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 482 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 485 CYS SG : rot -119:sc= -0.951 USER MOD Set 2.1: A 476 ASN : amide:sc= -8.09! C(o=-13!,f=-22!) USER MOD Set 2.2: A 480 GLN : amide:sc= -5.34! C(o=-13!,f=-19!) USER MOD Set 3.1: A 458 SER OG : rot -143:sc= 0.903 USER MOD Set 3.2: A 494 SER OG : rot -82:sc= -0.077 USER MOD Set 3.3: A 498 GLN : amide:sc= 0.126 K(o=0.95,f=0.32) USER MOD Set 4.1: A 401 HIS : no HD1:sc= -7.47! C(o=-7.5!,f=-10!) USER MOD Set 4.2: A 426 THR OG1 : rot 180:sc= 0 USER MOD Single : A 395 TYR OH : rot 180:sc= 0 USER MOD Single : A 396 ASN : amide:sc= -11.9! C(o=-12!,f=-13!) USER MOD Single : A 407 HIS : no HD1:sc= -1.83! X(o=-1.8!,f=-1.7) USER MOD Single : A 415 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0205) USER MOD Single : A 443 GLN : amide:sc= -4.9! C(o=-4.9!,f=-3.3!) USER MOD Single : A 448 HIS : no HD1:sc= -0.133 X(o=-0.13,f=-0.29) USER MOD Single : A 449 SER OG : rot -130:sc= -5.72! USER MOD Single : A 457 THR OG1 : rot 180:sc= -1.14 USER MOD Single : A 459 ASN : amide:sc= -0.0497 K(o=-0.05,f=-0.95) USER MOD Single : A 462 CYS SG : rot 130:sc= -3.04 USER MOD Single : A 465 SER OG : rot -86:sc= 0.177 USER MOD Single : A 467 HIS : no HE2:sc= -1.95 K(o=-1.9,f=-3.2!) USER MOD Single : A 468 GLN : amide:sc= -0.0342 X(o=-0.034,f=0) USER MOD Single : A 470 ASN : amide:sc= -4.32! K(o=-4.3!,f=-1.8) USER MOD Single : A 471 GLN : amide:sc= -0.408 K(o=-0.41,f=-2.2!) USER MOD Single : A 473 MET CE :methyl -129:sc= -10.2! (180deg=-14.3!) USER MOD Single : A 474 MET CE :methyl -150:sc= -3.95! (180deg=-6.66!) USER MOD Single : A 475 SER OG : rot 180:sc= 0 USER MOD Single : A 478 THR OG1 : rot -40:sc= 0.23 USER MOD Single : A 495 SER OG : rot 180:sc= 0 USER MOD Single : A 500 SER OG : rot -157:sc= -0.173 USER MOD Single : A 501 SER OG : rot -37:sc= 0.118 USER MOD Single : A 503 THR OG1 : rot 180:sc= 0 USER MOD Single : A 505 SER OG : rot 180:sc= 0 USER MOD Single : A 508 SER OG : rot 33:sc= -0.116 USER MOD Single : A 516 HIS : no HD1:sc= -5.66! C(o=-5.7!,f=-5.4!) USER MOD Single : A 517 SER OG : rot 180:sc= 0.466 USER MOD Single : A 518 GLN : amide:sc= -1.42 K(o=-1.4,f=-2.2!) USER MOD Single : A 523 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 526 ASN : amide:sc= -3.33! C(o=-3.3!,f=-5.1!) USER MOD Single : A 527 THR OG1 : rot -140:sc= 0 USER MOD Single : A 529 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 531 HIS : no HD1:sc= -6.42! C(o=-6.4!,f=-10!) USER MOD ----------------------------------------------------------------- ATOM 125 N TYR A 395 3.278 9.111 4.285 1.00 75.41 N ATOM 126 CA TYR A 395 3.474 7.700 3.993 1.00 45.24 C ATOM 127 C TYR A 395 4.056 7.506 2.592 1.00 32.43 C ATOM 128 O TYR A 395 3.966 8.396 1.748 1.00 55.42 O ATOM 129 CB TYR A 395 2.085 7.063 4.047 1.00 53.11 C ATOM 130 CG TYR A 395 1.203 7.588 5.181 1.00 1.02 C ATOM 131 CD1 TYR A 395 1.727 7.745 6.448 1.00 72.35 C ATOM 132 CD2 TYR A 395 -0.119 7.905 4.939 1.00 11.34 C ATOM 133 CE1 TYR A 395 0.898 8.239 7.515 1.00 65.03 C ATOM 134 CE2 TYR A 395 -0.950 8.398 6.007 1.00 74.44 C ATOM 135 CZ TYR A 395 -0.400 8.541 7.243 1.00 51.24 C ATOM 136 OH TYR A 395 -1.184 9.009 8.250 1.00 23.12 O ATOM 0 HA TYR A 395 4.168 7.253 4.705 1.00 45.24 H new ATOM 0 HB2 TYR A 395 1.580 7.237 3.097 1.00 53.11 H new ATOM 0 HB3 TYR A 395 2.195 5.984 4.156 1.00 53.11 H new ATOM 0 HD1 TYR A 395 2.761 7.497 6.639 1.00 72.35 H new ATOM 0 HD2 TYR A 395 -0.530 7.783 3.948 1.00 11.34 H new ATOM 0 HE1 TYR A 395 1.298 8.367 8.510 1.00 65.03 H new ATOM 0 HE2 TYR A 395 -1.986 8.648 5.831 1.00 74.44 H new ATOM 0 HH TYR A 395 -2.086 9.183 7.909 1.00 23.12 H new ATOM 145 N ASN A 396 4.644 6.336 2.388 1.00 74.55 N ATOM 146 CA ASN A 396 5.243 6.013 1.103 1.00 51.24 C ATOM 147 C ASN A 396 4.451 4.881 0.447 1.00 23.24 C ATOM 148 O ASN A 396 4.618 4.609 -0.741 1.00 53.42 O ATOM 149 CB ASN A 396 6.689 5.544 1.272 1.00 52.01 C ATOM 150 CG ASN A 396 7.263 5.049 -0.058 1.00 61.42 C ATOM 151 OD1 ASN A 396 7.955 5.760 -0.769 1.00 64.23 O ATOM 152 ND2 ASN A 396 6.940 3.793 -0.352 1.00 52.13 N ATOM 0 H ASN A 396 4.719 5.600 3.090 1.00 74.55 H new ATOM 0 HA ASN A 396 5.226 6.912 0.487 1.00 51.24 H new ATOM 0 HB2 ASN A 396 7.299 6.363 1.653 1.00 52.01 H new ATOM 0 HB3 ASN A 396 6.732 4.744 2.011 1.00 52.01 H new ATOM 0 HD21 ASN A 396 7.275 3.369 -1.217 1.00 52.13 H new ATOM 0 HD22 ASN A 396 6.357 3.253 0.288 1.00 52.13 H new ATOM 158 N PHE A 397 3.607 4.250 1.249 1.00 2.21 N ATOM 159 CA PHE A 397 2.789 3.152 0.762 1.00 74.11 C ATOM 160 C PHE A 397 1.643 2.851 1.731 1.00 32.23 C ATOM 161 O PHE A 397 1.863 2.704 2.931 1.00 54.24 O ATOM 162 CB PHE A 397 3.697 1.925 0.666 1.00 62.35 C ATOM 163 CG PHE A 397 4.276 1.474 2.009 1.00 11.42 C ATOM 164 CD1 PHE A 397 5.291 2.174 2.583 1.00 50.11 C ATOM 165 CD2 PHE A 397 3.775 0.372 2.630 1.00 15.32 C ATOM 166 CE1 PHE A 397 5.827 1.755 3.829 1.00 71.31 C ATOM 167 CE2 PHE A 397 4.311 -0.046 3.876 1.00 23.12 C ATOM 168 CZ PHE A 397 5.325 0.653 4.449 1.00 75.51 C ATOM 0 H PHE A 397 3.472 4.478 2.234 1.00 2.21 H new ATOM 0 HA PHE A 397 2.354 3.411 -0.203 1.00 74.11 H new ATOM 0 HB2 PHE A 397 3.132 1.101 0.230 1.00 62.35 H new ATOM 0 HB3 PHE A 397 4.518 2.145 -0.017 1.00 62.35 H new ATOM 0 HD1 PHE A 397 5.689 3.049 2.091 1.00 50.11 H new ATOM 0 HD2 PHE A 397 2.969 -0.185 2.175 1.00 15.32 H new ATOM 0 HE1 PHE A 397 6.633 2.311 4.285 1.00 71.31 H new ATOM 0 HE2 PHE A 397 3.912 -0.920 4.369 1.00 23.12 H new ATOM 0 HZ PHE A 397 5.733 0.334 5.397 1.00 75.51 H new ATOM 177 N VAL A 398 0.445 2.765 1.171 1.00 51.43 N ATOM 178 CA VAL A 398 -0.736 2.483 1.969 1.00 63.54 C ATOM 179 C VAL A 398 -1.077 0.995 1.859 1.00 10.40 C ATOM 180 O VAL A 398 -1.413 0.511 0.780 1.00 33.34 O ATOM 181 CB VAL A 398 -1.888 3.394 1.541 1.00 73.23 C ATOM 182 CG1 VAL A 398 -2.437 2.978 0.174 1.00 0.01 C ATOM 183 CG2 VAL A 398 -2.996 3.410 2.595 1.00 10.21 C ATOM 0 H VAL A 398 0.267 2.886 0.174 1.00 51.43 H new ATOM 0 HA VAL A 398 -0.546 2.696 3.021 1.00 63.54 H new ATOM 0 HB VAL A 398 -1.497 4.408 1.451 1.00 73.23 H new ATOM 0 HG11 VAL A 398 -3.255 3.642 -0.107 1.00 0.01 H new ATOM 0 HG12 VAL A 398 -1.645 3.043 -0.572 1.00 0.01 H new ATOM 0 HG13 VAL A 398 -2.803 1.953 0.226 1.00 0.01 H new ATOM 0 HG21 VAL A 398 -3.802 4.065 2.265 1.00 10.21 H new ATOM 0 HG22 VAL A 398 -3.382 2.400 2.732 1.00 10.21 H new ATOM 0 HG23 VAL A 398 -2.594 3.776 3.540 1.00 10.21 H new ATOM 193 N ILE A 399 -0.979 0.314 2.991 1.00 60.40 N ATOM 194 CA ILE A 399 -1.272 -1.109 3.035 1.00 53.53 C ATOM 195 C ILE A 399 -2.777 -1.307 3.238 1.00 21.54 C ATOM 196 O ILE A 399 -3.274 -1.205 4.357 1.00 43.31 O ATOM 197 CB ILE A 399 -0.413 -1.801 4.094 1.00 74.55 C ATOM 198 CG1 ILE A 399 1.076 -1.656 3.771 1.00 70.55 C ATOM 199 CG2 ILE A 399 -0.822 -3.265 4.261 1.00 0.01 C ATOM 200 CD1 ILE A 399 1.939 -2.156 4.932 1.00 34.12 C ATOM 0 H ILE A 399 -0.701 0.720 3.884 1.00 60.40 H new ATOM 0 HA ILE A 399 -1.011 -1.582 2.088 1.00 53.53 H new ATOM 0 HB ILE A 399 -0.586 -1.307 5.050 1.00 74.55 H new ATOM 0 HG12 ILE A 399 1.313 -2.219 2.868 1.00 70.55 H new ATOM 0 HG13 ILE A 399 1.307 -0.611 3.565 1.00 70.55 H new ATOM 0 HG21 ILE A 399 -0.195 -3.734 5.020 1.00 0.01 H new ATOM 0 HG22 ILE A 399 -1.866 -3.318 4.569 1.00 0.01 H new ATOM 0 HG23 ILE A 399 -0.696 -3.788 3.313 1.00 0.01 H new ATOM 0 HD11 ILE A 399 2.993 -2.042 4.677 1.00 34.12 H new ATOM 0 HD12 ILE A 399 1.717 -1.575 5.827 1.00 34.12 H new ATOM 0 HD13 ILE A 399 1.723 -3.208 5.120 1.00 34.12 H new ATOM 211 N LEU A 400 -3.457 -1.590 2.137 1.00 1.13 N ATOM 212 CA LEU A 400 -4.894 -1.806 2.179 1.00 61.22 C ATOM 213 C LEU A 400 -5.179 -3.200 2.742 1.00 53.31 C ATOM 214 O LEU A 400 -4.711 -4.199 2.201 1.00 20.22 O ATOM 215 CB LEU A 400 -5.513 -1.560 0.803 1.00 53.32 C ATOM 216 CG LEU A 400 -6.056 -0.150 0.554 1.00 51.43 C ATOM 217 CD1 LEU A 400 -5.258 0.560 -0.540 1.00 51.13 C ATOM 218 CD2 LEU A 400 -7.553 -0.187 0.238 1.00 21.34 C ATOM 0 H LEU A 400 -3.040 -1.675 1.210 1.00 1.13 H new ATOM 0 HA LEU A 400 -5.368 -1.088 2.848 1.00 61.22 H new ATOM 0 HB2 LEU A 400 -4.761 -1.778 0.044 1.00 53.32 H new ATOM 0 HB3 LEU A 400 -6.326 -2.272 0.660 1.00 53.32 H new ATOM 0 HG LEU A 400 -5.934 0.429 1.469 1.00 51.43 H new ATOM 0 HD11 LEU A 400 -5.665 1.559 -0.697 1.00 51.13 H new ATOM 0 HD12 LEU A 400 -4.214 0.637 -0.237 1.00 51.13 H new ATOM 0 HD13 LEU A 400 -5.326 -0.009 -1.467 1.00 51.13 H new ATOM 0 HD21 LEU A 400 -7.914 0.827 0.065 1.00 21.34 H new ATOM 0 HD22 LEU A 400 -7.722 -0.789 -0.655 1.00 21.34 H new ATOM 0 HD23 LEU A 400 -8.091 -0.625 1.078 1.00 21.34 H new ATOM 229 N HIS A 401 -5.950 -3.220 3.820 1.00 21.40 N ATOM 230 CA HIS A 401 -6.304 -4.476 4.463 1.00 74.33 C ATOM 231 C HIS A 401 -7.682 -4.346 5.113 1.00 10.35 C ATOM 232 O HIS A 401 -8.339 -3.315 4.986 1.00 71.54 O ATOM 233 CB HIS A 401 -5.218 -4.904 5.452 1.00 4.32 C ATOM 234 CG HIS A 401 -5.204 -4.104 6.732 1.00 61.12 C ATOM 235 ND1 HIS A 401 -5.889 -4.494 7.870 1.00 13.14 N ATOM 236 CD2 HIS A 401 -4.580 -2.931 7.044 1.00 34.32 C ATOM 237 CE1 HIS A 401 -5.680 -3.591 8.815 1.00 42.13 C ATOM 238 NE2 HIS A 401 -4.869 -2.623 8.301 1.00 45.21 N ATOM 0 H HIS A 401 -6.339 -2.388 4.264 1.00 21.40 H new ATOM 0 HA HIS A 401 -6.366 -5.268 3.717 1.00 74.33 H new ATOM 0 HB2 HIS A 401 -5.357 -5.957 5.695 1.00 4.32 H new ATOM 0 HB3 HIS A 401 -4.245 -4.814 4.969 1.00 4.32 H new ATOM 0 HD2 HIS A 401 -3.956 -2.352 6.379 1.00 34.32 H new ATOM 0 HE1 HIS A 401 -6.081 -3.617 9.817 1.00 42.13 H new ATOM 0 HE2 HIS A 401 -4.539 -1.798 8.801 1.00 45.21 H new ATOM 246 N ALA A 402 -8.081 -5.412 5.795 1.00 74.24 N ATOM 247 CA ALA A 402 -9.369 -5.430 6.465 1.00 23.14 C ATOM 248 C ALA A 402 -9.243 -4.738 7.825 1.00 34.54 C ATOM 249 O ALA A 402 -8.316 -3.961 8.046 1.00 34.14 O ATOM 250 CB ALA A 402 -9.858 -6.875 6.590 1.00 71.32 C ATOM 0 H ALA A 402 -7.535 -6.267 5.897 1.00 74.24 H new ATOM 0 HA ALA A 402 -10.111 -4.882 5.884 1.00 23.14 H new ATOM 0 HB1 ALA A 402 -10.825 -6.890 7.093 1.00 71.32 H new ATOM 0 HB2 ALA A 402 -9.959 -7.312 5.597 1.00 71.32 H new ATOM 0 HB3 ALA A 402 -9.139 -7.454 7.170 1.00 71.32 H new ATOM 256 N ARG A 403 -10.189 -5.047 8.700 1.00 40.12 N ATOM 257 CA ARG A 403 -10.195 -4.465 10.031 1.00 65.02 C ATOM 258 C ARG A 403 -9.586 -5.442 11.040 1.00 52.52 C ATOM 259 O ARG A 403 -9.217 -5.047 12.146 1.00 2.24 O ATOM 260 CB ARG A 403 -11.617 -4.110 10.471 1.00 61.10 C ATOM 261 CG ARG A 403 -11.623 -3.519 11.882 1.00 3.43 C ATOM 262 CD ARG A 403 -12.146 -4.535 12.899 1.00 1.31 C ATOM 263 NE ARG A 403 -11.382 -4.428 14.161 1.00 31.41 N ATOM 264 CZ ARG A 403 -11.668 -5.124 15.282 1.00 13.43 C ATOM 265 NH1 ARG A 403 -12.707 -5.987 15.305 1.00 31.21 N ATOM 266 NH2 ARG A 403 -10.917 -4.951 16.353 1.00 11.21 N ATOM 0 H ARG A 403 -10.956 -5.693 8.513 1.00 40.12 H new ATOM 0 HA ARG A 403 -9.599 -3.553 9.997 1.00 65.02 H new ATOM 0 HB2 ARG A 403 -12.050 -3.395 9.772 1.00 61.10 H new ATOM 0 HB3 ARG A 403 -12.243 -5.002 10.444 1.00 61.10 H new ATOM 0 HG2 ARG A 403 -10.614 -3.211 12.156 1.00 3.43 H new ATOM 0 HG3 ARG A 403 -12.246 -2.624 11.903 1.00 3.43 H new ATOM 0 HD2 ARG A 403 -13.205 -4.359 13.089 1.00 1.31 H new ATOM 0 HD3 ARG A 403 -12.058 -5.544 12.496 1.00 1.31 H new ATOM 0 HE ARG A 403 -10.589 -3.788 14.186 1.00 31.41 H new ATOM 0 HH11 ARG A 403 -13.281 -6.116 14.472 1.00 31.21 H new ATOM 0 HH12 ARG A 403 -12.917 -6.510 16.155 1.00 31.21 H new ATOM 0 HH21 ARG A 403 -10.133 -4.299 16.326 1.00 11.21 H new ATOM 0 HH22 ARG A 403 -11.120 -5.469 17.208 1.00 11.21 H new ATOM 276 N ALA A 404 -9.499 -6.696 10.623 1.00 44.41 N ATOM 277 CA ALA A 404 -8.942 -7.732 11.477 1.00 54.30 C ATOM 278 C ALA A 404 -7.554 -8.119 10.962 1.00 73.11 C ATOM 279 O ALA A 404 -7.024 -9.167 11.325 1.00 71.43 O ATOM 280 CB ALA A 404 -9.899 -8.924 11.525 1.00 33.12 C ATOM 0 H ALA A 404 -9.805 -7.019 9.705 1.00 44.41 H new ATOM 0 HA ALA A 404 -8.826 -7.367 12.497 1.00 54.30 H new ATOM 0 HB1 ALA A 404 -9.481 -9.701 12.165 1.00 33.12 H new ATOM 0 HB2 ALA A 404 -10.861 -8.603 11.925 1.00 33.12 H new ATOM 0 HB3 ALA A 404 -10.038 -9.319 10.519 1.00 33.12 H new ATOM 286 N ASP A 405 -7.005 -7.250 10.124 1.00 21.03 N ATOM 287 CA ASP A 405 -5.689 -7.488 9.556 1.00 15.31 C ATOM 288 C ASP A 405 -4.759 -6.335 9.936 1.00 43.13 C ATOM 289 O ASP A 405 -3.801 -6.043 9.221 1.00 0.34 O ATOM 290 CB ASP A 405 -5.754 -7.559 8.028 1.00 11.51 C ATOM 291 CG ASP A 405 -5.339 -8.902 7.426 1.00 1.24 C ATOM 292 OD1 ASP A 405 -4.422 -8.973 6.594 1.00 12.14 O ATOM 293 OD2 ASP A 405 -6.010 -9.920 7.849 1.00 55.22 O ATOM 0 H ASP A 405 -7.448 -6.381 9.825 1.00 21.03 H new ATOM 0 HA ASP A 405 -5.319 -8.436 9.946 1.00 15.31 H new ATOM 0 HB2 ASP A 405 -6.773 -7.335 7.712 1.00 11.51 H new ATOM 0 HB3 ASP A 405 -5.114 -6.779 7.615 1.00 11.51 H new ATOM 298 N GLU A 406 -5.073 -5.710 11.062 1.00 73.51 N ATOM 299 CA GLU A 406 -4.277 -4.596 11.546 1.00 70.33 C ATOM 300 C GLU A 406 -2.845 -5.053 11.838 1.00 42.23 C ATOM 301 O GLU A 406 -1.936 -4.798 11.051 1.00 54.21 O ATOM 302 CB GLU A 406 -4.913 -3.964 12.786 1.00 10.52 C ATOM 303 CG GLU A 406 -3.998 -2.897 13.390 1.00 73.22 C ATOM 304 CD GLU A 406 -4.595 -2.327 14.678 1.00 4.01 C ATOM 305 OE1 GLU A 406 -5.580 -1.575 14.624 1.00 4.33 O ATOM 306 OE2 GLU A 406 -4.002 -2.693 15.763 1.00 33.23 O ATOM 0 H GLU A 406 -5.868 -5.955 11.652 1.00 73.51 H new ATOM 0 HA GLU A 406 -4.244 -3.835 10.767 1.00 70.33 H new ATOM 0 HB2 GLU A 406 -5.871 -3.518 12.520 1.00 10.52 H new ATOM 0 HB3 GLU A 406 -5.116 -4.736 13.528 1.00 10.52 H new ATOM 0 HG2 GLU A 406 -3.019 -3.328 13.599 1.00 73.22 H new ATOM 0 HG3 GLU A 406 -3.845 -2.094 12.669 1.00 73.22 H new ATOM 312 N HIS A 407 -2.691 -5.721 12.972 1.00 21.01 N ATOM 313 CA HIS A 407 -1.386 -6.216 13.377 1.00 30.14 C ATOM 314 C HIS A 407 -0.641 -6.756 12.155 1.00 32.42 C ATOM 315 O HIS A 407 0.565 -6.551 12.018 1.00 24.31 O ATOM 316 CB HIS A 407 -1.521 -7.251 14.494 1.00 21.41 C ATOM 317 CG HIS A 407 -2.171 -8.544 14.060 1.00 60.24 C ATOM 318 ND1 HIS A 407 -3.441 -8.597 13.512 1.00 21.51 N ATOM 319 CD2 HIS A 407 -1.713 -9.827 14.096 1.00 4.20 C ATOM 320 CE1 HIS A 407 -3.724 -9.861 13.237 1.00 0.34 C ATOM 321 NE2 HIS A 407 -2.653 -10.623 13.601 1.00 62.53 N ATOM 0 H HIS A 407 -3.448 -5.931 13.623 1.00 21.01 H new ATOM 0 HA HIS A 407 -0.794 -5.398 13.788 1.00 30.14 H new ATOM 0 HB2 HIS A 407 -0.531 -7.470 14.893 1.00 21.41 H new ATOM 0 HB3 HIS A 407 -2.104 -6.819 15.307 1.00 21.41 H new ATOM 0 HD2 HIS A 407 -0.748 -10.143 14.465 1.00 4.20 H new ATOM 0 HE1 HIS A 407 -4.642 -10.225 12.801 1.00 0.34 H new ATOM 0 HE2 HIS A 407 -2.585 -11.637 13.508 1.00 62.53 H new ATOM 328 N ILE A 408 -1.389 -7.435 11.299 1.00 34.43 N ATOM 329 CA ILE A 408 -0.813 -8.007 10.092 1.00 71.03 C ATOM 330 C ILE A 408 -0.118 -6.904 9.291 1.00 14.52 C ATOM 331 O ILE A 408 1.041 -7.047 8.906 1.00 20.40 O ATOM 332 CB ILE A 408 -1.878 -8.767 9.298 1.00 42.32 C ATOM 333 CG1 ILE A 408 -2.317 -10.029 10.040 1.00 3.23 C ATOM 334 CG2 ILE A 408 -1.390 -9.075 7.881 1.00 40.15 C ATOM 335 CD1 ILE A 408 -3.485 -10.708 9.322 1.00 4.54 C ATOM 0 H ILE A 408 -2.388 -7.603 11.416 1.00 34.43 H new ATOM 0 HA ILE A 408 -0.052 -8.744 10.346 1.00 71.03 H new ATOM 0 HB ILE A 408 -2.755 -8.127 9.204 1.00 42.32 H new ATOM 0 HG12 ILE A 408 -1.479 -10.722 10.114 1.00 3.23 H new ATOM 0 HG13 ILE A 408 -2.610 -9.773 11.058 1.00 3.23 H new ATOM 0 HG21 ILE A 408 -2.166 -9.615 7.338 1.00 40.15 H new ATOM 0 HG22 ILE A 408 -1.167 -8.143 7.362 1.00 40.15 H new ATOM 0 HG23 ILE A 408 -0.489 -9.687 7.931 1.00 40.15 H new ATOM 0 HD11 ILE A 408 -3.778 -11.603 9.870 1.00 4.54 H new ATOM 0 HD12 ILE A 408 -4.330 -10.021 9.271 1.00 4.54 H new ATOM 0 HD13 ILE A 408 -3.180 -10.984 8.313 1.00 4.54 H new ATOM 346 N ALA A 409 -0.858 -5.828 9.063 1.00 45.25 N ATOM 347 CA ALA A 409 -0.327 -4.702 8.315 1.00 61.03 C ATOM 348 C ALA A 409 0.798 -4.046 9.119 1.00 73.33 C ATOM 349 O ALA A 409 1.885 -3.812 8.592 1.00 65.44 O ATOM 350 CB ALA A 409 -1.460 -3.723 7.993 1.00 4.44 C ATOM 0 H ALA A 409 -1.820 -5.713 9.383 1.00 45.25 H new ATOM 0 HA ALA A 409 0.096 -5.036 7.367 1.00 61.03 H new ATOM 0 HB1 ALA A 409 -1.062 -2.878 7.432 1.00 4.44 H new ATOM 0 HB2 ALA A 409 -2.220 -4.229 7.397 1.00 4.44 H new ATOM 0 HB3 ALA A 409 -1.906 -3.365 8.921 1.00 4.44 H new ATOM 356 N LEU A 410 0.498 -3.767 10.378 1.00 65.13 N ATOM 357 CA LEU A 410 1.471 -3.142 11.258 1.00 45.34 C ATOM 358 C LEU A 410 2.672 -4.076 11.428 1.00 52.35 C ATOM 359 O LEU A 410 3.719 -3.661 11.921 1.00 24.53 O ATOM 360 CB LEU A 410 0.815 -2.738 12.580 1.00 62.23 C ATOM 361 CG LEU A 410 -0.052 -1.477 12.540 1.00 21.54 C ATOM 362 CD1 LEU A 410 -1.268 -1.678 11.635 1.00 11.44 C ATOM 363 CD2 LEU A 410 -0.455 -1.044 13.952 1.00 34.41 C ATOM 0 H LEU A 410 -0.405 -3.962 10.810 1.00 65.13 H new ATOM 0 HA LEU A 410 1.845 -2.217 10.818 1.00 45.34 H new ATOM 0 HB2 LEU A 410 0.199 -3.568 12.926 1.00 62.23 H new ATOM 0 HB3 LEU A 410 1.599 -2.592 13.323 1.00 62.23 H new ATOM 0 HG LEU A 410 0.540 -0.668 12.111 1.00 21.54 H new ATOM 0 HD11 LEU A 410 -1.868 -0.768 11.624 1.00 11.44 H new ATOM 0 HD12 LEU A 410 -0.934 -1.905 10.623 1.00 11.44 H new ATOM 0 HD13 LEU A 410 -1.870 -2.504 12.013 1.00 11.44 H new ATOM 0 HD21 LEU A 410 -1.070 -0.146 13.896 1.00 34.41 H new ATOM 0 HD22 LEU A 410 -1.022 -1.843 14.430 1.00 34.41 H new ATOM 0 HD23 LEU A 410 0.440 -0.834 14.538 1.00 34.41 H new ATOM 374 N ARG A 411 2.479 -5.318 11.009 1.00 12.51 N ATOM 375 CA ARG A 411 3.532 -6.313 11.109 1.00 13.34 C ATOM 376 C ARG A 411 4.462 -6.224 9.896 1.00 1.22 C ATOM 377 O ARG A 411 5.566 -6.766 9.916 1.00 52.44 O ATOM 378 CB ARG A 411 2.950 -7.725 11.194 1.00 44.41 C ATOM 379 CG ARG A 411 2.919 -8.219 12.643 1.00 50.01 C ATOM 380 CD ARG A 411 3.245 -9.712 12.719 1.00 44.44 C ATOM 381 NE ARG A 411 2.704 -10.411 11.531 1.00 53.14 N ATOM 382 CZ ARG A 411 3.100 -11.636 11.128 1.00 10.30 C ATOM 383 NH1 ARG A 411 4.045 -12.311 11.815 1.00 41.55 N ATOM 384 NH2 ARG A 411 2.549 -12.164 10.051 1.00 21.30 N ATOM 0 H ARG A 411 1.609 -5.658 10.600 1.00 12.51 H new ATOM 0 HA ARG A 411 4.095 -6.110 12.020 1.00 13.34 H new ATOM 0 HB2 ARG A 411 1.941 -7.732 10.782 1.00 44.41 H new ATOM 0 HB3 ARG A 411 3.547 -8.405 10.587 1.00 44.41 H new ATOM 0 HG2 ARG A 411 3.637 -7.655 13.239 1.00 50.01 H new ATOM 0 HG3 ARG A 411 1.934 -8.036 13.073 1.00 50.01 H new ATOM 0 HD2 ARG A 411 4.324 -9.854 12.774 1.00 44.44 H new ATOM 0 HD3 ARG A 411 2.820 -10.139 13.627 1.00 44.44 H new ATOM 0 HE ARG A 411 1.987 -9.936 10.983 1.00 53.14 H new ATOM 0 HH11 ARG A 411 4.466 -11.895 12.646 1.00 41.55 H new ATOM 0 HH12 ARG A 411 4.339 -13.237 11.503 1.00 41.55 H new ATOM 0 HH21 ARG A 411 1.836 -11.647 9.537 1.00 21.30 H new ATOM 0 HH22 ARG A 411 2.837 -13.089 9.732 1.00 21.30 H new ATOM 394 N VAL A 412 3.980 -5.539 8.870 1.00 50.02 N ATOM 395 CA VAL A 412 4.754 -5.373 7.652 1.00 51.34 C ATOM 396 C VAL A 412 5.482 -4.028 7.694 1.00 40.12 C ATOM 397 O VAL A 412 6.692 -3.965 7.483 1.00 31.03 O ATOM 398 CB VAL A 412 3.845 -5.523 6.430 1.00 50.13 C ATOM 399 CG1 VAL A 412 4.453 -4.834 5.207 1.00 71.41 C ATOM 400 CG2 VAL A 412 3.554 -6.997 6.141 1.00 74.44 C ATOM 0 H VAL A 412 3.063 -5.092 8.857 1.00 50.02 H new ATOM 0 HA VAL A 412 5.513 -6.151 7.573 1.00 51.34 H new ATOM 0 HB VAL A 412 2.898 -5.032 6.654 1.00 50.13 H new ATOM 0 HG11 VAL A 412 3.787 -4.956 4.352 1.00 71.41 H new ATOM 0 HG12 VAL A 412 4.585 -3.772 5.416 1.00 71.41 H new ATOM 0 HG13 VAL A 412 5.420 -5.282 4.980 1.00 71.41 H new ATOM 0 HG21 VAL A 412 2.906 -7.076 5.268 1.00 74.44 H new ATOM 0 HG22 VAL A 412 4.490 -7.521 5.947 1.00 74.44 H new ATOM 0 HG23 VAL A 412 3.059 -7.446 7.002 1.00 74.44 H new ATOM 410 N ARG A 413 4.713 -2.983 7.968 1.00 44.12 N ATOM 411 CA ARG A 413 5.270 -1.643 8.042 1.00 64.43 C ATOM 412 C ARG A 413 6.671 -1.683 8.656 1.00 42.22 C ATOM 413 O ARG A 413 7.571 -0.978 8.202 1.00 25.11 O ATOM 414 CB ARG A 413 4.380 -0.722 8.878 1.00 43.00 C ATOM 415 CG ARG A 413 2.907 -0.888 8.497 1.00 13.20 C ATOM 416 CD ARG A 413 2.092 0.339 8.910 1.00 13.12 C ATOM 417 NE ARG A 413 2.584 0.861 10.205 1.00 55.21 N ATOM 418 CZ ARG A 413 1.814 1.520 11.096 1.00 72.43 C ATOM 419 NH1 ARG A 413 0.508 1.745 10.840 1.00 50.32 N ATOM 420 NH2 ARG A 413 2.357 1.943 12.222 1.00 62.51 N ATOM 0 H ARG A 413 3.709 -3.038 8.141 1.00 44.12 H new ATOM 0 HA ARG A 413 5.326 -1.251 7.026 1.00 64.43 H new ATOM 0 HB2 ARG A 413 4.513 -0.945 9.937 1.00 43.00 H new ATOM 0 HB3 ARG A 413 4.683 0.315 8.730 1.00 43.00 H new ATOM 0 HG2 ARG A 413 2.821 -1.041 7.421 1.00 13.20 H new ATOM 0 HG3 ARG A 413 2.501 -1.778 8.979 1.00 13.20 H new ATOM 0 HD2 ARG A 413 2.169 1.111 8.145 1.00 13.12 H new ATOM 0 HD3 ARG A 413 1.038 0.075 8.992 1.00 13.12 H new ATOM 0 HE ARG A 413 3.566 0.713 10.438 1.00 55.21 H new ATOM 0 HH11 ARG A 413 0.095 1.416 9.967 1.00 50.32 H new ATOM 0 HH12 ARG A 413 -0.066 2.244 11.519 1.00 50.32 H new ATOM 0 HH21 ARG A 413 3.345 1.770 12.408 1.00 62.51 H new ATOM 0 HH22 ARG A 413 1.789 2.443 12.906 1.00 62.51 H new ATOM 430 N GLU A 414 6.811 -2.514 9.678 1.00 10.01 N ATOM 431 CA GLU A 414 8.087 -2.655 10.359 1.00 53.50 C ATOM 432 C GLU A 414 9.075 -3.426 9.481 1.00 72.21 C ATOM 433 O GLU A 414 10.105 -2.885 9.077 1.00 3.44 O ATOM 434 CB GLU A 414 7.912 -3.338 11.717 1.00 53.24 C ATOM 435 CG GLU A 414 7.174 -2.424 12.698 1.00 12.21 C ATOM 436 CD GLU A 414 7.259 -2.970 14.125 1.00 54.24 C ATOM 437 OE1 GLU A 414 7.034 -4.169 14.344 1.00 12.24 O ATOM 438 OE2 GLU A 414 7.570 -2.100 15.024 1.00 22.42 O ATOM 0 H GLU A 414 6.062 -3.097 10.051 1.00 10.01 H new ATOM 0 HA GLU A 414 8.492 -1.659 10.540 1.00 53.50 H new ATOM 0 HB2 GLU A 414 7.357 -4.268 11.592 1.00 53.24 H new ATOM 0 HB3 GLU A 414 8.888 -3.602 12.124 1.00 53.24 H new ATOM 0 HG2 GLU A 414 7.604 -1.423 12.662 1.00 12.21 H new ATOM 0 HG3 GLU A 414 6.129 -2.334 12.401 1.00 12.21 H new ATOM 444 N LYS A 415 8.727 -4.675 9.212 1.00 21.22 N ATOM 445 CA LYS A 415 9.570 -5.527 8.389 1.00 71.35 C ATOM 446 C LYS A 415 10.169 -4.696 7.252 1.00 31.35 C ATOM 447 O LYS A 415 11.373 -4.751 7.006 1.00 21.34 O ATOM 448 CB LYS A 415 8.790 -6.754 7.912 1.00 51.23 C ATOM 449 CG LYS A 415 9.606 -8.033 8.110 1.00 2.22 C ATOM 450 CD LYS A 415 10.974 -7.921 7.432 1.00 3.41 C ATOM 451 CE LYS A 415 10.833 -7.936 5.909 1.00 53.40 C ATOM 452 NZ LYS A 415 10.777 -9.327 5.406 1.00 4.50 N ATOM 0 H LYS A 415 7.873 -5.118 9.549 1.00 21.22 H new ATOM 0 HA LYS A 415 10.404 -5.918 8.972 1.00 71.35 H new ATOM 0 HB2 LYS A 415 7.851 -6.829 8.461 1.00 51.23 H new ATOM 0 HB3 LYS A 415 8.535 -6.640 6.858 1.00 51.23 H new ATOM 0 HG2 LYS A 415 9.738 -8.223 9.175 1.00 2.22 H new ATOM 0 HG3 LYS A 415 9.061 -8.883 7.700 1.00 2.22 H new ATOM 0 HD2 LYS A 415 11.466 -7.000 7.746 1.00 3.41 H new ATOM 0 HD3 LYS A 415 11.610 -8.747 7.750 1.00 3.41 H new ATOM 0 HE2 LYS A 415 9.930 -7.401 5.616 1.00 53.40 H new ATOM 0 HE3 LYS A 415 11.675 -7.413 5.455 1.00 53.40 H new ATOM 0 HZ1 LYS A 415 10.767 -9.320 4.366 1.00 4.50 H new ATOM 0 HZ2 LYS A 415 11.611 -9.851 5.740 1.00 4.50 H new ATOM 0 HZ3 LYS A 415 9.914 -9.789 5.758 1.00 4.50 H new ATOM 461 N LEU A 416 9.302 -3.949 6.588 1.00 11.53 N ATOM 462 CA LEU A 416 9.729 -3.108 5.482 1.00 21.23 C ATOM 463 C LEU A 416 10.978 -2.327 5.894 1.00 4.05 C ATOM 464 O LEU A 416 12.032 -2.463 5.273 1.00 41.23 O ATOM 465 CB LEU A 416 8.577 -2.220 5.007 1.00 73.23 C ATOM 466 CG LEU A 416 7.408 -2.941 4.332 1.00 33.03 C ATOM 467 CD1 LEU A 416 6.217 -1.999 4.146 1.00 44.21 C ATOM 468 CD2 LEU A 416 7.847 -3.578 3.012 1.00 35.41 C ATOM 0 H LEU A 416 8.304 -3.908 6.794 1.00 11.53 H new ATOM 0 HA LEU A 416 10.004 -3.720 4.623 1.00 21.23 H new ATOM 0 HB2 LEU A 416 8.192 -1.669 5.865 1.00 73.23 H new ATOM 0 HB3 LEU A 416 8.976 -1.484 4.309 1.00 73.23 H new ATOM 0 HG LEU A 416 7.080 -3.749 4.986 1.00 33.03 H new ATOM 0 HD11 LEU A 416 5.400 -2.536 3.664 1.00 44.21 H new ATOM 0 HD12 LEU A 416 5.887 -1.633 5.118 1.00 44.21 H new ATOM 0 HD13 LEU A 416 6.514 -1.156 3.523 1.00 44.21 H new ATOM 0 HD21 LEU A 416 6.998 -4.084 2.552 1.00 35.41 H new ATOM 0 HD22 LEU A 416 8.216 -2.804 2.339 1.00 35.41 H new ATOM 0 HD23 LEU A 416 8.640 -4.301 3.203 1.00 35.41 H new ATOM 479 N GLU A 417 10.819 -1.528 6.938 1.00 72.25 N ATOM 480 CA GLU A 417 11.922 -0.725 7.439 1.00 43.21 C ATOM 481 C GLU A 417 13.229 -1.517 7.372 1.00 11.44 C ATOM 482 O GLU A 417 14.303 -0.938 7.213 1.00 40.13 O ATOM 483 CB GLU A 417 11.646 -0.245 8.866 1.00 11.10 C ATOM 484 CG GLU A 417 10.289 0.456 8.955 1.00 55.03 C ATOM 485 CD GLU A 417 10.375 1.708 9.832 1.00 64.51 C ATOM 486 OE1 GLU A 417 11.480 2.219 10.077 1.00 51.50 O ATOM 487 OE2 GLU A 417 9.244 2.149 10.265 1.00 1.33 O ATOM 0 H GLU A 417 9.944 -1.419 7.451 1.00 72.25 H new ATOM 0 HA GLU A 417 12.021 0.156 6.806 1.00 43.21 H new ATOM 0 HB2 GLU A 417 11.667 -1.094 9.550 1.00 11.10 H new ATOM 0 HB3 GLU A 417 12.434 0.438 9.183 1.00 11.10 H new ATOM 0 HG2 GLU A 417 9.951 0.730 7.956 1.00 55.03 H new ATOM 0 HG3 GLU A 417 9.548 -0.230 9.365 1.00 55.03 H new ATOM 493 N ALA A 418 13.096 -2.829 7.493 1.00 31.25 N ATOM 494 CA ALA A 418 14.254 -3.707 7.447 1.00 75.11 C ATOM 495 C ALA A 418 14.885 -3.638 6.056 1.00 74.22 C ATOM 496 O ALA A 418 16.081 -3.378 5.925 1.00 70.20 O ATOM 497 CB ALA A 418 13.832 -5.128 7.828 1.00 34.30 C ATOM 0 H ALA A 418 12.204 -3.306 7.623 1.00 31.25 H new ATOM 0 HA ALA A 418 15.008 -3.388 8.166 1.00 75.11 H new ATOM 0 HB1 ALA A 418 14.700 -5.787 7.794 1.00 34.30 H new ATOM 0 HB2 ALA A 418 13.417 -5.126 8.836 1.00 34.30 H new ATOM 0 HB3 ALA A 418 13.078 -5.484 7.126 1.00 34.30 H new ATOM 503 N LEU A 419 14.055 -3.875 5.052 1.00 11.23 N ATOM 504 CA LEU A 419 14.516 -3.843 3.674 1.00 64.54 C ATOM 505 C LEU A 419 14.872 -2.404 3.294 1.00 53.34 C ATOM 506 O LEU A 419 15.920 -2.156 2.700 1.00 74.32 O ATOM 507 CB LEU A 419 13.484 -4.489 2.748 1.00 72.43 C ATOM 508 CG LEU A 419 12.915 -5.831 3.209 1.00 23.32 C ATOM 509 CD1 LEU A 419 11.409 -5.904 2.958 1.00 0.33 C ATOM 510 CD2 LEU A 419 13.662 -6.996 2.556 1.00 34.54 C ATOM 0 H LEU A 419 13.064 -4.090 5.165 1.00 11.23 H new ATOM 0 HA LEU A 419 15.424 -4.436 3.561 1.00 64.54 H new ATOM 0 HB2 LEU A 419 12.656 -3.792 2.617 1.00 72.43 H new ATOM 0 HB3 LEU A 419 13.941 -4.628 1.768 1.00 72.43 H new ATOM 0 HG LEU A 419 13.066 -5.914 4.285 1.00 23.32 H new ATOM 0 HD11 LEU A 419 11.030 -6.869 3.295 1.00 0.33 H new ATOM 0 HD12 LEU A 419 10.909 -5.106 3.507 1.00 0.33 H new ATOM 0 HD13 LEU A 419 11.212 -5.789 1.892 1.00 0.33 H new ATOM 0 HD21 LEU A 419 13.238 -7.939 2.901 1.00 34.54 H new ATOM 0 HD22 LEU A 419 13.565 -6.929 1.472 1.00 34.54 H new ATOM 0 HD23 LEU A 419 14.716 -6.951 2.829 1.00 34.54 H new ATOM 521 N GLY A 420 13.977 -1.493 3.649 1.00 25.25 N ATOM 522 CA GLY A 420 14.182 -0.087 3.352 1.00 62.12 C ATOM 523 C GLY A 420 12.919 0.726 3.645 1.00 23.34 C ATOM 524 O GLY A 420 12.886 1.510 4.591 1.00 25.23 O ATOM 0 H GLY A 420 13.108 -1.703 4.140 1.00 25.25 H new ATOM 0 HA2 GLY A 420 15.011 0.297 3.946 1.00 62.12 H new ATOM 0 HA3 GLY A 420 14.459 0.030 2.304 1.00 62.12 H new ATOM 528 N VAL A 421 11.910 0.510 2.815 1.00 11.11 N ATOM 529 CA VAL A 421 10.647 1.212 2.974 1.00 12.24 C ATOM 530 C VAL A 421 10.313 1.323 4.462 1.00 23.31 C ATOM 531 O VAL A 421 10.482 0.364 5.213 1.00 4.41 O ATOM 532 CB VAL A 421 9.552 0.510 2.166 1.00 73.12 C ATOM 533 CG1 VAL A 421 9.785 -1.001 2.127 1.00 21.43 C ATOM 534 CG2 VAL A 421 8.166 0.838 2.722 1.00 52.12 C ATOM 0 H VAL A 421 11.941 -0.141 2.030 1.00 11.11 H new ATOM 0 HA VAL A 421 10.723 2.226 2.582 1.00 12.24 H new ATOM 0 HB VAL A 421 9.598 0.882 1.143 1.00 73.12 H new ATOM 0 HG11 VAL A 421 8.994 -1.476 1.547 1.00 21.43 H new ATOM 0 HG12 VAL A 421 10.749 -1.209 1.663 1.00 21.43 H new ATOM 0 HG13 VAL A 421 9.778 -1.397 3.143 1.00 21.43 H new ATOM 0 HG21 VAL A 421 7.406 0.327 2.130 1.00 52.12 H new ATOM 0 HG22 VAL A 421 8.102 0.507 3.759 1.00 52.12 H new ATOM 0 HG23 VAL A 421 8.000 1.914 2.674 1.00 52.12 H new ATOM 544 N PRO A 422 9.834 2.534 4.856 1.00 35.40 N ATOM 545 CA PRO A 422 9.476 2.782 6.241 1.00 72.23 C ATOM 546 C PRO A 422 8.150 2.104 6.594 1.00 64.41 C ATOM 547 O PRO A 422 7.690 1.218 5.875 1.00 62.55 O ATOM 548 CB PRO A 422 9.421 4.296 6.368 1.00 74.22 C ATOM 549 CG PRO A 422 9.293 4.829 4.949 1.00 40.31 C ATOM 550 CD PRO A 422 9.622 3.693 3.994 1.00 74.45 C ATOM 0 HA PRO A 422 10.196 2.363 6.943 1.00 72.23 H new ATOM 0 HB2 PRO A 422 8.574 4.606 6.980 1.00 74.22 H new ATOM 0 HB3 PRO A 422 10.320 4.680 6.850 1.00 74.22 H new ATOM 0 HG2 PRO A 422 8.283 5.199 4.769 1.00 40.31 H new ATOM 0 HG3 PRO A 422 9.972 5.668 4.793 1.00 40.31 H new ATOM 0 HD2 PRO A 422 8.808 3.519 3.290 1.00 74.45 H new ATOM 0 HD3 PRO A 422 10.511 3.916 3.405 1.00 74.45 H new ATOM 555 N ASP A 423 7.574 2.547 7.702 1.00 3.52 N ATOM 556 CA ASP A 423 6.310 1.994 8.160 1.00 40.52 C ATOM 557 C ASP A 423 5.231 2.261 7.109 1.00 13.42 C ATOM 558 O ASP A 423 4.425 1.385 6.804 1.00 30.02 O ATOM 559 CB ASP A 423 5.866 2.646 9.471 1.00 52.25 C ATOM 560 CG ASP A 423 5.941 4.174 9.491 1.00 20.43 C ATOM 561 OD1 ASP A 423 6.990 4.757 9.803 1.00 42.35 O ATOM 562 OD2 ASP A 423 4.850 4.778 9.164 1.00 12.41 O ATOM 0 H ASP A 423 7.959 3.282 8.296 1.00 3.52 H new ATOM 0 HA ASP A 423 6.447 0.924 8.318 1.00 40.52 H new ATOM 0 HB2 ASP A 423 4.839 2.345 9.680 1.00 52.25 H new ATOM 0 HB3 ASP A 423 6.483 2.256 10.280 1.00 52.25 H new ATOM 567 N GLY A 424 5.248 3.479 6.586 1.00 14.01 N ATOM 568 CA GLY A 424 4.281 3.874 5.576 1.00 62.35 C ATOM 569 C GLY A 424 2.921 4.178 6.209 1.00 32.55 C ATOM 570 O GLY A 424 2.696 5.279 6.705 1.00 30.22 O ATOM 0 H GLY A 424 5.917 4.205 6.843 1.00 14.01 H new ATOM 0 HA2 GLY A 424 4.644 4.754 5.044 1.00 62.35 H new ATOM 0 HA3 GLY A 424 4.174 3.078 4.839 1.00 62.35 H new ATOM 574 N ALA A 425 2.050 3.179 6.168 1.00 41.32 N ATOM 575 CA ALA A 425 0.718 3.326 6.731 1.00 74.44 C ATOM 576 C ALA A 425 -0.185 2.216 6.190 1.00 33.14 C ATOM 577 O ALA A 425 0.276 1.334 5.467 1.00 34.41 O ATOM 578 CB ALA A 425 0.180 4.723 6.412 1.00 12.44 C ATOM 0 H ALA A 425 2.241 2.266 5.754 1.00 41.32 H new ATOM 0 HA ALA A 425 0.747 3.228 7.816 1.00 74.44 H new ATOM 0 HB1 ALA A 425 -0.819 4.833 6.834 1.00 12.44 H new ATOM 0 HB2 ALA A 425 0.841 5.475 6.843 1.00 12.44 H new ATOM 0 HB3 ALA A 425 0.134 4.857 5.331 1.00 12.44 H new ATOM 584 N THR A 426 -1.453 2.295 6.562 1.00 70.50 N ATOM 585 CA THR A 426 -2.425 1.307 6.123 1.00 33.34 C ATOM 586 C THR A 426 -3.823 1.924 6.065 1.00 1.33 C ATOM 587 O THR A 426 -4.087 2.935 6.713 1.00 12.22 O ATOM 588 CB THR A 426 -2.330 0.101 7.060 1.00 51.22 C ATOM 589 OG1 THR A 426 -3.091 0.488 8.201 1.00 60.10 O ATOM 590 CG2 THR A 426 -0.917 -0.104 7.608 1.00 64.50 C ATOM 0 H THR A 426 -1.831 3.028 7.163 1.00 70.50 H new ATOM 0 HA THR A 426 -2.213 0.966 5.110 1.00 33.34 H new ATOM 0 HB THR A 426 -2.648 -0.797 6.530 1.00 51.22 H new ATOM 0 HG1 THR A 426 -3.084 -0.237 8.860 1.00 60.10 H new ATOM 0 HG21 THR A 426 -0.905 -0.972 8.267 1.00 64.50 H new ATOM 0 HG22 THR A 426 -0.226 -0.266 6.781 1.00 64.50 H new ATOM 0 HG23 THR A 426 -0.612 0.780 8.167 1.00 64.50 H new ATOM 598 N PHE A 427 -4.685 1.287 5.285 1.00 31.12 N ATOM 599 CA PHE A 427 -6.051 1.761 5.136 1.00 30.24 C ATOM 600 C PHE A 427 -7.024 0.884 5.926 1.00 70.20 C ATOM 601 O PHE A 427 -6.670 -0.214 6.353 1.00 30.13 O ATOM 602 CB PHE A 427 -6.394 1.671 3.648 1.00 30.05 C ATOM 603 CG PHE A 427 -7.576 2.547 3.228 1.00 10.10 C ATOM 604 CD1 PHE A 427 -8.849 2.123 3.450 1.00 71.22 C ATOM 605 CD2 PHE A 427 -7.352 3.749 2.633 1.00 40.53 C ATOM 606 CE1 PHE A 427 -9.946 2.937 3.061 1.00 75.31 C ATOM 607 CE2 PHE A 427 -8.450 4.563 2.243 1.00 74.52 C ATOM 608 CZ PHE A 427 -9.723 4.138 2.466 1.00 55.24 C ATOM 0 H PHE A 427 -4.464 0.447 4.750 1.00 31.12 H new ATOM 0 HA PHE A 427 -6.136 2.780 5.512 1.00 30.24 H new ATOM 0 HB2 PHE A 427 -5.518 1.957 3.066 1.00 30.05 H new ATOM 0 HB3 PHE A 427 -6.617 0.634 3.399 1.00 30.05 H new ATOM 0 HD1 PHE A 427 -9.026 1.168 3.922 1.00 71.22 H new ATOM 0 HD2 PHE A 427 -6.341 4.085 2.457 1.00 40.53 H new ATOM 0 HE1 PHE A 427 -10.957 2.601 3.238 1.00 75.31 H new ATOM 0 HE2 PHE A 427 -8.274 5.518 1.770 1.00 74.52 H new ATOM 0 HZ PHE A 427 -10.558 4.756 2.170 1.00 55.24 H new ATOM 823 N GLN A 443 -7.135 7.171 -2.874 1.00 70.23 N ATOM 824 CA GLN A 443 -6.289 7.668 -3.946 1.00 64.31 C ATOM 825 C GLN A 443 -5.292 8.694 -3.402 1.00 30.22 C ATOM 826 O GLN A 443 -4.410 9.153 -4.126 1.00 1.34 O ATOM 827 CB GLN A 443 -7.129 8.266 -5.075 1.00 14.15 C ATOM 828 CG GLN A 443 -6.272 9.145 -5.989 1.00 15.03 C ATOM 829 CD GLN A 443 -7.052 9.558 -7.239 1.00 74.45 C ATOM 830 OE1 GLN A 443 -8.015 10.306 -7.183 1.00 32.24 O ATOM 831 NE2 GLN A 443 -6.584 9.031 -8.368 1.00 4.42 N ATOM 0 HA GLN A 443 -5.729 6.829 -4.360 1.00 64.31 H new ATOM 0 HB2 GLN A 443 -7.585 7.465 -5.657 1.00 14.15 H new ATOM 0 HB3 GLN A 443 -7.942 8.857 -4.654 1.00 14.15 H new ATOM 0 HG2 GLN A 443 -5.949 10.034 -5.447 1.00 15.03 H new ATOM 0 HG3 GLN A 443 -5.371 8.604 -6.280 1.00 15.03 H new ATOM 0 HE21 GLN A 443 -5.774 8.412 -8.344 1.00 4.42 H new ATOM 0 HE22 GLN A 443 -7.036 9.246 -9.257 1.00 4.42 H new ATOM 838 N ASP A 444 -5.465 9.024 -2.130 1.00 73.34 N ATOM 839 CA ASP A 444 -4.591 9.988 -1.481 1.00 4.25 C ATOM 840 C ASP A 444 -3.179 9.406 -1.389 1.00 64.23 C ATOM 841 O ASP A 444 -2.197 10.117 -1.597 1.00 10.22 O ATOM 842 CB ASP A 444 -5.071 10.296 -0.062 1.00 21.41 C ATOM 843 CG ASP A 444 -4.368 11.473 0.618 1.00 32.14 C ATOM 844 OD1 ASP A 444 -4.377 12.602 0.106 1.00 75.42 O ATOM 845 OD2 ASP A 444 -3.784 11.191 1.733 1.00 75.40 O ATOM 0 H ASP A 444 -6.197 8.641 -1.532 1.00 73.34 H new ATOM 0 HA ASP A 444 -4.600 10.905 -2.071 1.00 4.25 H new ATOM 0 HB2 ASP A 444 -6.141 10.500 -0.093 1.00 21.41 H new ATOM 0 HB3 ASP A 444 -4.934 9.406 0.553 1.00 21.41 H new ATOM 850 N ALA A 445 -3.122 8.120 -1.075 1.00 12.12 N ATOM 851 CA ALA A 445 -1.846 7.436 -0.952 1.00 63.02 C ATOM 852 C ALA A 445 -1.288 7.150 -2.348 1.00 52.22 C ATOM 853 O ALA A 445 -0.075 7.076 -2.531 1.00 73.43 O ATOM 854 CB ALA A 445 -2.028 6.161 -0.125 1.00 11.43 C ATOM 0 H ALA A 445 -3.939 7.534 -0.902 1.00 12.12 H new ATOM 0 HA ALA A 445 -1.123 8.063 -0.430 1.00 63.02 H new ATOM 0 HB1 ALA A 445 -1.071 5.648 -0.033 1.00 11.43 H new ATOM 0 HB2 ALA A 445 -2.398 6.420 0.867 1.00 11.43 H new ATOM 0 HB3 ALA A 445 -2.745 5.506 -0.620 1.00 11.43 H new ATOM 860 N ILE A 446 -2.201 7.000 -3.296 1.00 51.43 N ATOM 861 CA ILE A 446 -1.816 6.725 -4.670 1.00 5.22 C ATOM 862 C ILE A 446 -0.822 7.789 -5.139 1.00 74.14 C ATOM 863 O ILE A 446 0.072 7.502 -5.933 1.00 41.50 O ATOM 864 CB ILE A 446 -3.056 6.606 -5.560 1.00 73.41 C ATOM 865 CG1 ILE A 446 -3.607 5.179 -5.544 1.00 64.14 C ATOM 866 CG2 ILE A 446 -2.757 7.089 -6.981 1.00 41.11 C ATOM 867 CD1 ILE A 446 -4.935 5.096 -6.299 1.00 74.03 C ATOM 0 H ILE A 446 -3.207 7.064 -3.140 1.00 51.43 H new ATOM 0 HA ILE A 446 -1.309 5.763 -4.739 1.00 5.22 H new ATOM 0 HB ILE A 446 -3.832 7.255 -5.155 1.00 73.41 H new ATOM 0 HG12 ILE A 446 -2.884 4.501 -5.997 1.00 64.14 H new ATOM 0 HG13 ILE A 446 -3.749 4.852 -4.514 1.00 64.14 H new ATOM 0 HG21 ILE A 446 -3.654 6.994 -7.594 1.00 41.11 H new ATOM 0 HG22 ILE A 446 -2.446 8.133 -6.952 1.00 41.11 H new ATOM 0 HG23 ILE A 446 -1.959 6.484 -7.411 1.00 41.11 H new ATOM 0 HD11 ILE A 446 -5.305 4.071 -6.273 1.00 74.03 H new ATOM 0 HD12 ILE A 446 -5.663 5.757 -5.829 1.00 74.03 H new ATOM 0 HD13 ILE A 446 -4.784 5.401 -7.335 1.00 74.03 H new ATOM 878 N ASP A 447 -1.011 8.997 -4.626 1.00 11.34 N ATOM 879 CA ASP A 447 -0.141 10.105 -4.983 1.00 13.31 C ATOM 880 C ASP A 447 0.829 10.377 -3.832 1.00 64.13 C ATOM 881 O ASP A 447 2.043 10.349 -4.019 1.00 61.42 O ATOM 882 CB ASP A 447 -0.949 11.381 -5.233 1.00 4.34 C ATOM 883 CG ASP A 447 -2.140 11.586 -4.293 1.00 75.50 C ATOM 884 OD1 ASP A 447 -3.292 11.302 -4.651 1.00 52.15 O ATOM 885 OD2 ASP A 447 -1.841 12.066 -3.134 1.00 42.13 O ATOM 0 H ASP A 447 -1.753 9.232 -3.967 1.00 11.34 H new ATOM 0 HA ASP A 447 0.395 9.834 -5.892 1.00 13.31 H new ATOM 0 HB2 ASP A 447 -0.282 12.239 -5.143 1.00 4.34 H new ATOM 0 HB3 ASP A 447 -1.314 11.367 -6.260 1.00 4.34 H new ATOM 890 N HIS A 448 0.255 10.635 -2.665 1.00 54.53 N ATOM 891 CA HIS A 448 1.053 10.912 -1.483 1.00 72.01 C ATOM 892 C HIS A 448 2.026 9.758 -1.239 1.00 23.31 C ATOM 893 O HIS A 448 3.222 9.977 -1.055 1.00 34.21 O ATOM 894 CB HIS A 448 0.156 11.199 -0.277 1.00 33.43 C ATOM 895 CG HIS A 448 0.773 12.130 0.738 1.00 64.51 C ATOM 896 ND1 HIS A 448 1.349 13.342 0.395 1.00 12.34 N ATOM 897 CD2 HIS A 448 0.898 12.016 2.093 1.00 55.24 C ATOM 898 CE1 HIS A 448 1.796 13.921 1.499 1.00 35.23 C ATOM 899 NE2 HIS A 448 1.516 13.098 2.550 1.00 11.05 N ATOM 0 H HIS A 448 -0.753 10.658 -2.514 1.00 54.53 H new ATOM 0 HA HIS A 448 1.646 11.813 -1.642 1.00 72.01 H new ATOM 0 HB2 HIS A 448 -0.781 11.631 -0.629 1.00 33.43 H new ATOM 0 HB3 HIS A 448 -0.091 10.257 0.212 1.00 33.43 H new ATOM 0 HD2 HIS A 448 0.553 11.186 2.691 1.00 55.24 H new ATOM 0 HE1 HIS A 448 2.295 14.877 1.557 1.00 35.23 H new ATOM 0 HE2 HIS A 448 1.744 13.284 3.527 1.00 11.05 H new ATOM 906 N SER A 449 1.477 8.553 -1.245 1.00 10.02 N ATOM 907 CA SER A 449 2.281 7.363 -1.026 1.00 24.44 C ATOM 908 C SER A 449 2.911 6.907 -2.344 1.00 51.21 C ATOM 909 O SER A 449 2.250 6.897 -3.381 1.00 42.33 O ATOM 910 CB SER A 449 1.442 6.235 -0.420 1.00 32.42 C ATOM 911 OG SER A 449 0.438 6.730 0.459 1.00 41.45 O ATOM 0 H SER A 449 0.484 8.375 -1.398 1.00 10.02 H new ATOM 0 HA SER A 449 3.073 7.611 -0.319 1.00 24.44 H new ATOM 0 HB2 SER A 449 0.973 5.662 -1.220 1.00 32.42 H new ATOM 0 HB3 SER A 449 2.093 5.550 0.123 1.00 32.42 H new ATOM 0 HG SER A 449 0.477 6.242 1.308 1.00 41.45 H new ATOM 916 N ALA A 450 4.182 6.539 -2.259 1.00 71.23 N ATOM 917 CA ALA A 450 4.908 6.084 -3.432 1.00 34.13 C ATOM 918 C ALA A 450 4.085 5.012 -4.151 1.00 73.51 C ATOM 919 O ALA A 450 3.404 5.304 -5.134 1.00 2.14 O ATOM 920 CB ALA A 450 6.287 5.575 -3.012 1.00 20.43 C ATOM 0 H ALA A 450 4.726 6.547 -1.396 1.00 71.23 H new ATOM 0 HA ALA A 450 5.063 6.906 -4.131 1.00 34.13 H new ATOM 0 HB1 ALA A 450 6.832 5.233 -3.892 1.00 20.43 H new ATOM 0 HB2 ALA A 450 6.842 6.381 -2.532 1.00 20.43 H new ATOM 0 HB3 ALA A 450 6.172 4.747 -2.313 1.00 20.43 H new ATOM 926 N PHE A 451 4.176 3.795 -3.635 1.00 72.43 N ATOM 927 CA PHE A 451 3.451 2.679 -4.216 1.00 53.44 C ATOM 928 C PHE A 451 2.418 2.126 -3.231 1.00 32.24 C ATOM 929 O PHE A 451 2.742 1.848 -2.079 1.00 11.35 O ATOM 930 CB PHE A 451 4.477 1.589 -4.526 1.00 51.03 C ATOM 931 CG PHE A 451 5.762 2.111 -5.174 1.00 14.12 C ATOM 932 CD1 PHE A 451 6.681 2.776 -4.424 1.00 42.51 C ATOM 933 CD2 PHE A 451 5.984 1.909 -6.500 1.00 62.43 C ATOM 934 CE1 PHE A 451 7.872 3.260 -5.025 1.00 13.44 C ATOM 935 CE2 PHE A 451 7.176 2.393 -7.101 1.00 13.52 C ATOM 936 CZ PHE A 451 8.095 3.058 -6.352 1.00 63.22 C ATOM 0 H PHE A 451 4.742 3.558 -2.820 1.00 72.43 H new ATOM 0 HA PHE A 451 2.923 3.005 -5.112 1.00 53.44 H new ATOM 0 HB2 PHE A 451 4.733 1.071 -3.602 1.00 51.03 H new ATOM 0 HB3 PHE A 451 4.021 0.853 -5.188 1.00 51.03 H new ATOM 0 HD1 PHE A 451 6.504 2.936 -3.371 1.00 42.51 H new ATOM 0 HD2 PHE A 451 5.254 1.381 -7.096 1.00 62.43 H new ATOM 0 HE1 PHE A 451 8.601 3.789 -4.429 1.00 13.44 H new ATOM 0 HE2 PHE A 451 7.353 2.233 -8.154 1.00 13.52 H new ATOM 0 HZ PHE A 451 9.001 3.426 -6.810 1.00 63.22 H new ATOM 945 N ILE A 452 1.195 1.983 -3.724 1.00 75.03 N ATOM 946 CA ILE A 452 0.114 1.468 -2.902 1.00 2.32 C ATOM 947 C ILE A 452 0.279 -0.044 -2.739 1.00 43.31 C ATOM 948 O ILE A 452 0.496 -0.757 -3.717 1.00 21.23 O ATOM 949 CB ILE A 452 -1.242 1.880 -3.481 1.00 60.34 C ATOM 950 CG1 ILE A 452 -1.252 3.366 -3.849 1.00 35.42 C ATOM 951 CG2 ILE A 452 -2.379 1.519 -2.523 1.00 40.53 C ATOM 952 CD1 ILE A 452 -1.085 4.241 -2.605 1.00 1.13 C ATOM 0 H ILE A 452 0.930 2.215 -4.681 1.00 75.03 H new ATOM 0 HA ILE A 452 0.154 1.903 -1.903 1.00 2.32 H new ATOM 0 HB ILE A 452 -1.406 1.319 -4.401 1.00 60.34 H new ATOM 0 HG12 ILE A 452 -0.448 3.575 -4.555 1.00 35.42 H new ATOM 0 HG13 ILE A 452 -2.188 3.614 -4.349 1.00 35.42 H new ATOM 0 HG21 ILE A 452 -3.331 1.822 -2.958 1.00 40.53 H new ATOM 0 HG22 ILE A 452 -2.384 0.442 -2.354 1.00 40.53 H new ATOM 0 HG23 ILE A 452 -2.233 2.035 -1.574 1.00 40.53 H new ATOM 0 HD11 ILE A 452 -1.096 5.292 -2.895 1.00 1.13 H new ATOM 0 HD12 ILE A 452 -1.904 4.048 -1.912 1.00 1.13 H new ATOM 0 HD13 ILE A 452 -0.137 4.008 -2.121 1.00 1.13 H new ATOM 963 N ILE A 453 0.169 -0.488 -1.496 1.00 12.32 N ATOM 964 CA ILE A 453 0.304 -1.903 -1.192 1.00 3.50 C ATOM 965 C ILE A 453 -1.077 -2.487 -0.887 1.00 25.33 C ATOM 966 O ILE A 453 -1.724 -2.090 0.081 1.00 21.23 O ATOM 967 CB ILE A 453 1.322 -2.116 -0.071 1.00 31.34 C ATOM 968 CG1 ILE A 453 2.751 -2.122 -0.623 1.00 41.44 C ATOM 969 CG2 ILE A 453 1.009 -3.387 0.722 1.00 73.12 C ATOM 970 CD1 ILE A 453 3.762 -1.770 0.470 1.00 52.32 C ATOM 0 H ILE A 453 -0.012 0.107 -0.687 1.00 12.32 H new ATOM 0 HA ILE A 453 0.697 -2.442 -2.054 1.00 3.50 H new ATOM 0 HB ILE A 453 1.247 -1.278 0.622 1.00 31.34 H new ATOM 0 HG12 ILE A 453 2.982 -3.105 -1.034 1.00 41.44 H new ATOM 0 HG13 ILE A 453 2.831 -1.407 -1.442 1.00 41.44 H new ATOM 0 HG21 ILE A 453 1.749 -3.514 1.513 1.00 73.12 H new ATOM 0 HG22 ILE A 453 0.016 -3.305 1.164 1.00 73.12 H new ATOM 0 HG23 ILE A 453 1.039 -4.249 0.055 1.00 73.12 H new ATOM 0 HD11 ILE A 453 4.769 -1.781 0.052 1.00 52.32 H new ATOM 0 HD12 ILE A 453 3.543 -0.777 0.862 1.00 52.32 H new ATOM 0 HD13 ILE A 453 3.696 -2.501 1.276 1.00 52.32 H new ATOM 981 N LEU A 454 -1.487 -3.422 -1.731 1.00 3.44 N ATOM 982 CA LEU A 454 -2.780 -4.067 -1.563 1.00 53.24 C ATOM 983 C LEU A 454 -2.597 -5.378 -0.796 1.00 71.22 C ATOM 984 O LEU A 454 -2.037 -6.337 -1.325 1.00 53.03 O ATOM 985 CB LEU A 454 -3.473 -4.237 -2.916 1.00 33.25 C ATOM 986 CG LEU A 454 -3.981 -2.955 -3.578 1.00 45.15 C ATOM 987 CD1 LEU A 454 -2.960 -1.824 -3.438 1.00 54.12 C ATOM 988 CD2 LEU A 454 -4.364 -3.205 -5.037 1.00 73.01 C ATOM 0 H LEU A 454 -0.948 -3.749 -2.533 1.00 3.44 H new ATOM 0 HA LEU A 454 -3.444 -3.440 -0.967 1.00 53.24 H new ATOM 0 HB2 LEU A 454 -2.777 -4.723 -3.599 1.00 33.25 H new ATOM 0 HB3 LEU A 454 -4.317 -4.914 -2.786 1.00 33.25 H new ATOM 0 HG LEU A 454 -4.885 -2.638 -3.059 1.00 45.15 H new ATOM 0 HD11 LEU A 454 -3.346 -0.924 -3.917 1.00 54.12 H new ATOM 0 HD12 LEU A 454 -2.781 -1.624 -2.382 1.00 54.12 H new ATOM 0 HD13 LEU A 454 -2.025 -2.117 -3.916 1.00 54.12 H new ATOM 0 HD21 LEU A 454 -4.722 -2.277 -5.483 1.00 73.01 H new ATOM 0 HD22 LEU A 454 -3.492 -3.559 -5.587 1.00 73.01 H new ATOM 0 HD23 LEU A 454 -5.152 -3.957 -5.083 1.00 73.01 H new ATOM 999 N LEU A 455 -3.079 -5.377 0.437 1.00 41.54 N ATOM 1000 CA LEU A 455 -2.975 -6.555 1.282 1.00 51.21 C ATOM 1001 C LEU A 455 -4.058 -7.559 0.886 1.00 53.11 C ATOM 1002 O LEU A 455 -5.092 -7.656 1.546 1.00 42.23 O ATOM 1003 CB LEU A 455 -3.015 -6.159 2.760 1.00 70.13 C ATOM 1004 CG LEU A 455 -2.264 -7.082 3.722 1.00 22.10 C ATOM 1005 CD1 LEU A 455 -0.860 -7.394 3.199 1.00 41.03 C ATOM 1006 CD2 LEU A 455 -2.233 -6.494 5.133 1.00 65.21 C ATOM 0 H LEU A 455 -3.543 -4.579 0.872 1.00 41.54 H new ATOM 0 HA LEU A 455 -2.014 -7.047 1.133 1.00 51.21 H new ATOM 0 HB2 LEU A 455 -2.605 -5.154 2.858 1.00 70.13 H new ATOM 0 HB3 LEU A 455 -4.057 -6.110 3.074 1.00 70.13 H new ATOM 0 HG LEU A 455 -2.803 -8.028 3.779 1.00 22.10 H new ATOM 0 HD11 LEU A 455 -0.348 -8.052 3.901 1.00 41.03 H new ATOM 0 HD12 LEU A 455 -0.934 -7.886 2.229 1.00 41.03 H new ATOM 0 HD13 LEU A 455 -0.297 -6.467 3.093 1.00 41.03 H new ATOM 0 HD21 LEU A 455 -1.694 -7.169 5.797 1.00 65.21 H new ATOM 0 HD22 LEU A 455 -1.731 -5.527 5.113 1.00 65.21 H new ATOM 0 HD23 LEU A 455 -3.253 -6.366 5.496 1.00 65.21 H new ATOM 1017 N LEU A 456 -3.786 -8.280 -0.191 1.00 14.05 N ATOM 1018 CA LEU A 456 -4.725 -9.275 -0.684 1.00 70.33 C ATOM 1019 C LEU A 456 -4.826 -10.419 0.325 1.00 43.12 C ATOM 1020 O LEU A 456 -4.037 -11.363 0.280 1.00 61.35 O ATOM 1021 CB LEU A 456 -4.334 -9.729 -2.092 1.00 42.33 C ATOM 1022 CG LEU A 456 -3.912 -8.621 -3.061 1.00 3.15 C ATOM 1023 CD1 LEU A 456 -4.077 -9.074 -4.513 1.00 74.02 C ATOM 1024 CD2 LEU A 456 -4.669 -7.324 -2.775 1.00 51.41 C ATOM 0 H LEU A 456 -2.929 -8.196 -0.737 1.00 14.05 H new ATOM 0 HA LEU A 456 -5.722 -8.844 -0.778 1.00 70.33 H new ATOM 0 HB2 LEU A 456 -3.514 -10.442 -2.008 1.00 42.33 H new ATOM 0 HB3 LEU A 456 -5.178 -10.263 -2.528 1.00 42.33 H new ATOM 0 HG LEU A 456 -2.853 -8.415 -2.905 1.00 3.15 H new ATOM 0 HD11 LEU A 456 -3.771 -8.270 -5.182 1.00 74.02 H new ATOM 0 HD12 LEU A 456 -3.456 -9.952 -4.693 1.00 74.02 H new ATOM 0 HD13 LEU A 456 -5.121 -9.324 -4.700 1.00 74.02 H new ATOM 0 HD21 LEU A 456 -4.350 -6.554 -3.478 1.00 51.41 H new ATOM 0 HD22 LEU A 456 -5.740 -7.496 -2.886 1.00 51.41 H new ATOM 0 HD23 LEU A 456 -4.458 -6.996 -1.757 1.00 51.41 H new ATOM 1035 N THR A 457 -5.802 -10.298 1.213 1.00 44.30 N ATOM 1036 CA THR A 457 -6.016 -11.312 2.232 1.00 71.24 C ATOM 1037 C THR A 457 -7.479 -11.761 2.239 1.00 62.44 C ATOM 1038 O THR A 457 -8.364 -11.005 1.843 1.00 2.54 O ATOM 1039 CB THR A 457 -5.549 -10.740 3.573 1.00 62.14 C ATOM 1040 OG1 THR A 457 -6.583 -9.831 3.941 1.00 33.21 O ATOM 1041 CG2 THR A 457 -4.309 -9.857 3.432 1.00 73.34 C ATOM 0 H THR A 457 -6.453 -9.514 1.248 1.00 44.30 H new ATOM 0 HA THR A 457 -5.434 -12.210 2.025 1.00 71.24 H new ATOM 0 HB THR A 457 -5.336 -11.557 4.262 1.00 62.14 H new ATOM 0 HG1 THR A 457 -6.363 -9.416 4.801 1.00 33.21 H new ATOM 0 HG21 THR A 457 -4.020 -9.477 4.412 1.00 73.34 H new ATOM 0 HG22 THR A 457 -3.491 -10.443 3.014 1.00 73.34 H new ATOM 0 HG23 THR A 457 -4.531 -9.020 2.770 1.00 73.34 H new ATOM 1049 N SER A 458 -7.685 -12.988 2.694 1.00 12.31 N ATOM 1050 CA SER A 458 -9.025 -13.547 2.758 1.00 41.23 C ATOM 1051 C SER A 458 -9.913 -12.676 3.651 1.00 10.14 C ATOM 1052 O SER A 458 -11.137 -12.789 3.612 1.00 65.33 O ATOM 1053 CB SER A 458 -8.999 -14.985 3.276 1.00 62.30 C ATOM 1054 OG SER A 458 -7.953 -15.192 4.222 1.00 20.21 O ATOM 0 H SER A 458 -6.947 -13.611 3.022 1.00 12.31 H new ATOM 0 HA SER A 458 -9.438 -13.562 1.749 1.00 41.23 H new ATOM 0 HB2 SER A 458 -9.958 -15.222 3.738 1.00 62.30 H new ATOM 0 HB3 SER A 458 -8.871 -15.670 2.438 1.00 62.30 H new ATOM 0 HG SER A 458 -7.573 -16.087 4.099 1.00 20.21 H new ATOM 1059 N ASN A 459 -9.261 -11.831 4.435 1.00 23.51 N ATOM 1060 CA ASN A 459 -9.974 -10.944 5.336 1.00 25.10 C ATOM 1061 C ASN A 459 -10.190 -9.593 4.652 1.00 54.31 C ATOM 1062 O ASN A 459 -11.051 -8.815 5.061 1.00 63.23 O ATOM 1063 CB ASN A 459 -9.175 -10.701 6.619 1.00 60.33 C ATOM 1064 CG ASN A 459 -9.308 -11.884 7.580 1.00 34.12 C ATOM 1065 OD1 ASN A 459 -9.464 -13.026 7.182 1.00 3.42 O ATOM 1066 ND2 ASN A 459 -9.236 -11.546 8.865 1.00 10.44 N ATOM 0 H ASN A 459 -8.245 -11.742 4.465 1.00 23.51 H new ATOM 0 HA ASN A 459 -10.925 -11.414 5.587 1.00 25.10 H new ATOM 0 HB2 ASN A 459 -8.125 -10.544 6.373 1.00 60.33 H new ATOM 0 HB3 ASN A 459 -9.528 -9.792 7.105 1.00 60.33 H new ATOM 0 HD21 ASN A 459 -9.312 -12.263 9.586 1.00 10.44 H new ATOM 0 HD22 ASN A 459 -9.104 -10.570 9.129 1.00 10.44 H new ATOM 1072 N PHE A 460 -9.394 -9.355 3.620 1.00 71.20 N ATOM 1073 CA PHE A 460 -9.487 -8.112 2.872 1.00 65.53 C ATOM 1074 C PHE A 460 -10.036 -8.357 1.466 1.00 4.11 C ATOM 1075 O PHE A 460 -10.001 -9.482 0.969 1.00 73.13 O ATOM 1076 CB PHE A 460 -8.068 -7.549 2.762 1.00 61.12 C ATOM 1077 CG PHE A 460 -7.918 -6.438 1.722 1.00 4.34 C ATOM 1078 CD1 PHE A 460 -8.341 -5.178 2.009 1.00 74.54 C ATOM 1079 CD2 PHE A 460 -7.364 -6.710 0.510 1.00 3.15 C ATOM 1080 CE1 PHE A 460 -8.201 -4.146 1.043 1.00 54.44 C ATOM 1081 CE2 PHE A 460 -7.226 -5.680 -0.455 1.00 44.14 C ATOM 1082 CZ PHE A 460 -7.647 -4.418 -0.169 1.00 55.23 C ATOM 0 H PHE A 460 -8.681 -10.002 3.284 1.00 71.20 H new ATOM 0 HA PHE A 460 -10.161 -7.422 3.380 1.00 65.53 H new ATOM 0 HB2 PHE A 460 -7.764 -7.164 3.736 1.00 61.12 H new ATOM 0 HB3 PHE A 460 -7.385 -8.361 2.513 1.00 61.12 H new ATOM 0 HD1 PHE A 460 -8.783 -4.962 2.970 1.00 74.54 H new ATOM 0 HD2 PHE A 460 -7.029 -7.711 0.282 1.00 3.15 H new ATOM 0 HE1 PHE A 460 -8.535 -3.145 1.271 1.00 54.44 H new ATOM 0 HE2 PHE A 460 -6.787 -5.897 -1.417 1.00 44.14 H new ATOM 0 HZ PHE A 460 -7.541 -3.633 -0.904 1.00 55.23 H new ATOM 1091 N ASP A 461 -10.532 -7.286 0.865 1.00 33.22 N ATOM 1092 CA ASP A 461 -11.089 -7.370 -0.475 1.00 61.13 C ATOM 1093 C ASP A 461 -10.119 -6.723 -1.466 1.00 34.13 C ATOM 1094 O ASP A 461 -9.649 -5.610 -1.244 1.00 71.43 O ATOM 1095 CB ASP A 461 -12.423 -6.626 -0.565 1.00 51.21 C ATOM 1096 CG ASP A 461 -13.248 -6.928 -1.817 1.00 13.23 C ATOM 1097 OD1 ASP A 461 -12.933 -6.456 -2.920 1.00 41.10 O ATOM 1098 OD2 ASP A 461 -14.269 -7.694 -1.625 1.00 24.43 O ATOM 0 H ASP A 461 -10.560 -6.355 1.281 1.00 33.22 H new ATOM 0 HA ASP A 461 -11.247 -8.423 -0.710 1.00 61.13 H new ATOM 0 HB2 ASP A 461 -13.020 -6.873 0.313 1.00 51.21 H new ATOM 0 HB3 ASP A 461 -12.228 -5.554 -0.527 1.00 51.21 H new ATOM 1103 N CYS A 462 -9.850 -7.451 -2.541 1.00 73.12 N ATOM 1104 CA CYS A 462 -8.945 -6.963 -3.567 1.00 74.12 C ATOM 1105 C CYS A 462 -9.776 -6.274 -4.652 1.00 31.11 C ATOM 1106 O CYS A 462 -9.523 -5.121 -4.996 1.00 30.30 O ATOM 1107 CB CYS A 462 -8.079 -8.087 -4.140 1.00 43.04 C ATOM 1108 SG CYS A 462 -7.600 -9.248 -2.808 1.00 53.53 S ATOM 0 H CYS A 462 -10.243 -8.374 -2.723 1.00 73.12 H new ATOM 0 HA CYS A 462 -8.251 -6.245 -3.131 1.00 74.12 H new ATOM 0 HB2 CYS A 462 -8.627 -8.619 -4.918 1.00 43.04 H new ATOM 0 HB3 CYS A 462 -7.188 -7.669 -4.607 1.00 43.04 H new ATOM 0 HG CYS A 462 -7.860 -10.466 -3.180 1.00 53.53 H new ATOM 1113 N ARG A 463 -10.752 -7.012 -5.162 1.00 74.23 N ATOM 1114 CA ARG A 463 -11.622 -6.486 -6.201 1.00 3.31 C ATOM 1115 C ARG A 463 -11.945 -5.016 -5.930 1.00 23.32 C ATOM 1116 O ARG A 463 -12.144 -4.239 -6.862 1.00 22.24 O ATOM 1117 CB ARG A 463 -12.927 -7.282 -6.281 1.00 62.32 C ATOM 1118 CG ARG A 463 -12.780 -8.484 -7.216 1.00 32.10 C ATOM 1119 CD ARG A 463 -14.014 -9.385 -7.148 1.00 41.10 C ATOM 1120 NE ARG A 463 -15.150 -8.742 -7.845 1.00 34.12 N ATOM 1121 CZ ARG A 463 -16.011 -7.885 -7.255 1.00 11.14 C ATOM 1122 NH1 ARG A 463 -15.873 -7.564 -5.953 1.00 40.22 N ATOM 1123 NH2 ARG A 463 -16.992 -7.369 -7.974 1.00 21.33 N ATOM 0 H ARG A 463 -10.959 -7.969 -4.875 1.00 74.23 H new ATOM 0 HA ARG A 463 -11.096 -6.576 -7.151 1.00 3.31 H new ATOM 0 HB2 ARG A 463 -13.210 -7.624 -5.285 1.00 62.32 H new ATOM 0 HB3 ARG A 463 -13.730 -6.636 -6.637 1.00 62.32 H new ATOM 0 HG2 ARG A 463 -12.634 -8.138 -8.239 1.00 32.10 H new ATOM 0 HG3 ARG A 463 -11.893 -9.055 -6.943 1.00 32.10 H new ATOM 0 HD2 ARG A 463 -13.795 -10.350 -7.605 1.00 41.10 H new ATOM 0 HD3 ARG A 463 -14.277 -9.577 -6.108 1.00 41.10 H new ATOM 0 HE ARG A 463 -15.291 -8.959 -8.831 1.00 34.12 H new ATOM 0 HH11 ARG A 463 -15.114 -7.969 -5.406 1.00 40.22 H new ATOM 0 HH12 ARG A 463 -16.528 -6.916 -5.515 1.00 40.22 H new ATOM 0 HH21 ARG A 463 -17.090 -7.620 -8.958 1.00 21.33 H new ATOM 0 HH22 ARG A 463 -17.652 -6.720 -7.545 1.00 21.33 H new ATOM 1133 N LEU A 464 -11.986 -4.679 -4.649 1.00 53.22 N ATOM 1134 CA LEU A 464 -12.282 -3.315 -4.244 1.00 63.41 C ATOM 1135 C LEU A 464 -11.075 -2.424 -4.548 1.00 3.01 C ATOM 1136 O LEU A 464 -11.091 -1.660 -5.512 1.00 62.43 O ATOM 1137 CB LEU A 464 -12.722 -3.276 -2.780 1.00 65.44 C ATOM 1138 CG LEU A 464 -13.297 -1.944 -2.288 1.00 61.20 C ATOM 1139 CD1 LEU A 464 -12.209 -1.080 -1.647 1.00 35.14 C ATOM 1140 CD2 LEU A 464 -14.022 -1.210 -3.417 1.00 53.33 C ATOM 0 H LEU A 464 -11.819 -5.326 -3.879 1.00 53.22 H new ATOM 0 HA LEU A 464 -13.122 -2.921 -4.816 1.00 63.41 H new ATOM 0 HB2 LEU A 464 -13.472 -4.052 -2.626 1.00 65.44 H new ATOM 0 HB3 LEU A 464 -11.865 -3.532 -2.157 1.00 65.44 H new ATOM 0 HG LEU A 464 -14.036 -2.155 -1.515 1.00 61.20 H new ATOM 0 HD11 LEU A 464 -12.644 -0.140 -1.306 1.00 35.14 H new ATOM 0 HD12 LEU A 464 -11.778 -1.609 -0.797 1.00 35.14 H new ATOM 0 HD13 LEU A 464 -11.429 -0.874 -2.380 1.00 35.14 H new ATOM 0 HD21 LEU A 464 -14.421 -0.268 -3.041 1.00 53.33 H new ATOM 0 HD22 LEU A 464 -13.323 -1.010 -4.229 1.00 53.33 H new ATOM 0 HD23 LEU A 464 -14.840 -1.828 -3.787 1.00 53.33 H new ATOM 1151 N SER A 465 -10.059 -2.552 -3.707 1.00 30.15 N ATOM 1152 CA SER A 465 -8.846 -1.770 -3.873 1.00 15.13 C ATOM 1153 C SER A 465 -8.504 -1.645 -5.360 1.00 2.11 C ATOM 1154 O SER A 465 -7.919 -0.649 -5.785 1.00 12.33 O ATOM 1155 CB SER A 465 -7.677 -2.394 -3.110 1.00 42.34 C ATOM 1156 OG SER A 465 -7.754 -3.817 -3.088 1.00 72.34 O ATOM 0 H SER A 465 -10.051 -3.186 -2.908 1.00 30.15 H new ATOM 0 HA SER A 465 -9.022 -0.776 -3.461 1.00 15.13 H new ATOM 0 HB2 SER A 465 -6.738 -2.089 -3.572 1.00 42.34 H new ATOM 0 HB3 SER A 465 -7.667 -2.015 -2.088 1.00 42.34 H new ATOM 0 HG SER A 465 -8.308 -4.103 -2.332 1.00 72.34 H new ATOM 1161 N LEU A 466 -8.882 -2.670 -6.109 1.00 63.42 N ATOM 1162 CA LEU A 466 -8.621 -2.688 -7.538 1.00 0.22 C ATOM 1163 C LEU A 466 -9.559 -1.702 -8.237 1.00 4.21 C ATOM 1164 O LEU A 466 -9.107 -0.796 -8.933 1.00 31.53 O ATOM 1165 CB LEU A 466 -8.715 -4.115 -8.082 1.00 25.52 C ATOM 1166 CG LEU A 466 -8.134 -4.342 -9.478 1.00 74.32 C ATOM 1167 CD1 LEU A 466 -7.557 -5.753 -9.611 1.00 55.14 C ATOM 1168 CD2 LEU A 466 -9.173 -4.044 -10.561 1.00 60.34 C ATOM 0 H LEU A 466 -9.367 -3.494 -5.753 1.00 63.42 H new ATOM 0 HA LEU A 466 -7.602 -2.359 -7.742 1.00 0.22 H new ATOM 0 HB2 LEU A 466 -8.206 -4.782 -7.386 1.00 25.52 H new ATOM 0 HB3 LEU A 466 -9.765 -4.409 -8.095 1.00 25.52 H new ATOM 0 HG LEU A 466 -7.310 -3.643 -9.621 1.00 74.32 H new ATOM 0 HD11 LEU A 466 -7.151 -5.887 -10.614 1.00 55.14 H new ATOM 0 HD12 LEU A 466 -6.764 -5.893 -8.876 1.00 55.14 H new ATOM 0 HD13 LEU A 466 -8.345 -6.486 -9.438 1.00 55.14 H new ATOM 0 HD21 LEU A 466 -8.733 -4.214 -11.544 1.00 60.34 H new ATOM 0 HD22 LEU A 466 -10.033 -4.700 -10.430 1.00 60.34 H new ATOM 0 HD23 LEU A 466 -9.494 -3.005 -10.481 1.00 60.34 H new ATOM 1179 N HIS A 467 -10.850 -1.912 -8.023 1.00 40.33 N ATOM 1180 CA HIS A 467 -11.857 -1.051 -8.623 1.00 34.44 C ATOM 1181 C HIS A 467 -11.545 0.409 -8.295 1.00 55.04 C ATOM 1182 O HIS A 467 -11.690 1.285 -9.146 1.00 33.44 O ATOM 1183 CB HIS A 467 -13.260 -1.471 -8.184 1.00 10.45 C ATOM 1184 CG HIS A 467 -14.316 -0.415 -8.408 1.00 34.30 C ATOM 1185 ND1 HIS A 467 -14.230 0.529 -9.417 1.00 75.20 N ATOM 1186 CD2 HIS A 467 -15.481 -0.162 -7.743 1.00 75.32 C ATOM 1187 CE1 HIS A 467 -15.299 1.309 -9.352 1.00 14.33 C ATOM 1188 NE2 HIS A 467 -16.073 0.880 -8.316 1.00 25.43 N ATOM 0 H HIS A 467 -11.222 -2.664 -7.443 1.00 40.33 H new ATOM 0 HA HIS A 467 -11.832 -1.156 -9.708 1.00 34.44 H new ATOM 0 HB2 HIS A 467 -13.544 -2.374 -8.725 1.00 10.45 H new ATOM 0 HB3 HIS A 467 -13.236 -1.728 -7.125 1.00 10.45 H new ATOM 0 HD1 HIS A 467 -13.472 0.610 -10.095 1.00 75.20 H new ATOM 0 HD2 HIS A 467 -15.857 -0.715 -6.895 1.00 75.32 H new ATOM 0 HE1 HIS A 467 -15.519 2.140 -10.006 1.00 14.33 H new ATOM 1195 N GLN A 468 -11.122 0.628 -7.059 1.00 10.12 N ATOM 1196 CA GLN A 468 -10.789 1.968 -6.606 1.00 22.11 C ATOM 1197 C GLN A 468 -9.505 2.451 -7.283 1.00 64.33 C ATOM 1198 O GLN A 468 -9.550 3.289 -8.182 1.00 34.21 O ATOM 1199 CB GLN A 468 -10.659 2.017 -5.083 1.00 21.40 C ATOM 1200 CG GLN A 468 -11.900 1.432 -4.407 1.00 1.34 C ATOM 1201 CD GLN A 468 -12.164 2.112 -3.062 1.00 1.35 C ATOM 1202 OE1 GLN A 468 -13.179 2.756 -2.852 1.00 3.10 O ATOM 1203 NE2 GLN A 468 -11.198 1.933 -2.167 1.00 72.44 N ATOM 0 H GLN A 468 -11.002 -0.101 -6.356 1.00 10.12 H new ATOM 0 HA GLN A 468 -11.601 2.639 -6.888 1.00 22.11 H new ATOM 0 HB2 GLN A 468 -9.775 1.460 -4.772 1.00 21.40 H new ATOM 0 HB3 GLN A 468 -10.517 3.048 -4.760 1.00 21.40 H new ATOM 0 HG2 GLN A 468 -12.766 1.557 -5.058 1.00 1.34 H new ATOM 0 HG3 GLN A 468 -11.766 0.361 -4.257 1.00 1.34 H new ATOM 0 HE21 GLN A 468 -10.374 1.382 -2.409 1.00 72.44 H new ATOM 0 HE22 GLN A 468 -11.280 2.347 -1.238 1.00 72.44 H new ATOM 1210 N VAL A 469 -8.390 1.902 -6.824 1.00 73.14 N ATOM 1211 CA VAL A 469 -7.093 2.267 -7.372 1.00 12.13 C ATOM 1212 C VAL A 469 -7.211 2.413 -8.891 1.00 62.50 C ATOM 1213 O VAL A 469 -6.523 3.234 -9.494 1.00 53.31 O ATOM 1214 CB VAL A 469 -6.040 1.242 -6.951 1.00 23.43 C ATOM 1215 CG1 VAL A 469 -6.202 -0.065 -7.730 1.00 53.22 C ATOM 1216 CG2 VAL A 469 -4.628 1.807 -7.117 1.00 74.22 C ATOM 0 H VAL A 469 -8.357 1.207 -6.078 1.00 73.14 H new ATOM 0 HA VAL A 469 -6.767 3.229 -6.976 1.00 12.13 H new ATOM 0 HB VAL A 469 -6.192 1.022 -5.894 1.00 23.43 H new ATOM 0 HG11 VAL A 469 -5.440 -0.776 -7.410 1.00 53.22 H new ATOM 0 HG12 VAL A 469 -7.191 -0.482 -7.539 1.00 53.22 H new ATOM 0 HG13 VAL A 469 -6.091 0.131 -8.796 1.00 53.22 H new ATOM 0 HG21 VAL A 469 -3.898 1.058 -6.811 1.00 74.22 H new ATOM 0 HG22 VAL A 469 -4.462 2.070 -8.162 1.00 74.22 H new ATOM 0 HG23 VAL A 469 -4.517 2.697 -6.497 1.00 74.22 H new ATOM 1226 N ASN A 470 -8.089 1.603 -9.465 1.00 55.21 N ATOM 1227 CA ASN A 470 -8.306 1.632 -10.903 1.00 65.15 C ATOM 1228 C ASN A 470 -8.876 2.995 -11.299 1.00 73.32 C ATOM 1229 O ASN A 470 -8.194 3.794 -11.942 1.00 23.23 O ATOM 1230 CB ASN A 470 -9.308 0.558 -11.330 1.00 43.13 C ATOM 1231 CG ASN A 470 -8.596 -0.757 -11.657 1.00 52.14 C ATOM 1232 OD1 ASN A 470 -8.971 -1.487 -12.559 1.00 63.03 O ATOM 1233 ND2 ASN A 470 -7.551 -1.015 -10.876 1.00 62.14 N ATOM 0 H ASN A 470 -8.658 0.923 -8.961 1.00 55.21 H new ATOM 0 HA ASN A 470 -7.350 1.448 -11.393 1.00 65.15 H new ATOM 0 HB2 ASN A 470 -10.033 0.395 -10.533 1.00 43.13 H new ATOM 0 HB3 ASN A 470 -9.865 0.901 -12.202 1.00 43.13 H new ATOM 0 HD21 ASN A 470 -7.009 -1.868 -11.015 1.00 62.14 H new ATOM 0 HD22 ASN A 470 -7.291 -0.360 -10.138 1.00 62.14 H new ATOM 1239 N GLN A 471 -10.119 3.220 -10.903 1.00 4.04 N ATOM 1240 CA GLN A 471 -10.789 4.473 -11.210 1.00 22.44 C ATOM 1241 C GLN A 471 -9.890 5.658 -10.850 1.00 21.24 C ATOM 1242 O GLN A 471 -9.657 6.538 -11.677 1.00 51.45 O ATOM 1243 CB GLN A 471 -12.134 4.567 -10.488 1.00 52.02 C ATOM 1244 CG GLN A 471 -13.062 3.426 -10.907 1.00 12.32 C ATOM 1245 CD GLN A 471 -13.916 3.827 -12.111 1.00 51.32 C ATOM 1246 OE1 GLN A 471 -14.315 4.970 -12.270 1.00 44.21 O ATOM 1247 NE2 GLN A 471 -14.174 2.826 -12.949 1.00 51.45 N ATOM 0 H GLN A 471 -10.681 2.555 -10.371 1.00 4.04 H new ATOM 0 HA GLN A 471 -10.986 4.504 -12.282 1.00 22.44 H new ATOM 0 HB2 GLN A 471 -11.975 4.534 -9.410 1.00 52.02 H new ATOM 0 HB3 GLN A 471 -12.605 5.524 -10.712 1.00 52.02 H new ATOM 0 HG2 GLN A 471 -12.471 2.544 -11.154 1.00 12.32 H new ATOM 0 HG3 GLN A 471 -13.709 3.153 -10.073 1.00 12.32 H new ATOM 0 HE21 GLN A 471 -13.809 1.893 -12.757 1.00 51.45 H new ATOM 0 HE22 GLN A 471 -14.736 2.992 -13.784 1.00 51.45 H new ATOM 1254 N ALA A 472 -9.407 5.640 -9.617 1.00 3.14 N ATOM 1255 CA ALA A 472 -8.537 6.701 -9.138 1.00 3.35 C ATOM 1256 C ALA A 472 -7.399 6.912 -10.138 1.00 72.32 C ATOM 1257 O ALA A 472 -7.193 8.022 -10.623 1.00 74.43 O ATOM 1258 CB ALA A 472 -8.028 6.352 -7.738 1.00 0.44 C ATOM 0 H ALA A 472 -9.601 4.907 -8.935 1.00 3.14 H new ATOM 0 HA ALA A 472 -9.084 7.640 -9.060 1.00 3.35 H new ATOM 0 HB1 ALA A 472 -7.376 7.148 -7.379 1.00 0.44 H new ATOM 0 HB2 ALA A 472 -8.874 6.243 -7.060 1.00 0.44 H new ATOM 0 HB3 ALA A 472 -7.471 5.416 -7.776 1.00 0.44 H new ATOM 1264 N MET A 473 -6.689 5.828 -10.415 1.00 3.44 N ATOM 1265 CA MET A 473 -5.577 5.879 -11.348 1.00 62.00 C ATOM 1266 C MET A 473 -5.970 6.614 -12.631 1.00 10.33 C ATOM 1267 O MET A 473 -5.527 7.737 -12.869 1.00 3.52 O ATOM 1268 CB MET A 473 -5.131 4.456 -11.690 1.00 60.24 C ATOM 1269 CG MET A 473 -4.168 3.914 -10.633 1.00 65.10 C ATOM 1270 SD MET A 473 -4.108 2.133 -10.717 1.00 11.14 S ATOM 1271 CE MET A 473 -2.658 1.823 -9.723 1.00 14.53 C ATOM 0 H MET A 473 -6.863 4.909 -10.009 1.00 3.44 H new ATOM 0 HA MET A 473 -4.758 6.422 -10.877 1.00 62.00 H new ATOM 0 HB2 MET A 473 -6.003 3.805 -11.761 1.00 60.24 H new ATOM 0 HB3 MET A 473 -4.647 4.448 -12.667 1.00 60.24 H new ATOM 0 HG2 MET A 473 -3.172 4.327 -10.791 1.00 65.10 H new ATOM 0 HG3 MET A 473 -4.490 4.229 -9.640 1.00 65.10 H new ATOM 0 HE1 MET A 473 -1.976 1.170 -10.268 1.00 14.53 H new ATOM 0 HE2 MET A 473 -2.159 2.767 -9.503 1.00 14.53 H new ATOM 0 HE3 MET A 473 -2.952 1.342 -8.790 1.00 14.53 H new ATOM 1279 N MET A 474 -6.798 5.950 -13.425 1.00 4.52 N ATOM 1280 CA MET A 474 -7.257 6.526 -14.677 1.00 43.14 C ATOM 1281 C MET A 474 -7.956 7.867 -14.442 1.00 0.44 C ATOM 1282 O MET A 474 -8.153 8.640 -15.377 1.00 2.40 O ATOM 1283 CB MET A 474 -8.226 5.558 -15.360 1.00 41.04 C ATOM 1284 CG MET A 474 -9.473 5.334 -14.502 1.00 62.43 C ATOM 1285 SD MET A 474 -10.664 6.629 -14.806 1.00 44.11 S ATOM 1286 CE MET A 474 -11.965 6.118 -13.697 1.00 2.21 C ATOM 0 H MET A 474 -7.163 5.019 -13.225 1.00 4.52 H new ATOM 0 HA MET A 474 -6.390 6.697 -15.315 1.00 43.14 H new ATOM 0 HB2 MET A 474 -8.516 5.954 -16.333 1.00 41.04 H new ATOM 0 HB3 MET A 474 -7.728 4.605 -15.540 1.00 41.04 H new ATOM 0 HG2 MET A 474 -9.913 4.363 -14.731 1.00 62.43 H new ATOM 0 HG3 MET A 474 -9.201 5.319 -13.447 1.00 62.43 H new ATOM 0 HE1 MET A 474 -12.929 6.433 -14.097 1.00 2.21 H new ATOM 0 HE2 MET A 474 -11.951 5.033 -13.595 1.00 2.21 H new ATOM 0 HE3 MET A 474 -11.811 6.576 -12.720 1.00 2.21 H new ATOM 1294 N SER A 475 -8.311 8.100 -13.185 1.00 15.41 N ATOM 1295 CA SER A 475 -8.985 9.332 -12.816 1.00 21.10 C ATOM 1296 C SER A 475 -7.954 10.430 -12.546 1.00 62.02 C ATOM 1297 O SER A 475 -8.260 11.617 -12.660 1.00 32.53 O ATOM 1298 CB SER A 475 -9.875 9.128 -11.588 1.00 23.40 C ATOM 1299 OG SER A 475 -10.389 10.359 -11.089 1.00 34.33 O ATOM 0 H SER A 475 -8.144 7.456 -12.412 1.00 15.41 H new ATOM 0 HA SER A 475 -9.623 9.635 -13.647 1.00 21.10 H new ATOM 0 HB2 SER A 475 -10.703 8.468 -11.846 1.00 23.40 H new ATOM 0 HB3 SER A 475 -9.303 8.630 -10.805 1.00 23.40 H new ATOM 0 HG SER A 475 -10.953 10.185 -10.307 1.00 34.33 H new ATOM 1304 N ASN A 476 -6.753 9.996 -12.193 1.00 64.54 N ATOM 1305 CA ASN A 476 -5.674 10.927 -11.904 1.00 12.53 C ATOM 1306 C ASN A 476 -4.381 10.412 -12.536 1.00 34.51 C ATOM 1307 O ASN A 476 -3.524 9.864 -11.845 1.00 3.10 O ATOM 1308 CB ASN A 476 -5.447 11.057 -10.398 1.00 44.54 C ATOM 1309 CG ASN A 476 -4.314 12.042 -10.097 1.00 50.11 C ATOM 1310 OD1 ASN A 476 -4.099 13.015 -10.801 1.00 33.03 O ATOM 1311 ND2 ASN A 476 -3.604 11.734 -9.016 1.00 70.25 N ATOM 0 H ASN A 476 -6.503 9.012 -12.100 1.00 64.54 H new ATOM 0 HA ASN A 476 -5.949 11.900 -12.311 1.00 12.53 H new ATOM 0 HB2 ASN A 476 -6.365 11.394 -9.916 1.00 44.54 H new ATOM 0 HB3 ASN A 476 -5.206 10.081 -9.977 1.00 44.54 H new ATOM 0 HD21 ASN A 476 -2.825 12.328 -8.731 1.00 70.25 H new ATOM 0 HD22 ASN A 476 -3.838 10.904 -8.471 1.00 70.25 H new ATOM 1317 N LEU A 477 -4.279 10.607 -13.843 1.00 3.10 N ATOM 1318 CA LEU A 477 -3.102 10.168 -14.575 1.00 55.41 C ATOM 1319 C LEU A 477 -2.194 11.371 -14.840 1.00 0.24 C ATOM 1320 O LEU A 477 -0.998 11.210 -15.073 1.00 62.51 O ATOM 1321 CB LEU A 477 -3.510 9.416 -15.844 1.00 44.32 C ATOM 1322 CG LEU A 477 -4.534 8.294 -15.658 1.00 23.15 C ATOM 1323 CD1 LEU A 477 -5.321 8.050 -16.947 1.00 11.14 C ATOM 1324 CD2 LEU A 477 -3.863 7.018 -15.146 1.00 31.41 C ATOM 0 H LEU A 477 -4.991 11.063 -14.414 1.00 3.10 H new ATOM 0 HA LEU A 477 -2.527 9.458 -13.981 1.00 55.41 H new ATOM 0 HB2 LEU A 477 -3.915 10.136 -16.555 1.00 44.32 H new ATOM 0 HB3 LEU A 477 -2.613 8.992 -16.295 1.00 44.32 H new ATOM 0 HG LEU A 477 -5.250 8.608 -14.898 1.00 23.15 H new ATOM 0 HD11 LEU A 477 -6.042 7.248 -16.787 1.00 11.14 H new ATOM 0 HD12 LEU A 477 -5.849 8.961 -17.229 1.00 11.14 H new ATOM 0 HD13 LEU A 477 -4.634 7.767 -17.745 1.00 11.14 H new ATOM 0 HD21 LEU A 477 -4.613 6.237 -15.023 1.00 31.41 H new ATOM 0 HD22 LEU A 477 -3.111 6.689 -15.864 1.00 31.41 H new ATOM 0 HD23 LEU A 477 -3.386 7.218 -14.187 1.00 31.41 H new ATOM 1335 N THR A 478 -2.799 12.549 -14.793 1.00 73.33 N ATOM 1336 CA THR A 478 -2.058 13.778 -15.024 1.00 10.22 C ATOM 1337 C THR A 478 -1.146 14.085 -13.834 1.00 51.50 C ATOM 1338 O THR A 478 -0.385 15.049 -13.864 1.00 44.22 O ATOM 1339 CB THR A 478 -3.068 14.889 -15.319 1.00 50.23 C ATOM 1340 OG1 THR A 478 -2.283 15.927 -15.900 1.00 65.24 O ATOM 1341 CG2 THR A 478 -3.634 15.518 -14.045 1.00 60.14 C ATOM 0 H THR A 478 -3.792 12.679 -14.599 1.00 73.33 H new ATOM 0 HA THR A 478 -1.395 13.684 -15.884 1.00 10.22 H new ATOM 0 HB THR A 478 -3.884 14.487 -15.919 1.00 50.23 H new ATOM 0 HG1 THR A 478 -1.428 15.995 -15.426 1.00 65.24 H new ATOM 0 HG21 THR A 478 -4.345 16.300 -14.310 1.00 60.14 H new ATOM 0 HG22 THR A 478 -4.139 14.753 -13.455 1.00 60.14 H new ATOM 0 HG23 THR A 478 -2.822 15.950 -13.460 1.00 60.14 H new ATOM 1349 N ARG A 479 -1.258 13.246 -12.815 1.00 31.33 N ATOM 1350 CA ARG A 479 -0.454 13.414 -11.616 1.00 35.40 C ATOM 1351 C ARG A 479 0.724 12.437 -11.624 1.00 0.04 C ATOM 1352 O ARG A 479 1.867 12.838 -11.837 1.00 12.53 O ATOM 1353 CB ARG A 479 -1.289 13.185 -10.355 1.00 42.21 C ATOM 1354 CG ARG A 479 -2.083 14.440 -9.988 1.00 1.03 C ATOM 1355 CD ARG A 479 -1.192 15.466 -9.283 1.00 73.42 C ATOM 1356 NE ARG A 479 -1.863 16.785 -9.255 1.00 32.44 N ATOM 1357 CZ ARG A 479 -2.117 17.528 -10.354 1.00 43.34 C ATOM 1358 NH1 ARG A 479 -1.757 17.087 -11.577 1.00 13.31 N ATOM 1359 NH2 ARG A 479 -2.722 18.692 -10.212 1.00 71.14 N ATOM 0 H ARG A 479 -1.893 12.448 -12.795 1.00 31.33 H new ATOM 0 HA ARG A 479 -0.081 14.438 -11.609 1.00 35.40 H new ATOM 0 HB2 ARG A 479 -1.973 12.351 -10.514 1.00 42.21 H new ATOM 0 HB3 ARG A 479 -0.636 12.908 -9.527 1.00 42.21 H new ATOM 0 HG2 ARG A 479 -2.509 14.881 -10.889 1.00 1.03 H new ATOM 0 HG3 ARG A 479 -2.917 14.171 -9.340 1.00 1.03 H new ATOM 0 HD2 ARG A 479 -0.978 15.136 -8.266 1.00 73.42 H new ATOM 0 HD3 ARG A 479 -0.236 15.546 -9.800 1.00 73.42 H new ATOM 0 HE ARG A 479 -2.151 17.156 -8.350 1.00 32.44 H new ATOM 0 HH11 ARG A 479 -1.289 16.186 -11.677 1.00 13.31 H new ATOM 0 HH12 ARG A 479 -1.953 17.654 -12.402 1.00 13.31 H new ATOM 0 HH21 ARG A 479 -2.990 19.018 -9.283 1.00 71.14 H new ATOM 0 HH22 ARG A 479 -2.922 19.266 -11.031 1.00 71.14 H new ATOM 1369 N GLN A 480 0.403 11.173 -11.390 1.00 4.14 N ATOM 1370 CA GLN A 480 1.420 10.134 -11.367 1.00 53.04 C ATOM 1371 C GLN A 480 1.171 9.124 -12.489 1.00 60.24 C ATOM 1372 O GLN A 480 2.115 8.592 -13.070 1.00 31.35 O ATOM 1373 CB GLN A 480 1.466 9.441 -10.005 1.00 44.53 C ATOM 1374 CG GLN A 480 0.092 9.466 -9.330 1.00 64.20 C ATOM 1375 CD GLN A 480 -0.894 8.555 -10.062 1.00 14.21 C ATOM 1376 OE1 GLN A 480 -0.528 7.568 -10.678 1.00 12.21 O ATOM 1377 NE2 GLN A 480 -2.164 8.940 -9.963 1.00 55.34 N ATOM 0 H GLN A 480 -0.547 10.844 -11.215 1.00 4.14 H new ATOM 0 HA GLN A 480 2.392 10.600 -11.532 1.00 53.04 H new ATOM 0 HB2 GLN A 480 1.796 8.409 -10.129 1.00 44.53 H new ATOM 0 HB3 GLN A 480 2.198 9.935 -9.366 1.00 44.53 H new ATOM 0 HG2 GLN A 480 0.187 9.146 -8.292 1.00 64.20 H new ATOM 0 HG3 GLN A 480 -0.292 10.486 -9.315 1.00 64.20 H new ATOM 0 HE21 GLN A 480 -2.403 9.777 -9.432 1.00 55.34 H new ATOM 0 HE22 GLN A 480 -2.898 8.398 -10.418 1.00 55.34 H new ATOM 1384 N GLY A 481 -0.105 8.890 -12.757 1.00 13.13 N ATOM 1385 CA GLY A 481 -0.490 7.951 -13.799 1.00 71.53 C ATOM 1386 C GLY A 481 0.438 6.735 -13.813 1.00 43.44 C ATOM 1387 O GLY A 481 1.071 6.443 -14.825 1.00 22.12 O ATOM 0 H GLY A 481 -0.885 9.333 -12.272 1.00 13.13 H new ATOM 0 HA2 GLY A 481 -1.518 7.626 -13.639 1.00 71.53 H new ATOM 0 HA3 GLY A 481 -0.460 8.447 -14.769 1.00 71.53 H new ATOM 1391 N SER A 482 0.489 6.059 -12.674 1.00 32.50 N ATOM 1392 CA SER A 482 1.329 4.880 -12.541 1.00 73.52 C ATOM 1393 C SER A 482 0.492 3.689 -12.072 1.00 72.14 C ATOM 1394 O SER A 482 0.280 3.509 -10.873 1.00 21.44 O ATOM 1395 CB SER A 482 2.483 5.133 -11.569 1.00 63.54 C ATOM 1396 OG SER A 482 3.644 4.381 -11.911 1.00 34.12 O ATOM 0 H SER A 482 -0.037 6.305 -11.836 1.00 32.50 H new ATOM 0 HA SER A 482 1.755 4.653 -13.518 1.00 73.52 H new ATOM 0 HB2 SER A 482 2.727 6.195 -11.565 1.00 63.54 H new ATOM 0 HB3 SER A 482 2.169 4.875 -10.558 1.00 63.54 H new ATOM 0 HG SER A 482 4.358 4.571 -11.268 1.00 34.12 H new ATOM 1401 N PRO A 483 0.023 2.889 -13.066 1.00 62.03 N ATOM 1402 CA PRO A 483 -0.787 1.720 -12.767 1.00 54.24 C ATOM 1403 C PRO A 483 0.072 0.585 -12.209 1.00 44.23 C ATOM 1404 O PRO A 483 -0.439 -0.490 -11.899 1.00 4.33 O ATOM 1405 CB PRO A 483 -1.464 1.364 -14.080 1.00 34.42 C ATOM 1406 CG PRO A 483 -0.653 2.053 -15.166 1.00 32.21 C ATOM 1407 CD PRO A 483 0.254 3.072 -14.496 1.00 1.40 C ATOM 0 HA PRO A 483 -1.529 1.910 -11.991 1.00 54.24 H new ATOM 0 HB2 PRO A 483 -1.481 0.285 -14.231 1.00 34.42 H new ATOM 0 HB3 PRO A 483 -2.500 1.704 -14.091 1.00 34.42 H new ATOM 0 HG2 PRO A 483 -0.063 1.324 -15.722 1.00 32.21 H new ATOM 0 HG3 PRO A 483 -1.313 2.542 -15.883 1.00 32.21 H new ATOM 0 HD2 PRO A 483 1.299 2.902 -14.753 1.00 1.40 H new ATOM 0 HD3 PRO A 483 0.010 4.087 -14.810 1.00 1.40 H new ATOM 1412 N ASP A 484 1.363 0.862 -12.097 1.00 33.44 N ATOM 1413 CA ASP A 484 2.298 -0.124 -11.582 1.00 62.41 C ATOM 1414 C ASP A 484 2.610 0.194 -10.117 1.00 2.25 C ATOM 1415 O ASP A 484 3.572 -0.329 -9.556 1.00 61.41 O ATOM 1416 CB ASP A 484 3.614 -0.095 -12.361 1.00 14.21 C ATOM 1417 CG ASP A 484 3.544 -0.690 -13.769 1.00 3.05 C ATOM 1418 OD1 ASP A 484 3.297 0.022 -14.753 1.00 65.20 O ATOM 1419 OD2 ASP A 484 3.759 -1.961 -13.833 1.00 13.21 O ATOM 0 H ASP A 484 1.783 1.755 -12.354 1.00 33.44 H new ATOM 0 HA ASP A 484 1.841 -1.108 -11.683 1.00 62.41 H new ATOM 0 HB2 ASP A 484 3.952 0.939 -12.436 1.00 14.21 H new ATOM 0 HB3 ASP A 484 4.369 -0.637 -11.791 1.00 14.21 H new ATOM 1424 N CYS A 485 1.776 1.047 -9.539 1.00 61.13 N ATOM 1425 CA CYS A 485 1.952 1.439 -8.152 1.00 42.53 C ATOM 1426 C CYS A 485 1.090 0.521 -7.281 1.00 22.13 C ATOM 1427 O CYS A 485 0.760 0.865 -6.147 1.00 12.42 O ATOM 1428 CB CYS A 485 1.611 2.915 -7.933 1.00 10.03 C ATOM 1429 SG CYS A 485 3.081 3.951 -8.274 1.00 11.42 S ATOM 0 H CYS A 485 0.978 1.477 -10.006 1.00 61.13 H new ATOM 0 HA CYS A 485 2.999 1.330 -7.871 1.00 42.53 H new ATOM 0 HB2 CYS A 485 0.789 3.208 -8.586 1.00 10.03 H new ATOM 0 HB3 CYS A 485 1.275 3.071 -6.908 1.00 10.03 H new ATOM 0 HG CYS A 485 3.417 4.595 -7.196 1.00 11.42 H new ATOM 1434 N VAL A 486 0.753 -0.630 -7.845 1.00 25.22 N ATOM 1435 CA VAL A 486 -0.063 -1.601 -7.134 1.00 64.24 C ATOM 1436 C VAL A 486 0.818 -2.769 -6.684 1.00 13.42 C ATOM 1437 O VAL A 486 1.338 -3.513 -7.514 1.00 52.33 O ATOM 1438 CB VAL A 486 -1.237 -2.040 -8.011 1.00 42.00 C ATOM 1439 CG1 VAL A 486 -2.383 -2.589 -7.159 1.00 52.10 C ATOM 1440 CG2 VAL A 486 -1.717 -0.890 -8.900 1.00 32.43 C ATOM 0 H VAL A 486 1.030 -0.912 -8.785 1.00 25.22 H new ATOM 0 HA VAL A 486 -0.494 -1.155 -6.238 1.00 64.24 H new ATOM 0 HB VAL A 486 -0.888 -2.843 -8.660 1.00 42.00 H new ATOM 0 HG11 VAL A 486 -3.205 -2.894 -7.807 1.00 52.10 H new ATOM 0 HG12 VAL A 486 -2.033 -3.449 -6.589 1.00 52.10 H new ATOM 0 HG13 VAL A 486 -2.729 -1.816 -6.473 1.00 52.10 H new ATOM 0 HG21 VAL A 486 -2.552 -1.228 -9.513 1.00 32.43 H new ATOM 0 HG22 VAL A 486 -2.040 -0.057 -8.275 1.00 32.43 H new ATOM 0 HG23 VAL A 486 -0.901 -0.564 -9.545 1.00 32.43 H new ATOM 1450 N ILE A 487 0.956 -2.893 -5.373 1.00 30.23 N ATOM 1451 CA ILE A 487 1.764 -3.958 -4.803 1.00 2.31 C ATOM 1452 C ILE A 487 0.866 -4.896 -3.994 1.00 61.21 C ATOM 1453 O ILE A 487 0.589 -4.640 -2.823 1.00 54.52 O ATOM 1454 CB ILE A 487 2.927 -3.376 -3.999 1.00 62.42 C ATOM 1455 CG1 ILE A 487 3.402 -2.051 -4.601 1.00 64.11 C ATOM 1456 CG2 ILE A 487 4.067 -4.388 -3.873 1.00 65.24 C ATOM 1457 CD1 ILE A 487 3.974 -2.259 -6.004 1.00 11.24 C ATOM 0 H ILE A 487 0.522 -2.274 -4.688 1.00 30.23 H new ATOM 0 HA ILE A 487 2.220 -4.555 -5.593 1.00 2.31 H new ATOM 0 HB ILE A 487 2.572 -3.163 -2.991 1.00 62.42 H new ATOM 0 HG12 ILE A 487 2.570 -1.348 -4.644 1.00 64.11 H new ATOM 0 HG13 ILE A 487 4.161 -1.607 -3.957 1.00 64.11 H new ATOM 0 HG21 ILE A 487 4.881 -3.949 -3.297 1.00 65.24 H new ATOM 0 HG22 ILE A 487 3.705 -5.283 -3.366 1.00 65.24 H new ATOM 0 HG23 ILE A 487 4.428 -4.655 -4.866 1.00 65.24 H new ATOM 0 HD11 ILE A 487 4.304 -1.302 -6.408 1.00 11.24 H new ATOM 0 HD12 ILE A 487 4.821 -2.943 -5.954 1.00 11.24 H new ATOM 0 HD13 ILE A 487 3.205 -2.681 -6.652 1.00 11.24 H new ATOM 1468 N PRO A 488 0.425 -5.992 -4.668 1.00 35.01 N ATOM 1469 CA PRO A 488 -0.435 -6.970 -4.025 1.00 3.50 C ATOM 1470 C PRO A 488 0.360 -7.845 -3.053 1.00 52.21 C ATOM 1471 O PRO A 488 0.997 -8.814 -3.461 1.00 51.20 O ATOM 1472 CB PRO A 488 -1.053 -7.761 -5.166 1.00 21.31 C ATOM 1473 CG PRO A 488 -0.168 -7.510 -6.375 1.00 62.11 C ATOM 1474 CD PRO A 488 0.733 -6.329 -6.055 1.00 74.32 C ATOM 0 HA PRO A 488 -1.209 -6.510 -3.411 1.00 3.50 H new ATOM 0 HB2 PRO A 488 -1.095 -8.824 -4.927 1.00 21.31 H new ATOM 0 HB3 PRO A 488 -2.076 -7.437 -5.357 1.00 21.31 H new ATOM 0 HG2 PRO A 488 0.428 -8.394 -6.602 1.00 62.11 H new ATOM 0 HG3 PRO A 488 -0.775 -7.300 -7.256 1.00 62.11 H new ATOM 0 HD2 PRO A 488 1.785 -6.589 -6.175 1.00 74.32 H new ATOM 0 HD3 PRO A 488 0.535 -5.488 -6.720 1.00 74.32 H new ATOM 1479 N PHE A 489 0.296 -7.470 -1.783 1.00 31.11 N ATOM 1480 CA PHE A 489 1.002 -8.209 -0.749 1.00 1.11 C ATOM 1481 C PHE A 489 0.213 -9.449 -0.325 1.00 33.12 C ATOM 1482 O PHE A 489 -0.952 -9.603 -0.691 1.00 35.33 O ATOM 1483 CB PHE A 489 1.140 -7.272 0.454 1.00 13.24 C ATOM 1484 CG PHE A 489 2.352 -7.571 1.339 1.00 11.23 C ATOM 1485 CD1 PHE A 489 2.242 -8.460 2.364 1.00 74.24 C ATOM 1486 CD2 PHE A 489 3.537 -6.949 1.101 1.00 62.13 C ATOM 1487 CE1 PHE A 489 3.367 -8.737 3.185 1.00 52.35 C ATOM 1488 CE2 PHE A 489 4.662 -7.227 1.922 1.00 44.34 C ATOM 1489 CZ PHE A 489 4.552 -8.115 2.947 1.00 62.11 C ATOM 0 H PHE A 489 -0.233 -6.665 -1.447 1.00 31.11 H new ATOM 0 HA PHE A 489 1.971 -8.538 -1.123 1.00 1.11 H new ATOM 0 HB2 PHE A 489 1.209 -6.245 0.096 1.00 13.24 H new ATOM 0 HB3 PHE A 489 0.236 -7.338 1.059 1.00 13.24 H new ATOM 0 HD1 PHE A 489 1.300 -8.954 2.553 1.00 74.24 H new ATOM 0 HD2 PHE A 489 3.623 -6.244 0.288 1.00 62.13 H new ATOM 0 HE1 PHE A 489 3.281 -9.442 3.999 1.00 52.35 H new ATOM 0 HE2 PHE A 489 5.604 -6.734 1.733 1.00 44.34 H new ATOM 0 HZ PHE A 489 5.407 -8.326 3.572 1.00 62.11 H new ATOM 1498 N LEU A 490 0.878 -10.302 0.440 1.00 73.45 N ATOM 1499 CA LEU A 490 0.254 -11.524 0.916 1.00 11.13 C ATOM 1500 C LEU A 490 0.903 -11.941 2.236 1.00 24.23 C ATOM 1501 O LEU A 490 2.016 -12.466 2.247 1.00 31.11 O ATOM 1502 CB LEU A 490 0.302 -12.607 -0.164 1.00 23.12 C ATOM 1503 CG LEU A 490 -0.518 -13.869 0.114 1.00 43.33 C ATOM 1504 CD1 LEU A 490 0.296 -14.889 0.909 1.00 31.35 C ATOM 1505 CD2 LEU A 490 -1.838 -13.522 0.808 1.00 71.52 C ATOM 0 H LEU A 490 1.843 -10.171 0.742 1.00 73.45 H new ATOM 0 HA LEU A 490 -0.804 -11.358 1.119 1.00 11.13 H new ATOM 0 HB2 LEU A 490 -0.044 -12.172 -1.102 1.00 23.12 H new ATOM 0 HB3 LEU A 490 1.342 -12.899 -0.312 1.00 23.12 H new ATOM 0 HG LEU A 490 -0.767 -14.332 -0.841 1.00 43.33 H new ATOM 0 HD11 LEU A 490 -0.311 -15.776 1.092 1.00 31.35 H new ATOM 0 HD12 LEU A 490 1.184 -15.168 0.341 1.00 31.35 H new ATOM 0 HD13 LEU A 490 0.597 -14.452 1.861 1.00 31.35 H new ATOM 0 HD21 LEU A 490 -2.402 -14.436 0.995 1.00 71.52 H new ATOM 0 HD22 LEU A 490 -1.631 -13.024 1.755 1.00 71.52 H new ATOM 0 HD23 LEU A 490 -2.422 -12.859 0.169 1.00 71.52 H new ATOM 1516 N PRO A 491 0.162 -11.688 3.347 1.00 24.31 N ATOM 1517 CA PRO A 491 0.655 -12.032 4.671 1.00 33.45 C ATOM 1518 C PRO A 491 0.565 -13.541 4.915 1.00 71.13 C ATOM 1519 O PRO A 491 0.006 -14.272 4.099 1.00 24.24 O ATOM 1520 CB PRO A 491 -0.202 -11.224 5.633 1.00 35.23 C ATOM 1521 CG PRO A 491 -1.439 -10.818 4.848 1.00 34.14 C ATOM 1522 CD PRO A 491 -1.160 -11.069 3.375 1.00 75.42 C ATOM 0 HA PRO A 491 1.710 -11.793 4.801 1.00 33.45 H new ATOM 0 HB2 PRO A 491 -0.471 -11.816 6.508 1.00 35.23 H new ATOM 0 HB3 PRO A 491 0.336 -10.348 5.994 1.00 35.23 H new ATOM 0 HG2 PRO A 491 -2.305 -11.393 5.176 1.00 34.14 H new ATOM 0 HG3 PRO A 491 -1.671 -9.767 5.019 1.00 34.14 H new ATOM 0 HD2 PRO A 491 -1.913 -11.723 2.936 1.00 75.42 H new ATOM 0 HD3 PRO A 491 -1.174 -10.140 2.806 1.00 75.42 H new ATOM 1527 N LEU A 492 1.127 -13.960 6.038 1.00 44.10 N ATOM 1528 CA LEU A 492 1.118 -15.368 6.400 1.00 10.44 C ATOM 1529 C LEU A 492 -0.258 -15.738 6.956 1.00 34.05 C ATOM 1530 O LEU A 492 -0.664 -16.898 6.898 1.00 62.32 O ATOM 1531 CB LEU A 492 2.272 -15.684 7.353 1.00 71.12 C ATOM 1532 CG LEU A 492 3.678 -15.391 6.824 1.00 2.50 C ATOM 1533 CD1 LEU A 492 3.853 -13.901 6.529 1.00 55.35 C ATOM 1534 CD2 LEU A 492 4.745 -15.914 7.787 1.00 71.23 C ATOM 0 H LEU A 492 1.592 -13.350 6.710 1.00 44.10 H new ATOM 0 HA LEU A 492 1.284 -15.989 5.520 1.00 10.44 H new ATOM 0 HB2 LEU A 492 2.125 -15.115 8.271 1.00 71.12 H new ATOM 0 HB3 LEU A 492 2.218 -16.740 7.620 1.00 71.12 H new ATOM 0 HG LEU A 492 3.806 -15.923 5.881 1.00 2.50 H new ATOM 0 HD11 LEU A 492 4.861 -13.720 6.155 1.00 55.35 H new ATOM 0 HD12 LEU A 492 3.126 -13.591 5.779 1.00 55.35 H new ATOM 0 HD13 LEU A 492 3.698 -13.328 7.443 1.00 55.35 H new ATOM 0 HD21 LEU A 492 5.735 -15.693 7.388 1.00 71.23 H new ATOM 0 HD22 LEU A 492 4.628 -15.430 8.757 1.00 71.23 H new ATOM 0 HD23 LEU A 492 4.633 -16.992 7.904 1.00 71.23 H new ATOM 1545 N GLU A 493 -0.939 -14.730 7.482 1.00 12.31 N ATOM 1546 CA GLU A 493 -2.261 -14.936 8.048 1.00 3.15 C ATOM 1547 C GLU A 493 -3.244 -15.373 6.960 1.00 21.12 C ATOM 1548 O GLU A 493 -4.129 -16.189 7.210 1.00 32.54 O ATOM 1549 CB GLU A 493 -2.755 -13.674 8.759 1.00 45.42 C ATOM 1550 CG GLU A 493 -2.284 -13.644 10.214 1.00 52.40 C ATOM 1551 CD GLU A 493 -3.352 -14.216 11.148 1.00 42.25 C ATOM 1552 OE1 GLU A 493 -4.453 -14.561 10.695 1.00 52.21 O ATOM 1553 OE2 GLU A 493 -3.005 -14.296 12.389 1.00 1.24 O ATOM 0 H GLU A 493 -0.600 -13.769 7.528 1.00 12.31 H new ATOM 0 HA GLU A 493 -2.196 -15.731 8.791 1.00 3.15 H new ATOM 0 HB2 GLU A 493 -2.388 -12.791 8.236 1.00 45.42 H new ATOM 0 HB3 GLU A 493 -3.844 -13.636 8.725 1.00 45.42 H new ATOM 0 HG2 GLU A 493 -1.363 -14.219 10.314 1.00 52.40 H new ATOM 0 HG3 GLU A 493 -2.053 -12.619 10.504 1.00 52.40 H new ATOM 1559 N SER A 494 -3.054 -14.809 5.776 1.00 30.23 N ATOM 1560 CA SER A 494 -3.912 -15.130 4.648 1.00 42.20 C ATOM 1561 C SER A 494 -3.079 -15.709 3.505 1.00 21.30 C ATOM 1562 O SER A 494 -1.849 -15.693 3.557 1.00 72.01 O ATOM 1563 CB SER A 494 -4.681 -13.896 4.172 1.00 71.00 C ATOM 1564 OG SER A 494 -5.747 -13.557 5.054 1.00 11.54 O ATOM 0 H SER A 494 -2.319 -14.132 5.573 1.00 30.23 H new ATOM 0 HA SER A 494 -4.639 -15.875 4.973 1.00 42.20 H new ATOM 0 HB2 SER A 494 -3.996 -13.052 4.090 1.00 71.00 H new ATOM 0 HB3 SER A 494 -5.081 -14.080 3.175 1.00 71.00 H new ATOM 0 HG SER A 494 -6.527 -14.116 4.855 1.00 11.54 H new ATOM 1569 N SER A 495 -3.780 -16.211 2.497 1.00 70.34 N ATOM 1570 CA SER A 495 -3.119 -16.794 1.342 1.00 62.01 C ATOM 1571 C SER A 495 -3.955 -16.553 0.084 1.00 10.42 C ATOM 1572 O SER A 495 -5.120 -16.168 0.173 1.00 61.33 O ATOM 1573 CB SER A 495 -2.882 -18.293 1.543 1.00 72.23 C ATOM 1574 OG SER A 495 -1.506 -18.589 1.772 1.00 15.44 O ATOM 0 H SER A 495 -4.799 -16.226 2.457 1.00 70.34 H new ATOM 0 HA SER A 495 -2.149 -16.312 1.223 1.00 62.01 H new ATOM 0 HB2 SER A 495 -3.474 -18.644 2.388 1.00 72.23 H new ATOM 0 HB3 SER A 495 -3.229 -18.836 0.664 1.00 72.23 H new ATOM 0 HG SER A 495 -1.396 -19.555 1.897 1.00 15.44 H new ATOM 1579 N PRO A 496 -3.311 -16.795 -1.088 1.00 34.12 N ATOM 1580 CA PRO A 496 -3.982 -16.608 -2.364 1.00 14.22 C ATOM 1581 C PRO A 496 -4.973 -17.744 -2.634 1.00 42.03 C ATOM 1582 O PRO A 496 -6.002 -17.534 -3.274 1.00 31.44 O ATOM 1583 CB PRO A 496 -2.865 -16.541 -3.391 1.00 73.42 C ATOM 1584 CG PRO A 496 -1.645 -17.154 -2.721 1.00 65.21 C ATOM 1585 CD PRO A 496 -1.931 -17.252 -1.232 1.00 4.42 C ATOM 0 HA PRO A 496 -4.586 -15.701 -2.392 1.00 14.22 H new ATOM 0 HB2 PRO A 496 -3.132 -17.090 -4.294 1.00 73.42 H new ATOM 0 HB3 PRO A 496 -2.670 -15.511 -3.690 1.00 73.42 H new ATOM 0 HG2 PRO A 496 -1.437 -18.140 -3.135 1.00 65.21 H new ATOM 0 HG3 PRO A 496 -0.762 -16.540 -2.901 1.00 65.21 H new ATOM 0 HD2 PRO A 496 -1.813 -18.274 -0.873 1.00 4.42 H new ATOM 0 HD3 PRO A 496 -1.246 -16.630 -0.656 1.00 4.42 H new ATOM 1590 N ALA A 497 -4.629 -18.919 -2.130 1.00 30.30 N ATOM 1591 CA ALA A 497 -5.475 -20.087 -2.307 1.00 32.23 C ATOM 1592 C ALA A 497 -6.806 -19.860 -1.588 1.00 52.41 C ATOM 1593 O ALA A 497 -7.822 -20.451 -1.953 1.00 14.12 O ATOM 1594 CB ALA A 497 -4.743 -21.331 -1.801 1.00 63.45 C ATOM 0 H ALA A 497 -3.775 -19.088 -1.598 1.00 30.30 H new ATOM 0 HA ALA A 497 -5.693 -20.246 -3.363 1.00 32.23 H new ATOM 0 HB1 ALA A 497 -5.379 -22.206 -1.934 1.00 63.45 H new ATOM 0 HB2 ALA A 497 -3.819 -21.464 -2.364 1.00 63.45 H new ATOM 0 HB3 ALA A 497 -4.509 -21.210 -0.743 1.00 63.45 H new ATOM 1600 N GLN A 498 -6.759 -19.004 -0.578 1.00 61.33 N ATOM 1601 CA GLN A 498 -7.949 -18.693 0.196 1.00 72.41 C ATOM 1602 C GLN A 498 -8.819 -17.682 -0.554 1.00 62.41 C ATOM 1603 O GLN A 498 -9.974 -17.462 -0.191 1.00 31.05 O ATOM 1604 CB GLN A 498 -7.577 -18.174 1.586 1.00 53.41 C ATOM 1605 CG GLN A 498 -6.315 -18.859 2.110 1.00 22.01 C ATOM 1606 CD GLN A 498 -6.311 -18.910 3.639 1.00 14.34 C ATOM 1607 OE1 GLN A 498 -6.338 -17.897 4.319 1.00 32.43 O ATOM 1608 NE2 GLN A 498 -6.278 -20.142 4.139 1.00 40.31 N ATOM 0 H GLN A 498 -5.915 -18.516 -0.278 1.00 61.33 H new ATOM 0 HA GLN A 498 -8.524 -19.609 0.329 1.00 72.41 H new ATOM 0 HB2 GLN A 498 -7.419 -17.096 1.545 1.00 53.41 H new ATOM 0 HB3 GLN A 498 -8.403 -18.349 2.276 1.00 53.41 H new ATOM 0 HG2 GLN A 498 -6.253 -19.871 1.709 1.00 22.01 H new ATOM 0 HG3 GLN A 498 -5.434 -18.323 1.759 1.00 22.01 H new ATOM 0 HE21 GLN A 498 -6.257 -20.946 3.512 1.00 40.31 H new ATOM 0 HE22 GLN A 498 -6.274 -20.282 5.149 1.00 40.31 H new ATOM 1615 N LEU A 499 -8.233 -17.094 -1.585 1.00 74.22 N ATOM 1616 CA LEU A 499 -8.940 -16.112 -2.389 1.00 10.01 C ATOM 1617 C LEU A 499 -9.654 -16.821 -3.541 1.00 50.31 C ATOM 1618 O LEU A 499 -9.654 -18.048 -3.615 1.00 62.20 O ATOM 1619 CB LEU A 499 -7.988 -15.004 -2.844 1.00 65.00 C ATOM 1620 CG LEU A 499 -6.985 -14.510 -1.799 1.00 22.22 C ATOM 1621 CD1 LEU A 499 -5.959 -13.565 -2.428 1.00 45.53 C ATOM 1622 CD2 LEU A 499 -7.704 -13.867 -0.611 1.00 13.02 C ATOM 0 H LEU A 499 -7.275 -17.279 -1.883 1.00 74.22 H new ATOM 0 HA LEU A 499 -9.707 -15.616 -1.795 1.00 10.01 H new ATOM 0 HB2 LEU A 499 -7.433 -15.363 -3.711 1.00 65.00 H new ATOM 0 HB3 LEU A 499 -8.584 -14.154 -3.177 1.00 65.00 H new ATOM 0 HG LEU A 499 -6.437 -15.371 -1.416 1.00 22.22 H new ATOM 0 HD11 LEU A 499 -5.258 -13.228 -1.664 1.00 45.53 H new ATOM 0 HD12 LEU A 499 -5.415 -14.089 -3.214 1.00 45.53 H new ATOM 0 HD13 LEU A 499 -6.472 -12.703 -2.855 1.00 45.53 H new ATOM 0 HD21 LEU A 499 -6.969 -13.524 0.117 1.00 13.02 H new ATOM 0 HD22 LEU A 499 -8.293 -13.018 -0.958 1.00 13.02 H new ATOM 0 HD23 LEU A 499 -8.363 -14.600 -0.144 1.00 13.02 H new ATOM 1633 N SER A 500 -10.248 -16.016 -4.412 1.00 42.11 N ATOM 1634 CA SER A 500 -10.964 -16.552 -5.557 1.00 21.31 C ATOM 1635 C SER A 500 -9.979 -16.909 -6.671 1.00 62.54 C ATOM 1636 O SER A 500 -8.788 -16.616 -6.569 1.00 74.30 O ATOM 1637 CB SER A 500 -12.006 -15.556 -6.069 1.00 11.50 C ATOM 1638 OG SER A 500 -12.348 -15.794 -7.432 1.00 62.53 O ATOM 0 H SER A 500 -10.248 -14.998 -4.347 1.00 42.11 H new ATOM 0 HA SER A 500 -11.487 -17.455 -5.241 1.00 21.31 H new ATOM 0 HB2 SER A 500 -12.903 -15.621 -5.453 1.00 11.50 H new ATOM 0 HB3 SER A 500 -11.621 -14.542 -5.964 1.00 11.50 H new ATOM 0 HG SER A 500 -12.701 -14.971 -7.829 1.00 62.53 H new ATOM 1643 N SER A 501 -10.510 -17.537 -7.710 1.00 65.14 N ATOM 1644 CA SER A 501 -9.692 -17.937 -8.842 1.00 25.51 C ATOM 1645 C SER A 501 -9.448 -16.738 -9.760 1.00 54.24 C ATOM 1646 O SER A 501 -8.678 -16.830 -10.715 1.00 41.50 O ATOM 1647 CB SER A 501 -10.350 -19.077 -9.621 1.00 70.32 C ATOM 1648 OG SER A 501 -9.439 -19.704 -10.520 1.00 11.22 O ATOM 0 H SER A 501 -11.498 -17.779 -7.791 1.00 65.14 H new ATOM 0 HA SER A 501 -8.735 -18.297 -8.463 1.00 25.51 H new ATOM 0 HB2 SER A 501 -10.737 -19.818 -8.922 1.00 70.32 H new ATOM 0 HB3 SER A 501 -11.202 -18.690 -10.180 1.00 70.32 H new ATOM 0 HG SER A 501 -8.845 -19.028 -10.909 1.00 11.22 H new ATOM 1653 N ASP A 502 -10.117 -15.641 -9.439 1.00 43.32 N ATOM 1654 CA ASP A 502 -9.983 -14.425 -10.223 1.00 11.13 C ATOM 1655 C ASP A 502 -8.967 -13.499 -9.552 1.00 4.23 C ATOM 1656 O ASP A 502 -8.170 -12.853 -10.229 1.00 2.11 O ATOM 1657 CB ASP A 502 -11.316 -13.678 -10.315 1.00 22.13 C ATOM 1658 CG ASP A 502 -12.536 -14.563 -10.579 1.00 13.13 C ATOM 1659 OD1 ASP A 502 -12.516 -15.431 -11.463 1.00 32.51 O ATOM 1660 OD2 ASP A 502 -13.553 -14.328 -9.821 1.00 53.41 O ATOM 0 H ASP A 502 -10.754 -15.569 -8.646 1.00 43.32 H new ATOM 0 HA ASP A 502 -9.657 -14.705 -11.225 1.00 11.13 H new ATOM 0 HB2 ASP A 502 -11.475 -13.134 -9.384 1.00 22.13 H new ATOM 0 HB3 ASP A 502 -11.245 -12.936 -11.110 1.00 22.13 H new ATOM 1665 N THR A 503 -9.030 -13.465 -8.228 1.00 20.54 N ATOM 1666 CA THR A 503 -8.125 -12.630 -7.458 1.00 64.25 C ATOM 1667 C THR A 503 -6.697 -12.757 -7.991 1.00 70.22 C ATOM 1668 O THR A 503 -5.894 -11.836 -7.852 1.00 31.23 O ATOM 1669 CB THR A 503 -8.260 -13.020 -5.985 1.00 32.00 C ATOM 1670 OG1 THR A 503 -9.477 -12.403 -5.573 1.00 30.45 O ATOM 1671 CG2 THR A 503 -7.195 -12.364 -5.105 1.00 62.12 C ATOM 0 H THR A 503 -9.694 -14.002 -7.670 1.00 20.54 H new ATOM 0 HA THR A 503 -8.382 -11.575 -7.555 1.00 64.25 H new ATOM 0 HB THR A 503 -8.193 -14.104 -5.889 1.00 32.00 H new ATOM 0 HG1 THR A 503 -9.643 -12.606 -4.629 1.00 30.45 H new ATOM 0 HG21 THR A 503 -7.337 -12.674 -4.070 1.00 62.12 H new ATOM 0 HG22 THR A 503 -6.205 -12.670 -5.443 1.00 62.12 H new ATOM 0 HG23 THR A 503 -7.283 -11.280 -5.174 1.00 62.12 H new ATOM 1679 N ALA A 504 -6.423 -13.907 -8.590 1.00 74.31 N ATOM 1680 CA ALA A 504 -5.105 -14.166 -9.146 1.00 3.24 C ATOM 1681 C ALA A 504 -4.938 -13.376 -10.444 1.00 60.11 C ATOM 1682 O ALA A 504 -3.902 -12.751 -10.666 1.00 44.23 O ATOM 1683 CB ALA A 504 -4.926 -15.672 -9.353 1.00 43.21 C ATOM 0 H ALA A 504 -7.091 -14.670 -8.703 1.00 74.31 H new ATOM 0 HA ALA A 504 -4.327 -13.836 -8.458 1.00 3.24 H new ATOM 0 HB1 ALA A 504 -3.938 -15.867 -9.770 1.00 43.21 H new ATOM 0 HB2 ALA A 504 -5.024 -16.185 -8.396 1.00 43.21 H new ATOM 0 HB3 ALA A 504 -5.689 -16.038 -10.041 1.00 43.21 H new ATOM 1689 N SER A 505 -5.974 -13.429 -11.268 1.00 15.12 N ATOM 1690 CA SER A 505 -5.955 -12.723 -12.540 1.00 3.24 C ATOM 1691 C SER A 505 -6.224 -11.234 -12.317 1.00 22.24 C ATOM 1692 O SER A 505 -6.058 -10.426 -13.229 1.00 20.25 O ATOM 1693 CB SER A 505 -6.985 -13.309 -13.508 1.00 53.12 C ATOM 1694 OG SER A 505 -6.557 -14.555 -14.054 1.00 61.30 O ATOM 0 H SER A 505 -6.831 -13.949 -11.081 1.00 15.12 H new ATOM 0 HA SER A 505 -4.967 -12.844 -12.984 1.00 3.24 H new ATOM 0 HB2 SER A 505 -7.933 -13.448 -12.988 1.00 53.12 H new ATOM 0 HB3 SER A 505 -7.165 -12.601 -14.317 1.00 53.12 H new ATOM 0 HG SER A 505 -7.242 -14.897 -14.665 1.00 61.30 H new ATOM 1699 N LEU A 506 -6.632 -10.916 -11.098 1.00 51.24 N ATOM 1700 CA LEU A 506 -6.925 -9.537 -10.743 1.00 22.12 C ATOM 1701 C LEU A 506 -5.615 -8.801 -10.455 1.00 14.20 C ATOM 1702 O LEU A 506 -5.529 -7.586 -10.633 1.00 11.30 O ATOM 1703 CB LEU A 506 -7.926 -9.482 -9.588 1.00 3.12 C ATOM 1704 CG LEU A 506 -9.336 -9.990 -9.899 1.00 50.43 C ATOM 1705 CD1 LEU A 506 -10.124 -10.239 -8.610 1.00 13.25 C ATOM 1706 CD2 LEU A 506 -10.068 -9.034 -10.842 1.00 3.31 C ATOM 0 H LEU A 506 -6.767 -11.589 -10.343 1.00 51.24 H new ATOM 0 HA LEU A 506 -7.405 -9.023 -11.576 1.00 22.12 H new ATOM 0 HB2 LEU A 506 -7.526 -10.065 -8.758 1.00 3.12 H new ATOM 0 HB3 LEU A 506 -8.000 -8.450 -9.246 1.00 3.12 H new ATOM 0 HG LEU A 506 -9.249 -10.946 -10.415 1.00 50.43 H new ATOM 0 HD11 LEU A 506 -11.122 -10.599 -8.858 1.00 13.25 H new ATOM 0 HD12 LEU A 506 -9.608 -10.986 -8.007 1.00 13.25 H new ATOM 0 HD13 LEU A 506 -10.203 -9.309 -8.047 1.00 13.25 H new ATOM 0 HD21 LEU A 506 -11.067 -9.419 -11.047 1.00 3.31 H new ATOM 0 HD22 LEU A 506 -10.146 -8.052 -10.376 1.00 3.31 H new ATOM 0 HD23 LEU A 506 -9.514 -8.949 -11.777 1.00 3.31 H new ATOM 1717 N LEU A 507 -4.626 -9.566 -10.017 1.00 74.11 N ATOM 1718 CA LEU A 507 -3.325 -9.001 -9.705 1.00 60.21 C ATOM 1719 C LEU A 507 -2.301 -9.490 -10.732 1.00 3.11 C ATOM 1720 O LEU A 507 -1.202 -8.945 -10.826 1.00 71.32 O ATOM 1721 CB LEU A 507 -2.939 -9.311 -8.256 1.00 14.52 C ATOM 1722 CG LEU A 507 -2.574 -10.764 -7.957 1.00 4.22 C ATOM 1723 CD1 LEU A 507 -1.075 -11.003 -8.141 1.00 73.24 C ATOM 1724 CD2 LEU A 507 -3.052 -11.173 -6.561 1.00 22.24 C ATOM 0 H LEU A 507 -4.700 -10.573 -9.871 1.00 74.11 H new ATOM 0 HA LEU A 507 -3.355 -7.914 -9.777 1.00 60.21 H new ATOM 0 HB2 LEU A 507 -2.092 -8.681 -7.984 1.00 14.52 H new ATOM 0 HB3 LEU A 507 -3.770 -9.025 -7.610 1.00 14.52 H new ATOM 0 HG LEU A 507 -3.091 -11.400 -8.675 1.00 4.22 H new ATOM 0 HD11 LEU A 507 -0.843 -12.045 -7.922 1.00 73.24 H new ATOM 0 HD12 LEU A 507 -0.794 -10.778 -9.170 1.00 73.24 H new ATOM 0 HD13 LEU A 507 -0.518 -10.357 -7.463 1.00 73.24 H new ATOM 0 HD21 LEU A 507 -2.780 -12.212 -6.373 1.00 22.24 H new ATOM 0 HD22 LEU A 507 -2.582 -10.534 -5.814 1.00 22.24 H new ATOM 0 HD23 LEU A 507 -4.135 -11.065 -6.501 1.00 22.24 H new ATOM 1735 N SER A 508 -2.697 -10.514 -11.473 1.00 72.11 N ATOM 1736 CA SER A 508 -1.828 -11.083 -12.488 1.00 32.22 C ATOM 1737 C SER A 508 -1.287 -9.975 -13.395 1.00 54.22 C ATOM 1738 O SER A 508 -2.013 -9.444 -14.234 1.00 2.21 O ATOM 1739 CB SER A 508 -2.566 -12.134 -13.319 1.00 3.12 C ATOM 1740 OG SER A 508 -3.619 -11.563 -14.091 1.00 20.12 O ATOM 0 H SER A 508 -3.608 -10.964 -11.391 1.00 72.11 H new ATOM 0 HA SER A 508 -0.994 -11.574 -11.987 1.00 32.22 H new ATOM 0 HB2 SER A 508 -1.860 -12.633 -13.983 1.00 3.12 H new ATOM 0 HB3 SER A 508 -2.975 -12.897 -12.657 1.00 3.12 H new ATOM 0 HG SER A 508 -3.368 -10.656 -14.366 1.00 20.12 H new ATOM 1745 N GLY A 509 -0.016 -9.658 -13.196 1.00 71.41 N ATOM 1746 CA GLY A 509 0.631 -8.624 -13.985 1.00 55.54 C ATOM 1747 C GLY A 509 1.447 -7.685 -13.094 1.00 41.34 C ATOM 1748 O GLY A 509 2.384 -7.040 -13.561 1.00 44.40 O ATOM 0 H GLY A 509 0.583 -10.100 -12.499 1.00 71.41 H new ATOM 0 HA2 GLY A 509 1.282 -9.083 -14.729 1.00 55.54 H new ATOM 0 HA3 GLY A 509 -0.121 -8.053 -14.529 1.00 55.54 H new ATOM 1752 N LEU A 510 1.060 -7.637 -11.828 1.00 64.22 N ATOM 1753 CA LEU A 510 1.744 -6.787 -10.868 1.00 4.32 C ATOM 1754 C LEU A 510 2.627 -7.653 -9.966 1.00 72.44 C ATOM 1755 O LEU A 510 2.208 -8.719 -9.519 1.00 71.32 O ATOM 1756 CB LEU A 510 0.737 -5.928 -10.101 1.00 4.10 C ATOM 1757 CG LEU A 510 -0.408 -5.339 -10.926 1.00 3.22 C ATOM 1758 CD1 LEU A 510 -1.487 -4.744 -10.019 1.00 52.45 C ATOM 1759 CD2 LEU A 510 0.115 -4.318 -11.938 1.00 30.42 C ATOM 0 H LEU A 510 0.281 -8.173 -11.444 1.00 64.22 H new ATOM 0 HA LEU A 510 2.402 -6.085 -11.380 1.00 4.32 H new ATOM 0 HB2 LEU A 510 0.309 -6.532 -9.301 1.00 4.10 H new ATOM 0 HB3 LEU A 510 1.276 -5.108 -9.627 1.00 4.10 H new ATOM 0 HG LEU A 510 -0.872 -6.147 -11.492 1.00 3.22 H new ATOM 0 HD11 LEU A 510 -2.290 -4.332 -10.631 1.00 52.45 H new ATOM 0 HD12 LEU A 510 -1.888 -5.523 -9.371 1.00 52.45 H new ATOM 0 HD13 LEU A 510 -1.053 -3.952 -9.408 1.00 52.45 H new ATOM 0 HD21 LEU A 510 -0.719 -3.914 -12.512 1.00 30.42 H new ATOM 0 HD22 LEU A 510 0.618 -3.508 -11.410 1.00 30.42 H new ATOM 0 HD23 LEU A 510 0.819 -4.803 -12.614 1.00 30.42 H new ATOM 1770 N VAL A 511 3.835 -7.161 -9.728 1.00 11.13 N ATOM 1771 CA VAL A 511 4.780 -7.876 -8.889 1.00 64.34 C ATOM 1772 C VAL A 511 4.122 -8.198 -7.545 1.00 52.04 C ATOM 1773 O VAL A 511 3.900 -7.305 -6.729 1.00 12.51 O ATOM 1774 CB VAL A 511 6.070 -7.063 -8.743 1.00 30.34 C ATOM 1775 CG1 VAL A 511 6.825 -7.456 -7.471 1.00 42.31 C ATOM 1776 CG2 VAL A 511 6.957 -7.220 -9.979 1.00 25.51 C ATOM 0 H VAL A 511 4.180 -6.277 -10.102 1.00 11.13 H new ATOM 0 HA VAL A 511 5.058 -8.824 -9.350 1.00 64.34 H new ATOM 0 HB VAL A 511 5.797 -6.011 -8.657 1.00 30.34 H new ATOM 0 HG11 VAL A 511 7.737 -6.864 -7.392 1.00 42.31 H new ATOM 0 HG12 VAL A 511 6.195 -7.270 -6.602 1.00 42.31 H new ATOM 0 HG13 VAL A 511 7.082 -8.514 -7.513 1.00 42.31 H new ATOM 0 HG21 VAL A 511 7.867 -6.633 -9.851 1.00 25.51 H new ATOM 0 HG22 VAL A 511 7.218 -8.270 -10.109 1.00 25.51 H new ATOM 0 HG23 VAL A 511 6.419 -6.868 -10.860 1.00 25.51 H new ATOM 1786 N ARG A 512 3.830 -9.476 -7.356 1.00 73.32 N ATOM 1787 CA ARG A 512 3.202 -9.927 -6.126 1.00 21.15 C ATOM 1788 C ARG A 512 4.191 -9.838 -4.961 1.00 41.21 C ATOM 1789 O ARG A 512 5.344 -10.248 -5.088 1.00 74.42 O ATOM 1790 CB ARG A 512 2.706 -11.368 -6.256 1.00 34.31 C ATOM 1791 CG ARG A 512 1.377 -11.560 -5.523 1.00 33.31 C ATOM 1792 CD ARG A 512 1.601 -12.136 -4.124 1.00 32.25 C ATOM 1793 NE ARG A 512 0.497 -13.057 -3.773 1.00 21.53 N ATOM 1794 CZ ARG A 512 -0.719 -12.654 -3.348 1.00 63.21 C ATOM 1795 NH1 ARG A 512 -0.997 -11.339 -3.217 1.00 14.14 N ATOM 1796 NH2 ARG A 512 -1.631 -13.563 -3.062 1.00 1.44 N ATOM 0 H ARG A 512 4.017 -10.214 -8.035 1.00 73.32 H new ATOM 0 HA ARG A 512 2.348 -9.278 -5.933 1.00 21.15 H new ATOM 0 HB2 ARG A 512 2.584 -11.620 -7.309 1.00 34.31 H new ATOM 0 HB3 ARG A 512 3.452 -12.051 -5.849 1.00 34.31 H new ATOM 0 HG2 ARG A 512 0.858 -10.605 -5.448 1.00 33.31 H new ATOM 0 HG3 ARG A 512 0.734 -12.228 -6.097 1.00 33.31 H new ATOM 0 HD2 ARG A 512 2.553 -12.666 -4.088 1.00 32.25 H new ATOM 0 HD3 ARG A 512 1.658 -11.328 -3.394 1.00 32.25 H new ATOM 0 HE ARG A 512 0.666 -14.059 -3.858 1.00 21.53 H new ATOM 0 HH11 ARG A 512 -0.286 -10.643 -3.440 1.00 14.14 H new ATOM 0 HH12 ARG A 512 -1.918 -11.042 -2.895 1.00 14.14 H new ATOM 0 HH21 ARG A 512 -1.412 -14.554 -3.163 1.00 1.44 H new ATOM 0 HH22 ARG A 512 -2.555 -13.275 -2.740 1.00 1.44 H new ATOM 1806 N LEU A 513 3.704 -9.300 -3.853 1.00 12.32 N ATOM 1807 CA LEU A 513 4.530 -9.152 -2.668 1.00 61.43 C ATOM 1808 C LEU A 513 4.133 -10.211 -1.637 1.00 14.44 C ATOM 1809 O LEU A 513 2.974 -10.625 -1.584 1.00 21.51 O ATOM 1810 CB LEU A 513 4.454 -7.720 -2.137 1.00 51.12 C ATOM 1811 CG LEU A 513 5.785 -7.080 -1.738 1.00 41.35 C ATOM 1812 CD1 LEU A 513 6.744 -7.020 -2.930 1.00 44.44 C ATOM 1813 CD2 LEU A 513 5.565 -5.702 -1.109 1.00 24.21 C ATOM 0 H LEU A 513 2.747 -8.961 -3.751 1.00 12.32 H new ATOM 0 HA LEU A 513 5.578 -9.322 -2.913 1.00 61.43 H new ATOM 0 HB2 LEU A 513 3.988 -7.096 -2.899 1.00 51.12 H new ATOM 0 HB3 LEU A 513 3.794 -7.710 -1.269 1.00 51.12 H new ATOM 0 HG LEU A 513 6.252 -7.709 -0.980 1.00 41.35 H new ATOM 0 HD11 LEU A 513 7.682 -6.561 -2.619 1.00 44.44 H new ATOM 0 HD12 LEU A 513 6.937 -8.030 -3.293 1.00 44.44 H new ATOM 0 HD13 LEU A 513 6.296 -6.427 -3.728 1.00 44.44 H new ATOM 0 HD21 LEU A 513 6.527 -5.269 -0.835 1.00 24.21 H new ATOM 0 HD22 LEU A 513 5.065 -5.050 -1.826 1.00 24.21 H new ATOM 0 HD23 LEU A 513 4.946 -5.803 -0.218 1.00 24.21 H new ATOM 1824 N ASP A 514 5.114 -10.620 -0.847 1.00 14.43 N ATOM 1825 CA ASP A 514 4.879 -11.623 0.177 1.00 3.23 C ATOM 1826 C ASP A 514 5.752 -11.315 1.395 1.00 45.31 C ATOM 1827 O ASP A 514 6.657 -10.485 1.322 1.00 15.44 O ATOM 1828 CB ASP A 514 5.246 -13.020 -0.326 1.00 60.02 C ATOM 1829 CG ASP A 514 4.355 -14.150 0.194 1.00 31.23 C ATOM 1830 OD1 ASP A 514 4.164 -15.174 -0.479 1.00 51.51 O ATOM 1831 OD2 ASP A 514 3.839 -13.946 1.357 1.00 3.25 O ATOM 0 H ASP A 514 6.073 -10.275 -0.895 1.00 14.43 H new ATOM 0 HA ASP A 514 3.820 -11.600 0.436 1.00 3.23 H new ATOM 0 HB2 ASP A 514 5.207 -13.019 -1.415 1.00 60.02 H new ATOM 0 HB3 ASP A 514 6.277 -13.232 -0.044 1.00 60.02 H new ATOM 1836 N GLU A 515 5.449 -12.000 2.489 1.00 74.14 N ATOM 1837 CA GLU A 515 6.196 -11.809 3.723 1.00 13.24 C ATOM 1838 C GLU A 515 7.001 -13.066 4.053 1.00 61.34 C ATOM 1839 O GLU A 515 8.100 -12.977 4.601 1.00 3.31 O ATOM 1840 CB GLU A 515 5.262 -11.437 4.876 1.00 33.23 C ATOM 1841 CG GLU A 515 5.996 -11.498 6.217 1.00 33.12 C ATOM 1842 CD GLU A 515 5.025 -11.301 7.382 1.00 32.51 C ATOM 1843 OE1 GLU A 515 5.294 -11.769 8.499 1.00 42.02 O ATOM 1844 OE2 GLU A 515 3.959 -10.633 7.097 1.00 32.25 O ATOM 0 H GLU A 515 4.698 -12.687 2.547 1.00 74.14 H new ATOM 0 HA GLU A 515 6.892 -10.982 3.581 1.00 13.24 H new ATOM 0 HB2 GLU A 515 4.866 -10.434 4.719 1.00 33.23 H new ATOM 0 HB3 GLU A 515 4.410 -12.117 4.892 1.00 33.23 H new ATOM 0 HG2 GLU A 515 6.499 -12.460 6.317 1.00 33.12 H new ATOM 0 HG3 GLU A 515 6.768 -10.729 6.248 1.00 33.12 H new ATOM 1850 N HIS A 516 6.428 -14.209 3.706 1.00 0.52 N ATOM 1851 CA HIS A 516 7.080 -15.482 3.961 1.00 75.03 C ATOM 1852 C HIS A 516 7.834 -15.931 2.708 1.00 72.11 C ATOM 1853 O HIS A 516 7.997 -17.127 2.472 1.00 54.42 O ATOM 1854 CB HIS A 516 6.070 -16.522 4.449 1.00 43.52 C ATOM 1855 CG HIS A 516 4.868 -16.682 3.546 1.00 21.32 C ATOM 1856 ND1 HIS A 516 3.676 -17.240 3.977 1.00 32.30 N ATOM 1857 CD2 HIS A 516 4.688 -16.351 2.236 1.00 20.04 C ATOM 1858 CE1 HIS A 516 2.826 -17.241 2.962 1.00 74.50 C ATOM 1859 NE2 HIS A 516 3.454 -16.689 1.884 1.00 21.34 N ATOM 0 H HIS A 516 5.518 -14.280 3.250 1.00 0.52 H new ATOM 0 HA HIS A 516 7.810 -15.367 4.762 1.00 75.03 H new ATOM 0 HB2 HIS A 516 6.572 -17.485 4.543 1.00 43.52 H new ATOM 0 HB3 HIS A 516 5.728 -16.242 5.446 1.00 43.52 H new ATOM 0 HD2 HIS A 516 5.425 -15.892 1.594 1.00 20.04 H new ATOM 0 HE1 HIS A 516 1.813 -17.614 2.984 1.00 74.50 H new ATOM 0 HE2 HIS A 516 3.043 -16.558 0.960 1.00 21.34 H new ATOM 1866 N SER A 517 8.276 -14.947 1.938 1.00 53.10 N ATOM 1867 CA SER A 517 9.010 -15.225 0.715 1.00 42.11 C ATOM 1868 C SER A 517 10.496 -14.925 0.917 1.00 32.10 C ATOM 1869 O SER A 517 10.862 -14.144 1.794 1.00 63.43 O ATOM 1870 CB SER A 517 8.457 -14.411 -0.456 1.00 73.33 C ATOM 1871 OG SER A 517 9.353 -14.397 -1.565 1.00 14.22 O ATOM 0 H SER A 517 8.140 -13.956 2.138 1.00 53.10 H new ATOM 0 HA SER A 517 8.889 -16.282 0.476 1.00 42.11 H new ATOM 0 HB2 SER A 517 7.500 -14.829 -0.768 1.00 73.33 H new ATOM 0 HB3 SER A 517 8.267 -13.388 -0.130 1.00 73.33 H new ATOM 0 HG SER A 517 8.964 -13.869 -2.293 1.00 14.22 H new ATOM 1876 N GLN A 518 11.313 -15.561 0.090 1.00 71.53 N ATOM 1877 CA GLN A 518 12.752 -15.371 0.167 1.00 72.44 C ATOM 1878 C GLN A 518 13.226 -14.444 -0.955 1.00 51.31 C ATOM 1879 O GLN A 518 14.389 -14.045 -0.985 1.00 51.20 O ATOM 1880 CB GLN A 518 13.485 -16.712 0.115 1.00 2.22 C ATOM 1881 CG GLN A 518 13.334 -17.368 -1.259 1.00 42.42 C ATOM 1882 CD GLN A 518 12.089 -18.258 -1.308 1.00 61.30 C ATOM 1883 OE1 GLN A 518 11.686 -18.859 -0.326 1.00 2.31 O ATOM 1884 NE2 GLN A 518 11.506 -18.308 -2.502 1.00 41.45 N ATOM 0 H GLN A 518 11.006 -16.208 -0.636 1.00 71.53 H new ATOM 0 HA GLN A 518 12.986 -14.902 1.123 1.00 72.44 H new ATOM 0 HB2 GLN A 518 14.542 -16.561 0.336 1.00 2.22 H new ATOM 0 HB3 GLN A 518 13.090 -17.376 0.884 1.00 2.22 H new ATOM 0 HG2 GLN A 518 13.266 -16.598 -2.028 1.00 42.42 H new ATOM 0 HG3 GLN A 518 14.220 -17.963 -1.481 1.00 42.42 H new ATOM 0 HE21 GLN A 518 11.896 -17.780 -3.282 1.00 41.45 H new ATOM 0 HE22 GLN A 518 10.669 -18.875 -2.637 1.00 41.45 H new ATOM 1891 N ILE A 519 12.301 -14.128 -1.848 1.00 13.24 N ATOM 1892 CA ILE A 519 12.609 -13.255 -2.969 1.00 44.30 C ATOM 1893 C ILE A 519 11.923 -11.904 -2.761 1.00 70.21 C ATOM 1894 O ILE A 519 12.384 -10.883 -3.271 1.00 33.04 O ATOM 1895 CB ILE A 519 12.246 -13.933 -4.291 1.00 0.23 C ATOM 1896 CG1 ILE A 519 11.578 -12.943 -5.249 1.00 60.32 C ATOM 1897 CG2 ILE A 519 11.380 -15.172 -4.054 1.00 71.41 C ATOM 1898 CD1 ILE A 519 12.588 -11.921 -5.774 1.00 33.31 C ATOM 0 H ILE A 519 11.337 -14.461 -1.819 1.00 13.24 H new ATOM 0 HA ILE A 519 13.681 -13.063 -3.020 1.00 44.30 H new ATOM 0 HB ILE A 519 13.168 -14.271 -4.765 1.00 0.23 H new ATOM 0 HG12 ILE A 519 11.134 -13.484 -6.085 1.00 60.32 H new ATOM 0 HG13 ILE A 519 10.766 -12.427 -4.736 1.00 60.32 H new ATOM 0 HG21 ILE A 519 11.137 -15.634 -5.011 1.00 71.41 H new ATOM 0 HG22 ILE A 519 11.926 -15.884 -3.435 1.00 71.41 H new ATOM 0 HG23 ILE A 519 10.460 -14.881 -3.547 1.00 71.41 H new ATOM 0 HD11 ILE A 519 12.087 -11.230 -6.452 1.00 33.31 H new ATOM 0 HD12 ILE A 519 13.012 -11.365 -4.937 1.00 33.31 H new ATOM 0 HD13 ILE A 519 13.386 -12.438 -6.307 1.00 33.31 H new ATOM 1909 N PHE A 520 10.831 -11.939 -2.011 1.00 23.11 N ATOM 1910 CA PHE A 520 10.077 -10.731 -1.729 1.00 43.14 C ATOM 1911 C PHE A 520 11.012 -9.545 -1.480 1.00 21.55 C ATOM 1912 O PHE A 520 10.703 -8.416 -1.857 1.00 23.31 O ATOM 1913 CB PHE A 520 9.262 -10.996 -0.462 1.00 15.24 C ATOM 1914 CG PHE A 520 8.943 -9.738 0.349 1.00 70.42 C ATOM 1915 CD1 PHE A 520 8.372 -8.664 -0.259 1.00 52.24 C ATOM 1916 CD2 PHE A 520 9.233 -9.695 1.678 1.00 12.43 C ATOM 1917 CE1 PHE A 520 8.076 -7.496 0.494 1.00 25.40 C ATOM 1918 CE2 PHE A 520 8.938 -8.527 2.430 1.00 75.34 C ATOM 1919 CZ PHE A 520 8.366 -7.452 1.822 1.00 3.44 C ATOM 0 H PHE A 520 10.451 -12.787 -1.590 1.00 23.11 H new ATOM 0 HA PHE A 520 9.440 -10.485 -2.579 1.00 43.14 H new ATOM 0 HB2 PHE A 520 8.327 -11.484 -0.739 1.00 15.24 H new ATOM 0 HB3 PHE A 520 9.810 -11.694 0.171 1.00 15.24 H new ATOM 0 HD1 PHE A 520 8.144 -8.699 -1.314 1.00 52.24 H new ATOM 0 HD2 PHE A 520 9.687 -10.548 2.160 1.00 12.43 H new ATOM 0 HE1 PHE A 520 7.621 -6.643 0.012 1.00 25.40 H new ATOM 0 HE2 PHE A 520 9.168 -8.492 3.485 1.00 75.34 H new ATOM 0 HZ PHE A 520 8.142 -6.564 2.394 1.00 3.44 H new ATOM 1928 N ALA A 521 12.138 -9.844 -0.848 1.00 44.35 N ATOM 1929 CA ALA A 521 13.121 -8.818 -0.544 1.00 41.51 C ATOM 1930 C ALA A 521 13.507 -8.090 -1.832 1.00 11.22 C ATOM 1931 O ALA A 521 13.537 -6.860 -1.870 1.00 22.14 O ATOM 1932 CB ALA A 521 14.326 -9.455 0.150 1.00 62.35 C ATOM 0 H ALA A 521 12.391 -10.782 -0.538 1.00 44.35 H new ATOM 0 HA ALA A 521 12.705 -8.078 0.140 1.00 41.51 H new ATOM 0 HB1 ALA A 521 15.063 -8.685 0.378 1.00 62.35 H new ATOM 0 HB2 ALA A 521 14.003 -9.933 1.075 1.00 62.35 H new ATOM 0 HB3 ALA A 521 14.772 -10.201 -0.507 1.00 62.35 H new ATOM 1938 N ARG A 522 13.793 -8.880 -2.857 1.00 22.00 N ATOM 1939 CA ARG A 522 14.176 -8.326 -4.145 1.00 30.13 C ATOM 1940 C ARG A 522 12.956 -7.732 -4.852 1.00 45.45 C ATOM 1941 O ARG A 522 13.096 -6.919 -5.763 1.00 73.43 O ATOM 1942 CB ARG A 522 14.804 -9.396 -5.040 1.00 31.24 C ATOM 1943 CG ARG A 522 16.192 -9.791 -4.530 1.00 32.32 C ATOM 1944 CD ARG A 522 16.088 -10.712 -3.312 1.00 14.25 C ATOM 1945 NE ARG A 522 17.427 -11.227 -2.950 1.00 32.34 N ATOM 1946 CZ ARG A 522 18.108 -12.141 -3.674 1.00 73.32 C ATOM 1947 NH1 ARG A 522 17.578 -12.651 -4.807 1.00 53.14 N ATOM 1948 NH2 ARG A 522 19.298 -12.529 -3.257 1.00 40.40 N ATOM 0 H ARG A 522 13.767 -9.899 -2.822 1.00 22.00 H new ATOM 0 HA ARG A 522 14.912 -7.543 -3.963 1.00 30.13 H new ATOM 0 HB2 ARG A 522 14.160 -10.275 -5.070 1.00 31.24 H new ATOM 0 HB3 ARG A 522 14.880 -9.022 -6.061 1.00 31.24 H new ATOM 0 HG2 ARG A 522 16.746 -10.293 -5.324 1.00 32.32 H new ATOM 0 HG3 ARG A 522 16.755 -8.896 -4.266 1.00 32.32 H new ATOM 0 HD2 ARG A 522 15.659 -10.168 -2.470 1.00 14.25 H new ATOM 0 HD3 ARG A 522 15.417 -11.543 -3.530 1.00 14.25 H new ATOM 0 HE ARG A 522 17.863 -10.869 -2.100 1.00 32.34 H new ATOM 0 HH11 ARG A 522 16.657 -12.346 -5.121 1.00 53.14 H new ATOM 0 HH12 ARG A 522 18.099 -13.341 -5.348 1.00 53.14 H new ATOM 0 HH21 ARG A 522 19.690 -12.139 -2.400 1.00 40.40 H new ATOM 0 HH22 ARG A 522 19.826 -13.219 -3.792 1.00 40.40 H new ATOM 1958 N LYS A 523 11.786 -8.161 -4.404 1.00 12.24 N ATOM 1959 CA LYS A 523 10.542 -7.682 -4.981 1.00 10.42 C ATOM 1960 C LYS A 523 10.246 -6.277 -4.454 1.00 23.01 C ATOM 1961 O LYS A 523 9.777 -5.417 -5.197 1.00 32.53 O ATOM 1962 CB LYS A 523 9.412 -8.683 -4.729 1.00 24.32 C ATOM 1963 CG LYS A 523 9.830 -10.096 -5.142 1.00 3.23 C ATOM 1964 CD LYS A 523 10.328 -10.120 -6.587 1.00 15.14 C ATOM 1965 CE LYS A 523 9.255 -9.598 -7.547 1.00 64.11 C ATOM 1966 NZ LYS A 523 9.232 -10.403 -8.788 1.00 73.24 N ATOM 0 H LYS A 523 11.673 -8.836 -3.647 1.00 12.24 H new ATOM 0 HA LYS A 523 10.632 -7.604 -6.064 1.00 10.42 H new ATOM 0 HB2 LYS A 523 9.142 -8.674 -3.673 1.00 24.32 H new ATOM 0 HB3 LYS A 523 8.525 -8.384 -5.288 1.00 24.32 H new ATOM 0 HG2 LYS A 523 10.615 -10.456 -4.477 1.00 3.23 H new ATOM 0 HG3 LYS A 523 8.985 -10.775 -5.034 1.00 3.23 H new ATOM 0 HD2 LYS A 523 11.227 -9.511 -6.675 1.00 15.14 H new ATOM 0 HD3 LYS A 523 10.604 -11.138 -6.863 1.00 15.14 H new ATOM 0 HE2 LYS A 523 8.278 -9.635 -7.065 1.00 64.11 H new ATOM 0 HE3 LYS A 523 9.452 -8.553 -7.788 1.00 64.11 H new ATOM 0 HZ1 LYS A 523 8.499 -10.035 -9.427 1.00 73.24 H new ATOM 0 HZ2 LYS A 523 10.159 -10.346 -9.256 1.00 73.24 H new ATOM 0 HZ3 LYS A 523 9.022 -11.395 -8.555 1.00 73.24 H new ATOM 1975 N VAL A 524 10.535 -6.088 -3.175 1.00 75.34 N ATOM 1976 CA VAL A 524 10.308 -4.801 -2.538 1.00 13.14 C ATOM 1977 C VAL A 524 11.449 -3.849 -2.900 1.00 63.14 C ATOM 1978 O VAL A 524 11.212 -2.699 -3.268 1.00 14.43 O ATOM 1979 CB VAL A 524 10.138 -4.986 -1.030 1.00 53.25 C ATOM 1980 CG1 VAL A 524 11.487 -4.905 -0.312 1.00 51.25 C ATOM 1981 CG2 VAL A 524 9.150 -3.966 -0.459 1.00 53.15 C ATOM 0 H VAL A 524 10.924 -6.804 -2.562 1.00 75.34 H new ATOM 0 HA VAL A 524 9.384 -4.352 -2.902 1.00 13.14 H new ATOM 0 HB VAL A 524 9.727 -5.981 -0.859 1.00 53.25 H new ATOM 0 HG11 VAL A 524 11.338 -5.040 0.759 1.00 51.25 H new ATOM 0 HG12 VAL A 524 12.147 -5.687 -0.688 1.00 51.25 H new ATOM 0 HG13 VAL A 524 11.939 -3.930 -0.496 1.00 51.25 H new ATOM 0 HG21 VAL A 524 9.048 -4.120 0.615 1.00 53.15 H new ATOM 0 HG22 VAL A 524 9.519 -2.958 -0.647 1.00 53.15 H new ATOM 0 HG23 VAL A 524 8.179 -4.093 -0.938 1.00 53.15 H new ATOM 1991 N ALA A 525 12.665 -4.362 -2.783 1.00 1.02 N ATOM 1992 CA ALA A 525 13.844 -3.572 -3.093 1.00 41.04 C ATOM 1993 C ALA A 525 13.840 -3.219 -4.581 1.00 1.20 C ATOM 1994 O ALA A 525 14.623 -2.381 -5.027 1.00 44.22 O ATOM 1995 CB ALA A 525 15.099 -4.344 -2.680 1.00 3.23 C ATOM 0 H ALA A 525 12.859 -5.316 -2.478 1.00 1.02 H new ATOM 0 HA ALA A 525 13.837 -2.637 -2.533 1.00 41.04 H new ATOM 0 HB1 ALA A 525 15.984 -3.751 -2.913 1.00 3.23 H new ATOM 0 HB2 ALA A 525 15.067 -4.544 -1.609 1.00 3.23 H new ATOM 0 HB3 ALA A 525 15.141 -5.288 -3.224 1.00 3.23 H new ATOM 2001 N ASN A 526 12.950 -3.876 -5.310 1.00 5.54 N ATOM 2002 CA ASN A 526 12.833 -3.643 -6.740 1.00 64.33 C ATOM 2003 C ASN A 526 11.829 -2.516 -6.987 1.00 14.12 C ATOM 2004 O ASN A 526 12.158 -1.514 -7.619 1.00 10.31 O ATOM 2005 CB ASN A 526 12.330 -4.894 -7.462 1.00 15.32 C ATOM 2006 CG ASN A 526 13.496 -5.710 -8.023 1.00 73.05 C ATOM 2007 OD1 ASN A 526 14.603 -5.227 -8.185 1.00 73.35 O ATOM 2008 ND2 ASN A 526 13.185 -6.971 -8.311 1.00 40.54 N ATOM 0 H ASN A 526 12.302 -4.570 -4.937 1.00 5.54 H new ATOM 0 HA ASN A 526 13.819 -3.380 -7.122 1.00 64.33 H new ATOM 0 HB2 ASN A 526 11.751 -5.508 -6.772 1.00 15.32 H new ATOM 0 HB3 ASN A 526 11.660 -4.606 -8.272 1.00 15.32 H new ATOM 0 HD21 ASN A 526 13.894 -7.597 -8.692 1.00 40.54 H new ATOM 0 HD22 ASN A 526 12.237 -7.312 -8.151 1.00 40.54 H new ATOM 2014 N THR A 527 10.622 -2.719 -6.477 1.00 22.33 N ATOM 2015 CA THR A 527 9.568 -1.733 -6.635 1.00 54.42 C ATOM 2016 C THR A 527 9.808 -0.542 -5.706 1.00 51.43 C ATOM 2017 O THR A 527 9.856 0.602 -6.157 1.00 74.42 O ATOM 2018 CB THR A 527 8.228 -2.431 -6.394 1.00 14.51 C ATOM 2019 OG1 THR A 527 7.263 -1.393 -6.547 1.00 72.32 O ATOM 2020 CG2 THR A 527 8.057 -2.886 -4.944 1.00 25.35 C ATOM 0 H THR A 527 10.352 -3.552 -5.954 1.00 22.33 H new ATOM 0 HA THR A 527 9.560 -1.321 -7.644 1.00 54.42 H new ATOM 0 HB THR A 527 8.143 -3.292 -7.057 1.00 14.51 H new ATOM 0 HG1 THR A 527 6.562 -1.495 -5.869 1.00 72.32 H new ATOM 0 HG21 THR A 527 7.090 -3.375 -4.828 1.00 25.35 H new ATOM 0 HG22 THR A 527 8.851 -3.587 -4.687 1.00 25.35 H new ATOM 0 HG23 THR A 527 8.108 -2.021 -4.283 1.00 25.35 H new ATOM 2028 N PHE A 528 9.951 -0.850 -4.426 1.00 1.11 N ATOM 2029 CA PHE A 528 10.185 0.181 -3.429 1.00 33.32 C ATOM 2030 C PHE A 528 11.678 0.499 -3.308 1.00 72.02 C ATOM 2031 O PHE A 528 12.209 0.586 -2.203 1.00 52.23 O ATOM 2032 CB PHE A 528 9.684 -0.366 -2.093 1.00 44.20 C ATOM 2033 CG PHE A 528 8.165 -0.286 -1.917 1.00 52.12 C ATOM 2034 CD1 PHE A 528 7.546 0.925 -1.890 1.00 64.23 C ATOM 2035 CD2 PHE A 528 7.434 -1.426 -1.789 1.00 33.21 C ATOM 2036 CE1 PHE A 528 6.138 1.000 -1.729 1.00 44.14 C ATOM 2037 CE2 PHE A 528 6.025 -1.351 -1.628 1.00 73.00 C ATOM 2038 CZ PHE A 528 5.407 -0.140 -1.601 1.00 62.21 C ATOM 0 H PHE A 528 9.909 -1.799 -4.056 1.00 1.11 H new ATOM 0 HA PHE A 528 9.667 1.097 -3.714 1.00 33.32 H new ATOM 0 HB2 PHE A 528 9.996 -1.406 -1.998 1.00 44.20 H new ATOM 0 HB3 PHE A 528 10.163 0.186 -1.284 1.00 44.20 H new ATOM 0 HD1 PHE A 528 8.127 1.830 -1.991 1.00 64.23 H new ATOM 0 HD2 PHE A 528 7.925 -2.388 -1.810 1.00 33.21 H new ATOM 0 HE1 PHE A 528 5.647 1.962 -1.708 1.00 44.14 H new ATOM 0 HE2 PHE A 528 5.444 -2.256 -1.527 1.00 73.00 H new ATOM 0 HZ PHE A 528 4.336 -0.083 -1.478 1.00 62.21 H new ATOM 2047 N LYS A 529 12.310 0.662 -4.461 1.00 15.11 N ATOM 2048 CA LYS A 529 13.730 0.967 -4.498 1.00 53.34 C ATOM 2049 C LYS A 529 14.038 2.066 -3.478 1.00 54.14 C ATOM 2050 O LYS A 529 13.176 2.887 -3.164 1.00 20.44 O ATOM 2051 CB LYS A 529 14.167 1.313 -5.924 1.00 11.42 C ATOM 2052 CG LYS A 529 14.493 0.047 -6.718 1.00 12.22 C ATOM 2053 CD LYS A 529 14.219 0.251 -8.211 1.00 65.54 C ATOM 2054 CE LYS A 529 14.560 -1.010 -9.007 1.00 21.11 C ATOM 2055 NZ LYS A 529 14.041 -0.904 -10.390 1.00 64.41 N ATOM 0 H LYS A 529 11.865 0.589 -5.376 1.00 15.11 H new ATOM 0 HA LYS A 529 14.315 0.092 -4.213 1.00 53.34 H new ATOM 0 HB2 LYS A 529 13.375 1.868 -6.427 1.00 11.42 H new ATOM 0 HB3 LYS A 529 15.042 1.963 -5.893 1.00 11.42 H new ATOM 0 HG2 LYS A 529 15.539 -0.221 -6.570 1.00 12.22 H new ATOM 0 HG3 LYS A 529 13.895 -0.785 -6.345 1.00 12.22 H new ATOM 0 HD2 LYS A 529 13.170 0.507 -8.360 1.00 65.54 H new ATOM 0 HD3 LYS A 529 14.808 1.090 -8.581 1.00 65.54 H new ATOM 0 HE2 LYS A 529 15.640 -1.154 -9.027 1.00 21.11 H new ATOM 0 HE3 LYS A 529 14.131 -1.884 -8.517 1.00 21.11 H new ATOM 0 HZ1 LYS A 529 14.280 -1.768 -10.918 1.00 64.41 H new ATOM 0 HZ2 LYS A 529 13.008 -0.789 -10.365 1.00 64.41 H new ATOM 0 HZ3 LYS A 529 14.470 -0.081 -10.860 1.00 64.41 H new ATOM 2064 N PRO A 530 15.301 2.046 -2.976 1.00 25.14 N ATOM 2065 CA PRO A 530 15.734 3.029 -1.997 1.00 71.13 C ATOM 2066 C PRO A 530 15.982 4.387 -2.658 1.00 42.33 C ATOM 2067 O PRO A 530 15.363 5.383 -2.287 1.00 2.12 O ATOM 2068 CB PRO A 530 16.986 2.437 -1.370 1.00 24.35 C ATOM 2069 CG PRO A 530 17.469 1.369 -2.336 1.00 21.22 C ATOM 2070 CD PRO A 530 16.348 1.090 -3.324 1.00 64.30 C ATOM 0 HA PRO A 530 14.979 3.225 -1.236 1.00 71.13 H new ATOM 0 HB2 PRO A 530 17.748 3.202 -1.221 1.00 24.35 H new ATOM 0 HB3 PRO A 530 16.768 2.009 -0.391 1.00 24.35 H new ATOM 0 HG2 PRO A 530 18.364 1.705 -2.860 1.00 21.22 H new ATOM 0 HG3 PRO A 530 17.737 0.460 -1.797 1.00 21.22 H new ATOM 0 HD2 PRO A 530 16.683 1.227 -4.352 1.00 64.30 H new ATOM 0 HD3 PRO A 530 15.991 0.064 -3.239 1.00 64.30 H new ATOM 2075 N HIS A 531 16.887 4.383 -3.624 1.00 31.30 N ATOM 2076 CA HIS A 531 17.224 5.602 -4.340 1.00 24.12 C ATOM 2077 C HIS A 531 15.951 6.227 -4.914 1.00 74.34 C ATOM 2078 O HIS A 531 15.931 7.413 -5.239 1.00 41.21 O ATOM 2079 CB HIS A 531 18.285 5.329 -5.407 1.00 72.33 C ATOM 2080 CG HIS A 531 18.132 3.996 -6.101 1.00 50.13 C ATOM 2081 ND1 HIS A 531 16.898 3.455 -6.418 1.00 20.50 N ATOM 2082 CD2 HIS A 531 19.068 3.104 -6.534 1.00 2.22 C ATOM 2083 CE1 HIS A 531 17.095 2.287 -7.014 1.00 73.21 C ATOM 2084 NE2 HIS A 531 18.440 2.072 -7.084 1.00 12.23 N ATOM 0 H HIS A 531 17.398 3.555 -3.929 1.00 31.30 H new ATOM 0 HA HIS A 531 17.663 6.324 -3.652 1.00 24.12 H new ATOM 0 HB2 HIS A 531 18.246 6.122 -6.154 1.00 72.33 H new ATOM 0 HB3 HIS A 531 19.271 5.375 -4.944 1.00 72.33 H new ATOM 0 HD2 HIS A 531 20.138 3.218 -6.445 1.00 2.22 H new ATOM 0 HE1 HIS A 531 16.326 1.623 -7.380 1.00 73.21 H new ATOM 0 HE2 HIS A 531 18.890 1.252 -7.492 1.00 12.23 H new ATOM 2091 N ARG A 532 14.921 5.402 -5.024 1.00 31.33 N ATOM 2092 CA ARG A 532 13.648 5.859 -5.553 1.00 61.14 C ATOM 2093 C ARG A 532 12.779 6.425 -4.430 1.00 55.03 C ATOM 2094 O ARG A 532 12.066 7.409 -4.627 1.00 20.01 O ATOM 2095 CB ARG A 532 12.898 4.718 -6.244 1.00 33.11 C ATOM 2096 CG ARG A 532 13.162 4.721 -7.751 1.00 52.21 C ATOM 2097 CD ARG A 532 14.524 4.101 -8.069 1.00 31.44 C ATOM 2098 NE ARG A 532 14.606 3.773 -9.510 1.00 74.02 N ATOM 2099 CZ ARG A 532 15.763 3.646 -10.193 1.00 22.33 C ATOM 2100 NH1 ARG A 532 16.948 3.819 -9.571 1.00 24.55 N ATOM 2101 NH2 ARG A 532 15.720 3.350 -11.479 1.00 4.33 N ATOM 0 H ARG A 532 14.942 4.418 -4.755 1.00 31.33 H new ATOM 0 HA ARG A 532 13.854 6.640 -6.285 1.00 61.14 H new ATOM 0 HB2 ARG A 532 13.209 3.764 -5.819 1.00 33.11 H new ATOM 0 HB3 ARG A 532 11.828 4.816 -6.058 1.00 33.11 H new ATOM 0 HG2 ARG A 532 12.377 4.165 -8.263 1.00 52.21 H new ATOM 0 HG3 ARG A 532 13.126 5.743 -8.128 1.00 52.21 H new ATOM 0 HD2 ARG A 532 15.321 4.795 -7.799 1.00 31.44 H new ATOM 0 HD3 ARG A 532 14.671 3.200 -7.473 1.00 31.44 H new ATOM 0 HE ARG A 532 13.733 3.634 -10.019 1.00 74.02 H new ATOM 0 HH11 ARG A 532 16.974 4.048 -8.577 1.00 24.55 H new ATOM 0 HH12 ARG A 532 17.818 3.721 -10.095 1.00 24.55 H new ATOM 0 HH21 ARG A 532 14.821 3.221 -11.943 1.00 4.33 H new ATOM 0 HH22 ARG A 532 16.586 3.251 -12.009 1.00 4.33 H new ATOM 2111 N LEU A 533 12.864 5.782 -3.275 1.00 31.31 N ATOM 2112 CA LEU A 533 12.094 6.210 -2.120 1.00 23.33 C ATOM 2113 C LEU A 533 12.484 7.645 -1.756 1.00 11.31 C ATOM 2114 O LEU A 533 11.644 8.543 -1.778 1.00 63.21 O ATOM 2115 CB LEU A 533 12.260 5.217 -0.968 1.00 41.30 C ATOM 2116 CG LEU A 533 11.225 4.091 -0.900 1.00 24.53 C ATOM 2117 CD1 LEU A 533 10.180 4.370 0.182 1.00 54.02 C ATOM 2118 CD2 LEU A 533 10.584 3.853 -2.269 1.00 4.33 C ATOM 0 H LEU A 533 13.455 4.967 -3.114 1.00 31.31 H new ATOM 0 HA LEU A 533 11.029 6.218 -2.353 1.00 23.33 H new ATOM 0 HB2 LEU A 533 13.251 4.769 -1.040 1.00 41.30 H new ATOM 0 HB3 LEU A 533 12.228 5.771 -0.030 1.00 41.30 H new ATOM 0 HG LEU A 533 11.739 3.171 -0.620 1.00 24.53 H new ATOM 0 HD11 LEU A 533 9.457 3.555 0.209 1.00 54.02 H new ATOM 0 HD12 LEU A 533 10.672 4.450 1.151 1.00 54.02 H new ATOM 0 HD13 LEU A 533 9.665 5.304 -0.042 1.00 54.02 H new ATOM 0 HD21 LEU A 533 9.853 3.048 -2.193 1.00 4.33 H new ATOM 0 HD22 LEU A 533 10.088 4.765 -2.602 1.00 4.33 H new ATOM 0 HD23 LEU A 533 11.355 3.576 -2.988 1.00 4.33 H new