C ATOM 0 H PHE A 533 -1.151 -13.469 3.640 1.00 0.00 H new ATOM 0 HA PHE A 533 -2.223 -11.512 5.412 1.00 0.00 H new ATOM 0 HB2 PHE A 533 0.031 -11.519 4.242 1.00 0.00 H new ATOM 0 HB3 PHE A 533 -0.820 -11.062 2.780 1.00 0.00 H new ATOM 0 HD1 PHE A 533 -1.760 -8.811 2.535 1.00 0.00 H new ATOM 0 HD2 PHE A 533 0.146 -10.003 6.146 1.00 0.00 H new ATOM 0 HE1 PHE A 533 -1.657 -6.472 3.256 1.00 0.00 H new ATOM 0 HE2 PHE A 533 0.240 -7.671 6.872 1.00 0.00 H new ATOM 0 HZ PHE A 533 -0.661 -5.899 5.432 1.00 0.00 H new ATOM 2288 N VAL A 534 -3.533 -11.764 2.378 1.00 0.00 N ATOM 2289 CA VAL A 534 -4.711 -11.422 1.585 1.00 0.00 C ATOM 2290 C VAL A 534 -5.965 -11.930 2.288 1.00 0.00 C ATOM 2291 O VAL A 534 -6.966 -11.248 2.324 1.00 0.00 O ATOM 2292 CB VAL A 534 -4.641 -11.984 0.122 1.00 0.00 C ATOM 2293 CG1 VAL A 534 -5.942 -11.727 -0.636 1.00 0.00 C ATOM 2294 CG2 VAL A 534 -3.493 -11.335 -0.628 1.00 0.00 C ATOM 0 H VAL A 534 -2.875 -12.384 1.906 1.00 0.00 H new ATOM 0 HA VAL A 534 -4.745 -10.336 1.501 1.00 0.00 H new ATOM 0 HB VAL A 534 -4.483 -13.061 0.187 1.00 0.00 H new ATOM 0 HG11 VAL A 534 -5.860 -12.129 -1.646 1.00 0.00 H new ATOM 0 HG12 VAL A 534 -6.768 -12.214 -0.117 1.00 0.00 H new ATOM 0 HG13 VAL A 534 -6.128 -10.654 -0.686 1.00 0.00 H new ATOM 0 HG21 VAL A 534 -3.451 -11.731 -1.643 1.00 0.00 H new ATOM 0 HG22 VAL A 534 -3.646 -10.256 -0.665 1.00 0.00 H new ATOM 0 HG23 VAL A 534 -2.555 -11.551 -0.116 1.00 0.00 H new ATOM 2304 N ASN A 535 -5.874 -13.121 2.884 1.00 0.00 N ATOM 2305 CA ASN A 535 -6.986 -13.708 3.652 1.00 0.00 C ATOM 2306 C ASN A 535 -7.406 -12.770 4.778 1.00 0.00 C ATOM 2307 O ASN A 535 -8.598 -12.504 4.965 1.00 0.00 O ATOM 2308 CB ASN A 535 -6.582 -15.072 4.236 1.00 0.00 C ATOM 2309 CG ASN A 535 -7.654 -15.701 5.110 1.00 0.00 C ATOM 2310 OD1 ASN A 535 -7.698 -15.485 6.325 1.00 0.00 O ATOM 2311 ND2 ASN A 535 -8.503 -16.497 4.518 1.00 0.00 N ATOM 0 H ASN A 535 -5.038 -13.705 2.852 1.00 0.00 H new ATOM 0 HA ASN A 535 -7.828 -13.852 2.975 1.00 0.00 H new ATOM 0 HB2 ASN A 535 -6.346 -15.753 3.418 1.00 0.00 H new ATOM 0 HB3 ASN A 535 -5.671 -14.951 4.823 1.00 0.00 H new ATOM 0 HD21 ASN A 535 -9.230 -16.962 5.061 1.00 0.00 H new ATOM 0 HD22 ASN A 535 -8.439 -16.654 3.512 1.00 0.00 H new ATOM 2318 N GLY A 536 -6.422 -12.251 5.500 1.00 0.00 N ATOM 2319 CA GLY A 536 -6.694 -11.312 6.567 1.00 0.00 C ATOM 2320 C GLY A 536 -7.296 -10.022 6.038 1.00 0.00 C ATOM 2321 O GLY A 536 -8.250 -9.492 6.606 1.00 0.00 O ATOM 0 H GLY A 536 -5.434 -12.466 5.363 1.00 0.00 H new ATOM 0 HA2 GLY A 536 -7.377 -11.765 7.285 1.00 0.00 H new ATOM 0 HA3 GLY A 536 -5.770 -11.090 7.102 1.00 0.00 H new ATOM 2325 N ILE A 537 -6.759 -9.540 4.932 1.00 0.00 N ATOM 2326 CA ILE A 537 -7.246 -8.324 4.303 1.00 0.00 C ATOM 2327 C ILE A 537 -8.666 -8.523 3.748 1.00 0.00 C ATOM 2328 O ILE A 537 -9.485 -7.626 3.832 1.00 0.00 O ATOM 2329 CB ILE A 537 -6.266 -7.806 3.207 1.00 0.00 C ATOM 2330 CG1 ILE A 537 -4.892 -7.495 3.826 1.00 0.00 C ATOM 2331 CG2 ILE A 537 -6.818 -6.573 2.489 1.00 0.00 C ATOM 2332 CD1 ILE A 537 -4.909 -6.432 4.919 1.00 0.00 C ATOM 0 H ILE A 537 -5.976 -9.977 4.446 1.00 0.00 H new ATOM 0 HA ILE A 537 -7.295 -7.552 5.071 1.00 0.00 H new ATOM 0 HB ILE A 537 -6.153 -8.595 2.464 1.00 0.00 H new ATOM 0 HG12 ILE A 537 -4.479 -8.415 4.240 1.00 0.00 H new ATOM 0 HG13 ILE A 537 -4.217 -7.171 3.034 1.00 0.00 H new ATOM 0 HG21 ILE A 537 -6.106 -6.243 1.733 1.00 0.00 H new ATOM 0 HG22 ILE A 537 -7.765 -6.824 2.011 1.00 0.00 H new ATOM 0 HG23 ILE A 537 -6.978 -5.772 3.211 1.00 0.00 H new ATOM 0 HD11 ILE A 537 -3.897 -6.280 5.295 1.00 0.00 H new ATOM 0 HD12 ILE A 537 -5.288 -5.496 4.510 1.00 0.00 H new ATOM 0 HD13 ILE A 537 -5.554 -6.759 5.735 1.00 0.00 H new ATOM 2344 N ARG A 538 -8.954 -9.720 3.235 1.00 0.00 N ATOM 2345 CA ARG A 538 -10.300 -10.086 2.761 1.00 0.00 C ATOM 2346 C ARG A 538 -11.312 -9.892 3.867 1.00 0.00 C ATOM 2347 O ARG A 538 -12.401 -9.368 3.635 1.00 0.00 O ATOM 2348 CB ARG A 538 -10.338 -11.542 2.311 1.00 0.00 C ATOM 2349 CG ARG A 538 -9.757 -11.827 0.933 1.00 0.00 C ATOM 2350 CD ARG A 538 -10.739 -11.505 -0.204 1.00 0.00 C ATOM 2351 NE ARG A 538 -10.977 -10.067 -0.444 1.00 0.00 N ATOM 2352 CZ ARG A 538 -12.201 -9.528 -0.644 1.00 0.00 C ATOM 2353 NH1 ARG A 538 -13.294 -10.179 -0.235 1.00 0.00 N ATOM 2354 NH2 ARG A 538 -12.331 -8.327 -1.207 1.00 0.00 N ATOM 0 H ARG A 538 -8.266 -10.466 3.134 1.00 0.00 H new ATOM 0 HA ARG A 538 -10.544 -9.442 1.916 1.00 0.00 H new ATOM 0 HB2 ARG A 538 -9.798 -12.143 3.043 1.00 0.00 H new ATOM 0 HB3 ARG A 538 -11.374 -11.879 2.324 1.00 0.00 H new ATOM 0 HG2 ARG A 538 -8.848 -11.241 0.799 1.00 0.00 H new ATOM 0 HG3 ARG A 538 -9.471 -12.877 0.874 1.00 0.00 H new ATOM 0 HD2 ARG A 538 -10.363 -11.953 -1.124 1.00 0.00 H new ATOM 0 HD3 ARG A 538 -11.694 -11.983 0.016 1.00 0.00 H new ATOM 0 HE ARG A 538 -10.170 -9.443 -0.460 1.00 0.00 H new ATOM 0 HH11 ARG A 538 -13.205 -11.083 0.229 1.00 0.00 H new ATOM 0 HH12 ARG A 538 -14.217 -9.772 -0.386 1.00 0.00 H new ATOM 0 HH21 ARG A 538 -11.502 -7.805 -1.492 1.00 0.00 H new ATOM 0 HH22 ARG A 538 -13.259 -7.930 -1.353 1.00 0.00 H new ATOM 2368 N GLN A 539 -10.923 -10.284 5.079 1.00 0.00 N ATOM 2369 CA GLN A 539 -11.762 -10.126 6.255 1.00 0.00 C ATOM 2370 C GLN A 539 -12.010 -8.653 6.510 1.00 0.00 C ATOM 2371 O GLN A 539 -13.145 -8.225 6.720 1.00 0.00 O ATOM 2372 CB GLN A 539 -11.100 -10.741 7.488 1.00 0.00 C ATOM 2373 CG GLN A 539 -10.827 -12.225 7.391 1.00 0.00 C ATOM 2374 CD GLN A 539 -10.228 -12.767 8.662 1.00 0.00 C ATOM 2375 OE1 GLN A 539 -9.006 -12.809 8.835 1.00 0.00 O ATOM 2376 NE2 GLN A 539 -11.072 -13.167 9.568 1.00 0.00 N ATOM 0 H GLN A 539 -10.020 -10.718 5.268 1.00 0.00 H new ATOM 0 HA GLN A 539 -12.705 -10.640 6.070 1.00 0.00 H new ATOM 0 HB2 GLN A 539 -10.158 -10.224 7.672 1.00 0.00 H new ATOM 0 HB3 GLN A 539 -11.738 -10.560 8.353 1.00 0.00 H new ATOM 0 HG2 GLN A 539 -11.756 -12.752 7.173 1.00 0.00 H new ATOM 0 HG3 GLN A 539 -10.149 -12.416 6.559 1.00 0.00 H new ATOM 0 HE21 GLN A 539 -12.075 -13.117 9.388 1.00 0.00 H new ATOM 0 HE22 GLN A 539 -10.731 -13.531 10.458 1.00 0.00 H new ATOM 2385 N VAL A 540 -10.943 -7.880 6.434 1.00 0.00 N ATOM 2386 CA VAL A 540 -11.009 -6.452 6.647 1.00 0.00 C ATOM 2387 C VAL A 540 -11.905 -5.796 5.589 1.00 0.00 C ATOM 2388 O VAL A 540 -12.771 -5.005 5.922 1.00 0.00 O ATOM 2389 CB VAL A 540 -9.594 -5.796 6.632 1.00 0.00 C ATOM 2390 CG1 VAL A 540 -9.678 -4.302 6.906 1.00 0.00 C ATOM 2391 CG2 VAL A 540 -8.676 -6.461 7.647 1.00 0.00 C ATOM 0 H VAL A 540 -10.007 -8.227 6.223 1.00 0.00 H new ATOM 0 HA VAL A 540 -11.439 -6.289 7.635 1.00 0.00 H new ATOM 0 HB VAL A 540 -9.176 -5.941 5.636 1.00 0.00 H new ATOM 0 HG11 VAL A 540 -8.676 -3.872 6.889 1.00 0.00 H new ATOM 0 HG12 VAL A 540 -10.290 -3.826 6.140 1.00 0.00 H new ATOM 0 HG13 VAL A 540 -10.128 -4.136 7.885 1.00 0.00 H new ATOM 0 HG21 VAL A 540 -7.696 -5.986 7.617 1.00 0.00 H new ATOM 0 HG22 VAL A 540 -9.100 -6.355 8.645 1.00 0.00 H new ATOM 0 HG23 VAL A 540 -8.574 -7.519 7.407 1.00 0.00 H new ATOM 2401 N ILE A 541 -11.715 -6.174 4.328 1.00 0.00 N ATOM 2402 CA ILE A 541 -12.488 -5.616 3.219 1.00 0.00 C ATOM 2403 C ILE A 541 -13.966 -5.995 3.322 1.00 0.00 C ATOM 2404 O ILE A 541 -14.827 -5.137 3.193 1.00 0.00 O ATOM 2405 CB ILE A 541 -11.950 -6.081 1.830 1.00 0.00 C ATOM 2406 CG1 ILE A 541 -10.470 -5.688 1.639 1.00 0.00 C ATOM 2407 CG2 ILE A 541 -12.809 -5.502 0.692 1.00 0.00 C ATOM 2408 CD1 ILE A 541 -9.866 -6.157 0.327 1.00 0.00 C ATOM 0 H ILE A 541 -11.026 -6.871 4.046 1.00 0.00 H new ATOM 0 HA ILE A 541 -12.379 -4.534 3.294 1.00 0.00 H new ATOM 0 HB ILE A 541 -12.016 -7.169 1.799 1.00 0.00 H new ATOM 0 HG12 ILE A 541 -10.383 -4.603 1.699 1.00 0.00 H new ATOM 0 HG13 ILE A 541 -9.887 -6.100 2.462 1.00 0.00 H new ATOM 0 HG21 ILE A 541 -12.416 -5.839 -0.268 1.00 0.00 H new ATOM 0 HG22 ILE A 541 -13.838 -5.844 0.803 1.00 0.00 H new ATOM 0 HG23 ILE A 541 -12.782 -4.413 0.733 1.00 0.00 H new ATOM 0 HD11 ILE A 541 -8.825 -5.840 0.272 1.00 0.00 H new ATOM 0 HD12 ILE A 541 -9.918 -7.244 0.271 1.00 0.00 H new ATOM 0 HD13 ILE A 541 -10.422 -5.724 -0.505 1.00 0.00 H new ATOM 2420 N THR A 542 -14.257 -7.259 3.608 1.00 0.00 N ATOM 2421 CA THR A 542 -15.642 -7.694 3.679 1.00 0.00 C ATOM 2422 C THR A 542 -16.340 -7.031 4.881 1.00 0.00 C ATOM 2423 O THR A 542 -17.505 -6.635 4.796 1.00 0.00 O ATOM 2424 CB THR A 542 -15.800 -9.270 3.673 1.00 0.00 C ATOM 2425 OG1 THR A 542 -17.177 -9.647 3.502 1.00 0.00 O ATOM 2426 CG2 THR A 542 -15.283 -9.903 4.953 1.00 0.00 C ATOM 0 H THR A 542 -13.566 -7.986 3.791 1.00 0.00 H new ATOM 0 HA THR A 542 -16.142 -7.362 2.769 1.00 0.00 H new ATOM 0 HB THR A 542 -15.205 -9.634 2.836 1.00 0.00 H new ATOM 0 HG1 THR A 542 -17.251 -10.624 3.500 1.00 0.00 H new ATOM 0 HG21 THR A 542 -15.412 -10.984 4.902 1.00 0.00 H new ATOM 0 HG22 THR A 542 -14.225 -9.669 5.073 1.00 0.00 H new ATOM 0 HG23 THR A 542 -15.840 -9.510 5.804 1.00 0.00 H new ATOM 2434 N ASN A 543 -15.597 -6.852 5.970 1.00 0.00 N ATOM 2435 CA ASN A 543 -16.118 -6.151 7.143 1.00 0.00 C ATOM 2436 C ASN A 543 -16.333 -4.684 6.812 1.00 0.00 C ATOM 2437 O ASN A 543 -17.352 -4.095 7.164 1.00 0.00 O ATOM 2438 CB ASN A 543 -15.164 -6.288 8.347 1.00 0.00 C ATOM 2439 CG ASN A 543 -15.598 -5.457 9.557 1.00 0.00 C ATOM 2440 OD1 ASN A 543 -16.368 -5.911 10.402 1.00 0.00 O ATOM 2441 ND2 ASN A 543 -15.090 -4.251 9.658 1.00 0.00 N ATOM 0 H ASN A 543 -14.636 -7.181 6.066 1.00 0.00 H new ATOM 0 HA ASN A 543 -17.070 -6.605 7.416 1.00 0.00 H new ATOM 0 HB2 ASN A 543 -15.104 -7.337 8.637 1.00 0.00 H new ATOM 0 HB3 ASN A 543 -14.162 -5.983 8.045 1.00 0.00 H new ATOM 0 HD21 ASN A 543 -15.331 -3.661 10.454 1.00 0.00 H new ATOM 0 HD22 ASN A 543 -14.454 -3.904 8.940 1.00 0.00 H new ATOM 2448 N LEU A 544 -15.375 -4.117 6.100 1.00 0.00 N ATOM 2449 CA LEU A 544 -15.391 -2.718 5.708 1.00 0.00 C ATOM 2450 C LEU A 544 -16.556 -2.436 4.773 1.00 0.00 C ATOM 2451 O LEU A 544 -17.182 -1.404 4.874 1.00 0.00 O ATOM 2452 CB LEU A 544 -14.061 -2.339 5.048 1.00 0.00 C ATOM 2453 CG LEU A 544 -13.861 -0.871 4.688 1.00 0.00 C ATOM 2454 CD1 LEU A 544 -13.897 0.007 5.935 1.00 0.00 C ATOM 2455 CD2 LEU A 544 -12.552 -0.688 3.938 1.00 0.00 C ATOM 0 H LEU A 544 -14.552 -4.623 5.773 1.00 0.00 H new ATOM 0 HA LEU A 544 -15.521 -2.108 6.602 1.00 0.00 H new ATOM 0 HB2 LEU A 544 -13.254 -2.637 5.717 1.00 0.00 H new ATOM 0 HB3 LEU A 544 -13.954 -2.929 4.138 1.00 0.00 H new ATOM 0 HG LEU A 544 -14.680 -0.562 4.039 1.00 0.00 H new ATOM 0 HD11 LEU A 544 -13.752 1.049 5.651 1.00 0.00 H new ATOM 0 HD12 LEU A 544 -14.862 -0.103 6.430 1.00 0.00 H new ATOM 0 HD13 LEU A 544 -13.103 -0.297 6.617 1.00 0.00 H new ATOM 0 HD21 LEU A 544 -12.421 0.364 3.687 1.00 0.00 H new ATOM 0 HD22 LEU A 544 -11.724 -1.017 4.566 1.00 0.00 H new ATOM 0 HD23 LEU A 544 -12.571 -1.280 3.023 1.00 0.00 H new