USER MOD reduce.3.24.130724 H: found=0, std=0, add=976, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 829 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 476 ASN : amide:sc= -6.73! C(o=-9.1!,f=-7.7!) USER MOD Set 1.2: A 480 GLN : amide:sc= -2.39! K(o=-9.1!,f=-7.7) USER MOD Set 2.1: A 443 GLN : amide:sc= -0.162 X(o=-0.16,f=0.0028) USER MOD Set 2.2: A 475 SER OG : rot -42:sc= 0.00297 USER MOD Set 3.1: A 473 MET CE :methyl 162:sc= -12.1! (180deg=-10.7!) USER MOD Set 3.2: A 485 CYS SG : rot -90:sc= -2.84! USER MOD Set 4.1: A 471 GLN : amide:sc= -0.248 X(o=-0.25,f=-0.14) USER MOD Set 4.2: A 474 MET CE :methyl -156:sc= 0 (180deg=-0.182) USER MOD Set 5.1: A 458 SER OG : rot -131:sc= 0.259 USER MOD Set 5.2: A 494 SER OG : rot 80:sc= -1.18 USER MOD Set 5.3: A 498 GLN : amide:sc= 0.196 K(o=-0.72,f=-1.8) USER MOD Set 6.1: A 401 HIS : no HD1:sc= -6.88! C(o=-6!,f=-8.9!) USER MOD Set 6.2: A 426 THR OG1 : rot -18:sc= 0.889 USER MOD Single : A 395 TYR OH : rot 180:sc= 0 USER MOD Single : A 396 ASN : amide:sc= -3.98! C(o=-4!,f=-10!) USER MOD Single : A 407 HIS : no HD1:sc= -0.477 K(o=-0.48,f=-1.4) USER MOD Single : A 415 LYS NZ :NH3+ -166:sc= -0.0624 (180deg=-0.155) USER MOD Single : A 448 HIS : no HE2:sc= -11.1! C(o=-11!,f=-18!) USER MOD Single : A 449 SER OG : rot -64:sc= 0.63 USER MOD Single : A 457 THR OG1 : rot 173:sc= -0.885 USER MOD Single : A 459 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 462 CYS SG : rot 180:sc= -2.4 USER MOD Single : A 465 SER OG : rot -60:sc= -1.18 USER MOD Single : A 467 HIS : no HD1:sc= -0.861 K(o=-0.86,f=-2.2!) USER MOD Single : A 468 GLN : amide:sc= -0.031 X(o=-0.031,f=-0.031) USER MOD Single : A 470 ASN : amide:sc= -6.16! K(o=-6.2!,f=-2.6) USER MOD Single : A 478 THR OG1 : rot -3:sc= 0.889 USER MOD Single : A 482 SER OG : rot 180:sc= -0.866 USER MOD Single : A 495 SER OG : rot 180:sc= 0 USER MOD Single : A 500 SER OG : rot 180:sc= 0 USER MOD Single : A 501 SER OG : rot -29:sc= 0.324 USER MOD Single : A 503 THR OG1 : rot -130:sc=-0.00141 USER MOD Single : A 505 SER OG : rot 180:sc= 0 USER MOD Single : A 508 SER OG : rot 34:sc= 0.464 USER MOD Single : A 516 HIS : no HD1:sc= -1.58 K(o=-1.6,f=-2.8!) USER MOD Single : A 517 SER OG : rot -176:sc= -1.44! USER MOD Single : A 518 GLN : amide:sc= -0.0164 X(o=-0.016,f=0) USER MOD Single : A 523 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 526 ASN : amide:sc= -3.45! C(o=-3.4!,f=-4.3!) USER MOD Single : A 527 THR OG1 : rot 100:sc= -0.399 USER MOD Single : A 529 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 531 HIS : no HD1:sc= -11.6! C(o=-12!,f=-13!) USER MOD ----------------------------------------------------------------- ATOM 125 N TYR A 395 3.230 9.324 3.607 1.00 51.32 N ATOM 126 CA TYR A 395 3.406 7.883 3.532 1.00 41.10 C ATOM 127 C TYR A 395 4.082 7.480 2.219 1.00 42.02 C ATOM 128 O TYR A 395 4.217 8.298 1.310 1.00 64.41 O ATOM 129 CB TYR A 395 1.999 7.285 3.573 1.00 23.24 C ATOM 130 CG TYR A 395 1.211 7.631 4.838 1.00 23.01 C ATOM 131 CD1 TYR A 395 1.860 7.712 6.055 1.00 34.01 C ATOM 132 CD2 TYR A 395 -0.147 7.863 4.764 1.00 2.11 C ATOM 133 CE1 TYR A 395 1.118 8.039 7.245 1.00 32.53 C ATOM 134 CE2 TYR A 395 -0.889 8.189 5.955 1.00 24.33 C ATOM 135 CZ TYR A 395 -0.218 8.261 7.135 1.00 5.05 C ATOM 136 OH TYR A 395 -0.918 8.569 8.261 1.00 72.11 O ATOM 0 HA TYR A 395 4.035 7.530 4.349 1.00 41.10 H new ATOM 0 HB2 TYR A 395 1.442 7.634 2.704 1.00 23.24 H new ATOM 0 HB3 TYR A 395 2.074 6.201 3.489 1.00 23.24 H new ATOM 0 HD1 TYR A 395 2.923 7.530 6.114 1.00 34.01 H new ATOM 0 HD2 TYR A 395 -0.654 7.800 3.813 1.00 2.11 H new ATOM 0 HE1 TYR A 395 1.612 8.106 8.203 1.00 32.53 H new ATOM 0 HE2 TYR A 395 -1.953 8.372 5.911 1.00 24.33 H new ATOM 0 HH TYR A 395 -1.862 8.703 8.033 1.00 72.11 H new ATOM 145 N ASN A 396 4.486 6.220 2.161 1.00 4.01 N ATOM 146 CA ASN A 396 5.143 5.699 0.976 1.00 73.40 C ATOM 147 C ASN A 396 4.236 4.663 0.308 1.00 3.24 C ATOM 148 O ASN A 396 4.465 4.278 -0.838 1.00 41.30 O ATOM 149 CB ASN A 396 6.462 5.012 1.333 1.00 42.21 C ATOM 150 CG ASN A 396 7.648 5.953 1.114 1.00 33.52 C ATOM 151 OD1 ASN A 396 8.495 6.139 1.972 1.00 62.01 O ATOM 152 ND2 ASN A 396 7.662 6.536 -0.083 1.00 43.55 N ATOM 0 H ASN A 396 4.371 5.544 2.916 1.00 4.01 H new ATOM 0 HA ASN A 396 5.342 6.536 0.307 1.00 73.40 H new ATOM 0 HB2 ASN A 396 6.437 4.688 2.374 1.00 42.21 H new ATOM 0 HB3 ASN A 396 6.586 4.117 0.724 1.00 42.21 H new ATOM 0 HD21 ASN A 396 8.413 7.182 -0.327 1.00 43.55 H new ATOM 0 HD22 ASN A 396 6.922 6.337 -0.756 1.00 43.55 H new ATOM 158 N PHE A 397 3.226 4.240 1.054 1.00 45.52 N ATOM 159 CA PHE A 397 2.283 3.255 0.550 1.00 52.32 C ATOM 160 C PHE A 397 1.136 3.039 1.540 1.00 14.45 C ATOM 161 O PHE A 397 1.349 3.022 2.750 1.00 62.32 O ATOM 162 CB PHE A 397 3.054 1.944 0.384 1.00 4.53 C ATOM 163 CG PHE A 397 3.697 1.433 1.676 1.00 34.40 C ATOM 164 CD1 PHE A 397 4.838 2.009 2.140 1.00 61.31 C ATOM 165 CD2 PHE A 397 3.129 0.403 2.358 1.00 21.14 C ATOM 166 CE1 PHE A 397 5.435 1.536 3.338 1.00 22.44 C ATOM 167 CE2 PHE A 397 3.726 -0.071 3.556 1.00 61.20 C ATOM 168 CZ PHE A 397 4.867 0.505 4.021 1.00 73.22 C ATOM 0 H PHE A 397 3.040 4.561 2.004 1.00 45.52 H new ATOM 0 HA PHE A 397 1.854 3.596 -0.392 1.00 52.32 H new ATOM 0 HB2 PHE A 397 2.376 1.181 0.001 1.00 4.53 H new ATOM 0 HB3 PHE A 397 3.832 2.084 -0.366 1.00 4.53 H new ATOM 0 HD1 PHE A 397 5.290 2.826 1.597 1.00 61.31 H new ATOM 0 HD2 PHE A 397 2.223 -0.055 1.988 1.00 21.14 H new ATOM 0 HE1 PHE A 397 6.340 1.995 3.708 1.00 22.44 H new ATOM 0 HE2 PHE A 397 3.274 -0.889 4.098 1.00 61.20 H new ATOM 0 HZ PHE A 397 5.322 0.144 4.932 1.00 73.22 H new ATOM 177 N VAL A 398 -0.057 2.878 0.984 1.00 42.42 N ATOM 178 CA VAL A 398 -1.238 2.663 1.802 1.00 41.02 C ATOM 179 C VAL A 398 -1.600 1.176 1.788 1.00 61.14 C ATOM 180 O VAL A 398 -1.941 0.626 0.744 1.00 14.33 O ATOM 181 CB VAL A 398 -2.381 3.560 1.318 1.00 64.40 C ATOM 182 CG1 VAL A 398 -3.172 2.883 0.198 1.00 73.12 C ATOM 183 CG2 VAL A 398 -3.298 3.953 2.478 1.00 71.14 C ATOM 0 H VAL A 398 -0.230 2.892 -0.021 1.00 42.42 H new ATOM 0 HA VAL A 398 -1.040 2.940 2.837 1.00 41.02 H new ATOM 0 HB VAL A 398 -1.943 4.473 0.914 1.00 64.40 H new ATOM 0 HG11 VAL A 398 -3.978 3.541 -0.128 1.00 73.12 H new ATOM 0 HG12 VAL A 398 -2.509 2.677 -0.643 1.00 73.12 H new ATOM 0 HG13 VAL A 398 -3.594 1.947 0.565 1.00 73.12 H new ATOM 0 HG21 VAL A 398 -4.101 4.590 2.107 1.00 71.14 H new ATOM 0 HG22 VAL A 398 -3.724 3.055 2.925 1.00 71.14 H new ATOM 0 HG23 VAL A 398 -2.723 4.495 3.229 1.00 71.14 H new ATOM 193 N ILE A 399 -1.511 0.569 2.962 1.00 65.30 N ATOM 194 CA ILE A 399 -1.823 -0.844 3.099 1.00 51.34 C ATOM 195 C ILE A 399 -3.342 -1.021 3.178 1.00 25.42 C ATOM 196 O ILE A 399 -3.983 -0.497 4.087 1.00 42.53 O ATOM 197 CB ILE A 399 -1.071 -1.447 4.287 1.00 35.25 C ATOM 198 CG1 ILE A 399 0.440 -1.270 4.126 1.00 14.44 C ATOM 199 CG2 ILE A 399 -1.457 -2.914 4.493 1.00 42.33 C ATOM 200 CD1 ILE A 399 1.176 -1.635 5.417 1.00 23.33 C ATOM 0 H ILE A 399 -1.227 1.029 3.827 1.00 65.30 H new ATOM 0 HA ILE A 399 -1.482 -1.396 2.223 1.00 51.34 H new ATOM 0 HB ILE A 399 -1.365 -0.907 5.187 1.00 35.25 H new ATOM 0 HG12 ILE A 399 0.798 -1.897 3.309 1.00 14.44 H new ATOM 0 HG13 ILE A 399 0.662 -0.238 3.856 1.00 14.44 H new ATOM 0 HG21 ILE A 399 -0.908 -3.319 5.344 1.00 42.33 H new ATOM 0 HG22 ILE A 399 -2.528 -2.985 4.685 1.00 42.33 H new ATOM 0 HG23 ILE A 399 -1.210 -3.484 3.598 1.00 42.33 H new ATOM 0 HD11 ILE A 399 2.248 -1.500 5.275 1.00 23.33 H new ATOM 0 HD12 ILE A 399 0.833 -0.990 6.226 1.00 23.33 H new ATOM 0 HD13 ILE A 399 0.971 -2.675 5.671 1.00 23.33 H new ATOM 211 N LEU A 400 -3.870 -1.760 2.215 1.00 4.13 N ATOM 212 CA LEU A 400 -5.301 -2.012 2.164 1.00 22.33 C ATOM 213 C LEU A 400 -5.585 -3.420 2.693 1.00 71.31 C ATOM 214 O LEU A 400 -5.369 -4.407 1.991 1.00 74.01 O ATOM 215 CB LEU A 400 -5.838 -1.766 0.755 1.00 73.33 C ATOM 216 CG LEU A 400 -6.455 -0.388 0.503 1.00 42.33 C ATOM 217 CD1 LEU A 400 -7.933 -0.368 0.901 1.00 42.31 C ATOM 218 CD2 LEU A 400 -5.656 0.708 1.212 1.00 73.11 C ATOM 0 H LEU A 400 -3.334 -2.193 1.463 1.00 4.13 H new ATOM 0 HA LEU A 400 -5.834 -1.314 2.810 1.00 22.33 H new ATOM 0 HB2 LEU A 400 -5.023 -1.912 0.046 1.00 73.33 H new ATOM 0 HB3 LEU A 400 -6.590 -2.524 0.537 1.00 73.33 H new ATOM 0 HG LEU A 400 -6.406 -0.182 -0.566 1.00 42.33 H new ATOM 0 HD11 LEU A 400 -8.347 0.622 0.712 1.00 42.31 H new ATOM 0 HD12 LEU A 400 -8.478 -1.107 0.314 1.00 42.31 H new ATOM 0 HD13 LEU A 400 -8.028 -0.605 1.961 1.00 42.31 H new ATOM 0 HD21 LEU A 400 -6.115 1.677 1.017 1.00 73.11 H new ATOM 0 HD22 LEU A 400 -5.651 0.518 2.285 1.00 73.11 H new ATOM 0 HD23 LEU A 400 -4.632 0.710 0.839 1.00 73.11 H new ATOM 229 N HIS A 401 -6.064 -3.468 3.928 1.00 11.41 N ATOM 230 CA HIS A 401 -6.379 -4.738 4.558 1.00 4.31 C ATOM 231 C HIS A 401 -7.748 -4.648 5.238 1.00 51.22 C ATOM 232 O HIS A 401 -8.477 -3.676 5.046 1.00 65.24 O ATOM 233 CB HIS A 401 -5.267 -5.159 5.521 1.00 31.14 C ATOM 234 CG HIS A 401 -5.234 -4.366 6.806 1.00 4.24 C ATOM 235 ND1 HIS A 401 -5.843 -4.802 7.971 1.00 15.13 N ATOM 236 CD2 HIS A 401 -4.660 -3.164 7.097 1.00 44.42 C ATOM 237 CE1 HIS A 401 -5.639 -3.894 8.914 1.00 0.00 C ATOM 238 NE2 HIS A 401 -4.906 -2.880 8.371 1.00 14.13 N ATOM 0 H HIS A 401 -6.241 -2.648 4.508 1.00 11.41 H new ATOM 0 HA HIS A 401 -6.438 -5.519 3.799 1.00 4.31 H new ATOM 0 HB2 HIS A 401 -5.389 -6.215 5.761 1.00 31.14 H new ATOM 0 HB3 HIS A 401 -4.306 -5.055 5.017 1.00 31.14 H new ATOM 0 HD2 HIS A 401 -4.101 -2.548 6.409 1.00 44.42 H new ATOM 0 HE1 HIS A 401 -5.991 -3.947 9.934 1.00 0.00 H new ATOM 0 HE2 HIS A 401 -4.597 -2.041 8.863 1.00 14.13 H new ATOM 246 N ALA A 402 -8.055 -5.675 6.017 1.00 64.43 N ATOM 247 CA ALA A 402 -9.322 -5.723 6.726 1.00 73.12 C ATOM 248 C ALA A 402 -9.182 -4.993 8.062 1.00 2.44 C ATOM 249 O ALA A 402 -8.248 -4.217 8.256 1.00 34.40 O ATOM 250 CB ALA A 402 -9.755 -7.180 6.900 1.00 31.52 C ATOM 0 H ALA A 402 -7.448 -6.480 6.173 1.00 64.43 H new ATOM 0 HA ALA A 402 -10.101 -5.218 6.155 1.00 73.12 H new ATOM 0 HB1 ALA A 402 -10.706 -7.216 7.432 1.00 31.52 H new ATOM 0 HB2 ALA A 402 -9.869 -7.645 5.921 1.00 31.52 H new ATOM 0 HB3 ALA A 402 -8.999 -7.719 7.471 1.00 31.52 H new ATOM 256 N ARG A 403 -10.126 -5.267 8.952 1.00 53.45 N ATOM 257 CA ARG A 403 -10.120 -4.646 10.265 1.00 41.22 C ATOM 258 C ARG A 403 -9.517 -5.599 11.300 1.00 53.42 C ATOM 259 O ARG A 403 -9.138 -5.175 12.392 1.00 72.40 O ATOM 260 CB ARG A 403 -11.536 -4.261 10.700 1.00 1.22 C ATOM 261 CG ARG A 403 -11.562 -3.832 12.168 1.00 72.35 C ATOM 262 CD ARG A 403 -11.995 -4.988 13.070 1.00 20.24 C ATOM 263 NE ARG A 403 -11.382 -4.843 14.409 1.00 64.30 N ATOM 264 CZ ARG A 403 -11.688 -5.620 15.469 1.00 61.54 C ATOM 265 NH1 ARG A 403 -12.603 -6.606 15.357 1.00 14.13 N ATOM 266 NH2 ARG A 403 -11.077 -5.403 16.620 1.00 41.42 N ATOM 0 H ARG A 403 -10.900 -5.911 8.789 1.00 53.45 H new ATOM 0 HA ARG A 403 -9.514 -3.742 10.201 1.00 41.22 H new ATOM 0 HB2 ARG A 403 -11.904 -3.448 10.074 1.00 1.22 H new ATOM 0 HB3 ARG A 403 -12.208 -5.107 10.553 1.00 1.22 H new ATOM 0 HG2 ARG A 403 -10.573 -3.484 12.466 1.00 72.35 H new ATOM 0 HG3 ARG A 403 -12.246 -2.993 12.293 1.00 72.35 H new ATOM 0 HD2 ARG A 403 -13.081 -5.004 13.158 1.00 20.24 H new ATOM 0 HD3 ARG A 403 -11.697 -5.938 12.626 1.00 20.24 H new ATOM 0 HE ARG A 403 -10.685 -4.110 14.539 1.00 64.30 H new ATOM 0 HH11 ARG A 403 -13.070 -6.769 14.465 1.00 14.13 H new ATOM 0 HH12 ARG A 403 -12.827 -7.188 16.164 1.00 14.13 H new ATOM 0 HH21 ARG A 403 -10.386 -4.657 16.698 1.00 41.42 H new ATOM 0 HH22 ARG A 403 -11.297 -5.981 17.431 1.00 41.42 H new ATOM 276 N ALA A 404 -9.448 -6.866 10.921 1.00 15.12 N ATOM 277 CA ALA A 404 -8.898 -7.882 11.803 1.00 74.04 C ATOM 278 C ALA A 404 -7.525 -8.311 11.284 1.00 74.44 C ATOM 279 O ALA A 404 -7.008 -9.358 11.674 1.00 52.24 O ATOM 280 CB ALA A 404 -9.875 -9.054 11.903 1.00 2.13 C ATOM 0 H ALA A 404 -9.764 -7.213 10.015 1.00 15.12 H new ATOM 0 HA ALA A 404 -8.762 -7.485 12.809 1.00 74.04 H new ATOM 0 HB1 ALA A 404 -9.463 -9.816 12.564 1.00 2.13 H new ATOM 0 HB2 ALA A 404 -10.826 -8.702 12.303 1.00 2.13 H new ATOM 0 HB3 ALA A 404 -10.034 -9.481 10.913 1.00 2.13 H new ATOM 286 N ASP A 405 -6.970 -7.480 10.413 1.00 13.12 N ATOM 287 CA ASP A 405 -5.666 -7.761 9.837 1.00 41.42 C ATOM 288 C ASP A 405 -4.724 -6.592 10.127 1.00 64.34 C ATOM 289 O ASP A 405 -3.785 -6.342 9.372 1.00 21.32 O ATOM 290 CB ASP A 405 -5.758 -7.927 8.319 1.00 34.41 C ATOM 291 CG ASP A 405 -5.566 -9.357 7.812 1.00 3.33 C ATOM 292 OD1 ASP A 405 -4.754 -9.612 6.910 1.00 23.21 O ATOM 293 OD2 ASP A 405 -6.302 -10.245 8.391 1.00 63.20 O ATOM 0 H ASP A 405 -7.400 -6.612 10.093 1.00 13.12 H new ATOM 0 HA ASP A 405 -5.294 -8.685 10.279 1.00 41.42 H new ATOM 0 HB2 ASP A 405 -6.732 -7.568 7.988 1.00 34.41 H new ATOM 0 HB3 ASP A 405 -5.008 -7.288 7.853 1.00 34.41 H new ATOM 298 N GLU A 406 -5.004 -5.906 11.227 1.00 13.44 N ATOM 299 CA GLU A 406 -4.192 -4.769 11.626 1.00 45.21 C ATOM 300 C GLU A 406 -2.768 -5.222 11.952 1.00 35.43 C ATOM 301 O GLU A 406 -1.846 -4.996 11.168 1.00 53.43 O ATOM 302 CB GLU A 406 -4.819 -4.039 12.817 1.00 3.14 C ATOM 303 CG GLU A 406 -3.891 -2.941 13.339 1.00 33.22 C ATOM 304 CD GLU A 406 -4.443 -2.319 14.622 1.00 1.14 C ATOM 305 OE1 GLU A 406 -5.661 -2.116 14.738 1.00 52.12 O ATOM 306 OE2 GLU A 406 -3.558 -2.048 15.522 1.00 31.33 O ATOM 0 H GLU A 406 -5.781 -6.116 11.853 1.00 13.44 H new ATOM 0 HA GLU A 406 -4.149 -4.068 10.792 1.00 45.21 H new ATOM 0 HB2 GLU A 406 -5.773 -3.603 12.519 1.00 3.14 H new ATOM 0 HB3 GLU A 406 -5.030 -4.751 13.615 1.00 3.14 H new ATOM 0 HG2 GLU A 406 -2.901 -3.357 13.529 1.00 33.22 H new ATOM 0 HG3 GLU A 406 -3.772 -2.169 12.579 1.00 33.22 H new ATOM 312 N HIS A 407 -2.630 -5.853 13.108 1.00 20.03 N ATOM 313 CA HIS A 407 -1.332 -6.342 13.545 1.00 53.04 C ATOM 314 C HIS A 407 -0.556 -6.883 12.343 1.00 53.01 C ATOM 315 O HIS A 407 0.666 -6.757 12.281 1.00 14.34 O ATOM 316 CB HIS A 407 -1.488 -7.373 14.664 1.00 11.42 C ATOM 317 CG HIS A 407 -2.747 -8.201 14.564 1.00 24.41 C ATOM 318 ND1 HIS A 407 -2.944 -9.148 13.575 1.00 4.34 N ATOM 319 CD2 HIS A 407 -3.869 -8.214 15.340 1.00 44.15 C ATOM 320 CE1 HIS A 407 -4.135 -9.701 13.757 1.00 62.22 C ATOM 321 NE2 HIS A 407 -4.706 -9.120 14.851 1.00 12.12 N ATOM 0 H HIS A 407 -3.395 -6.038 13.756 1.00 20.03 H new ATOM 0 HA HIS A 407 -0.753 -5.520 13.967 1.00 53.04 H new ATOM 0 HB2 HIS A 407 -0.625 -8.039 14.653 1.00 11.42 H new ATOM 0 HB3 HIS A 407 -1.480 -6.857 15.624 1.00 11.42 H new ATOM 0 HD2 HIS A 407 -4.046 -7.592 16.205 1.00 44.15 H new ATOM 0 HE1 HIS A 407 -4.576 -10.475 13.146 1.00 62.22 H new ATOM 0 HE2 HIS A 407 -5.625 -9.345 15.231 1.00 12.12 H new ATOM 328 N ILE A 408 -1.298 -7.474 11.418 1.00 11.13 N ATOM 329 CA ILE A 408 -0.694 -8.036 10.222 1.00 0.42 C ATOM 330 C ILE A 408 0.014 -6.926 9.443 1.00 74.23 C ATOM 331 O ILE A 408 1.207 -7.022 9.163 1.00 5.32 O ATOM 332 CB ILE A 408 -1.739 -8.793 9.400 1.00 12.04 C ATOM 333 CG1 ILE A 408 -2.469 -9.827 10.260 1.00 15.15 C ATOM 334 CG2 ILE A 408 -1.106 -9.425 8.157 1.00 2.51 C ATOM 335 CD1 ILE A 408 -3.420 -10.673 9.410 1.00 13.12 C ATOM 0 H ILE A 408 -2.311 -7.576 11.473 1.00 11.13 H new ATOM 0 HA ILE A 408 0.064 -8.772 10.488 1.00 0.42 H new ATOM 0 HB ILE A 408 -2.485 -8.078 9.054 1.00 12.04 H new ATOM 0 HG12 ILE A 408 -1.743 -10.474 10.753 1.00 15.15 H new ATOM 0 HG13 ILE A 408 -3.030 -9.321 11.046 1.00 15.15 H new ATOM 0 HG21 ILE A 408 -1.870 -9.957 7.590 1.00 2.51 H new ATOM 0 HG22 ILE A 408 -0.670 -8.644 7.534 1.00 2.51 H new ATOM 0 HG23 ILE A 408 -0.327 -10.124 8.461 1.00 2.51 H new ATOM 0 HD11 ILE A 408 -3.926 -11.400 10.045 1.00 13.12 H new ATOM 0 HD12 ILE A 408 -4.159 -10.026 8.938 1.00 13.12 H new ATOM 0 HD13 ILE A 408 -2.852 -11.196 8.641 1.00 13.12 H new ATOM 346 N ALA A 409 -0.753 -5.895 9.115 1.00 75.31 N ATOM 347 CA ALA A 409 -0.213 -4.768 8.374 1.00 42.25 C ATOM 348 C ALA A 409 0.875 -4.088 9.207 1.00 43.32 C ATOM 349 O ALA A 409 1.948 -3.777 8.696 1.00 70.45 O ATOM 350 CB ALA A 409 -1.348 -3.809 8.006 1.00 43.54 C ATOM 0 H ALA A 409 -1.743 -5.817 9.349 1.00 75.31 H new ATOM 0 HA ALA A 409 0.246 -5.105 7.445 1.00 42.25 H new ATOM 0 HB1 ALA A 409 -0.944 -2.963 7.450 1.00 43.54 H new ATOM 0 HB2 ALA A 409 -2.080 -4.331 7.390 1.00 43.54 H new ATOM 0 HB3 ALA A 409 -1.829 -3.449 8.915 1.00 43.54 H new ATOM 356 N LEU A 410 0.560 -3.880 10.478 1.00 30.32 N ATOM 357 CA LEU A 410 1.498 -3.244 11.387 1.00 50.10 C ATOM 358 C LEU A 410 2.760 -4.104 11.494 1.00 41.42 C ATOM 359 O LEU A 410 3.824 -3.608 11.861 1.00 51.21 O ATOM 360 CB LEU A 410 0.831 -2.962 12.734 1.00 23.11 C ATOM 361 CG LEU A 410 -0.272 -1.901 12.726 1.00 12.20 C ATOM 362 CD1 LEU A 410 -0.556 -1.396 14.143 1.00 31.10 C ATOM 363 CD2 LEU A 410 0.074 -0.758 11.770 1.00 51.52 C ATOM 0 H LEU A 410 -0.332 -4.141 10.899 1.00 30.32 H new ATOM 0 HA LEU A 410 1.805 -2.272 11.000 1.00 50.10 H new ATOM 0 HB2 LEU A 410 0.409 -3.894 13.110 1.00 23.11 H new ATOM 0 HB3 LEU A 410 1.601 -2.652 13.441 1.00 23.11 H new ATOM 0 HG LEU A 410 -1.188 -2.363 12.358 1.00 12.20 H new ATOM 0 HD11 LEU A 410 -1.343 -0.643 14.110 1.00 31.10 H new ATOM 0 HD12 LEU A 410 -0.877 -2.229 14.769 1.00 31.10 H new ATOM 0 HD13 LEU A 410 0.350 -0.956 14.561 1.00 31.10 H new ATOM 0 HD21 LEU A 410 -0.726 -0.018 11.783 1.00 51.52 H new ATOM 0 HD22 LEU A 410 1.007 -0.290 12.085 1.00 51.52 H new ATOM 0 HD23 LEU A 410 0.188 -1.151 10.760 1.00 51.52 H new ATOM 374 N ARG A 411 2.599 -5.377 11.167 1.00 40.41 N ATOM 375 CA ARG A 411 3.712 -6.311 11.222 1.00 24.31 C ATOM 376 C ARG A 411 4.563 -6.197 9.957 1.00 73.51 C ATOM 377 O ARG A 411 5.676 -6.718 9.903 1.00 64.23 O ATOM 378 CB ARG A 411 3.216 -7.751 11.367 1.00 3.03 C ATOM 379 CG ARG A 411 3.369 -8.241 12.808 1.00 40.20 C ATOM 380 CD ARG A 411 3.630 -9.748 12.850 1.00 41.15 C ATOM 381 NE ARG A 411 2.678 -10.452 11.964 1.00 2.23 N ATOM 382 CZ ARG A 411 1.424 -10.801 12.325 1.00 30.52 C ATOM 383 NH1 ARG A 411 0.961 -10.515 13.560 1.00 72.42 N ATOM 384 NH2 ARG A 411 0.659 -11.428 11.451 1.00 21.33 N ATOM 0 H ARG A 411 1.715 -5.785 10.863 1.00 40.41 H new ATOM 0 HA ARG A 411 4.315 -6.057 12.094 1.00 24.31 H new ATOM 0 HB2 ARG A 411 2.170 -7.811 11.068 1.00 3.03 H new ATOM 0 HB3 ARG A 411 3.777 -8.402 10.696 1.00 3.03 H new ATOM 0 HG2 ARG A 411 4.191 -7.712 13.290 1.00 40.20 H new ATOM 0 HG3 ARG A 411 2.466 -8.009 13.373 1.00 40.20 H new ATOM 0 HD2 ARG A 411 4.653 -9.957 12.537 1.00 41.15 H new ATOM 0 HD3 ARG A 411 3.528 -10.115 13.871 1.00 41.15 H new ATOM 0 HE ARG A 411 2.988 -10.689 11.021 1.00 2.23 H new ATOM 0 HH11 ARG A 411 1.559 -10.031 14.230 1.00 72.42 H new ATOM 0 HH12 ARG A 411 0.013 -10.782 13.824 1.00 72.42 H new ATOM 0 HH21 ARG A 411 1.017 -11.641 10.520 1.00 21.33 H new ATOM 0 HH22 ARG A 411 -0.291 -11.699 11.706 1.00 21.33 H new ATOM 394 N VAL A 412 4.008 -5.512 8.968 1.00 52.23 N ATOM 395 CA VAL A 412 4.701 -5.323 7.705 1.00 54.12 C ATOM 396 C VAL A 412 5.405 -3.964 7.714 1.00 22.11 C ATOM 397 O VAL A 412 6.606 -3.880 7.461 1.00 21.44 O ATOM 398 CB VAL A 412 3.723 -5.482 6.540 1.00 43.34 C ATOM 399 CG1 VAL A 412 4.257 -4.802 5.278 1.00 52.13 C ATOM 400 CG2 VAL A 412 3.417 -6.958 6.279 1.00 12.43 C ATOM 0 H VAL A 412 3.085 -5.081 9.016 1.00 52.23 H new ATOM 0 HA VAL A 412 5.468 -6.087 7.573 1.00 54.12 H new ATOM 0 HB VAL A 412 2.791 -4.990 6.816 1.00 43.34 H new ATOM 0 HG11 VAL A 412 3.542 -4.930 4.465 1.00 52.13 H new ATOM 0 HG12 VAL A 412 4.400 -3.739 5.471 1.00 52.13 H new ATOM 0 HG13 VAL A 412 5.210 -5.252 4.998 1.00 52.13 H new ATOM 0 HG21 VAL A 412 2.719 -7.043 5.446 1.00 12.43 H new ATOM 0 HG22 VAL A 412 4.340 -7.483 6.034 1.00 12.43 H new ATOM 0 HG23 VAL A 412 2.973 -7.401 7.171 1.00 12.43 H new ATOM 410 N ARG A 413 4.627 -2.932 8.007 1.00 3.40 N ATOM 411 CA ARG A 413 5.160 -1.582 8.052 1.00 61.41 C ATOM 412 C ARG A 413 6.591 -1.594 8.594 1.00 63.53 C ATOM 413 O ARG A 413 7.467 -0.915 8.061 1.00 72.04 O ATOM 414 CB ARG A 413 4.297 -0.677 8.934 1.00 12.14 C ATOM 415 CG ARG A 413 2.812 -0.857 8.613 1.00 15.13 C ATOM 416 CD ARG A 413 2.020 0.407 8.956 1.00 5.42 C ATOM 417 NE ARG A 413 2.555 1.017 10.193 1.00 55.24 N ATOM 418 CZ ARG A 413 1.817 1.747 11.057 1.00 72.23 C ATOM 419 NH1 ARG A 413 0.504 1.961 10.827 1.00 42.44 N ATOM 420 NH2 ARG A 413 2.398 2.247 12.132 1.00 74.45 N ATOM 0 H ARG A 413 3.631 -3.004 8.216 1.00 3.40 H new ATOM 0 HA ARG A 413 5.155 -1.191 7.035 1.00 61.41 H new ATOM 0 HB2 ARG A 413 4.477 -0.907 9.984 1.00 12.14 H new ATOM 0 HB3 ARG A 413 4.582 0.364 8.783 1.00 12.14 H new ATOM 0 HG2 ARG A 413 2.691 -1.091 7.555 1.00 15.13 H new ATOM 0 HG3 ARG A 413 2.415 -1.703 9.174 1.00 15.13 H new ATOM 0 HD2 ARG A 413 2.081 1.119 8.133 1.00 5.42 H new ATOM 0 HD3 ARG A 413 0.966 0.162 9.088 1.00 5.42 H new ATOM 0 HE ARG A 413 3.543 0.878 10.407 1.00 55.24 H new ATOM 0 HH11 ARG A 413 0.062 1.570 9.995 1.00 42.44 H new ATOM 0 HH12 ARG A 413 -0.046 2.514 11.485 1.00 42.44 H new ATOM 0 HH21 ARG A 413 3.390 2.080 12.300 1.00 74.45 H new ATOM 0 HH22 ARG A 413 1.855 2.801 12.794 1.00 74.45 H new ATOM 430 N GLU A 414 6.785 -2.373 9.648 1.00 2.45 N ATOM 431 CA GLU A 414 8.094 -2.483 10.268 1.00 74.43 C ATOM 432 C GLU A 414 9.040 -3.288 9.373 1.00 1.51 C ATOM 433 O GLU A 414 10.060 -2.771 8.919 1.00 11.31 O ATOM 434 CB GLU A 414 7.992 -3.110 11.660 1.00 32.12 C ATOM 435 CG GLU A 414 7.098 -2.269 12.574 1.00 44.40 C ATOM 436 CD GLU A 414 7.532 -0.802 12.569 1.00 62.21 C ATOM 437 OE1 GLU A 414 6.695 0.094 12.752 1.00 2.23 O ATOM 438 OE2 GLU A 414 8.792 -0.607 12.367 1.00 10.23 O ATOM 0 H GLU A 414 6.056 -2.935 10.089 1.00 2.45 H new ATOM 0 HA GLU A 414 8.502 -1.479 10.387 1.00 74.43 H new ATOM 0 HB2 GLU A 414 7.589 -4.120 11.580 1.00 32.12 H new ATOM 0 HB3 GLU A 414 8.986 -3.197 12.098 1.00 32.12 H new ATOM 0 HG2 GLU A 414 6.062 -2.346 12.246 1.00 44.40 H new ATOM 0 HG3 GLU A 414 7.140 -2.661 13.590 1.00 44.40 H new ATOM 444 N LYS A 415 8.667 -4.539 9.147 1.00 52.50 N ATOM 445 CA LYS A 415 9.469 -5.419 8.314 1.00 44.40 C ATOM 446 C LYS A 415 10.034 -4.626 7.136 1.00 74.53 C ATOM 447 O LYS A 415 11.241 -4.636 6.896 1.00 23.12 O ATOM 448 CB LYS A 415 8.657 -6.647 7.896 1.00 33.04 C ATOM 449 CG LYS A 415 9.447 -7.935 8.135 1.00 4.13 C ATOM 450 CD LYS A 415 10.801 -7.887 7.426 1.00 75.51 C ATOM 451 CE LYS A 415 10.630 -7.998 5.909 1.00 52.53 C ATOM 452 NZ LYS A 415 10.745 -9.408 5.476 1.00 50.21 N ATOM 0 H LYS A 415 7.821 -4.964 9.526 1.00 52.50 H new ATOM 0 HA LYS A 415 10.320 -5.804 8.876 1.00 44.40 H new ATOM 0 HB2 LYS A 415 7.724 -6.679 8.459 1.00 33.04 H new ATOM 0 HB3 LYS A 415 8.391 -6.570 6.842 1.00 33.04 H new ATOM 0 HG2 LYS A 415 9.598 -8.080 9.205 1.00 4.13 H new ATOM 0 HG3 LYS A 415 8.874 -8.789 7.775 1.00 4.13 H new ATOM 0 HD2 LYS A 415 11.311 -6.955 7.671 1.00 75.51 H new ATOM 0 HD3 LYS A 415 11.432 -8.700 7.785 1.00 75.51 H new ATOM 0 HE2 LYS A 415 9.658 -7.600 5.617 1.00 52.53 H new ATOM 0 HE3 LYS A 415 11.386 -7.394 5.407 1.00 52.53 H new ATOM 0 HZ1 LYS A 415 10.865 -9.445 4.444 1.00 50.21 H new ATOM 0 HZ2 LYS A 415 11.568 -9.846 5.936 1.00 50.21 H new ATOM 0 HZ3 LYS A 415 9.883 -9.925 5.743 1.00 50.21 H new ATOM 461 N LEU A 416 9.135 -3.954 6.430 1.00 63.30 N ATOM 462 CA LEU A 416 9.530 -3.156 5.281 1.00 42.32 C ATOM 463 C LEU A 416 10.766 -2.328 5.641 1.00 22.13 C ATOM 464 O LEU A 416 11.815 -2.469 5.014 1.00 75.04 O ATOM 465 CB LEU A 416 8.352 -2.316 4.783 1.00 2.24 C ATOM 466 CG LEU A 416 7.132 -3.099 4.292 1.00 51.30 C ATOM 467 CD1 LEU A 416 5.945 -2.164 4.046 1.00 30.15 C ATOM 468 CD2 LEU A 416 7.474 -3.929 3.054 1.00 33.15 C ATOM 0 H LEU A 416 8.135 -3.946 6.632 1.00 63.30 H new ATOM 0 HA LEU A 416 9.809 -3.800 4.447 1.00 42.32 H new ATOM 0 HB2 LEU A 416 8.035 -1.656 5.590 1.00 2.24 H new ATOM 0 HB3 LEU A 416 8.702 -1.680 3.970 1.00 2.24 H new ATOM 0 HG LEU A 416 6.836 -3.798 5.075 1.00 51.30 H new ATOM 0 HD11 LEU A 416 5.091 -2.744 3.698 1.00 30.15 H new ATOM 0 HD12 LEU A 416 5.684 -1.655 4.974 1.00 30.15 H new ATOM 0 HD13 LEU A 416 6.214 -1.426 3.291 1.00 30.15 H new ATOM 0 HD21 LEU A 416 6.589 -4.475 2.726 1.00 33.15 H new ATOM 0 HD22 LEU A 416 7.810 -3.269 2.254 1.00 33.15 H new ATOM 0 HD23 LEU A 416 8.267 -4.636 3.298 1.00 33.15 H new ATOM 479 N GLU A 417 10.601 -1.485 6.650 1.00 72.42 N ATOM 480 CA GLU A 417 11.690 -0.635 7.101 1.00 32.43 C ATOM 481 C GLU A 417 13.022 -1.383 7.004 1.00 23.12 C ATOM 482 O GLU A 417 14.058 -0.778 6.733 1.00 65.52 O ATOM 483 CB GLU A 417 11.444 -0.138 8.526 1.00 12.15 C ATOM 484 CG GLU A 417 10.119 0.622 8.620 1.00 44.23 C ATOM 485 CD GLU A 417 10.289 1.923 9.407 1.00 52.22 C ATOM 486 OE1 GLU A 417 11.227 2.689 9.143 1.00 72.55 O ATOM 487 OE2 GLU A 417 9.402 2.128 10.321 1.00 12.15 O ATOM 0 H GLU A 417 9.730 -1.372 7.168 1.00 72.42 H new ATOM 0 HA GLU A 417 11.737 0.238 6.450 1.00 32.43 H new ATOM 0 HB2 GLU A 417 11.432 -0.984 9.213 1.00 12.15 H new ATOM 0 HB3 GLU A 417 12.263 0.512 8.835 1.00 12.15 H new ATOM 0 HG2 GLU A 417 9.751 0.844 7.618 1.00 44.23 H new ATOM 0 HG3 GLU A 417 9.370 -0.005 9.103 1.00 44.23 H new ATOM 493 N ALA A 418 12.950 -2.687 7.229 1.00 71.13 N ATOM 494 CA ALA A 418 14.137 -3.523 7.170 1.00 61.33 C ATOM 495 C ALA A 418 14.704 -3.497 5.749 1.00 74.43 C ATOM 496 O ALA A 418 15.872 -3.166 5.550 1.00 11.01 O ATOM 497 CB ALA A 418 13.787 -4.939 7.633 1.00 53.40 C ATOM 0 H ALA A 418 12.088 -3.185 7.452 1.00 71.13 H new ATOM 0 HA ALA A 418 14.909 -3.142 7.839 1.00 61.33 H new ATOM 0 HB1 ALA A 418 14.677 -5.567 7.589 1.00 53.40 H new ATOM 0 HB2 ALA A 418 13.417 -4.906 8.658 1.00 53.40 H new ATOM 0 HB3 ALA A 418 13.017 -5.355 6.983 1.00 53.40 H new ATOM 503 N LEU A 419 13.851 -3.850 4.800 1.00 54.15 N ATOM 504 CA LEU A 419 14.253 -3.869 3.403 1.00 4.15 C ATOM 505 C LEU A 419 14.586 -2.448 2.952 1.00 51.21 C ATOM 506 O LEU A 419 15.604 -2.222 2.299 1.00 2.12 O ATOM 507 CB LEU A 419 13.183 -4.553 2.548 1.00 43.54 C ATOM 508 CG LEU A 419 12.696 -5.915 3.043 1.00 44.13 C ATOM 509 CD1 LEU A 419 11.189 -6.069 2.831 1.00 0.31 C ATOM 510 CD2 LEU A 419 13.487 -7.052 2.393 1.00 71.23 C ATOM 0 H LEU A 419 12.884 -4.125 4.970 1.00 54.15 H new ATOM 0 HA LEU A 419 15.158 -4.462 3.275 1.00 4.15 H new ATOM 0 HB2 LEU A 419 12.323 -3.887 2.476 1.00 43.54 H new ATOM 0 HB3 LEU A 419 13.577 -4.675 1.539 1.00 43.54 H new ATOM 0 HG LEU A 419 12.877 -5.972 4.116 1.00 44.13 H new ATOM 0 HD11 LEU A 419 10.869 -7.047 3.192 1.00 0.31 H new ATOM 0 HD12 LEU A 419 10.663 -5.289 3.381 1.00 0.31 H new ATOM 0 HD13 LEU A 419 10.960 -5.981 1.769 1.00 0.31 H new ATOM 0 HD21 LEU A 419 13.119 -8.009 2.763 1.00 71.23 H new ATOM 0 HD22 LEU A 419 13.363 -7.010 1.311 1.00 71.23 H new ATOM 0 HD23 LEU A 419 14.543 -6.948 2.641 1.00 71.23 H new ATOM 521 N GLY A 420 13.709 -1.524 3.317 1.00 12.21 N ATOM 522 CA GLY A 420 13.898 -0.128 2.957 1.00 34.24 C ATOM 523 C GLY A 420 12.632 0.684 3.235 1.00 52.15 C ATOM 524 O GLY A 420 12.604 1.502 4.155 1.00 1.42 O ATOM 0 H GLY A 420 12.866 -1.714 3.858 1.00 12.21 H new ATOM 0 HA2 GLY A 420 14.733 0.287 3.522 1.00 34.24 H new ATOM 0 HA3 GLY A 420 14.159 -0.053 1.901 1.00 34.24 H new ATOM 528 N VAL A 421 11.615 0.434 2.423 1.00 65.21 N ATOM 529 CA VAL A 421 10.350 1.133 2.569 1.00 22.31 C ATOM 530 C VAL A 421 10.027 1.287 4.058 1.00 32.21 C ATOM 531 O VAL A 421 10.215 0.354 4.837 1.00 71.52 O ATOM 532 CB VAL A 421 9.254 0.401 1.793 1.00 70.52 C ATOM 533 CG1 VAL A 421 9.491 -1.111 1.804 1.00 63.21 C ATOM 534 CG2 VAL A 421 7.868 0.743 2.343 1.00 63.03 C ATOM 0 H VAL A 421 11.642 -0.244 1.661 1.00 65.21 H new ATOM 0 HA VAL A 421 10.416 2.135 2.144 1.00 22.31 H new ATOM 0 HB VAL A 421 9.295 0.739 0.758 1.00 70.52 H new ATOM 0 HG11 VAL A 421 8.698 -1.608 1.245 1.00 63.21 H new ATOM 0 HG12 VAL A 421 10.453 -1.332 1.342 1.00 63.21 H new ATOM 0 HG13 VAL A 421 9.491 -1.472 2.833 1.00 63.21 H new ATOM 0 HG21 VAL A 421 7.108 0.209 1.773 1.00 63.03 H new ATOM 0 HG22 VAL A 421 7.809 0.448 3.391 1.00 63.03 H new ATOM 0 HG23 VAL A 421 7.698 1.816 2.258 1.00 63.03 H new ATOM 544 N PRO A 422 9.533 2.502 4.416 1.00 55.12 N ATOM 545 CA PRO A 422 9.182 2.791 5.795 1.00 2.32 C ATOM 546 C PRO A 422 7.870 2.105 6.181 1.00 5.12 C ATOM 547 O PRO A 422 7.397 1.216 5.475 1.00 34.34 O ATOM 548 CB PRO A 422 9.104 4.306 5.874 1.00 72.41 C ATOM 549 CG PRO A 422 8.958 4.791 4.440 1.00 13.12 C ATOM 550 CD PRO A 422 9.296 3.631 3.519 1.00 30.13 C ATOM 0 HA PRO A 422 9.915 2.407 6.504 1.00 2.32 H new ATOM 0 HB2 PRO A 422 8.256 4.622 6.482 1.00 72.41 H new ATOM 0 HB3 PRO A 422 10.000 4.720 6.337 1.00 72.41 H new ATOM 0 HG2 PRO A 422 7.942 5.140 4.257 1.00 13.12 H new ATOM 0 HG3 PRO A 422 9.623 5.634 4.252 1.00 13.12 H new ATOM 0 HD2 PRO A 422 8.479 3.423 2.828 1.00 30.13 H new ATOM 0 HD3 PRO A 422 10.177 3.849 2.915 1.00 30.13 H new ATOM 555 N ASP A 423 7.319 2.543 7.304 1.00 44.42 N ATOM 556 CA ASP A 423 6.070 1.983 7.794 1.00 14.21 C ATOM 557 C ASP A 423 4.979 2.182 6.739 1.00 64.42 C ATOM 558 O ASP A 423 4.209 1.265 6.459 1.00 14.23 O ATOM 559 CB ASP A 423 5.619 2.680 9.079 1.00 74.20 C ATOM 560 CG ASP A 423 5.550 4.206 8.995 1.00 62.34 C ATOM 561 OD1 ASP A 423 6.581 4.896 9.038 1.00 11.40 O ATOM 562 OD2 ASP A 423 4.361 4.693 8.882 1.00 74.23 O ATOM 0 H ASP A 423 7.715 3.279 7.889 1.00 44.42 H new ATOM 0 HA ASP A 423 6.232 0.924 7.997 1.00 14.21 H new ATOM 0 HB2 ASP A 423 4.635 2.301 9.354 1.00 74.20 H new ATOM 0 HB3 ASP A 423 6.302 2.406 9.883 1.00 74.20 H new ATOM 567 N GLY A 424 4.948 3.385 6.186 1.00 73.54 N ATOM 568 CA GLY A 424 3.963 3.716 5.170 1.00 72.41 C ATOM 569 C GLY A 424 2.619 4.077 5.805 1.00 1.14 C ATOM 570 O GLY A 424 2.398 5.226 6.186 1.00 3.32 O ATOM 0 H GLY A 424 5.589 4.143 6.422 1.00 73.54 H new ATOM 0 HA2 GLY A 424 4.322 4.552 4.570 1.00 72.41 H new ATOM 0 HA3 GLY A 424 3.834 2.870 4.494 1.00 72.41 H new ATOM 574 N ALA A 425 1.757 3.075 5.899 1.00 10.40 N ATOM 575 CA ALA A 425 0.441 3.273 6.481 1.00 3.01 C ATOM 576 C ALA A 425 -0.468 2.109 6.082 1.00 50.34 C ATOM 577 O ALA A 425 -0.052 1.216 5.347 1.00 25.31 O ATOM 578 CB ALA A 425 -0.115 4.628 6.036 1.00 24.11 C ATOM 0 H ALA A 425 1.945 2.124 5.582 1.00 10.40 H new ATOM 0 HA ALA A 425 0.500 3.287 7.569 1.00 3.01 H new ATOM 0 HB1 ALA A 425 -1.103 4.777 6.472 1.00 24.11 H new ATOM 0 HB2 ALA A 425 0.553 5.422 6.369 1.00 24.11 H new ATOM 0 HB3 ALA A 425 -0.192 4.651 4.949 1.00 24.11 H new ATOM 584 N THR A 426 -1.694 2.158 6.585 1.00 73.42 N ATOM 585 CA THR A 426 -2.666 1.120 6.290 1.00 22.43 C ATOM 586 C THR A 426 -4.087 1.680 6.371 1.00 33.42 C ATOM 587 O THR A 426 -4.585 1.962 7.459 1.00 72.23 O ATOM 588 CB THR A 426 -2.416 -0.047 7.249 1.00 11.22 C ATOM 589 OG1 THR A 426 -3.103 0.330 8.440 1.00 32.33 O ATOM 590 CG2 THR A 426 -0.952 -0.148 7.680 1.00 31.40 C ATOM 0 H THR A 426 -2.035 2.901 7.195 1.00 73.42 H new ATOM 0 HA THR A 426 -2.554 0.752 5.270 1.00 22.43 H new ATOM 0 HB THR A 426 -2.719 -0.979 6.773 1.00 11.22 H new ATOM 0 HG1 THR A 426 -3.277 1.294 8.426 1.00 32.33 H new ATOM 0 HG21 THR A 426 -0.830 -0.992 8.359 1.00 31.40 H new ATOM 0 HG22 THR A 426 -0.323 -0.295 6.802 1.00 31.40 H new ATOM 0 HG23 THR A 426 -0.658 0.771 8.187 1.00 31.40 H new ATOM 598 N PHE A 427 -4.699 1.824 5.205 1.00 23.33 N ATOM 599 CA PHE A 427 -6.053 2.345 5.131 1.00 5.41 C ATOM 600 C PHE A 427 -7.075 1.208 5.062 1.00 2.21 C ATOM 601 O PHE A 427 -7.378 0.705 3.982 1.00 21.33 O ATOM 602 CB PHE A 427 -6.144 3.173 3.847 1.00 62.43 C ATOM 603 CG PHE A 427 -7.575 3.455 3.388 1.00 20.25 C ATOM 604 CD1 PHE A 427 -8.579 3.539 4.302 1.00 15.30 C ATOM 605 CD2 PHE A 427 -7.845 3.618 2.065 1.00 71.33 C ATOM 606 CE1 PHE A 427 -9.908 3.801 3.874 1.00 31.35 C ATOM 607 CE2 PHE A 427 -9.173 3.879 1.637 1.00 4.12 C ATOM 608 CZ PHE A 427 -10.177 3.965 2.552 1.00 72.43 C ATOM 0 H PHE A 427 -4.282 1.589 4.304 1.00 23.33 H new ATOM 0 HA PHE A 427 -6.271 2.941 6.017 1.00 5.41 H new ATOM 0 HB2 PHE A 427 -5.630 4.121 4.001 1.00 62.43 H new ATOM 0 HB3 PHE A 427 -5.615 2.649 3.051 1.00 62.43 H new ATOM 0 HD1 PHE A 427 -8.366 3.407 5.352 1.00 15.30 H new ATOM 0 HD2 PHE A 427 -7.048 3.549 1.339 1.00 71.33 H new ATOM 0 HE1 PHE A 427 -10.705 3.870 4.600 1.00 31.35 H new ATOM 0 HE2 PHE A 427 -9.387 4.009 0.586 1.00 4.12 H new ATOM 0 HZ PHE A 427 -11.188 4.164 2.227 1.00 72.43 H new ATOM 823 N GLN A 443 -7.021 7.385 -3.588 1.00 5.41 N ATOM 824 CA GLN A 443 -6.055 7.915 -4.535 1.00 44.15 C ATOM 825 C GLN A 443 -5.072 8.847 -3.823 1.00 53.34 C ATOM 826 O GLN A 443 -3.993 9.129 -4.342 1.00 23.10 O ATOM 827 CB GLN A 443 -6.756 8.633 -5.689 1.00 32.12 C ATOM 828 CG GLN A 443 -7.924 9.481 -5.178 1.00 22.03 C ATOM 829 CD GLN A 443 -8.258 10.602 -6.164 1.00 1.44 C ATOM 830 OE1 GLN A 443 -8.434 11.753 -5.800 1.00 2.14 O ATOM 831 NE2 GLN A 443 -8.340 10.202 -7.432 1.00 4.00 N ATOM 0 HA GLN A 443 -5.494 7.082 -4.958 1.00 44.15 H new ATOM 0 HB2 GLN A 443 -6.043 9.268 -6.214 1.00 32.12 H new ATOM 0 HB3 GLN A 443 -7.121 7.901 -6.410 1.00 32.12 H new ATOM 0 HG2 GLN A 443 -8.800 8.849 -5.030 1.00 22.03 H new ATOM 0 HG3 GLN A 443 -7.671 9.908 -4.208 1.00 22.03 H new ATOM 0 HE21 GLN A 443 -8.181 9.223 -7.669 1.00 4.00 H new ATOM 0 HE22 GLN A 443 -8.562 10.875 -8.166 1.00 4.00 H new ATOM 838 N ASP A 444 -5.481 9.301 -2.648 1.00 54.20 N ATOM 839 CA ASP A 444 -4.650 10.197 -1.861 1.00 62.12 C ATOM 840 C ASP A 444 -3.267 9.570 -1.675 1.00 74.43 C ATOM 841 O ASP A 444 -2.259 10.275 -1.659 1.00 75.42 O ATOM 842 CB ASP A 444 -5.253 10.433 -0.475 1.00 10.41 C ATOM 843 CG ASP A 444 -4.624 11.579 0.317 1.00 40.54 C ATOM 844 OD1 ASP A 444 -5.025 12.746 0.181 1.00 64.33 O ATOM 845 OD2 ASP A 444 -3.671 11.234 1.113 1.00 25.31 O ATOM 0 H ASP A 444 -6.377 9.065 -2.221 1.00 54.20 H new ATOM 0 HA ASP A 444 -4.583 11.147 -2.391 1.00 62.12 H new ATOM 0 HB2 ASP A 444 -6.319 10.632 -0.588 1.00 10.41 H new ATOM 0 HB3 ASP A 444 -5.160 9.516 0.106 1.00 10.41 H new ATOM 850 N ALA A 445 -3.263 8.253 -1.540 1.00 4.53 N ATOM 851 CA ALA A 445 -2.021 7.524 -1.355 1.00 33.44 C ATOM 852 C ALA A 445 -1.283 7.433 -2.693 1.00 41.45 C ATOM 853 O ALA A 445 -0.058 7.318 -2.725 1.00 2.41 O ATOM 854 CB ALA A 445 -2.321 6.145 -0.762 1.00 22.52 C ATOM 0 H ALA A 445 -4.101 7.671 -1.555 1.00 4.53 H new ATOM 0 HA ALA A 445 -1.371 8.047 -0.654 1.00 33.44 H new ATOM 0 HB1 ALA A 445 -1.389 5.598 -0.623 1.00 22.52 H new ATOM 0 HB2 ALA A 445 -2.819 6.263 0.200 1.00 22.52 H new ATOM 0 HB3 ALA A 445 -2.969 5.590 -1.440 1.00 22.52 H new ATOM 860 N ILE A 446 -2.060 7.492 -3.765 1.00 32.45 N ATOM 861 CA ILE A 446 -1.495 7.419 -5.102 1.00 2.43 C ATOM 862 C ILE A 446 -0.874 8.770 -5.464 1.00 23.21 C ATOM 863 O ILE A 446 -0.169 8.885 -6.466 1.00 42.45 O ATOM 864 CB ILE A 446 -2.549 6.939 -6.102 1.00 34.42 C ATOM 865 CG1 ILE A 446 -2.461 5.425 -6.308 1.00 15.11 C ATOM 866 CG2 ILE A 446 -2.440 7.703 -7.423 1.00 35.11 C ATOM 867 CD1 ILE A 446 -3.815 4.850 -6.731 1.00 22.33 C ATOM 0 H ILE A 446 -3.075 7.589 -3.735 1.00 32.45 H new ATOM 0 HA ILE A 446 -0.694 6.681 -5.138 1.00 2.43 H new ATOM 0 HB ILE A 446 -3.534 7.151 -5.687 1.00 34.42 H new ATOM 0 HG12 ILE A 446 -1.713 5.201 -7.068 1.00 15.11 H new ATOM 0 HG13 ILE A 446 -2.131 4.947 -5.385 1.00 15.11 H new ATOM 0 HG21 ILE A 446 -3.200 7.342 -8.116 1.00 35.11 H new ATOM 0 HG22 ILE A 446 -2.590 8.767 -7.241 1.00 35.11 H new ATOM 0 HG23 ILE A 446 -1.452 7.545 -7.854 1.00 35.11 H new ATOM 0 HD11 ILE A 446 -3.725 3.773 -6.871 1.00 22.33 H new ATOM 0 HD12 ILE A 446 -4.555 5.055 -5.957 1.00 22.33 H new ATOM 0 HD13 ILE A 446 -4.130 5.312 -7.666 1.00 22.33 H new ATOM 878 N ASP A 447 -1.160 9.758 -4.627 1.00 74.31 N ATOM 879 CA ASP A 447 -0.639 11.096 -4.847 1.00 73.44 C ATOM 880 C ASP A 447 0.512 11.357 -3.871 1.00 25.21 C ATOM 881 O ASP A 447 1.584 11.804 -4.275 1.00 2.53 O ATOM 882 CB ASP A 447 -1.715 12.154 -4.602 1.00 63.00 C ATOM 883 CG ASP A 447 -1.186 13.552 -4.271 1.00 13.13 C ATOM 884 OD1 ASP A 447 -0.896 13.866 -3.108 1.00 14.31 O ATOM 885 OD2 ASP A 447 -1.075 14.345 -5.282 1.00 12.04 O ATOM 0 H ASP A 447 -1.745 9.658 -3.797 1.00 74.31 H new ATOM 0 HA ASP A 447 -0.300 11.160 -5.881 1.00 73.44 H new ATOM 0 HB2 ASP A 447 -2.345 12.221 -5.489 1.00 63.00 H new ATOM 0 HB3 ASP A 447 -2.352 11.820 -3.783 1.00 63.00 H new ATOM 890 N HIS A 448 0.249 11.066 -2.606 1.00 35.41 N ATOM 891 CA HIS A 448 1.248 11.263 -1.570 1.00 21.03 C ATOM 892 C HIS A 448 2.110 10.005 -1.441 1.00 20.43 C ATOM 893 O HIS A 448 3.335 10.077 -1.516 1.00 23.44 O ATOM 894 CB HIS A 448 0.590 11.667 -0.249 1.00 51.20 C ATOM 895 CG HIS A 448 0.005 10.511 0.525 1.00 21.51 C ATOM 896 ND1 HIS A 448 -1.358 10.319 0.670 1.00 3.13 N ATOM 897 CD2 HIS A 448 0.610 9.487 1.192 1.00 63.11 C ATOM 898 CE1 HIS A 448 -1.552 9.227 1.397 1.00 30.32 C ATOM 899 NE2 HIS A 448 -0.331 8.713 1.719 1.00 42.14 N ATOM 0 H HIS A 448 -0.642 10.695 -2.275 1.00 35.41 H new ATOM 0 HA HIS A 448 1.906 12.086 -1.848 1.00 21.03 H new ATOM 0 HB2 HIS A 448 1.329 12.171 0.374 1.00 51.20 H new ATOM 0 HB3 HIS A 448 -0.200 12.390 -0.455 1.00 51.20 H new ATOM 0 HD1 HIS A 448 -2.089 10.916 0.283 1.00 3.13 H new ATOM 0 HD2 HIS A 448 1.675 9.332 1.277 1.00 63.11 H new ATOM 0 HE1 HIS A 448 -2.509 8.817 1.684 1.00 30.32 H new ATOM 906 N SER A 449 1.434 8.882 -1.250 1.00 20.15 N ATOM 907 CA SER A 449 2.123 7.609 -1.110 1.00 54.51 C ATOM 908 C SER A 449 2.716 7.186 -2.456 1.00 63.15 C ATOM 909 O SER A 449 2.192 7.541 -3.510 1.00 3.53 O ATOM 910 CB SER A 449 1.179 6.527 -0.583 1.00 50.51 C ATOM 911 OG SER A 449 0.956 5.498 -1.543 1.00 5.02 O ATOM 0 H SER A 449 0.417 8.826 -1.189 1.00 20.15 H new ATOM 0 HA SER A 449 2.929 7.733 -0.387 1.00 54.51 H new ATOM 0 HB2 SER A 449 1.598 6.092 0.324 1.00 50.51 H new ATOM 0 HB3 SER A 449 0.226 6.980 -0.309 1.00 50.51 H new ATOM 0 HG SER A 449 0.501 5.874 -2.325 1.00 5.02 H new ATOM 916 N ALA A 450 3.804 6.433 -2.375 1.00 72.04 N ATOM 917 CA ALA A 450 4.475 5.957 -3.573 1.00 62.31 C ATOM 918 C ALA A 450 3.570 4.960 -4.298 1.00 53.23 C ATOM 919 O ALA A 450 2.873 5.323 -5.244 1.00 32.22 O ATOM 920 CB ALA A 450 5.826 5.348 -3.193 1.00 23.20 C ATOM 0 H ALA A 450 4.237 6.141 -1.499 1.00 72.04 H new ATOM 0 HA ALA A 450 4.670 6.783 -4.257 1.00 62.31 H new ATOM 0 HB1 ALA A 450 6.330 4.991 -4.091 1.00 23.20 H new ATOM 0 HB2 ALA A 450 6.443 6.105 -2.708 1.00 23.20 H new ATOM 0 HB3 ALA A 450 5.670 4.514 -2.509 1.00 23.20 H new ATOM 926 N PHE A 451 3.609 3.723 -3.826 1.00 53.50 N ATOM 927 CA PHE A 451 2.800 2.671 -4.418 1.00 1.44 C ATOM 928 C PHE A 451 1.837 2.075 -3.389 1.00 63.41 C ATOM 929 O PHE A 451 2.232 1.783 -2.260 1.00 54.44 O ATOM 930 CB PHE A 451 3.762 1.580 -4.891 1.00 5.24 C ATOM 931 CG PHE A 451 4.787 2.057 -5.920 1.00 54.14 C ATOM 932 CD1 PHE A 451 4.534 3.163 -6.669 1.00 60.25 C ATOM 933 CD2 PHE A 451 5.952 1.375 -6.088 1.00 25.20 C ATOM 934 CE1 PHE A 451 5.487 3.608 -7.624 1.00 30.02 C ATOM 935 CE2 PHE A 451 6.904 1.819 -7.043 1.00 45.02 C ATOM 936 CZ PHE A 451 6.651 2.925 -7.791 1.00 72.33 C ATOM 0 H PHE A 451 4.188 3.425 -3.041 1.00 53.50 H new ATOM 0 HA PHE A 451 2.207 3.075 -5.239 1.00 1.44 H new ATOM 0 HB2 PHE A 451 4.290 1.177 -4.027 1.00 5.24 H new ATOM 0 HB3 PHE A 451 3.184 0.762 -5.321 1.00 5.24 H new ATOM 0 HD1 PHE A 451 3.608 3.704 -6.538 1.00 60.25 H new ATOM 0 HD2 PHE A 451 6.153 0.495 -5.495 1.00 25.20 H new ATOM 0 HE1 PHE A 451 5.287 4.488 -8.217 1.00 30.02 H new ATOM 0 HE2 PHE A 451 7.829 1.278 -7.175 1.00 45.02 H new ATOM 0 HZ PHE A 451 7.375 3.262 -8.518 1.00 72.33 H new ATOM 945 N ILE A 452 0.594 1.910 -3.815 1.00 4.13 N ATOM 946 CA ILE A 452 -0.428 1.353 -2.943 1.00 13.41 C ATOM 947 C ILE A 452 -0.152 -0.136 -2.727 1.00 1.12 C ATOM 948 O ILE A 452 0.140 -0.861 -3.677 1.00 62.11 O ATOM 949 CB ILE A 452 -1.823 1.645 -3.500 1.00 33.31 C ATOM 950 CG1 ILE A 452 -1.977 3.128 -3.845 1.00 23.31 C ATOM 951 CG2 ILE A 452 -2.910 1.165 -2.536 1.00 53.44 C ATOM 952 CD1 ILE A 452 -2.030 3.983 -2.578 1.00 62.45 C ATOM 0 H ILE A 452 0.270 2.152 -4.752 1.00 4.13 H new ATOM 0 HA ILE A 452 -0.394 1.829 -1.963 1.00 13.41 H new ATOM 0 HB ILE A 452 -1.944 1.085 -4.427 1.00 33.31 H new ATOM 0 HG12 ILE A 452 -1.143 3.448 -4.469 1.00 23.31 H new ATOM 0 HG13 ILE A 452 -2.887 3.277 -4.427 1.00 23.31 H new ATOM 0 HG21 ILE A 452 -3.892 1.385 -2.956 1.00 53.44 H new ATOM 0 HG22 ILE A 452 -2.813 0.090 -2.384 1.00 53.44 H new ATOM 0 HG23 ILE A 452 -2.801 1.678 -1.580 1.00 53.44 H new ATOM 0 HD11 ILE A 452 -2.140 5.032 -2.852 1.00 62.45 H new ATOM 0 HD12 ILE A 452 -2.879 3.676 -1.967 1.00 62.45 H new ATOM 0 HD13 ILE A 452 -1.109 3.850 -2.011 1.00 62.45 H new ATOM 963 N ILE A 453 -0.255 -0.548 -1.472 1.00 71.41 N ATOM 964 CA ILE A 453 -0.019 -1.938 -1.118 1.00 15.23 C ATOM 965 C ILE A 453 -1.351 -2.600 -0.759 1.00 64.10 C ATOM 966 O ILE A 453 -1.943 -2.290 0.273 1.00 51.43 O ATOM 967 CB ILE A 453 1.036 -2.039 -0.015 1.00 13.15 C ATOM 968 CG1 ILE A 453 2.447 -2.059 -0.606 1.00 53.41 C ATOM 969 CG2 ILE A 453 0.774 -3.249 0.884 1.00 75.30 C ATOM 970 CD1 ILE A 453 3.482 -1.611 0.428 1.00 64.03 C ATOM 0 H ILE A 453 -0.499 0.056 -0.687 1.00 71.41 H new ATOM 0 HA ILE A 453 0.391 -2.484 -1.968 1.00 15.23 H new ATOM 0 HB ILE A 453 0.962 -1.150 0.611 1.00 13.15 H new ATOM 0 HG12 ILE A 453 2.686 -3.065 -0.952 1.00 53.41 H new ATOM 0 HG13 ILE A 453 2.490 -1.404 -1.476 1.00 53.41 H new ATOM 0 HG21 ILE A 453 1.538 -3.298 1.660 1.00 75.30 H new ATOM 0 HG22 ILE A 453 -0.208 -3.152 1.347 1.00 75.30 H new ATOM 0 HG23 ILE A 453 0.805 -4.160 0.286 1.00 75.30 H new ATOM 0 HD11 ILE A 453 4.476 -1.635 -0.018 1.00 64.03 H new ATOM 0 HD12 ILE A 453 3.255 -0.596 0.754 1.00 64.03 H new ATOM 0 HD13 ILE A 453 3.454 -2.283 1.286 1.00 64.03 H new ATOM 981 N LEU A 454 -1.781 -3.500 -1.630 1.00 10.24 N ATOM 982 CA LEU A 454 -3.032 -4.209 -1.418 1.00 44.12 C ATOM 983 C LEU A 454 -2.764 -5.475 -0.602 1.00 21.42 C ATOM 984 O LEU A 454 -2.194 -6.438 -1.115 1.00 23.13 O ATOM 985 CB LEU A 454 -3.732 -4.474 -2.752 1.00 60.23 C ATOM 986 CG LEU A 454 -4.012 -3.244 -3.617 1.00 54.43 C ATOM 987 CD1 LEU A 454 -5.174 -3.503 -4.578 1.00 11.12 C ATOM 988 CD2 LEU A 454 -4.252 -2.006 -2.750 1.00 61.13 C ATOM 0 H LEU A 454 -1.286 -3.755 -2.484 1.00 10.24 H new ATOM 0 HA LEU A 454 -3.723 -3.596 -0.839 1.00 44.12 H new ATOM 0 HB2 LEU A 454 -3.121 -5.168 -3.329 1.00 60.23 H new ATOM 0 HB3 LEU A 454 -4.679 -4.975 -2.550 1.00 60.23 H new ATOM 0 HG LEU A 454 -3.129 -3.046 -4.224 1.00 54.43 H new ATOM 0 HD11 LEU A 454 -5.352 -2.613 -5.181 1.00 11.12 H new ATOM 0 HD12 LEU A 454 -4.927 -4.340 -5.231 1.00 11.12 H new ATOM 0 HD13 LEU A 454 -6.072 -3.741 -4.008 1.00 11.12 H new ATOM 0 HD21 LEU A 454 -4.449 -1.146 -3.390 1.00 61.13 H new ATOM 0 HD22 LEU A 454 -5.110 -2.178 -2.100 1.00 61.13 H new ATOM 0 HD23 LEU A 454 -3.369 -1.811 -2.142 1.00 61.13 H new ATOM 999 N LEU A 455 -3.184 -5.434 0.653 1.00 5.44 N ATOM 1000 CA LEU A 455 -2.996 -6.566 1.544 1.00 25.44 C ATOM 1001 C LEU A 455 -4.002 -7.662 1.188 1.00 33.35 C ATOM 1002 O LEU A 455 -5.027 -7.810 1.853 1.00 75.23 O ATOM 1003 CB LEU A 455 -3.068 -6.117 3.005 1.00 64.42 C ATOM 1004 CG LEU A 455 -2.340 -7.005 4.016 1.00 61.12 C ATOM 1005 CD1 LEU A 455 -0.962 -7.415 3.494 1.00 22.14 C ATOM 1006 CD2 LEU A 455 -2.254 -6.322 5.383 1.00 10.52 C ATOM 0 H LEU A 455 -3.655 -4.633 1.075 1.00 5.44 H new ATOM 0 HA LEU A 455 -2.001 -6.991 1.414 1.00 25.44 H new ATOM 0 HB2 LEU A 455 -2.659 -5.109 3.075 1.00 64.42 H new ATOM 0 HB3 LEU A 455 -4.117 -6.056 3.294 1.00 64.42 H new ATOM 0 HG LEU A 455 -2.920 -7.919 4.147 1.00 61.12 H new ATOM 0 HD11 LEU A 455 -0.466 -8.046 4.232 1.00 22.14 H new ATOM 0 HD12 LEU A 455 -1.076 -7.968 2.562 1.00 22.14 H new ATOM 0 HD13 LEU A 455 -0.361 -6.524 3.316 1.00 22.14 H new ATOM 0 HD21 LEU A 455 -1.732 -6.974 6.083 1.00 10.52 H new ATOM 0 HD22 LEU A 455 -1.709 -5.383 5.287 1.00 10.52 H new ATOM 0 HD23 LEU A 455 -3.259 -6.122 5.754 1.00 10.52 H new ATOM 1017 N LEU A 456 -3.674 -8.404 0.141 1.00 34.22 N ATOM 1018 CA LEU A 456 -4.536 -9.482 -0.312 1.00 14.44 C ATOM 1019 C LEU A 456 -4.629 -10.548 0.781 1.00 25.14 C ATOM 1020 O LEU A 456 -3.808 -11.464 0.834 1.00 53.25 O ATOM 1021 CB LEU A 456 -4.055 -10.025 -1.659 1.00 71.21 C ATOM 1022 CG LEU A 456 -3.703 -8.976 -2.717 1.00 22.13 C ATOM 1023 CD1 LEU A 456 -3.805 -9.563 -4.126 1.00 70.53 C ATOM 1024 CD2 LEU A 456 -4.564 -7.723 -2.554 1.00 54.41 C ATOM 0 H LEU A 456 -2.823 -8.280 -0.407 1.00 34.22 H new ATOM 0 HA LEU A 456 -5.547 -9.112 -0.486 1.00 14.44 H new ATOM 0 HB2 LEU A 456 -3.176 -10.646 -1.485 1.00 71.21 H new ATOM 0 HB3 LEU A 456 -4.830 -10.675 -2.064 1.00 71.21 H new ATOM 0 HG LEU A 456 -2.666 -8.675 -2.568 1.00 22.13 H new ATOM 0 HD11 LEU A 456 -3.550 -8.797 -4.859 1.00 70.53 H new ATOM 0 HD12 LEU A 456 -3.115 -10.401 -4.222 1.00 70.53 H new ATOM 0 HD13 LEU A 456 -4.823 -9.910 -4.303 1.00 70.53 H new ATOM 0 HD21 LEU A 456 -4.294 -6.994 -3.318 1.00 54.41 H new ATOM 0 HD22 LEU A 456 -5.616 -7.988 -2.661 1.00 54.41 H new ATOM 0 HD23 LEU A 456 -4.397 -7.293 -1.567 1.00 54.41 H new ATOM 1035 N THR A 457 -5.636 -10.395 1.629 1.00 24.31 N ATOM 1036 CA THR A 457 -5.847 -11.334 2.719 1.00 75.51 C ATOM 1037 C THR A 457 -7.288 -11.848 2.708 1.00 53.42 C ATOM 1038 O THR A 457 -8.199 -11.142 2.278 1.00 43.03 O ATOM 1039 CB THR A 457 -5.459 -10.636 4.023 1.00 3.10 C ATOM 1040 OG1 THR A 457 -6.334 -9.514 4.091 1.00 54.33 O ATOM 1041 CG2 THR A 457 -4.061 -10.017 3.964 1.00 40.53 C ATOM 0 H THR A 457 -6.315 -9.635 1.584 1.00 24.31 H new ATOM 0 HA THR A 457 -5.220 -12.219 2.608 1.00 75.51 H new ATOM 0 HB THR A 457 -5.503 -11.352 4.844 1.00 3.10 H new ATOM 0 HG1 THR A 457 -6.233 -9.072 4.960 1.00 54.33 H new ATOM 0 HG21 THR A 457 -3.836 -9.535 4.915 1.00 40.53 H new ATOM 0 HG22 THR A 457 -3.325 -10.798 3.770 1.00 40.53 H new ATOM 0 HG23 THR A 457 -4.024 -9.277 3.164 1.00 40.53 H new ATOM 1049 N SER A 458 -7.449 -13.072 3.187 1.00 72.52 N ATOM 1050 CA SER A 458 -8.764 -13.689 3.239 1.00 41.11 C ATOM 1051 C SER A 458 -9.702 -12.847 4.107 1.00 11.22 C ATOM 1052 O SER A 458 -10.919 -13.022 4.060 1.00 22.02 O ATOM 1053 CB SER A 458 -8.681 -15.117 3.780 1.00 33.23 C ATOM 1054 OG SER A 458 -8.113 -15.163 5.086 1.00 4.30 O ATOM 0 H SER A 458 -6.691 -13.654 3.543 1.00 72.52 H new ATOM 0 HA SER A 458 -9.161 -13.736 2.225 1.00 41.11 H new ATOM 0 HB2 SER A 458 -9.679 -15.554 3.804 1.00 33.23 H new ATOM 0 HB3 SER A 458 -8.082 -15.726 3.103 1.00 33.23 H new ATOM 0 HG SER A 458 -7.407 -15.842 5.112 1.00 4.30 H new ATOM 1059 N ASN A 459 -9.101 -11.951 4.876 1.00 23.42 N ATOM 1060 CA ASN A 459 -9.869 -11.083 5.752 1.00 43.04 C ATOM 1061 C ASN A 459 -10.215 -9.793 5.007 1.00 22.21 C ATOM 1062 O ASN A 459 -11.149 -9.086 5.382 1.00 5.13 O ATOM 1063 CB ASN A 459 -9.064 -10.708 6.998 1.00 42.13 C ATOM 1064 CG ASN A 459 -9.181 -11.791 8.073 1.00 20.13 C ATOM 1065 OD1 ASN A 459 -8.326 -12.648 8.222 1.00 61.54 O ATOM 1066 ND2 ASN A 459 -10.284 -11.705 8.810 1.00 13.02 N ATOM 0 H ASN A 459 -8.092 -11.807 4.911 1.00 23.42 H new ATOM 0 HA ASN A 459 -10.770 -11.617 6.052 1.00 43.04 H new ATOM 0 HB2 ASN A 459 -8.017 -10.568 6.730 1.00 42.13 H new ATOM 0 HB3 ASN A 459 -9.422 -9.757 7.394 1.00 42.13 H new ATOM 0 HD21 ASN A 459 -10.455 -12.382 9.553 1.00 13.02 H new ATOM 0 HD22 ASN A 459 -10.960 -10.962 8.632 1.00 13.02 H new ATOM 1072 N PHE A 460 -9.443 -9.523 3.963 1.00 23.21 N ATOM 1073 CA PHE A 460 -9.657 -8.330 3.162 1.00 24.30 C ATOM 1074 C PHE A 460 -10.166 -8.691 1.765 1.00 61.52 C ATOM 1075 O PHE A 460 -10.211 -9.866 1.402 1.00 41.21 O ATOM 1076 CB PHE A 460 -8.303 -7.630 3.033 1.00 42.54 C ATOM 1077 CG PHE A 460 -8.340 -6.353 2.191 1.00 25.22 C ATOM 1078 CD1 PHE A 460 -8.965 -5.243 2.666 1.00 53.52 C ATOM 1079 CD2 PHE A 460 -7.748 -6.329 0.968 1.00 60.33 C ATOM 1080 CE1 PHE A 460 -9.001 -4.057 1.885 1.00 30.33 C ATOM 1081 CE2 PHE A 460 -7.782 -5.144 0.186 1.00 22.02 C ATOM 1082 CZ PHE A 460 -8.409 -4.033 0.660 1.00 65.42 C ATOM 0 H PHE A 460 -8.669 -10.111 3.654 1.00 23.21 H new ATOM 0 HA PHE A 460 -10.402 -7.692 3.637 1.00 24.30 H new ATOM 0 HB2 PHE A 460 -7.936 -7.385 4.030 1.00 42.54 H new ATOM 0 HB3 PHE A 460 -7.588 -8.324 2.591 1.00 42.54 H new ATOM 0 HD1 PHE A 460 -9.435 -5.263 3.638 1.00 53.52 H new ATOM 0 HD2 PHE A 460 -7.252 -7.211 0.591 1.00 60.33 H new ATOM 0 HE1 PHE A 460 -9.498 -3.176 2.263 1.00 30.33 H new ATOM 0 HE2 PHE A 460 -7.310 -5.124 -0.785 1.00 22.02 H new ATOM 0 HZ PHE A 460 -8.437 -3.133 0.064 1.00 65.42 H new ATOM 1091 N ASP A 461 -10.537 -7.660 1.021 1.00 74.20 N ATOM 1092 CA ASP A 461 -11.041 -7.854 -0.327 1.00 31.33 C ATOM 1093 C ASP A 461 -10.225 -6.999 -1.300 1.00 31.14 C ATOM 1094 O ASP A 461 -10.016 -5.811 -1.062 1.00 61.15 O ATOM 1095 CB ASP A 461 -12.506 -7.426 -0.436 1.00 63.34 C ATOM 1096 CG ASP A 461 -12.896 -6.232 0.439 1.00 34.02 C ATOM 1097 OD1 ASP A 461 -12.418 -6.087 1.573 1.00 33.43 O ATOM 1098 OD2 ASP A 461 -13.740 -5.418 -0.098 1.00 21.22 O ATOM 0 H ASP A 461 -10.499 -6.688 1.326 1.00 74.20 H new ATOM 0 HA ASP A 461 -10.957 -8.914 -0.568 1.00 31.33 H new ATOM 0 HB2 ASP A 461 -12.721 -7.181 -1.476 1.00 63.34 H new ATOM 0 HB3 ASP A 461 -13.138 -8.274 -0.171 1.00 63.34 H new ATOM 1103 N CYS A 462 -9.789 -7.637 -2.376 1.00 13.12 N ATOM 1104 CA CYS A 462 -9.001 -6.950 -3.385 1.00 72.13 C ATOM 1105 C CYS A 462 -9.949 -6.451 -4.477 1.00 11.24 C ATOM 1106 O CYS A 462 -9.813 -5.327 -4.956 1.00 13.43 O ATOM 1107 CB CYS A 462 -7.900 -7.847 -3.953 1.00 11.03 C ATOM 1108 SG CYS A 462 -6.684 -6.841 -4.877 1.00 52.24 S ATOM 0 H CYS A 462 -9.966 -8.622 -2.571 1.00 13.12 H new ATOM 0 HA CYS A 462 -8.489 -6.101 -2.932 1.00 72.13 H new ATOM 0 HB2 CYS A 462 -7.402 -8.381 -3.144 1.00 11.03 H new ATOM 0 HB3 CYS A 462 -8.336 -8.599 -4.611 1.00 11.03 H new ATOM 0 HG CYS A 462 -5.753 -7.614 -5.353 1.00 52.24 H new ATOM 1113 N ARG A 463 -10.889 -7.312 -4.838 1.00 13.32 N ATOM 1114 CA ARG A 463 -11.861 -6.973 -5.864 1.00 35.32 C ATOM 1115 C ARG A 463 -12.284 -5.509 -5.731 1.00 60.53 C ATOM 1116 O ARG A 463 -12.621 -4.863 -6.723 1.00 0.44 O ATOM 1117 CB ARG A 463 -13.099 -7.865 -5.767 1.00 11.03 C ATOM 1118 CG ARG A 463 -12.939 -9.122 -6.625 1.00 15.31 C ATOM 1119 CD ARG A 463 -14.009 -10.161 -6.281 1.00 34.31 C ATOM 1120 NE ARG A 463 -15.327 -9.717 -6.788 1.00 64.13 N ATOM 1121 CZ ARG A 463 -16.473 -10.411 -6.622 1.00 50.14 C ATOM 1122 NH1 ARG A 463 -16.473 -11.588 -5.962 1.00 21.31 N ATOM 1123 NH2 ARG A 463 -17.595 -9.919 -7.116 1.00 73.11 N ATOM 0 H ARG A 463 -10.998 -8.244 -4.438 1.00 13.32 H new ATOM 0 HA ARG A 463 -11.388 -7.132 -6.833 1.00 35.32 H new ATOM 0 HB2 ARG A 463 -13.266 -8.149 -4.728 1.00 11.03 H new ATOM 0 HB3 ARG A 463 -13.979 -7.309 -6.091 1.00 11.03 H new ATOM 0 HG2 ARG A 463 -13.010 -8.858 -7.680 1.00 15.31 H new ATOM 0 HG3 ARG A 463 -11.949 -9.549 -6.469 1.00 15.31 H new ATOM 0 HD2 ARG A 463 -13.747 -11.124 -6.720 1.00 34.31 H new ATOM 0 HD3 ARG A 463 -14.055 -10.304 -5.201 1.00 34.31 H new ATOM 0 HE ARG A 463 -15.372 -8.832 -7.294 1.00 64.13 H new ATOM 0 HH11 ARG A 463 -15.602 -11.960 -5.584 1.00 21.31 H new ATOM 0 HH12 ARG A 463 -17.344 -12.105 -5.842 1.00 21.31 H new ATOM 0 HH21 ARG A 463 -17.586 -9.029 -7.613 1.00 73.11 H new ATOM 0 HH22 ARG A 463 -18.470 -10.430 -7.000 1.00 73.11 H new ATOM 1133 N LEU A 464 -12.253 -5.026 -4.498 1.00 71.11 N ATOM 1134 CA LEU A 464 -12.629 -3.650 -4.223 1.00 31.42 C ATOM 1135 C LEU A 464 -11.421 -2.740 -4.454 1.00 54.21 C ATOM 1136 O LEU A 464 -11.389 -1.980 -5.423 1.00 24.42 O ATOM 1137 CB LEU A 464 -13.230 -3.529 -2.822 1.00 24.05 C ATOM 1138 CG LEU A 464 -13.796 -2.157 -2.451 1.00 43.42 C ATOM 1139 CD1 LEU A 464 -12.786 -1.348 -1.635 1.00 2.23 C ATOM 1140 CD2 LEU A 464 -14.264 -1.401 -3.697 1.00 22.44 C ATOM 0 H LEU A 464 -11.973 -5.563 -3.678 1.00 71.11 H new ATOM 0 HA LEU A 464 -13.410 -3.324 -4.910 1.00 31.42 H new ATOM 0 HB2 LEU A 464 -14.026 -4.267 -2.725 1.00 24.05 H new ATOM 0 HB3 LEU A 464 -12.462 -3.792 -2.095 1.00 24.05 H new ATOM 0 HG LEU A 464 -14.671 -2.309 -1.819 1.00 43.42 H new ATOM 0 HD11 LEU A 464 -13.214 -0.377 -1.385 1.00 2.23 H new ATOM 0 HD12 LEU A 464 -12.545 -1.886 -0.718 1.00 2.23 H new ATOM 0 HD13 LEU A 464 -11.878 -1.204 -2.220 1.00 2.23 H new ATOM 0 HD21 LEU A 464 -14.662 -0.429 -3.405 1.00 22.44 H new ATOM 0 HD22 LEU A 464 -13.422 -1.260 -4.375 1.00 22.44 H new ATOM 0 HD23 LEU A 464 -15.042 -1.975 -4.200 1.00 22.44 H new ATOM 1151 N SER A 465 -10.459 -2.845 -3.551 1.00 12.30 N ATOM 1152 CA SER A 465 -9.252 -2.040 -3.646 1.00 45.41 C ATOM 1153 C SER A 465 -8.779 -1.975 -5.099 1.00 51.51 C ATOM 1154 O SER A 465 -8.681 -0.893 -5.676 1.00 64.05 O ATOM 1155 CB SER A 465 -8.145 -2.602 -2.752 1.00 24.31 C ATOM 1156 OG SER A 465 -7.314 -1.574 -2.220 1.00 15.24 O ATOM 0 H SER A 465 -10.490 -3.475 -2.749 1.00 12.30 H new ATOM 0 HA SER A 465 -9.484 -1.032 -3.302 1.00 45.41 H new ATOM 0 HB2 SER A 465 -8.592 -3.167 -1.934 1.00 24.31 H new ATOM 0 HB3 SER A 465 -7.535 -3.300 -3.326 1.00 24.31 H new ATOM 0 HG SER A 465 -6.891 -1.082 -2.955 1.00 15.24 H new ATOM 1161 N LEU A 466 -8.501 -3.146 -5.651 1.00 3.02 N ATOM 1162 CA LEU A 466 -8.040 -3.235 -7.026 1.00 44.35 C ATOM 1163 C LEU A 466 -8.951 -2.393 -7.920 1.00 13.50 C ATOM 1164 O LEU A 466 -8.485 -1.746 -8.856 1.00 24.31 O ATOM 1165 CB LEU A 466 -7.933 -4.698 -7.461 1.00 14.15 C ATOM 1166 CG LEU A 466 -7.579 -4.936 -8.931 1.00 44.30 C ATOM 1167 CD1 LEU A 466 -8.678 -4.403 -9.852 1.00 0.05 C ATOM 1168 CD2 LEU A 466 -6.210 -4.344 -9.268 1.00 21.21 C ATOM 0 H LEU A 466 -8.586 -4.042 -5.171 1.00 3.02 H new ATOM 0 HA LEU A 466 -7.035 -2.824 -7.118 1.00 44.35 H new ATOM 0 HB2 LEU A 466 -7.180 -5.186 -6.843 1.00 14.15 H new ATOM 0 HB3 LEU A 466 -8.884 -5.189 -7.253 1.00 14.15 H new ATOM 0 HG LEU A 466 -7.513 -6.011 -9.097 1.00 44.30 H new ATOM 0 HD11 LEU A 466 -8.402 -4.585 -10.891 1.00 0.05 H new ATOM 0 HD12 LEU A 466 -9.616 -4.912 -9.632 1.00 0.05 H new ATOM 0 HD13 LEU A 466 -8.800 -3.332 -9.691 1.00 0.05 H new ATOM 0 HD21 LEU A 466 -5.983 -4.527 -10.318 1.00 21.21 H new ATOM 0 HD22 LEU A 466 -6.222 -3.270 -9.081 1.00 21.21 H new ATOM 0 HD23 LEU A 466 -5.448 -4.812 -8.645 1.00 21.21 H new ATOM 1179 N HIS A 467 -10.236 -2.427 -7.599 1.00 11.42 N ATOM 1180 CA HIS A 467 -11.219 -1.674 -8.362 1.00 3.14 C ATOM 1181 C HIS A 467 -11.088 -0.186 -8.037 1.00 52.51 C ATOM 1182 O HIS A 467 -11.357 0.664 -8.885 1.00 5.41 O ATOM 1183 CB HIS A 467 -12.629 -2.215 -8.115 1.00 33.10 C ATOM 1184 CG HIS A 467 -13.725 -1.205 -8.358 1.00 45.32 C ATOM 1185 ND1 HIS A 467 -13.749 -0.378 -9.468 1.00 41.31 N ATOM 1186 CD2 HIS A 467 -14.833 -0.899 -7.624 1.00 15.20 C ATOM 1187 CE1 HIS A 467 -14.828 0.388 -9.395 1.00 62.02 C ATOM 1188 NE2 HIS A 467 -15.498 0.064 -8.251 1.00 40.02 N ATOM 0 H HIS A 467 -10.620 -2.964 -6.821 1.00 11.42 H new ATOM 0 HA HIS A 467 -11.029 -1.795 -9.428 1.00 3.14 H new ATOM 0 HB2 HIS A 467 -12.794 -3.078 -8.760 1.00 33.10 H new ATOM 0 HB3 HIS A 467 -12.696 -2.569 -7.086 1.00 33.10 H new ATOM 0 HD2 HIS A 467 -15.121 -1.361 -6.691 1.00 15.20 H new ATOM 0 HE1 HIS A 467 -15.125 1.137 -10.114 1.00 62.02 H new ATOM 0 HE2 HIS A 467 -16.367 0.491 -7.930 1.00 40.02 H new ATOM 1195 N GLN A 468 -10.678 0.085 -6.807 1.00 73.40 N ATOM 1196 CA GLN A 468 -10.508 1.457 -6.359 1.00 52.31 C ATOM 1197 C GLN A 468 -9.204 2.038 -6.907 1.00 20.55 C ATOM 1198 O GLN A 468 -9.223 2.923 -7.761 1.00 50.41 O ATOM 1199 CB GLN A 468 -10.550 1.545 -4.833 1.00 25.52 C ATOM 1200 CG GLN A 468 -11.827 0.908 -4.280 1.00 51.44 C ATOM 1201 CD GLN A 468 -12.356 1.694 -3.079 1.00 62.14 C ATOM 1202 OE1 GLN A 468 -13.439 2.256 -3.099 1.00 51.41 O ATOM 1203 NE2 GLN A 468 -11.533 1.702 -2.033 1.00 1.33 N ATOM 0 H GLN A 468 -10.458 -0.623 -6.106 1.00 73.40 H new ATOM 0 HA GLN A 468 -11.337 2.050 -6.747 1.00 52.31 H new ATOM 0 HB2 GLN A 468 -9.678 1.044 -4.412 1.00 25.52 H new ATOM 0 HB3 GLN A 468 -10.497 2.589 -4.524 1.00 25.52 H new ATOM 0 HG2 GLN A 468 -12.588 0.873 -5.060 1.00 51.44 H new ATOM 0 HG3 GLN A 468 -11.626 -0.122 -3.985 1.00 51.44 H new ATOM 0 HE21 GLN A 468 -10.640 1.211 -2.083 1.00 1.33 H new ATOM 0 HE22 GLN A 468 -11.795 2.199 -1.182 1.00 1.33 H new ATOM 1210 N VAL A 469 -8.099 1.515 -6.393 1.00 14.05 N ATOM 1211 CA VAL A 469 -6.787 1.970 -6.821 1.00 50.54 C ATOM 1212 C VAL A 469 -6.787 2.159 -8.340 1.00 45.15 C ATOM 1213 O VAL A 469 -6.386 3.209 -8.838 1.00 52.33 O ATOM 1214 CB VAL A 469 -5.712 0.993 -6.341 1.00 44.15 C ATOM 1215 CG1 VAL A 469 -5.703 -0.276 -7.195 1.00 63.20 C ATOM 1216 CG2 VAL A 469 -4.334 1.657 -6.330 1.00 44.43 C ATOM 0 H VAL A 469 -8.086 0.781 -5.685 1.00 14.05 H new ATOM 0 HA VAL A 469 -6.554 2.936 -6.373 1.00 50.54 H new ATOM 0 HB VAL A 469 -5.953 0.705 -5.318 1.00 44.15 H new ATOM 0 HG11 VAL A 469 -4.930 -0.953 -6.832 1.00 63.20 H new ATOM 0 HG12 VAL A 469 -6.674 -0.766 -7.129 1.00 63.20 H new ATOM 0 HG13 VAL A 469 -5.498 -0.014 -8.233 1.00 63.20 H new ATOM 0 HG21 VAL A 469 -3.588 0.941 -5.985 1.00 44.43 H new ATOM 0 HG22 VAL A 469 -4.081 1.987 -7.338 1.00 44.43 H new ATOM 0 HG23 VAL A 469 -4.350 2.516 -5.660 1.00 44.43 H new ATOM 1226 N ASN A 470 -7.241 1.126 -9.033 1.00 4.15 N ATOM 1227 CA ASN A 470 -7.298 1.163 -10.484 1.00 11.13 C ATOM 1228 C ASN A 470 -7.841 2.522 -10.933 1.00 25.12 C ATOM 1229 O ASN A 470 -7.262 3.170 -11.804 1.00 22.34 O ATOM 1230 CB ASN A 470 -8.230 0.080 -11.027 1.00 32.41 C ATOM 1231 CG ASN A 470 -7.450 -1.189 -11.380 1.00 71.24 C ATOM 1232 OD1 ASN A 470 -7.633 -1.792 -12.424 1.00 2.01 O ATOM 1233 ND2 ASN A 470 -6.570 -1.558 -10.452 1.00 13.52 N ATOM 0 H ASN A 470 -7.573 0.257 -8.616 1.00 4.15 H new ATOM 0 HA ASN A 470 -6.291 0.996 -10.865 1.00 11.13 H new ATOM 0 HB2 ASN A 470 -8.994 -0.153 -10.285 1.00 32.41 H new ATOM 0 HB3 ASN A 470 -8.748 0.451 -11.912 1.00 32.41 H new ATOM 0 HD21 ASN A 470 -5.999 -2.391 -10.593 1.00 13.52 H new ATOM 0 HD22 ASN A 470 -6.467 -1.007 -9.600 1.00 13.52 H new ATOM 1239 N GLN A 471 -8.947 2.913 -10.318 1.00 0.22 N ATOM 1240 CA GLN A 471 -9.575 4.183 -10.642 1.00 20.03 C ATOM 1241 C GLN A 471 -8.696 5.345 -10.175 1.00 21.40 C ATOM 1242 O GLN A 471 -8.672 6.402 -10.804 1.00 31.20 O ATOM 1243 CB GLN A 471 -10.975 4.275 -10.030 1.00 32.04 C ATOM 1244 CG GLN A 471 -11.789 3.016 -10.335 1.00 52.04 C ATOM 1245 CD GLN A 471 -12.713 3.239 -11.535 1.00 1.24 C ATOM 1246 OE1 GLN A 471 -12.673 2.523 -12.523 1.00 44.23 O ATOM 1247 NE2 GLN A 471 -13.543 4.267 -11.395 1.00 52.21 N ATOM 0 H GLN A 471 -9.425 2.373 -9.597 1.00 0.22 H new ATOM 0 HA GLN A 471 -9.682 4.246 -11.725 1.00 20.03 H new ATOM 0 HB2 GLN A 471 -10.896 4.409 -8.951 1.00 32.04 H new ATOM 0 HB3 GLN A 471 -11.491 5.151 -10.423 1.00 32.04 H new ATOM 0 HG2 GLN A 471 -11.116 2.184 -10.539 1.00 52.04 H new ATOM 0 HG3 GLN A 471 -12.381 2.740 -9.462 1.00 52.04 H new ATOM 0 HE21 GLN A 471 -13.524 4.825 -10.542 1.00 52.21 H new ATOM 0 HE22 GLN A 471 -14.199 4.498 -12.141 1.00 52.21 H new ATOM 1254 N ALA A 472 -7.993 5.110 -9.077 1.00 14.05 N ATOM 1255 CA ALA A 472 -7.114 6.124 -8.519 1.00 54.20 C ATOM 1256 C ALA A 472 -5.963 6.385 -9.492 1.00 72.21 C ATOM 1257 O ALA A 472 -5.398 7.478 -9.511 1.00 72.12 O ATOM 1258 CB ALA A 472 -6.622 5.672 -7.143 1.00 4.34 C ATOM 0 H ALA A 472 -8.014 4.232 -8.558 1.00 14.05 H new ATOM 0 HA ALA A 472 -7.650 7.063 -8.381 1.00 54.20 H new ATOM 0 HB1 ALA A 472 -5.963 6.432 -6.724 1.00 4.34 H new ATOM 0 HB2 ALA A 472 -7.476 5.527 -6.481 1.00 4.34 H new ATOM 0 HB3 ALA A 472 -6.077 4.733 -7.242 1.00 4.34 H new ATOM 1264 N MET A 473 -5.648 5.364 -10.276 1.00 72.44 N ATOM 1265 CA MET A 473 -4.574 5.470 -11.249 1.00 55.11 C ATOM 1266 C MET A 473 -4.988 6.352 -12.428 1.00 14.12 C ATOM 1267 O MET A 473 -4.326 7.346 -12.727 1.00 3.50 O ATOM 1268 CB MET A 473 -4.206 4.075 -11.759 1.00 42.12 C ATOM 1269 CG MET A 473 -3.680 3.198 -10.622 1.00 31.24 C ATOM 1270 SD MET A 473 -3.109 1.635 -11.270 1.00 31.50 S ATOM 1271 CE MET A 473 -1.685 1.368 -10.227 1.00 11.32 C ATOM 0 H MET A 473 -6.118 4.459 -10.257 1.00 72.44 H new ATOM 0 HA MET A 473 -3.712 5.927 -10.762 1.00 55.11 H new ATOM 0 HB2 MET A 473 -5.081 3.606 -12.210 1.00 42.12 H new ATOM 0 HB3 MET A 473 -3.450 4.157 -12.540 1.00 42.12 H new ATOM 0 HG2 MET A 473 -2.865 3.707 -10.106 1.00 31.24 H new ATOM 0 HG3 MET A 473 -4.467 3.030 -9.887 1.00 31.24 H new ATOM 0 HE1 MET A 473 -1.398 0.317 -10.266 1.00 11.32 H new ATOM 0 HE2 MET A 473 -0.857 1.984 -10.577 1.00 11.32 H new ATOM 0 HE3 MET A 473 -1.930 1.640 -9.200 1.00 11.32 H new ATOM 1279 N MET A 474 -6.079 5.957 -13.067 1.00 24.35 N ATOM 1280 CA MET A 474 -6.589 6.700 -14.207 1.00 14.03 C ATOM 1281 C MET A 474 -7.088 8.082 -13.783 1.00 1.14 C ATOM 1282 O MET A 474 -7.413 8.915 -14.628 1.00 61.10 O ATOM 1283 CB MET A 474 -7.735 5.919 -14.854 1.00 44.52 C ATOM 1284 CG MET A 474 -8.801 5.553 -13.819 1.00 21.02 C ATOM 1285 SD MET A 474 -10.416 5.555 -14.579 1.00 42.33 S ATOM 1286 CE MET A 474 -11.318 6.532 -13.387 1.00 3.10 C ATOM 0 H MET A 474 -6.624 5.132 -12.817 1.00 24.35 H new ATOM 0 HA MET A 474 -5.778 6.832 -14.923 1.00 14.03 H new ATOM 0 HB2 MET A 474 -8.184 6.516 -15.648 1.00 44.52 H new ATOM 0 HB3 MET A 474 -7.346 5.012 -15.317 1.00 44.52 H new ATOM 0 HG2 MET A 474 -8.589 4.570 -13.399 1.00 21.02 H new ATOM 0 HG3 MET A 474 -8.778 6.264 -12.994 1.00 21.02 H new ATOM 0 HE1 MET A 474 -12.380 6.294 -13.450 1.00 3.10 H new ATOM 0 HE2 MET A 474 -10.955 6.308 -12.384 1.00 3.10 H new ATOM 0 HE3 MET A 474 -11.170 7.591 -13.598 1.00 3.10 H new ATOM 1294 N SER A 475 -7.132 8.284 -12.474 1.00 13.43 N ATOM 1295 CA SER A 475 -7.585 9.552 -11.928 1.00 44.11 C ATOM 1296 C SER A 475 -6.401 10.321 -11.339 1.00 12.43 C ATOM 1297 O SER A 475 -6.566 11.434 -10.841 1.00 53.10 O ATOM 1298 CB SER A 475 -8.663 9.337 -10.862 1.00 74.52 C ATOM 1299 OG SER A 475 -9.487 10.488 -10.697 1.00 72.20 O ATOM 0 H SER A 475 -6.861 7.591 -11.776 1.00 13.43 H new ATOM 0 HA SER A 475 -8.023 10.137 -12.737 1.00 44.11 H new ATOM 0 HB2 SER A 475 -9.283 8.484 -11.140 1.00 74.52 H new ATOM 0 HB3 SER A 475 -8.189 9.091 -9.912 1.00 74.52 H new ATOM 0 HG SER A 475 -8.929 11.293 -10.701 1.00 72.20 H new ATOM 1304 N ASN A 476 -5.235 9.698 -11.414 1.00 34.32 N ATOM 1305 CA ASN A 476 -4.025 10.310 -10.896 1.00 63.01 C ATOM 1306 C ASN A 476 -2.925 10.235 -11.957 1.00 31.44 C ATOM 1307 O ASN A 476 -1.825 9.762 -11.683 1.00 23.53 O ATOM 1308 CB ASN A 476 -3.528 9.577 -9.648 1.00 70.33 C ATOM 1309 CG ASN A 476 -2.229 10.196 -9.129 1.00 74.00 C ATOM 1310 OD1 ASN A 476 -1.135 9.724 -9.396 1.00 42.32 O ATOM 1311 ND2 ASN A 476 -2.408 11.277 -8.374 1.00 11.22 N ATOM 0 H ASN A 476 -5.103 8.774 -11.826 1.00 34.32 H new ATOM 0 HA ASN A 476 -4.254 11.345 -10.640 1.00 63.01 H new ATOM 0 HB2 ASN A 476 -4.291 9.618 -8.870 1.00 70.33 H new ATOM 0 HB3 ASN A 476 -3.366 8.525 -9.881 1.00 70.33 H new ATOM 0 HD21 ASN A 476 -1.602 11.763 -7.980 1.00 11.22 H new ATOM 0 HD22 ASN A 476 -3.351 11.620 -8.189 1.00 11.22 H new ATOM 1317 N LEU A 477 -3.263 10.710 -13.148 1.00 64.12 N ATOM 1318 CA LEU A 477 -2.317 10.702 -14.251 1.00 4.22 C ATOM 1319 C LEU A 477 -1.643 12.072 -14.349 1.00 44.21 C ATOM 1320 O LEU A 477 -0.614 12.216 -15.005 1.00 41.01 O ATOM 1321 CB LEU A 477 -3.008 10.264 -15.544 1.00 13.24 C ATOM 1322 CG LEU A 477 -3.864 8.999 -15.451 1.00 3.53 C ATOM 1323 CD1 LEU A 477 -5.041 9.060 -16.428 1.00 73.40 C ATOM 1324 CD2 LEU A 477 -3.014 7.744 -15.656 1.00 5.22 C ATOM 0 H LEU A 477 -4.177 11.102 -13.372 1.00 64.12 H new ATOM 0 HA LEU A 477 -1.529 9.970 -14.072 1.00 4.22 H new ATOM 0 HB2 LEU A 477 -3.640 11.082 -15.890 1.00 13.24 H new ATOM 0 HB3 LEU A 477 -2.244 10.107 -16.306 1.00 13.24 H new ATOM 0 HG LEU A 477 -4.282 8.943 -14.446 1.00 3.53 H new ATOM 0 HD11 LEU A 477 -5.633 8.149 -16.342 1.00 73.40 H new ATOM 0 HD12 LEU A 477 -5.665 9.922 -16.192 1.00 73.40 H new ATOM 0 HD13 LEU A 477 -4.664 9.152 -17.447 1.00 73.40 H new ATOM 0 HD21 LEU A 477 -3.648 6.860 -15.585 1.00 5.22 H new ATOM 0 HD22 LEU A 477 -2.547 7.778 -16.640 1.00 5.22 H new ATOM 0 HD23 LEU A 477 -2.241 7.699 -14.889 1.00 5.22 H new ATOM 1335 N THR A 478 -2.251 13.044 -13.684 1.00 71.10 N ATOM 1336 CA THR A 478 -1.722 14.397 -13.688 1.00 44.14 C ATOM 1337 C THR A 478 -0.668 14.561 -12.592 1.00 24.53 C ATOM 1338 O THR A 478 -0.120 15.647 -12.408 1.00 50.21 O ATOM 1339 CB THR A 478 -2.900 15.365 -13.548 1.00 61.32 C ATOM 1340 OG1 THR A 478 -2.283 16.641 -13.398 1.00 43.34 O ATOM 1341 CG2 THR A 478 -3.668 15.166 -12.240 1.00 61.24 C ATOM 0 H THR A 478 -3.105 12.921 -13.139 1.00 71.10 H new ATOM 0 HA THR A 478 -1.209 14.618 -14.624 1.00 44.14 H new ATOM 0 HB THR A 478 -3.579 15.236 -14.391 1.00 61.32 H new ATOM 0 HG1 THR A 478 -1.309 16.533 -13.372 1.00 43.34 H new ATOM 0 HG21 THR A 478 -4.493 15.877 -12.191 1.00 61.24 H new ATOM 0 HG22 THR A 478 -4.062 14.150 -12.200 1.00 61.24 H new ATOM 0 HG23 THR A 478 -2.998 15.329 -11.396 1.00 61.24 H new ATOM 1349 N ARG A 479 -0.413 13.465 -11.891 1.00 3.42 N ATOM 1350 CA ARG A 479 0.566 13.473 -10.816 1.00 55.21 C ATOM 1351 C ARG A 479 1.786 12.636 -11.206 1.00 53.20 C ATOM 1352 O ARG A 479 2.856 13.181 -11.479 1.00 3.20 O ATOM 1353 CB ARG A 479 -0.031 12.918 -9.523 1.00 4.13 C ATOM 1354 CG ARG A 479 -0.550 14.048 -8.630 1.00 60.21 C ATOM 1355 CD ARG A 479 0.606 14.872 -8.063 1.00 72.43 C ATOM 1356 NE ARG A 479 0.107 16.177 -7.572 1.00 15.51 N ATOM 1357 CZ ARG A 479 -0.408 17.138 -8.368 1.00 23.32 C ATOM 1358 NH1 ARG A 479 -0.492 16.950 -9.702 1.00 62.42 N ATOM 1359 NH2 ARG A 479 -0.825 18.265 -7.822 1.00 32.33 N ATOM 0 H ARG A 479 -0.868 12.565 -12.047 1.00 3.42 H new ATOM 0 HA ARG A 479 0.867 14.507 -10.649 1.00 55.21 H new ATOM 0 HB2 ARG A 479 -0.845 12.233 -9.759 1.00 4.13 H new ATOM 0 HB3 ARG A 479 0.724 12.343 -8.987 1.00 4.13 H new ATOM 0 HG2 ARG A 479 -1.215 14.694 -9.204 1.00 60.21 H new ATOM 0 HG3 ARG A 479 -1.138 13.630 -7.813 1.00 60.21 H new ATOM 0 HD2 ARG A 479 1.086 14.328 -7.250 1.00 72.43 H new ATOM 0 HD3 ARG A 479 1.363 15.029 -8.832 1.00 72.43 H new ATOM 0 HE ARG A 479 0.155 16.361 -6.570 1.00 15.51 H new ATOM 0 HH11 ARG A 479 -0.165 16.077 -10.116 1.00 62.42 H new ATOM 0 HH12 ARG A 479 -0.882 17.681 -10.296 1.00 62.42 H new ATOM 0 HH21 ARG A 479 -0.755 18.399 -6.813 1.00 32.33 H new ATOM 0 HH22 ARG A 479 -1.217 19.002 -8.409 1.00 32.33 H new ATOM 1369 N GLN A 480 1.587 11.327 -11.220 1.00 11.53 N ATOM 1370 CA GLN A 480 2.658 10.410 -11.572 1.00 1.32 C ATOM 1371 C GLN A 480 2.274 9.594 -12.808 1.00 51.23 C ATOM 1372 O GLN A 480 3.120 9.302 -13.652 1.00 43.12 O ATOM 1373 CB GLN A 480 3.003 9.494 -10.397 1.00 64.31 C ATOM 1374 CG GLN A 480 2.109 8.253 -10.386 1.00 31.41 C ATOM 1375 CD GLN A 480 2.058 7.625 -8.992 1.00 31.42 C ATOM 1376 OE1 GLN A 480 3.032 7.096 -8.485 1.00 72.12 O ATOM 1377 NE2 GLN A 480 0.869 7.713 -8.404 1.00 1.44 N ATOM 0 H GLN A 480 0.699 10.879 -10.993 1.00 11.53 H new ATOM 0 HA GLN A 480 3.547 10.995 -11.808 1.00 1.32 H new ATOM 0 HB2 GLN A 480 4.048 9.192 -10.462 1.00 64.31 H new ATOM 0 HB3 GLN A 480 2.886 10.039 -9.460 1.00 64.31 H new ATOM 0 HG2 GLN A 480 1.102 8.523 -10.704 1.00 31.41 H new ATOM 0 HG3 GLN A 480 2.485 7.524 -11.104 1.00 31.41 H new ATOM 0 HE21 GLN A 480 0.095 8.170 -8.885 1.00 1.44 H new ATOM 0 HE22 GLN A 480 0.731 7.324 -7.471 1.00 1.44 H new ATOM 1384 N GLY A 481 0.996 9.249 -12.876 1.00 73.51 N ATOM 1385 CA GLY A 481 0.490 8.472 -13.996 1.00 33.25 C ATOM 1386 C GLY A 481 1.263 7.160 -14.146 1.00 74.21 C ATOM 1387 O GLY A 481 1.806 6.875 -15.213 1.00 1.43 O ATOM 0 H GLY A 481 0.297 9.493 -12.175 1.00 73.51 H new ATOM 0 HA2 GLY A 481 -0.569 8.260 -13.847 1.00 33.25 H new ATOM 0 HA3 GLY A 481 0.572 9.054 -14.914 1.00 33.25 H new ATOM 1391 N SER A 482 1.287 6.397 -13.064 1.00 11.24 N ATOM 1392 CA SER A 482 1.984 5.122 -13.063 1.00 53.34 C ATOM 1393 C SER A 482 1.049 4.015 -12.569 1.00 35.00 C ATOM 1394 O SER A 482 0.735 3.947 -11.382 1.00 23.04 O ATOM 1395 CB SER A 482 3.240 5.183 -12.192 1.00 32.22 C ATOM 1396 OG SER A 482 3.958 6.400 -12.374 1.00 14.12 O ATOM 0 H SER A 482 0.835 6.637 -12.182 1.00 11.24 H new ATOM 0 HA SER A 482 2.293 4.899 -14.084 1.00 53.34 H new ATOM 0 HB2 SER A 482 2.959 5.081 -11.144 1.00 32.22 H new ATOM 0 HB3 SER A 482 3.888 4.340 -12.432 1.00 32.22 H new ATOM 0 HG SER A 482 4.752 6.401 -11.799 1.00 14.12 H new ATOM 1401 N PRO A 483 0.620 3.155 -13.531 1.00 13.24 N ATOM 1402 CA PRO A 483 -0.271 2.055 -13.207 1.00 2.53 C ATOM 1403 C PRO A 483 0.480 0.931 -12.489 1.00 74.34 C ATOM 1404 O PRO A 483 -0.105 -0.096 -12.153 1.00 5.34 O ATOM 1405 CB PRO A 483 -0.859 1.619 -14.539 1.00 64.14 C ATOM 1406 CG PRO A 483 0.069 2.176 -15.605 1.00 33.45 C ATOM 1407 CD PRO A 483 0.971 3.206 -14.947 1.00 35.44 C ATOM 0 HA PRO A 483 -1.060 2.345 -12.513 1.00 2.53 H new ATOM 0 HB2 PRO A 483 -0.920 0.533 -14.603 1.00 64.14 H new ATOM 0 HB3 PRO A 483 -1.872 2.002 -14.663 1.00 64.14 H new ATOM 0 HG2 PRO A 483 0.663 1.377 -16.049 1.00 33.45 H new ATOM 0 HG3 PRO A 483 -0.506 2.632 -16.411 1.00 33.45 H new ATOM 0 HD2 PRO A 483 2.023 2.968 -15.103 1.00 35.44 H new ATOM 0 HD3 PRO A 483 0.804 4.201 -15.361 1.00 35.44 H new ATOM 1412 N ASP A 484 1.766 1.167 -12.275 1.00 0.10 N ATOM 1413 CA ASP A 484 2.604 0.190 -11.602 1.00 14.04 C ATOM 1414 C ASP A 484 2.868 0.650 -10.168 1.00 22.21 C ATOM 1415 O ASP A 484 3.941 0.402 -9.619 1.00 4.34 O ATOM 1416 CB ASP A 484 3.954 0.043 -12.307 1.00 34.02 C ATOM 1417 CG ASP A 484 3.873 -0.181 -13.819 1.00 72.44 C ATOM 1418 OD1 ASP A 484 4.532 -1.076 -14.368 1.00 14.23 O ATOM 1419 OD2 ASP A 484 3.082 0.623 -14.447 1.00 32.30 O ATOM 0 H ASP A 484 2.248 2.021 -12.556 1.00 0.10 H new ATOM 0 HA ASP A 484 2.083 -0.767 -11.617 1.00 14.04 H new ATOM 0 HB2 ASP A 484 4.545 0.940 -12.119 1.00 34.02 H new ATOM 0 HB3 ASP A 484 4.492 -0.793 -11.859 1.00 34.02 H new ATOM 1424 N CYS A 485 1.870 1.313 -9.600 1.00 21.13 N ATOM 1425 CA CYS A 485 1.981 1.811 -8.239 1.00 4.23 C ATOM 1426 C CYS A 485 1.104 0.941 -7.337 1.00 62.41 C ATOM 1427 O CYS A 485 0.516 1.434 -6.375 1.00 62.42 O ATOM 1428 CB CYS A 485 1.606 3.291 -8.146 1.00 5.11 C ATOM 1429 SG CYS A 485 -0.106 3.540 -8.743 1.00 61.34 S ATOM 0 H CYS A 485 0.981 1.517 -10.058 1.00 21.13 H new ATOM 0 HA CYS A 485 3.017 1.746 -7.908 1.00 4.23 H new ATOM 0 HB2 CYS A 485 1.694 3.633 -7.115 1.00 5.11 H new ATOM 0 HB3 CYS A 485 2.298 3.888 -8.740 1.00 5.11 H new ATOM 0 HG CYS A 485 -0.090 3.771 -10.022 1.00 61.34 H new ATOM 1434 N VAL A 486 1.043 -0.338 -7.680 1.00 51.34 N ATOM 1435 CA VAL A 486 0.246 -1.280 -6.912 1.00 4.14 C ATOM 1436 C VAL A 486 1.099 -2.505 -6.575 1.00 65.21 C ATOM 1437 O VAL A 486 1.825 -3.014 -7.427 1.00 50.12 O ATOM 1438 CB VAL A 486 -1.030 -1.634 -7.679 1.00 51.02 C ATOM 1439 CG1 VAL A 486 -1.736 -2.833 -7.045 1.00 40.32 C ATOM 1440 CG2 VAL A 486 -1.967 -0.428 -7.767 1.00 3.32 C ATOM 0 H VAL A 486 1.532 -0.743 -8.478 1.00 51.34 H new ATOM 0 HA VAL A 486 -0.071 -0.833 -5.970 1.00 4.14 H new ATOM 0 HB VAL A 486 -0.746 -1.912 -8.694 1.00 51.02 H new ATOM 0 HG11 VAL A 486 -2.640 -3.063 -7.609 1.00 40.32 H new ATOM 0 HG12 VAL A 486 -1.070 -3.696 -7.058 1.00 40.32 H new ATOM 0 HG13 VAL A 486 -2.002 -2.596 -6.015 1.00 40.32 H new ATOM 0 HG21 VAL A 486 -2.866 -0.705 -8.317 1.00 3.32 H new ATOM 0 HG22 VAL A 486 -2.241 -0.106 -6.762 1.00 3.32 H new ATOM 0 HG23 VAL A 486 -1.462 0.388 -8.285 1.00 3.32 H new ATOM 1450 N ILE A 487 0.982 -2.942 -5.329 1.00 21.52 N ATOM 1451 CA ILE A 487 1.734 -4.097 -4.868 1.00 2.02 C ATOM 1452 C ILE A 487 0.854 -4.934 -3.937 1.00 54.23 C ATOM 1453 O ILE A 487 0.679 -4.589 -2.768 1.00 12.25 O ATOM 1454 CB ILE A 487 3.057 -3.659 -4.236 1.00 14.14 C ATOM 1455 CG1 ILE A 487 3.670 -2.486 -5.004 1.00 14.51 C ATOM 1456 CG2 ILE A 487 4.026 -4.837 -4.122 1.00 65.22 C ATOM 1457 CD1 ILE A 487 4.209 -2.942 -6.362 1.00 54.44 C ATOM 0 H ILE A 487 0.378 -2.517 -4.625 1.00 21.52 H new ATOM 0 HA ILE A 487 2.006 -4.735 -5.709 1.00 2.02 H new ATOM 0 HB ILE A 487 2.853 -3.310 -3.224 1.00 14.14 H new ATOM 0 HG12 ILE A 487 2.919 -1.709 -5.149 1.00 14.51 H new ATOM 0 HG13 ILE A 487 4.476 -2.045 -4.418 1.00 14.51 H new ATOM 0 HG21 ILE A 487 4.958 -4.499 -3.670 1.00 65.22 H new ATOM 0 HG22 ILE A 487 3.582 -5.614 -3.500 1.00 65.22 H new ATOM 0 HG23 ILE A 487 4.229 -5.238 -5.115 1.00 65.22 H new ATOM 0 HD11 ILE A 487 4.639 -2.089 -6.888 1.00 54.44 H new ATOM 0 HD12 ILE A 487 4.977 -3.701 -6.212 1.00 54.44 H new ATOM 0 HD13 ILE A 487 3.395 -3.361 -6.954 1.00 54.44 H new ATOM 1468 N PRO A 488 0.311 -6.044 -4.502 1.00 52.32 N ATOM 1469 CA PRO A 488 -0.546 -6.932 -3.736 1.00 63.22 C ATOM 1470 C PRO A 488 0.276 -7.786 -2.766 1.00 74.10 C ATOM 1471 O PRO A 488 0.935 -8.739 -3.179 1.00 60.04 O ATOM 1472 CB PRO A 488 -1.285 -7.759 -4.773 1.00 35.33 C ATOM 1473 CG PRO A 488 -0.482 -7.632 -6.058 1.00 53.21 C ATOM 1474 CD PRO A 488 0.497 -6.483 -5.883 1.00 63.43 C ATOM 0 HA PRO A 488 -1.249 -6.392 -3.102 1.00 63.22 H new ATOM 0 HB2 PRO A 488 -1.360 -8.801 -4.461 1.00 35.33 H new ATOM 0 HB3 PRO A 488 -2.303 -7.394 -4.911 1.00 35.33 H new ATOM 0 HG2 PRO A 488 0.051 -8.559 -6.268 1.00 53.21 H new ATOM 0 HG3 PRO A 488 -1.143 -7.445 -6.904 1.00 53.21 H new ATOM 0 HD2 PRO A 488 1.523 -6.806 -6.061 1.00 63.43 H new ATOM 0 HD3 PRO A 488 0.290 -5.676 -6.586 1.00 63.43 H new ATOM 1479 N PHE A 489 0.209 -7.412 -1.497 1.00 60.21 N ATOM 1480 CA PHE A 489 0.939 -8.131 -0.466 1.00 1.14 C ATOM 1481 C PHE A 489 0.196 -9.405 -0.056 1.00 22.02 C ATOM 1482 O PHE A 489 -1.010 -9.518 -0.263 1.00 54.51 O ATOM 1483 CB PHE A 489 1.036 -7.201 0.744 1.00 73.15 C ATOM 1484 CG PHE A 489 2.259 -7.455 1.628 1.00 23.45 C ATOM 1485 CD1 PHE A 489 3.459 -6.902 1.304 1.00 55.13 C ATOM 1486 CD2 PHE A 489 2.148 -8.233 2.737 1.00 1.52 C ATOM 1487 CE1 PHE A 489 4.594 -7.137 2.124 1.00 32.32 C ATOM 1488 CE2 PHE A 489 3.282 -8.470 3.556 1.00 44.02 C ATOM 1489 CZ PHE A 489 4.481 -7.917 3.233 1.00 73.50 C ATOM 0 H PHE A 489 -0.339 -6.621 -1.159 1.00 60.21 H new ATOM 0 HA PHE A 489 1.922 -8.419 -0.838 1.00 1.14 H new ATOM 0 HB2 PHE A 489 1.061 -6.169 0.395 1.00 73.15 H new ATOM 0 HB3 PHE A 489 0.135 -7.312 1.347 1.00 73.15 H new ATOM 0 HD1 PHE A 489 3.548 -6.284 0.423 1.00 55.13 H new ATOM 0 HD2 PHE A 489 1.195 -8.671 2.995 1.00 1.52 H new ATOM 0 HE1 PHE A 489 5.546 -6.697 1.868 1.00 32.32 H new ATOM 0 HE2 PHE A 489 3.193 -9.090 4.436 1.00 44.02 H new ATOM 0 HZ PHE A 489 5.344 -8.097 3.857 1.00 73.50 H new ATOM 1498 N LEU A 490 0.949 -10.332 0.516 1.00 64.13 N ATOM 1499 CA LEU A 490 0.379 -11.593 0.957 1.00 5.34 C ATOM 1500 C LEU A 490 1.053 -12.026 2.261 1.00 22.31 C ATOM 1501 O LEU A 490 2.165 -12.551 2.243 1.00 3.23 O ATOM 1502 CB LEU A 490 0.464 -12.639 -0.157 1.00 74.32 C ATOM 1503 CG LEU A 490 -0.334 -13.925 0.066 1.00 54.53 C ATOM 1504 CD1 LEU A 490 0.566 -15.047 0.581 1.00 63.14 C ATOM 1505 CD2 LEU A 490 -1.527 -13.675 0.993 1.00 35.31 C ATOM 0 H LEU A 490 1.950 -10.235 0.684 1.00 64.13 H new ATOM 0 HA LEU A 490 -0.683 -11.476 1.172 1.00 5.34 H new ATOM 0 HB2 LEU A 490 0.123 -12.180 -1.085 1.00 74.32 H new ATOM 0 HB3 LEU A 490 1.511 -12.905 -0.299 1.00 74.32 H new ATOM 0 HG LEU A 490 -0.734 -14.250 -0.895 1.00 54.53 H new ATOM 0 HD11 LEU A 490 -0.027 -15.949 0.731 1.00 63.14 H new ATOM 0 HD12 LEU A 490 1.352 -15.246 -0.147 1.00 63.14 H new ATOM 0 HD13 LEU A 490 1.016 -14.747 1.527 1.00 63.14 H new ATOM 0 HD21 LEU A 490 -2.078 -14.605 1.136 1.00 35.31 H new ATOM 0 HD22 LEU A 490 -1.169 -13.314 1.957 1.00 35.31 H new ATOM 0 HD23 LEU A 490 -2.184 -12.928 0.547 1.00 35.31 H new ATOM 1516 N PRO A 491 0.332 -11.784 3.389 1.00 42.02 N ATOM 1517 CA PRO A 491 0.850 -12.143 4.698 1.00 61.03 C ATOM 1518 C PRO A 491 0.764 -13.653 4.926 1.00 22.53 C ATOM 1519 O PRO A 491 0.159 -14.372 4.132 1.00 62.22 O ATOM 1520 CB PRO A 491 0.013 -11.345 5.685 1.00 11.34 C ATOM 1521 CG PRO A 491 -1.238 -10.929 4.928 1.00 74.23 C ATOM 1522 CD PRO A 491 -0.988 -11.163 3.447 1.00 24.05 C ATOM 0 HA PRO A 491 1.908 -11.907 4.811 1.00 61.03 H new ATOM 0 HB2 PRO A 491 -0.240 -11.946 6.558 1.00 11.34 H new ATOM 0 HB3 PRO A 491 0.559 -10.474 6.046 1.00 11.34 H new ATOM 0 HG2 PRO A 491 -2.098 -11.507 5.266 1.00 74.23 H new ATOM 0 HG3 PRO A 491 -1.466 -9.880 5.115 1.00 74.23 H new ATOM 0 HD2 PRO A 491 -1.750 -11.811 3.014 1.00 24.05 H new ATOM 0 HD3 PRO A 491 -1.011 -10.227 2.889 1.00 24.05 H new ATOM 1527 N LEU A 492 1.378 -14.090 6.016 1.00 31.43 N ATOM 1528 CA LEU A 492 1.379 -15.503 6.359 1.00 61.43 C ATOM 1529 C LEU A 492 0.018 -15.881 6.946 1.00 11.23 C ATOM 1530 O LEU A 492 -0.410 -17.030 6.841 1.00 5.20 O ATOM 1531 CB LEU A 492 2.556 -15.831 7.277 1.00 64.44 C ATOM 1532 CG LEU A 492 3.950 -15.553 6.708 1.00 61.12 C ATOM 1533 CD1 LEU A 492 4.129 -14.064 6.400 1.00 22.12 C ATOM 1534 CD2 LEU A 492 5.040 -16.080 7.643 1.00 35.01 C ATOM 0 H LEU A 492 1.878 -13.491 6.673 1.00 31.43 H new ATOM 0 HA LEU A 492 1.523 -16.111 5.466 1.00 61.43 H new ATOM 0 HB2 LEU A 492 2.442 -15.261 8.199 1.00 64.44 H new ATOM 0 HB3 LEU A 492 2.499 -16.886 7.545 1.00 64.44 H new ATOM 0 HG LEU A 492 4.048 -16.091 5.765 1.00 61.12 H new ATOM 0 HD11 LEU A 492 5.127 -13.893 5.997 1.00 22.12 H new ATOM 0 HD12 LEU A 492 3.384 -13.752 5.668 1.00 22.12 H new ATOM 0 HD13 LEU A 492 4.003 -13.485 7.315 1.00 22.12 H new ATOM 0 HD21 LEU A 492 6.020 -15.869 7.215 1.00 35.01 H new ATOM 0 HD22 LEU A 492 4.955 -15.590 8.613 1.00 35.01 H new ATOM 0 HD23 LEU A 492 4.923 -17.156 7.768 1.00 35.01 H new ATOM 1545 N GLU A 493 -0.625 -14.893 7.550 1.00 0.22 N ATOM 1546 CA GLU A 493 -1.930 -15.108 8.154 1.00 0.23 C ATOM 1547 C GLU A 493 -2.957 -15.476 7.080 1.00 13.11 C ATOM 1548 O GLU A 493 -3.881 -16.247 7.338 1.00 62.11 O ATOM 1549 CB GLU A 493 -2.379 -13.876 8.942 1.00 31.50 C ATOM 1550 CG GLU A 493 -1.900 -13.950 10.393 1.00 53.34 C ATOM 1551 CD GLU A 493 -2.644 -15.044 11.161 1.00 51.42 C ATOM 1552 OE1 GLU A 493 -2.214 -16.206 11.155 1.00 3.14 O ATOM 1553 OE2 GLU A 493 -3.705 -14.649 11.781 1.00 23.01 O ATOM 0 H GLU A 493 -0.267 -13.942 7.634 1.00 0.22 H new ATOM 0 HA GLU A 493 -1.852 -15.939 8.855 1.00 0.23 H new ATOM 0 HB2 GLU A 493 -1.986 -12.975 8.471 1.00 31.50 H new ATOM 0 HB3 GLU A 493 -3.466 -13.800 8.917 1.00 31.50 H new ATOM 0 HG2 GLU A 493 -0.829 -14.149 10.416 1.00 53.34 H new ATOM 0 HG3 GLU A 493 -2.056 -12.988 10.881 1.00 53.34 H new ATOM 1559 N SER A 494 -2.763 -14.907 5.900 1.00 24.41 N ATOM 1560 CA SER A 494 -3.661 -15.166 4.787 1.00 61.33 C ATOM 1561 C SER A 494 -2.890 -15.808 3.631 1.00 33.11 C ATOM 1562 O SER A 494 -1.666 -15.915 3.680 1.00 55.13 O ATOM 1563 CB SER A 494 -4.344 -13.879 4.321 1.00 60.33 C ATOM 1564 OG SER A 494 -5.394 -13.484 5.199 1.00 41.52 O ATOM 0 H SER A 494 -1.997 -14.267 5.690 1.00 24.41 H new ATOM 0 HA SER A 494 -4.436 -15.855 5.124 1.00 61.33 H new ATOM 0 HB2 SER A 494 -3.606 -13.080 4.256 1.00 60.33 H new ATOM 0 HB3 SER A 494 -4.745 -14.024 3.318 1.00 60.33 H new ATOM 0 HG SER A 494 -5.014 -13.032 5.981 1.00 41.52 H new ATOM 1569 N SER A 495 -3.640 -16.218 2.618 1.00 64.14 N ATOM 1570 CA SER A 495 -3.043 -16.847 1.453 1.00 61.14 C ATOM 1571 C SER A 495 -3.814 -16.449 0.192 1.00 70.20 C ATOM 1572 O SER A 495 -4.925 -15.931 0.278 1.00 13.24 O ATOM 1573 CB SER A 495 -3.016 -18.369 1.601 1.00 34.34 C ATOM 1574 OG SER A 495 -1.739 -18.842 2.022 1.00 33.20 O ATOM 0 H SER A 495 -4.655 -16.127 2.581 1.00 64.14 H new ATOM 0 HA SER A 495 -2.013 -16.500 1.367 1.00 61.14 H new ATOM 0 HB2 SER A 495 -3.773 -18.677 2.323 1.00 34.34 H new ATOM 0 HB3 SER A 495 -3.278 -18.831 0.649 1.00 34.34 H new ATOM 0 HG SER A 495 -1.763 -19.818 2.106 1.00 33.20 H new ATOM 1579 N PRO A 496 -3.175 -16.714 -0.979 1.00 72.33 N ATOM 1580 CA PRO A 496 -3.789 -16.390 -2.256 1.00 62.33 C ATOM 1581 C PRO A 496 -4.901 -17.383 -2.598 1.00 51.32 C ATOM 1582 O PRO A 496 -5.893 -17.018 -3.228 1.00 64.14 O ATOM 1583 CB PRO A 496 -2.646 -16.411 -3.258 1.00 70.42 C ATOM 1584 CG PRO A 496 -1.525 -17.195 -2.596 1.00 34.51 C ATOM 1585 CD PRO A 496 -1.857 -17.327 -1.119 1.00 32.23 C ATOM 0 HA PRO A 496 -4.280 -15.417 -2.251 1.00 62.33 H new ATOM 0 HB2 PRO A 496 -2.954 -16.882 -4.191 1.00 70.42 H new ATOM 0 HB3 PRO A 496 -2.323 -15.399 -3.503 1.00 70.42 H new ATOM 0 HG2 PRO A 496 -1.425 -18.179 -3.054 1.00 34.51 H new ATOM 0 HG3 PRO A 496 -0.572 -16.684 -2.729 1.00 34.51 H new ATOM 0 HD2 PRO A 496 -1.871 -18.372 -0.808 1.00 32.23 H new ATOM 0 HD3 PRO A 496 -1.117 -16.820 -0.500 1.00 32.23 H new ATOM 1590 N ALA A 497 -4.700 -18.619 -2.167 1.00 64.02 N ATOM 1591 CA ALA A 497 -5.673 -19.669 -2.418 1.00 33.42 C ATOM 1592 C ALA A 497 -6.992 -19.309 -1.733 1.00 5.32 C ATOM 1593 O ALA A 497 -8.058 -19.751 -2.158 1.00 22.21 O ATOM 1594 CB ALA A 497 -5.114 -21.009 -1.941 1.00 25.12 C ATOM 0 H ALA A 497 -3.876 -18.918 -1.645 1.00 64.02 H new ATOM 0 HA ALA A 497 -5.871 -19.762 -3.486 1.00 33.42 H new ATOM 0 HB1 ALA A 497 -5.844 -21.796 -2.130 1.00 25.12 H new ATOM 0 HB2 ALA A 497 -4.193 -21.232 -2.480 1.00 25.12 H new ATOM 0 HB3 ALA A 497 -4.905 -20.956 -0.872 1.00 25.12 H new ATOM 1600 N GLN A 498 -6.877 -18.509 -0.682 1.00 0.13 N ATOM 1601 CA GLN A 498 -8.048 -18.085 0.068 1.00 21.31 C ATOM 1602 C GLN A 498 -8.844 -17.051 -0.732 1.00 4.44 C ATOM 1603 O GLN A 498 -9.960 -16.697 -0.356 1.00 53.45 O ATOM 1604 CB GLN A 498 -7.651 -17.531 1.437 1.00 2.25 C ATOM 1605 CG GLN A 498 -6.435 -18.272 1.997 1.00 34.54 C ATOM 1606 CD GLN A 498 -6.479 -18.324 3.526 1.00 55.13 C ATOM 1607 OE1 GLN A 498 -6.217 -17.350 4.212 1.00 51.20 O ATOM 1608 NE2 GLN A 498 -6.823 -19.510 4.018 1.00 74.13 N ATOM 0 H GLN A 498 -5.991 -18.144 -0.332 1.00 0.13 H new ATOM 0 HA GLN A 498 -8.683 -18.955 0.235 1.00 21.31 H new ATOM 0 HB2 GLN A 498 -7.426 -16.468 1.352 1.00 2.25 H new ATOM 0 HB3 GLN A 498 -8.489 -17.625 2.128 1.00 2.25 H new ATOM 0 HG2 GLN A 498 -6.406 -19.285 1.596 1.00 34.54 H new ATOM 0 HG3 GLN A 498 -5.521 -17.775 1.673 1.00 34.54 H new ATOM 0 HE21 GLN A 498 -7.030 -20.284 3.386 1.00 74.13 H new ATOM 0 HE22 GLN A 498 -6.880 -19.646 5.027 1.00 74.13 H new ATOM 1615 N LEU A 499 -8.240 -16.598 -1.820 1.00 60.25 N ATOM 1616 CA LEU A 499 -8.878 -15.613 -2.675 1.00 71.34 C ATOM 1617 C LEU A 499 -9.549 -16.323 -3.852 1.00 14.34 C ATOM 1618 O LEU A 499 -9.246 -17.480 -4.139 1.00 61.42 O ATOM 1619 CB LEU A 499 -7.874 -14.538 -3.097 1.00 62.31 C ATOM 1620 CG LEU A 499 -6.837 -14.139 -2.045 1.00 32.01 C ATOM 1621 CD1 LEU A 499 -6.031 -12.922 -2.503 1.00 61.12 C ATOM 1622 CD2 LEU A 499 -7.497 -13.910 -0.684 1.00 1.31 C ATOM 0 H LEU A 499 -7.315 -16.895 -2.129 1.00 60.25 H new ATOM 0 HA LEU A 499 -9.662 -15.088 -2.130 1.00 71.34 H new ATOM 0 HB2 LEU A 499 -7.346 -14.890 -3.984 1.00 62.31 H new ATOM 0 HB3 LEU A 499 -8.428 -13.646 -3.389 1.00 62.31 H new ATOM 0 HG LEU A 499 -6.135 -14.964 -1.928 1.00 32.01 H new ATOM 0 HD11 LEU A 499 -5.301 -12.660 -1.737 1.00 61.12 H new ATOM 0 HD12 LEU A 499 -5.513 -13.158 -3.432 1.00 61.12 H new ATOM 0 HD13 LEU A 499 -6.704 -12.080 -2.666 1.00 61.12 H new ATOM 0 HD21 LEU A 499 -6.738 -13.628 0.046 1.00 1.31 H new ATOM 0 HD22 LEU A 499 -8.235 -13.112 -0.767 1.00 1.31 H new ATOM 0 HD23 LEU A 499 -7.989 -14.827 -0.359 1.00 1.31 H new ATOM 1633 N SER A 500 -10.449 -15.601 -4.504 1.00 65.10 N ATOM 1634 CA SER A 500 -11.165 -16.147 -5.642 1.00 22.14 C ATOM 1635 C SER A 500 -10.196 -16.398 -6.799 1.00 11.33 C ATOM 1636 O SER A 500 -9.097 -15.845 -6.824 1.00 73.14 O ATOM 1637 CB SER A 500 -12.291 -15.212 -6.087 1.00 53.32 C ATOM 1638 OG SER A 500 -13.233 -14.976 -5.044 1.00 74.12 O ATOM 0 H SER A 500 -10.698 -14.641 -4.264 1.00 65.10 H new ATOM 0 HA SER A 500 -11.614 -17.093 -5.340 1.00 22.14 H new ATOM 0 HB2 SER A 500 -11.866 -14.263 -6.413 1.00 53.32 H new ATOM 0 HB3 SER A 500 -12.803 -15.645 -6.947 1.00 53.32 H new ATOM 0 HG SER A 500 -13.935 -14.373 -5.367 1.00 74.12 H new ATOM 1643 N SER A 501 -10.637 -17.234 -7.729 1.00 42.05 N ATOM 1644 CA SER A 501 -9.822 -17.564 -8.885 1.00 0.11 C ATOM 1645 C SER A 501 -9.612 -16.320 -9.749 1.00 33.13 C ATOM 1646 O SER A 501 -8.788 -16.326 -10.663 1.00 20.33 O ATOM 1647 CB SER A 501 -10.463 -18.682 -9.709 1.00 41.42 C ATOM 1648 OG SER A 501 -9.670 -19.036 -10.838 1.00 42.51 O ATOM 0 H SER A 501 -11.548 -17.692 -7.705 1.00 42.05 H new ATOM 0 HA SER A 501 -8.854 -17.920 -8.532 1.00 0.11 H new ATOM 0 HB2 SER A 501 -10.608 -19.559 -9.079 1.00 41.42 H new ATOM 0 HB3 SER A 501 -11.450 -18.364 -10.045 1.00 41.42 H new ATOM 0 HG SER A 501 -9.156 -18.256 -11.134 1.00 42.51 H new ATOM 1653 N ASP A 502 -10.371 -15.282 -9.432 1.00 40.30 N ATOM 1654 CA ASP A 502 -10.279 -14.034 -10.170 1.00 64.05 C ATOM 1655 C ASP A 502 -9.087 -13.226 -9.649 1.00 12.34 C ATOM 1656 O ASP A 502 -8.363 -12.609 -10.428 1.00 64.34 O ATOM 1657 CB ASP A 502 -11.541 -13.188 -9.982 1.00 73.33 C ATOM 1658 CG ASP A 502 -12.855 -13.914 -10.279 1.00 73.44 C ATOM 1659 OD1 ASP A 502 -13.262 -14.823 -9.543 1.00 3.25 O ATOM 1660 OD2 ASP A 502 -13.477 -13.504 -11.333 1.00 63.32 O ATOM 0 H ASP A 502 -11.053 -15.279 -8.674 1.00 40.30 H new ATOM 0 HA ASP A 502 -10.160 -14.275 -11.226 1.00 64.05 H new ATOM 0 HB2 ASP A 502 -11.568 -12.825 -8.954 1.00 73.33 H new ATOM 0 HB3 ASP A 502 -11.473 -12.312 -10.627 1.00 73.33 H new ATOM 1665 N THR A 503 -8.921 -13.257 -8.334 1.00 32.14 N ATOM 1666 CA THR A 503 -7.830 -12.537 -7.701 1.00 4.31 C ATOM 1667 C THR A 503 -6.544 -12.698 -8.511 1.00 70.43 C ATOM 1668 O THR A 503 -5.765 -11.754 -8.640 1.00 41.22 O ATOM 1669 CB THR A 503 -7.707 -13.037 -6.260 1.00 12.33 C ATOM 1670 OG1 THR A 503 -8.681 -12.281 -5.545 1.00 13.12 O ATOM 1671 CG2 THR A 503 -6.378 -12.640 -5.614 1.00 3.45 C ATOM 0 H THR A 503 -9.524 -13.770 -7.691 1.00 32.14 H new ATOM 0 HA THR A 503 -8.027 -11.465 -7.673 1.00 4.31 H new ATOM 0 HB THR A 503 -7.809 -14.122 -6.243 1.00 12.33 H new ATOM 0 HG1 THR A 503 -8.269 -11.889 -4.747 1.00 13.12 H new ATOM 0 HG21 THR A 503 -6.342 -13.019 -4.593 1.00 3.45 H new ATOM 0 HG22 THR A 503 -5.554 -13.064 -6.188 1.00 3.45 H new ATOM 0 HG23 THR A 503 -6.290 -11.554 -5.601 1.00 3.45 H new ATOM 1679 N ALA A 504 -6.360 -13.898 -9.037 1.00 35.54 N ATOM 1680 CA ALA A 504 -5.179 -14.195 -9.833 1.00 3.10 C ATOM 1681 C ALA A 504 -5.150 -13.275 -11.055 1.00 62.55 C ATOM 1682 O ALA A 504 -4.114 -12.689 -11.372 1.00 2.45 O ATOM 1683 CB ALA A 504 -5.181 -15.675 -10.216 1.00 31.41 C ATOM 0 H ALA A 504 -7.008 -14.678 -8.929 1.00 35.54 H new ATOM 0 HA ALA A 504 -4.271 -14.009 -9.259 1.00 3.10 H new ATOM 0 HB1 ALA A 504 -4.296 -15.898 -10.812 1.00 31.41 H new ATOM 0 HB2 ALA A 504 -5.172 -16.285 -9.312 1.00 31.41 H new ATOM 0 HB3 ALA A 504 -6.076 -15.899 -10.797 1.00 31.41 H new ATOM 1689 N SER A 505 -6.296 -13.177 -11.710 1.00 3.15 N ATOM 1690 CA SER A 505 -6.415 -12.341 -12.891 1.00 40.32 C ATOM 1691 C SER A 505 -6.439 -10.865 -12.486 1.00 53.15 C ATOM 1692 O SER A 505 -6.193 -9.987 -13.312 1.00 72.34 O ATOM 1693 CB SER A 505 -7.673 -12.690 -13.690 1.00 73.13 C ATOM 1694 OG SER A 505 -7.883 -11.789 -14.775 1.00 14.43 O ATOM 0 H SER A 505 -7.152 -13.664 -11.445 1.00 3.15 H new ATOM 0 HA SER A 505 -5.550 -12.525 -13.528 1.00 40.32 H new ATOM 0 HB2 SER A 505 -7.588 -13.707 -14.074 1.00 73.13 H new ATOM 0 HB3 SER A 505 -8.540 -12.670 -13.029 1.00 73.13 H new ATOM 0 HG SER A 505 -8.694 -12.046 -15.261 1.00 14.43 H new ATOM 1699 N LEU A 506 -6.735 -10.638 -11.215 1.00 40.12 N ATOM 1700 CA LEU A 506 -6.793 -9.283 -10.690 1.00 22.04 C ATOM 1701 C LEU A 506 -5.369 -8.759 -10.489 1.00 53.44 C ATOM 1702 O LEU A 506 -5.108 -7.573 -10.687 1.00 63.21 O ATOM 1703 CB LEU A 506 -7.650 -9.236 -9.424 1.00 22.53 C ATOM 1704 CG LEU A 506 -9.118 -9.635 -9.593 1.00 3.24 C ATOM 1705 CD1 LEU A 506 -9.781 -9.874 -8.235 1.00 62.24 C ATOM 1706 CD2 LEU A 506 -9.875 -8.600 -10.426 1.00 43.33 C ATOM 0 H LEU A 506 -6.937 -11.369 -10.533 1.00 40.12 H new ATOM 0 HA LEU A 506 -7.281 -8.618 -11.402 1.00 22.04 H new ATOM 0 HB2 LEU A 506 -7.199 -9.892 -8.679 1.00 22.53 H new ATOM 0 HB3 LEU A 506 -7.613 -8.224 -9.021 1.00 22.53 H new ATOM 0 HG LEU A 506 -9.155 -10.577 -10.140 1.00 3.24 H new ATOM 0 HD11 LEU A 506 -10.823 -10.156 -8.384 1.00 62.24 H new ATOM 0 HD12 LEU A 506 -9.259 -10.675 -7.711 1.00 62.24 H new ATOM 0 HD13 LEU A 506 -9.733 -8.961 -7.641 1.00 62.24 H new ATOM 0 HD21 LEU A 506 -10.915 -8.908 -10.531 1.00 43.33 H new ATOM 0 HD22 LEU A 506 -9.832 -7.631 -9.929 1.00 43.33 H new ATOM 0 HD23 LEU A 506 -9.418 -8.523 -11.413 1.00 43.33 H new ATOM 1717 N LEU A 507 -4.488 -9.666 -10.098 1.00 21.34 N ATOM 1718 CA LEU A 507 -3.098 -9.310 -9.868 1.00 42.14 C ATOM 1719 C LEU A 507 -2.227 -9.943 -10.955 1.00 70.14 C ATOM 1720 O LEU A 507 -1.009 -10.033 -10.804 1.00 14.00 O ATOM 1721 CB LEU A 507 -2.677 -9.684 -8.445 1.00 20.03 C ATOM 1722 CG LEU A 507 -2.335 -11.158 -8.214 1.00 42.15 C ATOM 1723 CD1 LEU A 507 -0.841 -11.414 -8.425 1.00 12.33 C ATOM 1724 CD2 LEU A 507 -2.805 -11.619 -6.833 1.00 61.12 C ATOM 0 H LEU A 507 -4.709 -10.648 -9.934 1.00 21.34 H new ATOM 0 HA LEU A 507 -2.964 -8.231 -9.941 1.00 42.14 H new ATOM 0 HB2 LEU A 507 -1.809 -9.083 -8.174 1.00 20.03 H new ATOM 0 HB3 LEU A 507 -3.482 -9.407 -7.764 1.00 20.03 H new ATOM 0 HG LEU A 507 -2.871 -11.753 -8.953 1.00 42.15 H new ATOM 0 HD11 LEU A 507 -0.625 -12.469 -8.255 1.00 12.33 H new ATOM 0 HD12 LEU A 507 -0.567 -11.148 -9.446 1.00 12.33 H new ATOM 0 HD13 LEU A 507 -0.266 -10.808 -7.725 1.00 12.33 H new ATOM 0 HD21 LEU A 507 -2.550 -12.670 -6.694 1.00 61.12 H new ATOM 0 HD22 LEU A 507 -2.315 -11.022 -6.064 1.00 61.12 H new ATOM 0 HD23 LEU A 507 -3.885 -11.495 -6.756 1.00 61.12 H new ATOM 1735 N SER A 508 -2.885 -10.366 -12.024 1.00 63.52 N ATOM 1736 CA SER A 508 -2.184 -10.988 -13.135 1.00 52.53 C ATOM 1737 C SER A 508 -1.440 -9.925 -13.945 1.00 74.44 C ATOM 1738 O SER A 508 -2.057 -9.143 -14.665 1.00 51.52 O ATOM 1739 CB SER A 508 -3.155 -11.758 -14.034 1.00 42.02 C ATOM 1740 OG SER A 508 -3.329 -13.105 -13.601 1.00 54.32 O ATOM 0 H SER A 508 -3.895 -10.291 -12.145 1.00 63.52 H new ATOM 0 HA SER A 508 -1.462 -11.698 -12.731 1.00 52.53 H new ATOM 0 HB2 SER A 508 -4.120 -11.252 -14.042 1.00 42.02 H new ATOM 0 HB3 SER A 508 -2.783 -11.752 -15.059 1.00 42.02 H new ATOM 0 HG SER A 508 -3.276 -13.144 -12.623 1.00 54.32 H new ATOM 1745 N GLY A 509 -0.123 -9.932 -13.802 1.00 3.21 N ATOM 1746 CA GLY A 509 0.712 -8.979 -14.510 1.00 23.11 C ATOM 1747 C GLY A 509 1.516 -8.120 -13.533 1.00 70.34 C ATOM 1748 O GLY A 509 2.568 -7.589 -13.886 1.00 43.55 O ATOM 0 H GLY A 509 0.386 -10.584 -13.205 1.00 3.21 H new ATOM 0 HA2 GLY A 509 1.392 -9.511 -15.176 1.00 23.11 H new ATOM 0 HA3 GLY A 509 0.089 -8.339 -15.135 1.00 23.11 H new ATOM 1752 N LEU A 510 0.990 -8.008 -12.322 1.00 0.33 N ATOM 1753 CA LEU A 510 1.643 -7.222 -11.290 1.00 14.20 C ATOM 1754 C LEU A 510 2.632 -8.109 -10.529 1.00 53.43 C ATOM 1755 O LEU A 510 2.785 -9.287 -10.847 1.00 63.35 O ATOM 1756 CB LEU A 510 0.606 -6.547 -10.391 1.00 15.51 C ATOM 1757 CG LEU A 510 -0.284 -5.499 -11.064 1.00 53.34 C ATOM 1758 CD1 LEU A 510 -0.605 -4.353 -10.102 1.00 24.11 C ATOM 1759 CD2 LEU A 510 0.350 -4.994 -12.363 1.00 61.20 C ATOM 0 H LEU A 510 0.117 -8.450 -12.032 1.00 0.33 H new ATOM 0 HA LEU A 510 2.218 -6.411 -11.737 1.00 14.20 H new ATOM 0 HB2 LEU A 510 -0.034 -7.319 -9.965 1.00 15.51 H new ATOM 0 HB3 LEU A 510 1.128 -6.072 -9.560 1.00 15.51 H new ATOM 0 HG LEU A 510 -1.229 -5.973 -11.329 1.00 53.34 H new ATOM 0 HD11 LEU A 510 -1.238 -3.622 -10.605 1.00 24.11 H new ATOM 0 HD12 LEU A 510 -1.127 -4.746 -9.229 1.00 24.11 H new ATOM 0 HD13 LEU A 510 0.321 -3.873 -9.786 1.00 24.11 H new ATOM 0 HD21 LEU A 510 -0.302 -4.251 -12.821 1.00 61.20 H new ATOM 0 HD22 LEU A 510 1.317 -4.542 -12.144 1.00 61.20 H new ATOM 0 HD23 LEU A 510 0.487 -5.829 -13.050 1.00 61.20 H new ATOM 1770 N VAL A 511 3.276 -7.508 -9.540 1.00 14.11 N ATOM 1771 CA VAL A 511 4.246 -8.228 -8.731 1.00 73.21 C ATOM 1772 C VAL A 511 3.669 -8.452 -7.333 1.00 3.52 C ATOM 1773 O VAL A 511 3.695 -7.552 -6.494 1.00 23.12 O ATOM 1774 CB VAL A 511 5.577 -7.474 -8.716 1.00 4.14 C ATOM 1775 CG1 VAL A 511 6.569 -8.135 -7.756 1.00 11.43 C ATOM 1776 CG2 VAL A 511 6.164 -7.370 -10.125 1.00 43.22 C ATOM 0 H VAL A 511 3.146 -6.530 -9.280 1.00 14.11 H new ATOM 0 HA VAL A 511 4.449 -9.209 -9.160 1.00 73.21 H new ATOM 0 HB VAL A 511 5.386 -6.462 -8.358 1.00 4.14 H new ATOM 0 HG11 VAL A 511 7.507 -7.580 -7.763 1.00 11.43 H new ATOM 0 HG12 VAL A 511 6.155 -8.134 -6.748 1.00 11.43 H new ATOM 0 HG13 VAL A 511 6.752 -9.162 -8.072 1.00 11.43 H new ATOM 0 HG21 VAL A 511 7.110 -6.830 -10.086 1.00 43.22 H new ATOM 0 HG22 VAL A 511 6.334 -8.370 -10.523 1.00 43.22 H new ATOM 0 HG23 VAL A 511 5.467 -6.836 -10.771 1.00 43.22 H new ATOM 1786 N ARG A 512 3.161 -9.658 -7.122 1.00 51.11 N ATOM 1787 CA ARG A 512 2.580 -10.012 -5.839 1.00 11.15 C ATOM 1788 C ARG A 512 3.661 -10.050 -4.757 1.00 73.45 C ATOM 1789 O ARG A 512 4.632 -10.797 -4.871 1.00 42.54 O ATOM 1790 CB ARG A 512 1.887 -11.375 -5.906 1.00 64.54 C ATOM 1791 CG ARG A 512 0.612 -11.384 -5.059 1.00 24.40 C ATOM 1792 CD ARG A 512 0.396 -12.754 -4.411 1.00 4.51 C ATOM 1793 NE ARG A 512 -0.187 -13.693 -5.393 1.00 31.12 N ATOM 1794 CZ ARG A 512 -0.043 -15.034 -5.337 1.00 22.01 C ATOM 1795 NH1 ARG A 512 0.667 -15.605 -4.342 1.00 64.33 N ATOM 1796 NH2 ARG A 512 -0.608 -15.778 -6.270 1.00 41.34 N ATOM 0 H ARG A 512 3.140 -10.402 -7.819 1.00 51.11 H new ATOM 0 HA ARG A 512 1.840 -9.252 -5.590 1.00 11.15 H new ATOM 0 HB2 ARG A 512 1.642 -11.612 -6.941 1.00 64.54 H new ATOM 0 HB3 ARG A 512 2.567 -12.151 -5.554 1.00 64.54 H new ATOM 0 HG2 ARG A 512 0.679 -10.618 -4.286 1.00 24.40 H new ATOM 0 HG3 ARG A 512 -0.246 -11.133 -5.683 1.00 24.40 H new ATOM 0 HD2 ARG A 512 1.344 -13.144 -4.042 1.00 4.51 H new ATOM 0 HD3 ARG A 512 -0.266 -12.658 -3.550 1.00 4.51 H new ATOM 0 HE ARG A 512 -0.733 -13.303 -6.161 1.00 31.12 H new ATOM 0 HH11 ARG A 512 1.100 -15.023 -3.625 1.00 64.33 H new ATOM 0 HH12 ARG A 512 0.771 -16.619 -4.307 1.00 64.33 H new ATOM 0 HH21 ARG A 512 -1.144 -15.338 -7.018 1.00 41.34 H new ATOM 0 HH22 ARG A 512 -0.509 -16.793 -6.242 1.00 41.34 H new ATOM 1806 N LEU A 513 3.460 -9.232 -3.735 1.00 0.34 N ATOM 1807 CA LEU A 513 4.405 -9.162 -2.635 1.00 41.13 C ATOM 1808 C LEU A 513 4.111 -10.288 -1.641 1.00 32.11 C ATOM 1809 O LEU A 513 2.976 -10.753 -1.544 1.00 62.45 O ATOM 1810 CB LEU A 513 4.391 -7.767 -2.003 1.00 35.24 C ATOM 1811 CG LEU A 513 5.760 -7.166 -1.678 1.00 62.45 C ATOM 1812 CD1 LEU A 513 6.713 -7.292 -2.868 1.00 35.01 C ATOM 1813 CD2 LEU A 513 5.623 -5.716 -1.205 1.00 3.13 C ATOM 0 H LEU A 513 2.655 -8.611 -3.646 1.00 0.34 H new ATOM 0 HA LEU A 513 5.421 -9.313 -2.998 1.00 41.13 H new ATOM 0 HB2 LEU A 513 3.869 -7.089 -2.678 1.00 35.24 H new ATOM 0 HB3 LEU A 513 3.808 -7.812 -1.083 1.00 35.24 H new ATOM 0 HG LEU A 513 6.196 -7.735 -0.856 1.00 62.45 H new ATOM 0 HD11 LEU A 513 7.678 -6.857 -2.609 1.00 35.01 H new ATOM 0 HD12 LEU A 513 6.845 -8.345 -3.118 1.00 35.01 H new ATOM 0 HD13 LEU A 513 6.296 -6.765 -3.726 1.00 35.01 H new ATOM 0 HD21 LEU A 513 6.610 -5.312 -0.980 1.00 3.13 H new ATOM 0 HD22 LEU A 513 5.157 -5.120 -1.989 1.00 3.13 H new ATOM 0 HD23 LEU A 513 5.005 -5.683 -0.308 1.00 3.13 H new ATOM 1824 N ASP A 514 5.153 -10.694 -0.931 1.00 51.12 N ATOM 1825 CA ASP A 514 5.021 -11.757 0.052 1.00 54.44 C ATOM 1826 C ASP A 514 5.766 -11.362 1.328 1.00 20.42 C ATOM 1827 O ASP A 514 6.538 -10.406 1.329 1.00 51.43 O ATOM 1828 CB ASP A 514 5.627 -13.063 -0.466 1.00 62.31 C ATOM 1829 CG ASP A 514 4.684 -13.925 -1.308 1.00 32.14 C ATOM 1830 OD1 ASP A 514 3.766 -14.570 -0.781 1.00 53.45 O ATOM 1831 OD2 ASP A 514 4.924 -13.918 -2.575 1.00 72.40 O ATOM 0 H ASP A 514 6.093 -10.306 -1.016 1.00 51.12 H new ATOM 0 HA ASP A 514 3.959 -11.905 0.249 1.00 54.44 H new ATOM 0 HB2 ASP A 514 6.508 -12.826 -1.063 1.00 62.31 H new ATOM 0 HB3 ASP A 514 5.968 -13.651 0.386 1.00 62.31 H new ATOM 1836 N GLU A 515 5.509 -12.122 2.383 1.00 70.35 N ATOM 1837 CA GLU A 515 6.147 -11.863 3.663 1.00 24.02 C ATOM 1838 C GLU A 515 6.836 -13.129 4.178 1.00 55.51 C ATOM 1839 O GLU A 515 7.409 -13.129 5.266 1.00 60.11 O ATOM 1840 CB GLU A 515 5.135 -11.336 4.682 1.00 64.14 C ATOM 1841 CG GLU A 515 5.805 -11.067 6.031 1.00 30.24 C ATOM 1842 CD GLU A 515 5.111 -9.922 6.770 1.00 54.41 C ATOM 1843 OE1 GLU A 515 3.892 -9.975 6.990 1.00 44.44 O ATOM 1844 OE2 GLU A 515 5.885 -8.951 7.121 1.00 40.32 O ATOM 0 H GLU A 515 4.869 -12.916 2.378 1.00 70.35 H new ATOM 0 HA GLU A 515 6.905 -11.093 3.521 1.00 24.02 H new ATOM 0 HB2 GLU A 515 4.681 -10.418 4.308 1.00 64.14 H new ATOM 0 HB3 GLU A 515 4.331 -12.061 4.809 1.00 64.14 H new ATOM 0 HG2 GLU A 515 5.776 -11.969 6.642 1.00 30.24 H new ATOM 0 HG3 GLU A 515 6.856 -10.821 5.876 1.00 30.24 H new ATOM 1850 N HIS A 516 6.757 -14.176 3.371 1.00 30.14 N ATOM 1851 CA HIS A 516 7.365 -15.446 3.732 1.00 1.13 C ATOM 1852 C HIS A 516 8.247 -15.938 2.582 1.00 42.35 C ATOM 1853 O HIS A 516 8.687 -17.086 2.580 1.00 55.24 O ATOM 1854 CB HIS A 516 6.297 -16.465 4.138 1.00 55.22 C ATOM 1855 CG HIS A 516 5.119 -16.527 3.196 1.00 14.04 C ATOM 1856 ND1 HIS A 516 3.900 -17.075 3.556 1.00 54.21 N ATOM 1857 CD2 HIS A 516 4.986 -16.106 1.905 1.00 43.04 C ATOM 1858 CE1 HIS A 516 3.078 -16.982 2.520 1.00 32.33 C ATOM 1859 NE2 HIS A 516 3.754 -16.381 1.498 1.00 5.41 N ATOM 0 H HIS A 516 6.282 -14.172 2.469 1.00 30.14 H new ATOM 0 HA HIS A 516 8.005 -15.311 4.604 1.00 1.13 H new ATOM 0 HB2 HIS A 516 6.755 -17.452 4.196 1.00 55.22 H new ATOM 0 HB3 HIS A 516 5.938 -16.221 5.138 1.00 55.22 H new ATOM 0 HD2 HIS A 516 5.754 -15.629 1.314 1.00 43.04 H new ATOM 0 HE1 HIS A 516 2.053 -17.322 2.490 1.00 32.33 H new ATOM 0 HE2 HIS A 516 3.374 -16.177 0.574 1.00 5.41 H new ATOM 1866 N SER A 517 8.477 -15.043 1.633 1.00 33.52 N ATOM 1867 CA SER A 517 9.300 -15.370 0.480 1.00 14.35 C ATOM 1868 C SER A 517 10.718 -14.832 0.678 1.00 42.42 C ATOM 1869 O SER A 517 10.900 -13.707 1.141 1.00 4.22 O ATOM 1870 CB SER A 517 8.692 -14.808 -0.807 1.00 74.24 C ATOM 1871 OG SER A 517 9.096 -15.548 -1.956 1.00 32.30 O ATOM 0 H SER A 517 8.108 -14.092 1.638 1.00 33.52 H new ATOM 0 HA SER A 517 9.342 -16.455 0.386 1.00 14.35 H new ATOM 0 HB2 SER A 517 7.605 -14.822 -0.731 1.00 74.24 H new ATOM 0 HB3 SER A 517 8.990 -13.766 -0.924 1.00 74.24 H new ATOM 0 HG SER A 517 8.738 -15.122 -2.762 1.00 32.30 H new ATOM 1876 N GLN A 518 11.687 -15.661 0.317 1.00 12.43 N ATOM 1877 CA GLN A 518 13.083 -15.281 0.449 1.00 12.24 C ATOM 1878 C GLN A 518 13.492 -14.356 -0.698 1.00 31.33 C ATOM 1879 O GLN A 518 14.628 -13.888 -0.746 1.00 33.30 O ATOM 1880 CB GLN A 518 13.984 -16.518 0.503 1.00 2.40 C ATOM 1881 CG GLN A 518 13.795 -17.390 -0.739 1.00 2.42 C ATOM 1882 CD GLN A 518 15.030 -18.255 -0.994 1.00 74.13 C ATOM 1883 OE1 GLN A 518 15.389 -19.118 -0.212 1.00 62.13 O ATOM 1884 NE2 GLN A 518 15.660 -17.975 -2.133 1.00 51.23 N ATOM 0 H GLN A 518 11.533 -16.594 -0.066 1.00 12.43 H new ATOM 0 HA GLN A 518 13.205 -14.740 1.387 1.00 12.24 H new ATOM 0 HB2 GLN A 518 15.027 -16.209 0.580 1.00 2.40 H new ATOM 0 HB3 GLN A 518 13.757 -17.099 1.397 1.00 2.40 H new ATOM 0 HG2 GLN A 518 12.920 -18.028 -0.611 1.00 2.42 H new ATOM 0 HG3 GLN A 518 13.604 -16.758 -1.606 1.00 2.42 H new ATOM 0 HE21 GLN A 518 15.306 -17.239 -2.744 1.00 51.23 H new ATOM 0 HE22 GLN A 518 16.496 -18.497 -2.395 1.00 51.23 H new ATOM 1891 N ILE A 519 12.545 -14.120 -1.593 1.00 1.24 N ATOM 1892 CA ILE A 519 12.793 -13.259 -2.736 1.00 53.42 C ATOM 1893 C ILE A 519 12.032 -11.943 -2.554 1.00 64.31 C ATOM 1894 O ILE A 519 12.420 -10.916 -3.108 1.00 11.30 O ATOM 1895 CB ILE A 519 12.456 -13.987 -4.039 1.00 53.40 C ATOM 1896 CG1 ILE A 519 11.701 -13.068 -5.002 1.00 71.33 C ATOM 1897 CG2 ILE A 519 11.688 -15.281 -3.761 1.00 24.15 C ATOM 1898 CD1 ILE A 519 12.626 -11.992 -5.573 1.00 62.01 C ATOM 0 H ILE A 519 11.604 -14.510 -1.550 1.00 1.24 H new ATOM 0 HA ILE A 519 13.852 -13.010 -2.801 1.00 53.42 H new ATOM 0 HB ILE A 519 13.391 -14.265 -4.526 1.00 53.40 H new ATOM 0 HG12 ILE A 519 11.277 -13.657 -5.815 1.00 71.33 H new ATOM 0 HG13 ILE A 519 10.867 -12.597 -4.482 1.00 71.33 H new ATOM 0 HG21 ILE A 519 11.461 -15.779 -4.704 1.00 24.15 H new ATOM 0 HG22 ILE A 519 12.296 -15.939 -3.140 1.00 24.15 H new ATOM 0 HG23 ILE A 519 10.759 -15.048 -3.241 1.00 24.15 H new ATOM 0 HD11 ILE A 519 12.064 -11.353 -6.254 1.00 62.01 H new ATOM 0 HD12 ILE A 519 13.029 -11.389 -4.759 1.00 62.01 H new ATOM 0 HD13 ILE A 519 13.445 -12.466 -6.113 1.00 62.01 H new ATOM 1909 N PHE A 520 10.964 -12.018 -1.774 1.00 64.22 N ATOM 1910 CA PHE A 520 10.146 -10.847 -1.509 1.00 73.22 C ATOM 1911 C PHE A 520 11.017 -9.605 -1.303 1.00 1.54 C ATOM 1912 O PHE A 520 10.636 -8.503 -1.696 1.00 64.42 O ATOM 1913 CB PHE A 520 9.366 -11.126 -0.225 1.00 41.40 C ATOM 1914 CG PHE A 520 9.018 -9.870 0.579 1.00 71.40 C ATOM 1915 CD1 PHE A 520 8.408 -8.820 -0.031 1.00 11.41 C ATOM 1916 CD2 PHE A 520 9.324 -9.805 1.903 1.00 34.13 C ATOM 1917 CE1 PHE A 520 8.085 -7.656 0.715 1.00 63.12 C ATOM 1918 CE2 PHE A 520 9.003 -8.640 2.649 1.00 50.31 C ATOM 1919 CZ PHE A 520 8.390 -7.589 2.039 1.00 10.21 C ATOM 0 H PHE A 520 10.646 -12.872 -1.317 1.00 64.22 H new ATOM 0 HA PHE A 520 9.483 -10.658 -2.354 1.00 73.22 H new ATOM 0 HB2 PHE A 520 8.444 -11.649 -0.479 1.00 41.40 H new ATOM 0 HB3 PHE A 520 9.951 -11.797 0.404 1.00 41.40 H new ATOM 0 HD1 PHE A 520 8.169 -8.871 -1.083 1.00 11.41 H new ATOM 0 HD2 PHE A 520 9.811 -10.639 2.387 1.00 34.13 H new ATOM 0 HE1 PHE A 520 7.597 -6.823 0.231 1.00 63.12 H new ATOM 0 HE2 PHE A 520 9.245 -8.588 3.700 1.00 50.31 H new ATOM 0 HZ PHE A 520 8.146 -6.703 2.606 1.00 10.21 H new ATOM 1928 N ALA A 521 12.170 -9.825 -0.688 1.00 4.04 N ATOM 1929 CA ALA A 521 13.097 -8.738 -0.424 1.00 2.32 C ATOM 1930 C ALA A 521 13.417 -8.017 -1.736 1.00 23.04 C ATOM 1931 O ALA A 521 13.383 -6.789 -1.797 1.00 14.54 O ATOM 1932 CB ALA A 521 14.350 -9.291 0.258 1.00 40.12 C ATOM 0 H ALA A 521 12.483 -10.740 -0.365 1.00 4.04 H new ATOM 0 HA ALA A 521 12.652 -8.009 0.253 1.00 2.32 H new ATOM 0 HB1 ALA A 521 15.046 -8.476 0.456 1.00 40.12 H new ATOM 0 HB2 ALA A 521 14.072 -9.768 1.198 1.00 40.12 H new ATOM 0 HB3 ALA A 521 14.826 -10.024 -0.394 1.00 40.12 H new ATOM 1938 N ARG A 522 13.720 -8.812 -2.752 1.00 40.04 N ATOM 1939 CA ARG A 522 14.046 -8.266 -4.058 1.00 32.13 C ATOM 1940 C ARG A 522 12.780 -7.759 -4.752 1.00 11.50 C ATOM 1941 O ARG A 522 12.854 -6.928 -5.656 1.00 45.52 O ATOM 1942 CB ARG A 522 14.718 -9.317 -4.943 1.00 65.44 C ATOM 1943 CG ARG A 522 16.127 -9.636 -4.440 1.00 42.01 C ATOM 1944 CD ARG A 522 16.078 -10.548 -3.212 1.00 53.13 C ATOM 1945 NE ARG A 522 17.440 -11.022 -2.879 1.00 55.32 N ATOM 1946 CZ ARG A 522 18.119 -11.937 -3.601 1.00 34.43 C ATOM 1947 NH1 ARG A 522 17.569 -12.486 -4.705 1.00 54.41 N ATOM 1948 NH2 ARG A 522 19.331 -12.289 -3.211 1.00 62.44 N ATOM 0 H ARG A 522 13.746 -9.830 -2.697 1.00 40.04 H new ATOM 0 HA ARG A 522 14.739 -7.438 -3.907 1.00 32.13 H new ATOM 0 HB2 ARG A 522 14.117 -10.226 -4.954 1.00 65.44 H new ATOM 0 HB3 ARG A 522 14.768 -8.955 -5.970 1.00 65.44 H new ATOM 0 HG2 ARG A 522 16.699 -10.118 -5.233 1.00 42.01 H new ATOM 0 HG3 ARG A 522 16.646 -8.711 -4.190 1.00 42.01 H new ATOM 0 HD2 ARG A 522 15.654 -10.009 -2.365 1.00 53.13 H new ATOM 0 HD3 ARG A 522 15.425 -11.399 -3.407 1.00 53.13 H new ATOM 0 HE ARG A 522 17.893 -10.633 -2.052 1.00 55.32 H new ATOM 0 HH11 ARG A 522 16.632 -12.210 -4.999 1.00 54.41 H new ATOM 0 HH12 ARG A 522 18.090 -13.177 -5.245 1.00 54.41 H new ATOM 0 HH21 ARG A 522 19.740 -11.870 -2.375 1.00 62.44 H new ATOM 0 HH22 ARG A 522 19.858 -12.980 -3.745 1.00 62.44 H new ATOM 1958 N LYS A 523 11.648 -8.282 -4.303 1.00 34.12 N ATOM 1959 CA LYS A 523 10.368 -7.893 -4.869 1.00 14.21 C ATOM 1960 C LYS A 523 10.017 -6.478 -4.404 1.00 71.32 C ATOM 1961 O LYS A 523 9.541 -5.663 -5.191 1.00 52.35 O ATOM 1962 CB LYS A 523 9.297 -8.933 -4.536 1.00 40.23 C ATOM 1963 CG LYS A 523 9.761 -10.341 -4.912 1.00 14.12 C ATOM 1964 CD LYS A 523 10.214 -10.394 -6.373 1.00 12.34 C ATOM 1965 CE LYS A 523 9.099 -9.926 -7.312 1.00 41.25 C ATOM 1966 NZ LYS A 523 9.272 -10.515 -8.658 1.00 24.31 N ATOM 0 H LYS A 523 11.591 -8.972 -3.554 1.00 34.12 H new ATOM 0 HA LYS A 523 10.426 -7.865 -5.957 1.00 14.21 H new ATOM 0 HB2 LYS A 523 9.067 -8.895 -3.471 1.00 40.23 H new ATOM 0 HB3 LYS A 523 8.377 -8.695 -5.069 1.00 40.23 H new ATOM 0 HG2 LYS A 523 10.581 -10.644 -4.261 1.00 14.12 H new ATOM 0 HG3 LYS A 523 8.949 -11.051 -4.753 1.00 14.12 H new ATOM 0 HD2 LYS A 523 11.095 -9.766 -6.507 1.00 12.34 H new ATOM 0 HD3 LYS A 523 10.507 -11.412 -6.630 1.00 12.34 H new ATOM 0 HE2 LYS A 523 8.129 -10.213 -6.905 1.00 41.25 H new ATOM 0 HE3 LYS A 523 9.107 -8.838 -7.381 1.00 41.25 H new ATOM 0 HZ1 LYS A 523 8.507 -10.187 -9.281 1.00 24.31 H new ATOM 0 HZ2 LYS A 523 10.189 -10.221 -9.051 1.00 24.31 H new ATOM 0 HZ3 LYS A 523 9.242 -11.552 -8.590 1.00 24.31 H new ATOM 1975 N VAL A 524 10.268 -6.231 -3.127 1.00 62.54 N ATOM 1976 CA VAL A 524 9.985 -4.928 -2.548 1.00 31.11 C ATOM 1977 C VAL A 524 11.084 -3.944 -2.955 1.00 3.13 C ATOM 1978 O VAL A 524 10.797 -2.810 -3.334 1.00 24.24 O ATOM 1979 CB VAL A 524 9.826 -5.054 -1.031 1.00 22.11 C ATOM 1980 CG1 VAL A 524 11.180 -4.944 -0.327 1.00 63.43 C ATOM 1981 CG2 VAL A 524 8.843 -4.011 -0.495 1.00 43.24 C ATOM 0 H VAL A 524 10.664 -6.910 -2.477 1.00 62.54 H new ATOM 0 HA VAL A 524 9.042 -4.537 -2.929 1.00 31.11 H new ATOM 0 HB VAL A 524 9.417 -6.041 -0.817 1.00 22.11 H new ATOM 0 HG11 VAL A 524 11.039 -5.037 0.750 1.00 63.43 H new ATOM 0 HG12 VAL A 524 11.838 -5.740 -0.677 1.00 63.43 H new ATOM 0 HG13 VAL A 524 11.630 -3.977 -0.552 1.00 63.43 H new ATOM 0 HG21 VAL A 524 8.748 -4.122 0.585 1.00 43.24 H new ATOM 0 HG22 VAL A 524 9.211 -3.011 -0.726 1.00 43.24 H new ATOM 0 HG23 VAL A 524 7.869 -4.156 -0.962 1.00 43.24 H new ATOM 1991 N ALA A 525 12.319 -4.415 -2.861 1.00 23.10 N ATOM 1992 CA ALA A 525 13.462 -3.590 -3.214 1.00 21.00 C ATOM 1993 C ALA A 525 13.451 -3.328 -4.721 1.00 21.42 C ATOM 1994 O ALA A 525 14.228 -2.517 -5.220 1.00 31.41 O ATOM 1995 CB ALA A 525 14.749 -4.277 -2.751 1.00 63.21 C ATOM 0 H ALA A 525 12.553 -5.356 -2.546 1.00 23.10 H new ATOM 0 HA ALA A 525 13.408 -2.624 -2.712 1.00 21.00 H new ATOM 0 HB1 ALA A 525 15.607 -3.659 -3.015 1.00 63.21 H new ATOM 0 HB2 ALA A 525 14.720 -4.414 -1.670 1.00 63.21 H new ATOM 0 HB3 ALA A 525 14.838 -5.248 -3.237 1.00 63.21 H new ATOM 2001 N ASN A 526 12.560 -4.032 -5.404 1.00 32.41 N ATOM 2002 CA ASN A 526 12.436 -3.885 -6.844 1.00 14.15 C ATOM 2003 C ASN A 526 11.481 -2.732 -7.156 1.00 70.14 C ATOM 2004 O ASN A 526 11.802 -1.852 -7.952 1.00 70.31 O ATOM 2005 CB ASN A 526 11.868 -5.156 -7.481 1.00 41.30 C ATOM 2006 CG ASN A 526 12.980 -6.000 -8.105 1.00 12.43 C ATOM 2007 OD1 ASN A 526 14.004 -5.502 -8.541 1.00 31.31 O ATOM 2008 ND2 ASN A 526 12.721 -7.305 -8.124 1.00 33.51 N ATOM 0 H ASN A 526 11.917 -4.705 -4.987 1.00 32.41 H new ATOM 0 HA ASN A 526 13.429 -3.691 -7.249 1.00 14.15 H new ATOM 0 HB2 ASN A 526 11.342 -5.741 -6.727 1.00 41.30 H new ATOM 0 HB3 ASN A 526 11.137 -4.889 -8.244 1.00 41.30 H new ATOM 0 HD21 ASN A 526 13.401 -7.954 -8.521 1.00 33.51 H new ATOM 0 HD22 ASN A 526 11.843 -7.656 -7.742 1.00 33.51 H new ATOM 2014 N THR A 527 10.323 -2.774 -6.511 1.00 32.22 N ATOM 2015 CA THR A 527 9.318 -1.743 -6.709 1.00 25.34 C ATOM 2016 C THR A 527 9.591 -0.550 -5.791 1.00 41.10 C ATOM 2017 O THR A 527 9.703 0.583 -6.256 1.00 24.23 O ATOM 2018 CB THR A 527 7.942 -2.377 -6.492 1.00 22.30 C ATOM 2019 OG1 THR A 527 7.028 -1.315 -6.745 1.00 42.13 O ATOM 2020 CG2 THR A 527 7.692 -2.744 -5.027 1.00 75.44 C ATOM 0 H THR A 527 10.059 -3.506 -5.851 1.00 32.22 H new ATOM 0 HA THR A 527 9.352 -1.346 -7.723 1.00 25.34 H new ATOM 0 HB THR A 527 7.851 -3.270 -7.110 1.00 22.30 H new ATOM 0 HG1 THR A 527 6.666 -1.404 -7.651 1.00 42.13 H new ATOM 0 HG21 THR A 527 6.702 -3.190 -4.927 1.00 75.44 H new ATOM 0 HG22 THR A 527 8.447 -3.458 -4.697 1.00 75.44 H new ATOM 0 HG23 THR A 527 7.749 -1.846 -4.412 1.00 75.44 H new ATOM 2028 N PHE A 528 9.687 -0.846 -4.503 1.00 33.53 N ATOM 2029 CA PHE A 528 9.943 0.188 -3.516 1.00 64.45 C ATOM 2030 C PHE A 528 11.441 0.479 -3.401 1.00 70.45 C ATOM 2031 O PHE A 528 11.983 0.550 -2.299 1.00 55.21 O ATOM 2032 CB PHE A 528 9.436 -0.341 -2.172 1.00 15.20 C ATOM 2033 CG PHE A 528 7.914 -0.297 -2.021 1.00 73.13 C ATOM 2034 CD1 PHE A 528 7.266 0.899 -2.006 1.00 21.05 C ATOM 2035 CD2 PHE A 528 7.209 -1.454 -1.905 1.00 62.44 C ATOM 2036 CE1 PHE A 528 5.854 0.939 -1.866 1.00 53.12 C ATOM 2037 CE2 PHE A 528 5.796 -1.414 -1.764 1.00 72.42 C ATOM 2038 CZ PHE A 528 5.148 -0.218 -1.749 1.00 62.24 C ATOM 0 H PHE A 528 9.592 -1.787 -4.121 1.00 33.53 H new ATOM 0 HA PHE A 528 9.441 1.111 -3.807 1.00 64.45 H new ATOM 0 HB2 PHE A 528 9.774 -1.370 -2.047 1.00 15.20 H new ATOM 0 HB3 PHE A 528 9.888 0.242 -1.370 1.00 15.20 H new ATOM 0 HD1 PHE A 528 7.826 1.818 -2.101 1.00 21.05 H new ATOM 0 HD2 PHE A 528 7.723 -2.404 -1.920 1.00 62.44 H new ATOM 0 HE1 PHE A 528 5.340 1.889 -1.852 1.00 53.12 H new ATOM 0 HE2 PHE A 528 5.236 -2.333 -1.669 1.00 72.42 H new ATOM 0 HZ PHE A 528 4.074 -0.187 -1.644 1.00 62.24 H new ATOM 2047 N LYS A 529 12.070 0.640 -4.557 1.00 63.14 N ATOM 2048 CA LYS A 529 13.494 0.922 -4.602 1.00 52.44 C ATOM 2049 C LYS A 529 13.792 2.159 -3.751 1.00 10.35 C ATOM 2050 O LYS A 529 12.898 2.957 -3.476 1.00 50.13 O ATOM 2051 CB LYS A 529 13.973 1.042 -6.050 1.00 10.42 C ATOM 2052 CG LYS A 529 14.032 -0.330 -6.724 1.00 13.11 C ATOM 2053 CD LYS A 529 13.966 -0.198 -8.246 1.00 75.14 C ATOM 2054 CE LYS A 529 14.452 -1.476 -8.930 1.00 1.22 C ATOM 2055 NZ LYS A 529 14.365 -1.343 -10.402 1.00 24.15 N ATOM 0 H LYS A 529 11.618 0.580 -5.470 1.00 63.14 H new ATOM 0 HA LYS A 529 14.059 0.095 -4.172 1.00 52.44 H new ATOM 0 HB2 LYS A 529 13.301 1.696 -6.606 1.00 10.42 H new ATOM 0 HB3 LYS A 529 14.959 1.505 -6.073 1.00 10.42 H new ATOM 0 HG2 LYS A 529 14.953 -0.839 -6.439 1.00 13.11 H new ATOM 0 HG3 LYS A 529 13.205 -0.947 -6.373 1.00 13.11 H new ATOM 0 HD2 LYS A 529 12.942 0.015 -8.552 1.00 75.14 H new ATOM 0 HD3 LYS A 529 14.577 0.645 -8.568 1.00 75.14 H new ATOM 0 HE2 LYS A 529 15.482 -1.682 -8.638 1.00 1.22 H new ATOM 0 HE3 LYS A 529 13.851 -2.323 -8.600 1.00 1.22 H new ATOM 0 HZ1 LYS A 529 14.699 -2.220 -10.850 1.00 24.15 H new ATOM 0 HZ2 LYS A 529 13.377 -1.168 -10.677 1.00 24.15 H new ATOM 0 HZ3 LYS A 529 14.957 -0.547 -10.714 1.00 24.15 H new ATOM 2064 N PRO A 530 15.085 2.280 -3.347 1.00 54.01 N ATOM 2065 CA PRO A 530 15.512 3.405 -2.534 1.00 50.51 C ATOM 2066 C PRO A 530 15.618 4.681 -3.374 1.00 4.52 C ATOM 2067 O PRO A 530 15.128 5.734 -2.971 1.00 52.34 O ATOM 2068 CB PRO A 530 16.842 2.976 -1.935 1.00 51.12 C ATOM 2069 CG PRO A 530 17.335 1.825 -2.796 1.00 14.43 C ATOM 2070 CD PRO A 530 16.171 1.353 -3.653 1.00 40.40 C ATOM 0 HA PRO A 530 14.797 3.651 -1.749 1.00 50.51 H new ATOM 0 HB2 PRO A 530 17.556 3.800 -1.938 1.00 51.12 H new ATOM 0 HB3 PRO A 530 16.721 2.664 -0.898 1.00 51.12 H new ATOM 0 HG2 PRO A 530 18.166 2.147 -3.424 1.00 14.43 H new ATOM 0 HG3 PRO A 530 17.704 1.011 -2.171 1.00 14.43 H new ATOM 0 HD2 PRO A 530 16.425 1.376 -4.713 1.00 40.40 H new ATOM 0 HD3 PRO A 530 15.894 0.326 -3.414 1.00 40.40 H new ATOM 2075 N HIS A 531 16.260 4.542 -4.524 1.00 4.10 N ATOM 2076 CA HIS A 531 16.436 5.669 -5.423 1.00 43.03 C ATOM 2077 C HIS A 531 15.070 6.258 -5.781 1.00 45.11 C ATOM 2078 O HIS A 531 14.983 7.395 -6.244 1.00 2.44 O ATOM 2079 CB HIS A 531 17.246 5.259 -6.656 1.00 44.24 C ATOM 2080 CG HIS A 531 16.782 3.975 -7.296 1.00 4.22 C ATOM 2081 ND1 HIS A 531 15.977 3.945 -8.422 1.00 74.31 N ATOM 2082 CD2 HIS A 531 17.017 2.675 -6.958 1.00 24.14 C ATOM 2083 CE1 HIS A 531 15.745 2.680 -8.738 1.00 5.12 C ATOM 2084 NE2 HIS A 531 16.389 1.894 -7.829 1.00 53.14 N ATOM 0 H HIS A 531 16.665 3.666 -4.854 1.00 4.10 H new ATOM 0 HA HIS A 531 17.011 6.450 -4.925 1.00 43.03 H new ATOM 0 HB2 HIS A 531 17.195 6.060 -7.394 1.00 44.24 H new ATOM 0 HB3 HIS A 531 18.293 5.153 -6.372 1.00 44.24 H new ATOM 0 HD2 HIS A 531 17.613 2.338 -6.123 1.00 24.14 H new ATOM 0 HE1 HIS A 531 15.150 2.332 -9.570 1.00 5.12 H new ATOM 0 HE2 HIS A 531 16.388 0.874 -7.820 1.00 53.14 H new ATOM 2091 N ARG A 532 14.038 5.460 -5.550 1.00 61.21 N ATOM 2092 CA ARG A 532 12.681 5.888 -5.843 1.00 42.53 C ATOM 2093 C ARG A 532 11.988 6.364 -4.564 1.00 33.21 C ATOM 2094 O ARG A 532 11.286 7.374 -4.574 1.00 65.33 O ATOM 2095 CB ARG A 532 11.866 4.751 -6.463 1.00 61.43 C ATOM 2096 CG ARG A 532 11.884 4.835 -7.990 1.00 11.24 C ATOM 2097 CD ARG A 532 13.301 4.641 -8.535 1.00 43.01 C ATOM 2098 NE ARG A 532 13.354 5.034 -9.959 1.00 14.11 N ATOM 2099 CZ ARG A 532 13.569 6.296 -10.389 1.00 5.03 C ATOM 2100 NH1 ARG A 532 13.754 7.299 -9.504 1.00 64.51 N ATOM 2101 NH2 ARG A 532 13.597 6.534 -11.687 1.00 43.11 N ATOM 0 H ARG A 532 14.114 4.519 -5.163 1.00 61.21 H new ATOM 0 HA ARG A 532 12.739 6.709 -6.557 1.00 42.53 H new ATOM 0 HB2 ARG A 532 12.272 3.791 -6.143 1.00 61.43 H new ATOM 0 HB3 ARG A 532 10.838 4.798 -6.104 1.00 61.43 H new ATOM 0 HG2 ARG A 532 11.223 4.075 -8.407 1.00 11.24 H new ATOM 0 HG3 ARG A 532 11.498 5.803 -8.309 1.00 11.24 H new ATOM 0 HD2 ARG A 532 14.006 5.239 -7.958 1.00 43.01 H new ATOM 0 HD3 ARG A 532 13.602 3.599 -8.425 1.00 43.01 H new ATOM 0 HE ARG A 532 13.220 4.306 -10.661 1.00 14.11 H new ATOM 0 HH11 ARG A 532 13.732 7.106 -8.503 1.00 64.51 H new ATOM 0 HH12 ARG A 532 13.916 8.249 -9.837 1.00 64.51 H new ATOM 0 HH21 ARG A 532 13.457 5.770 -12.349 1.00 43.11 H new ATOM 0 HH22 ARG A 532 13.758 7.482 -12.028 1.00 43.11 H new ATOM 2111 N LEU A 533 12.209 5.614 -3.494 1.00 34.33 N ATOM 2112 CA LEU A 533 11.615 5.947 -2.211 1.00 11.12 C ATOM 2113 C LEU A 533 12.007 7.374 -1.827 1.00 64.12 C ATOM 2114 O LEU A 533 11.174 8.144 -1.352 1.00 60.43 O ATOM 2115 CB LEU A 533 11.991 4.901 -1.159 1.00 35.23 C ATOM 2116 CG LEU A 533 10.997 3.754 -0.967 1.00 73.42 C ATOM 2117 CD1 LEU A 533 10.010 4.066 0.157 1.00 4.40 C ATOM 2118 CD2 LEU A 533 10.284 3.421 -2.280 1.00 72.01 C ATOM 0 H LEU A 533 12.791 4.777 -3.490 1.00 34.33 H new ATOM 0 HA LEU A 533 10.527 5.922 -2.277 1.00 11.12 H new ATOM 0 HB2 LEU A 533 12.958 4.476 -1.428 1.00 35.23 H new ATOM 0 HB3 LEU A 533 12.120 5.407 -0.202 1.00 35.23 H new ATOM 0 HG LEU A 533 11.554 2.866 -0.668 1.00 73.42 H new ATOM 0 HD11 LEU A 533 9.315 3.234 0.272 1.00 4.40 H new ATOM 0 HD12 LEU A 533 10.555 4.215 1.089 1.00 4.40 H new ATOM 0 HD13 LEU A 533 9.455 4.972 -0.087 1.00 4.40 H new ATOM 0 HD21 LEU A 533 9.583 2.603 -2.116 1.00 72.01 H new ATOM 0 HD22 LEU A 533 9.741 4.298 -2.632 1.00 72.01 H new ATOM 0 HD23 LEU A 533 11.019 3.125 -3.028 1.00 72.01 H new