USER MOD reduce.3.24.130724 H: found=0, std=0, add=715, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 715 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 514 ASN : amide:sc= -0.866 K(o=-0.77,f=-6.2!) USER MOD Set 1.2: A 534 THR OG1 : rot 180:sc= 0.0993 USER MOD Single : A 441 THR OG1 : rot 180:sc= -0.0281 USER MOD Single : A 445 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 453 ASN : amide:sc= -0.66 K(o=-0.66,f=-2.8!) USER MOD Single : A 454 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 458 TYR OH : rot -153:sc= 0.851 USER MOD Single : A 461 HIS : no HD1:sc= 0 K(o=0,f=-0.65) USER MOD Single : A 463 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0598) USER MOD Single : A 464 ASN : amide:sc= -1.71! C(o=-1.7!,f=-15!) USER MOD Single : A 472 SER OG : rot 180:sc= 0 USER MOD Single : A 473 THR OG1 : rot 94:sc= 0.23 USER MOD Single : A 474 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 478 TYR OH : rot 180:sc= 0 USER MOD Single : A 480 ASN : amide:sc= 0.508 K(o=0.51,f=-3.7!) USER MOD Single : A 482 THR OG1 : rot 180:sc= 0 USER MOD Single : A 484 TYR OH : rot 64:sc= -0.486 USER MOD Single : A 485 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 486 ASN : amide:sc= -0.107 K(o=-0.11,f=-0.75) USER MOD Single : A 488 THR OG1 : rot 180:sc= 0 USER MOD Single : A 490 SER OG : rot -45:sc= 0.309 USER MOD Single : A 494 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 497 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 500 THR OG1 : rot 180:sc= 0 USER MOD Single : A 502 SER OG : rot 180:sc= 0 USER MOD Single : A 504 THR OG1 : rot 180:sc= -0.0922 USER MOD Single : A 506 THR OG1 : rot 180:sc= 0 USER MOD Single : A 507 GLN : amide:sc= 0 K(o=0,f=-0.74) USER MOD Single : A 510 MET CE :methyl -126:sc= -0.0503 (180deg=-0.391) USER MOD Single : A 511 TYR OH : rot 17:sc= 0.675 USER MOD Single : A 516 THR OG1 : rot 180:sc= 0 USER MOD Single : A 538 SER OG : rot 87:sc= 0.0348 USER MOD ----------------------------------------------------------------- ATOM 55 N PRO A 438 -5.364 -16.932 -6.215 1.00 0.00 N ATOM 56 CA PRO A 438 -5.589 -15.556 -6.642 1.00 0.00 C ATOM 57 C PRO A 438 -4.298 -14.911 -7.128 1.00 0.00 C ATOM 58 O PRO A 438 -3.210 -15.458 -6.940 1.00 0.00 O ATOM 59 CB PRO A 438 -6.146 -14.863 -5.395 1.00 0.00 C ATOM 60 CG PRO A 438 -5.547 -15.613 -4.254 1.00 0.00 C ATOM 61 CD PRO A 438 -5.442 -17.039 -4.726 1.00 0.00 C ATOM 0 HA PRO A 438 -6.274 -15.484 -7.487 1.00 0.00 H new ATOM 0 HB2 PRO A 438 -5.867 -13.810 -5.368 1.00 0.00 H new ATOM 0 HB3 PRO A 438 -7.235 -14.905 -5.370 1.00 0.00 H new ATOM 0 HG2 PRO A 438 -4.568 -15.213 -3.991 1.00 0.00 H new ATOM 0 HG3 PRO A 438 -6.171 -15.539 -3.364 1.00 0.00 H new ATOM 0 HD2 PRO A 438 -4.559 -17.529 -4.316 1.00 0.00 H new ATOM 0 HD3 PRO A 438 -6.306 -17.626 -4.414 1.00 0.00 H new ATOM 69 N ASP A 439 -4.423 -13.746 -7.755 1.00 0.00 N ATOM 70 CA ASP A 439 -3.261 -12.951 -8.134 1.00 0.00 C ATOM 71 C ASP A 439 -3.382 -11.520 -7.628 1.00 0.00 C ATOM 72 O ASP A 439 -3.775 -10.620 -8.370 1.00 0.00 O ATOM 73 CB ASP A 439 -3.080 -12.957 -9.655 1.00 0.00 C ATOM 74 CG ASP A 439 -1.812 -12.268 -10.140 1.00 0.00 C ATOM 75 OD1 ASP A 439 -1.063 -11.798 -9.317 1.00 0.00 O ATOM 76 OD2 ASP A 439 -1.525 -12.351 -11.310 1.00 0.00 O ATOM 0 H ASP A 439 -5.319 -13.331 -8.012 1.00 0.00 H new ATOM 0 HA ASP A 439 -2.384 -13.403 -7.671 1.00 0.00 H new ATOM 0 HB2 ASP A 439 -3.074 -13.990 -10.004 1.00 0.00 H new ATOM 0 HB3 ASP A 439 -3.941 -12.471 -10.113 1.00 0.00 H new ATOM 81 N LEU A 440 -3.045 -11.316 -6.359 1.00 0.00 N ATOM 82 CA LEU A 440 -3.231 -10.021 -5.715 1.00 0.00 C ATOM 83 C LEU A 440 -2.001 -9.139 -5.890 1.00 0.00 C ATOM 84 O LEU A 440 -0.869 -9.597 -5.735 1.00 0.00 O ATOM 85 CB LEU A 440 -3.545 -10.210 -4.226 1.00 0.00 C ATOM 86 CG LEU A 440 -4.816 -11.012 -3.924 1.00 0.00 C ATOM 87 CD1 LEU A 440 -4.877 -11.357 -2.441 1.00 0.00 C ATOM 88 CD2 LEU A 440 -6.038 -10.208 -4.341 1.00 0.00 C ATOM 0 H LEU A 440 -2.641 -12.032 -5.755 1.00 0.00 H new ATOM 0 HA LEU A 440 -4.074 -9.522 -6.193 1.00 0.00 H new ATOM 0 HB2 LEU A 440 -2.699 -10.709 -3.753 1.00 0.00 H new ATOM 0 HB3 LEU A 440 -3.636 -9.228 -3.763 1.00 0.00 H new ATOM 0 HG LEU A 440 -4.800 -11.943 -4.490 1.00 0.00 H new ATOM 0 HD11 LEU A 440 -5.784 -11.927 -2.237 1.00 0.00 H new ATOM 0 HD12 LEU A 440 -4.005 -11.953 -2.170 1.00 0.00 H new ATOM 0 HD13 LEU A 440 -4.886 -10.439 -1.854 1.00 0.00 H new ATOM 0 HD21 LEU A 440 -6.941 -10.780 -4.126 1.00 0.00 H new ATOM 0 HD22 LEU A 440 -6.062 -9.269 -3.787 1.00 0.00 H new ATOM 0 HD23 LEU A 440 -5.988 -9.998 -5.409 1.00 0.00 H new ATOM 100 N THR A 441 -2.230 -7.872 -6.215 1.00 0.00 N ATOM 101 CA THR A 441 -1.147 -6.906 -6.347 1.00 0.00 C ATOM 102 C THR A 441 -1.546 -5.547 -5.788 1.00 0.00 C ATOM 103 O THR A 441 -2.728 -5.200 -5.759 1.00 0.00 O ATOM 104 CB THR A 441 -0.715 -6.737 -7.816 1.00 0.00 C ATOM 105 OG1 THR A 441 0.338 -5.770 -7.900 1.00 0.00 O ATOM 106 CG2 THR A 441 -1.889 -6.278 -8.667 1.00 0.00 C ATOM 0 H THR A 441 -3.159 -7.489 -6.392 1.00 0.00 H new ATOM 0 HA THR A 441 -0.308 -7.299 -5.773 1.00 0.00 H new ATOM 0 HB THR A 441 -0.363 -7.699 -8.188 1.00 0.00 H new ATOM 0 HG1 THR A 441 0.612 -5.665 -8.835 1.00 0.00 H new ATOM 0 HG21 THR A 441 -1.566 -6.164 -9.702 1.00 0.00 H new ATOM 0 HG22 THR A 441 -2.687 -7.019 -8.616 1.00 0.00 H new ATOM 0 HG23 THR A 441 -2.257 -5.322 -8.294 1.00 0.00 H new ATOM 114 N VAL A 442 -0.556 -4.780 -5.344 1.00 0.00 N ATOM 115 CA VAL A 442 -0.806 -3.468 -4.759 1.00 0.00 C ATOM 116 C VAL A 442 0.113 -2.413 -5.363 1.00 0.00 C ATOM 117 O VAL A 442 1.197 -2.728 -5.852 1.00 0.00 O ATOM 118 CB VAL A 442 -0.618 -3.485 -3.231 1.00 0.00 C ATOM 119 CG1 VAL A 442 -1.546 -4.508 -2.591 1.00 0.00 C ATOM 120 CG2 VAL A 442 0.827 -3.784 -2.874 1.00 0.00 C ATOM 0 H VAL A 442 0.428 -5.045 -5.378 1.00 0.00 H new ATOM 0 HA VAL A 442 -1.842 -3.215 -4.984 1.00 0.00 H new ATOM 0 HB VAL A 442 -0.871 -2.498 -2.843 1.00 0.00 H new ATOM 0 HG11 VAL A 442 -1.400 -4.506 -1.511 1.00 0.00 H new ATOM 0 HG12 VAL A 442 -2.581 -4.252 -2.817 1.00 0.00 H new ATOM 0 HG13 VAL A 442 -1.323 -5.499 -2.986 1.00 0.00 H new ATOM 0 HG21 VAL A 442 0.940 -3.792 -1.790 1.00 0.00 H new ATOM 0 HG22 VAL A 442 1.107 -4.758 -3.275 1.00 0.00 H new ATOM 0 HG23 VAL A 442 1.473 -3.017 -3.301 1.00 0.00 H new ATOM 130 N GLU A 443 -0.328 -1.160 -5.324 1.00 0.00 N ATOM 131 CA GLU A 443 0.447 -0.058 -5.881 1.00 0.00 C ATOM 132 C GLU A 443 0.381 1.170 -4.984 1.00 0.00 C ATOM 133 O GLU A 443 -0.686 1.538 -4.496 1.00 0.00 O ATOM 134 CB GLU A 443 -0.050 0.289 -7.286 1.00 0.00 C ATOM 135 CG GLU A 443 0.282 -0.751 -8.345 1.00 0.00 C ATOM 136 CD GLU A 443 -0.236 -0.341 -9.697 1.00 0.00 C ATOM 137 OE1 GLU A 443 -0.834 0.704 -9.788 1.00 0.00 O ATOM 138 OE2 GLU A 443 0.063 -1.012 -10.654 1.00 0.00 O ATOM 0 H GLU A 443 -1.219 -0.883 -4.912 1.00 0.00 H new ATOM 0 HA GLU A 443 1.487 -0.379 -5.942 1.00 0.00 H new ATOM 0 HB2 GLU A 443 -1.131 0.423 -7.253 1.00 0.00 H new ATOM 0 HB3 GLU A 443 0.381 1.244 -7.585 1.00 0.00 H new ATOM 0 HG2 GLU A 443 1.362 -0.891 -8.394 1.00 0.00 H new ATOM 0 HG3 GLU A 443 -0.151 -1.711 -8.063 1.00 0.00 H new ATOM 145 N ILE A 444 1.530 1.804 -4.770 1.00 0.00 N ATOM 146 CA ILE A 444 1.592 3.041 -4.005 1.00 0.00 C ATOM 147 C ILE A 444 1.853 4.237 -4.912 1.00 0.00 C ATOM 148 O ILE A 444 2.806 4.242 -5.690 1.00 0.00 O ATOM 149 CB ILE A 444 2.684 2.982 -2.922 1.00 0.00 C ATOM 150 CG1 ILE A 444 2.406 1.840 -1.944 1.00 0.00 C ATOM 151 CG2 ILE A 444 2.774 4.309 -2.184 1.00 0.00 C ATOM 152 CD1 ILE A 444 3.533 1.581 -0.970 1.00 0.00 C ATOM 0 H ILE A 444 2.432 1.479 -5.118 1.00 0.00 H new ATOM 0 HA ILE A 444 0.622 3.160 -3.522 1.00 0.00 H new ATOM 0 HB ILE A 444 3.642 2.793 -3.407 1.00 0.00 H new ATOM 0 HG12 ILE A 444 1.499 2.067 -1.383 1.00 0.00 H new ATOM 0 HG13 ILE A 444 2.211 0.929 -2.510 1.00 0.00 H new ATOM 0 HG21 ILE A 444 3.551 4.250 -1.422 1.00 0.00 H new ATOM 0 HG22 ILE A 444 3.019 5.102 -2.890 1.00 0.00 H new ATOM 0 HG23 ILE A 444 1.817 4.527 -1.710 1.00 0.00 H new ATOM 0 HD11 ILE A 444 3.261 0.757 -0.310 1.00 0.00 H new ATOM 0 HD12 ILE A 444 4.437 1.321 -1.521 1.00 0.00 H new ATOM 0 HD13 ILE A 444 3.714 2.477 -0.377 1.00 0.00 H new ATOM 164 N LYS A 445 0.998 5.250 -4.807 1.00 0.00 N ATOM 165 CA LYS A 445 1.156 6.470 -5.590 1.00 0.00 C ATOM 166 C LYS A 445 0.929 7.708 -4.734 1.00 0.00 C ATOM 167 O LYS A 445 0.133 7.688 -3.795 1.00 0.00 O ATOM 168 CB LYS A 445 0.194 6.470 -6.780 1.00 0.00 C ATOM 169 CG LYS A 445 0.495 5.409 -7.832 1.00 0.00 C ATOM 170 CD LYS A 445 -0.461 5.511 -9.010 1.00 0.00 C ATOM 171 CE LYS A 445 -0.182 4.434 -10.047 1.00 0.00 C ATOM 172 NZ LYS A 445 -1.127 4.505 -11.194 1.00 0.00 N ATOM 0 H LYS A 445 0.188 5.250 -4.187 1.00 0.00 H new ATOM 0 HA LYS A 445 2.180 6.497 -5.962 1.00 0.00 H new ATOM 0 HB2 LYS A 445 -0.821 6.321 -6.411 1.00 0.00 H new ATOM 0 HB3 LYS A 445 0.221 7.452 -7.253 1.00 0.00 H new ATOM 0 HG2 LYS A 445 1.521 5.523 -8.183 1.00 0.00 H new ATOM 0 HG3 LYS A 445 0.419 4.418 -7.384 1.00 0.00 H new ATOM 0 HD2 LYS A 445 -1.488 5.420 -8.656 1.00 0.00 H new ATOM 0 HD3 LYS A 445 -0.369 6.494 -9.471 1.00 0.00 H new ATOM 0 HE2 LYS A 445 0.840 4.539 -10.412 1.00 0.00 H new ATOM 0 HE3 LYS A 445 -0.254 3.452 -9.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 445 -0.901 3.754 -11.877 1.00 0.00 H new ATOM 0 HZ2 LYS A 445 -2.100 4.379 -10.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 445 -1.041 5.432 -11.658 1.00 0.00 H new ATOM 186 N GLY A 446 1.633 8.785 -5.062 1.00 0.00 N ATOM 187 CA GLY A 446 1.490 10.044 -4.339 1.00 0.00 C ATOM 188 C GLY A 446 2.723 10.922 -4.514 1.00 0.00 C ATOM 189 O GLY A 446 3.590 10.635 -5.339 1.00 0.00 O ATOM 0 H GLY A 446 2.310 8.812 -5.825 1.00 0.00 H new ATOM 0 HA2 GLY A 446 0.608 10.575 -4.698 1.00 0.00 H new ATOM 0 HA3 GLY A 446 1.331 9.842 -3.280 1.00 0.00 H new ATOM 193 N PRO A 447 2.795 11.995 -3.732 1.00 0.00 N ATOM 194 CA PRO A 447 3.911 12.930 -3.815 1.00 0.00 C ATOM 195 C PRO A 447 5.212 12.275 -3.367 1.00 0.00 C ATOM 196 O PRO A 447 5.364 11.912 -2.199 1.00 0.00 O ATOM 197 CB PRO A 447 3.499 14.085 -2.897 1.00 0.00 C ATOM 198 CG PRO A 447 2.500 13.483 -1.968 1.00 0.00 C ATOM 199 CD PRO A 447 1.767 12.452 -2.783 1.00 0.00 C ATOM 0 HA PRO A 447 4.104 13.269 -4.833 1.00 0.00 H new ATOM 0 HB2 PRO A 447 4.355 14.486 -2.354 1.00 0.00 H new ATOM 0 HB3 PRO A 447 3.067 14.909 -3.465 1.00 0.00 H new ATOM 0 HG2 PRO A 447 2.989 13.028 -1.107 1.00 0.00 H new ATOM 0 HG3 PRO A 447 1.816 14.239 -1.583 1.00 0.00 H new ATOM 0 HD2 PRO A 447 1.397 11.635 -2.163 1.00 0.00 H new ATOM 0 HD3 PRO A 447 0.905 12.879 -3.295 1.00 0.00 H new ATOM 207 N ASP A 448 6.145 12.126 -4.299 1.00 0.00 N ATOM 208 CA ASP A 448 7.448 11.546 -3.993 1.00 0.00 C ATOM 209 C ASP A 448 8.272 12.477 -3.113 1.00 0.00 C ATOM 210 O ASP A 448 9.135 12.030 -2.358 1.00 0.00 O ATOM 211 CB ASP A 448 8.210 11.230 -5.282 1.00 0.00 C ATOM 212 CG ASP A 448 8.386 12.420 -6.217 1.00 0.00 C ATOM 213 OD1 ASP A 448 7.850 13.463 -5.928 1.00 0.00 O ATOM 214 OD2 ASP A 448 9.178 12.325 -7.125 1.00 0.00 O ATOM 0 H ASP A 448 6.024 12.399 -5.274 1.00 0.00 H new ATOM 0 HA ASP A 448 7.280 10.619 -3.445 1.00 0.00 H new ATOM 0 HB2 ASP A 448 9.194 10.839 -5.022 1.00 0.00 H new ATOM 0 HB3 ASP A 448 7.684 10.439 -5.816 1.00 0.00 H new ATOM 219 N VAL A 449 8.002 13.774 -3.216 1.00 0.00 N ATOM 220 CA VAL A 449 8.601 14.754 -2.318 1.00 0.00 C ATOM 221 C VAL A 449 7.533 15.572 -1.603 1.00 0.00 C ATOM 222 O VAL A 449 6.610 16.089 -2.231 1.00 0.00 O ATOM 223 CB VAL A 449 9.544 15.710 -3.074 1.00 0.00 C ATOM 224 CG1 VAL A 449 10.129 16.744 -2.123 1.00 0.00 C ATOM 225 CG2 VAL A 449 10.656 14.930 -3.758 1.00 0.00 C ATOM 0 H VAL A 449 7.372 14.171 -3.913 1.00 0.00 H new ATOM 0 HA VAL A 449 9.178 14.194 -1.582 1.00 0.00 H new ATOM 0 HB VAL A 449 8.966 16.231 -3.838 1.00 0.00 H new ATOM 0 HG11 VAL A 449 10.792 17.411 -2.674 1.00 0.00 H new ATOM 0 HG12 VAL A 449 9.322 17.324 -1.675 1.00 0.00 H new ATOM 0 HG13 VAL A 449 10.692 16.239 -1.338 1.00 0.00 H new ATOM 0 HG21 VAL A 449 11.313 15.621 -4.287 1.00 0.00 H new ATOM 0 HG22 VAL A 449 11.231 14.384 -3.010 1.00 0.00 H new ATOM 0 HG23 VAL A 449 10.223 14.225 -4.468 1.00 0.00 H new ATOM 235 N VAL A 450 7.665 15.684 -0.285 1.00 0.00 N ATOM 236 CA VAL A 450 6.727 16.463 0.515 1.00 0.00 C ATOM 237 C VAL A 450 7.459 17.427 1.437 1.00 0.00 C ATOM 238 O VAL A 450 8.593 17.172 1.844 1.00 0.00 O ATOM 239 CB VAL A 450 5.814 15.553 1.356 1.00 0.00 C ATOM 240 CG1 VAL A 450 4.973 14.660 0.457 1.00 0.00 C ATOM 241 CG2 VAL A 450 6.638 14.712 2.318 1.00 0.00 C ATOM 0 H VAL A 450 8.413 15.245 0.252 1.00 0.00 H new ATOM 0 HA VAL A 450 6.113 17.032 -0.183 1.00 0.00 H new ATOM 0 HB VAL A 450 5.143 16.186 1.938 1.00 0.00 H new ATOM 0 HG11 VAL A 450 4.334 14.024 1.070 1.00 0.00 H new ATOM 0 HG12 VAL A 450 4.353 15.278 -0.193 1.00 0.00 H new ATOM 0 HG13 VAL A 450 5.628 14.037 -0.152 1.00 0.00 H new ATOM 0 HG21 VAL A 450 5.975 14.075 2.904 1.00 0.00 H new ATOM 0 HG22 VAL A 450 7.333 14.090 1.754 1.00 0.00 H new ATOM 0 HG23 VAL A 450 7.197 15.367 2.987 1.00 0.00 H new ATOM 251 N GLY A 451 6.804 18.536 1.766 1.00 0.00 N ATOM 252 CA GLY A 451 7.387 19.535 2.655 1.00 0.00 C ATOM 253 C GLY A 451 7.241 19.125 4.115 1.00 0.00 C ATOM 254 O GLY A 451 6.387 18.308 4.458 1.00 0.00 O ATOM 0 H GLY A 451 5.869 18.766 1.430 1.00 0.00 H new ATOM 0 HA2 GLY A 451 8.442 19.667 2.415 1.00 0.00 H new ATOM 0 HA3 GLY A 451 6.900 20.497 2.494 1.00 0.00 H new ATOM 258 N VAL A 452 8.080 19.697 4.971 1.00 0.00 N ATOM 259 CA VAL A 452 8.055 19.383 6.393 1.00 0.00 C ATOM 260 C VAL A 452 6.860 20.032 7.081 1.00 0.00 C ATOM 261 O VAL A 452 6.532 21.188 6.815 1.00 0.00 O ATOM 262 CB VAL A 452 9.348 19.840 7.096 1.00 0.00 C ATOM 263 CG1 VAL A 452 9.359 21.351 7.263 1.00 0.00 C ATOM 264 CG2 VAL A 452 9.491 19.154 8.448 1.00 0.00 C ATOM 0 H VAL A 452 8.787 20.382 4.703 1.00 0.00 H new ATOM 0 HA VAL A 452 7.972 18.299 6.472 1.00 0.00 H new ATOM 0 HB VAL A 452 10.196 19.556 6.473 1.00 0.00 H new ATOM 0 HG11 VAL A 452 10.279 21.655 7.761 1.00 0.00 H new ATOM 0 HG12 VAL A 452 9.303 21.826 6.283 1.00 0.00 H new ATOM 0 HG13 VAL A 452 8.503 21.657 7.864 1.00 0.00 H new ATOM 0 HG21 VAL A 452 10.409 19.488 8.930 1.00 0.00 H new ATOM 0 HG22 VAL A 452 8.638 19.408 9.077 1.00 0.00 H new ATOM 0 HG23 VAL A 452 9.528 18.074 8.306 1.00 0.00 H new ATOM 274 N ASN A 453 6.213 19.282 7.966 1.00 0.00 N ATOM 275 CA ASN A 453 5.036 19.772 8.670 1.00 0.00 C ATOM 276 C ASN A 453 3.903 20.088 7.701 1.00 0.00 C ATOM 277 O ASN A 453 3.038 20.913 7.990 1.00 0.00 O ATOM 278 CB ASN A 453 5.361 20.993 9.512 1.00 0.00 C ATOM 279 CG ASN A 453 6.220 20.692 10.709 1.00 0.00 C ATOM 280 OD1 ASN A 453 6.200 19.579 11.248 1.00 0.00 O ATOM 281 ND2 ASN A 453 6.911 21.699 11.176 1.00 0.00 N ATOM 0 H ASN A 453 6.485 18.330 8.213 1.00 0.00 H new ATOM 0 HA ASN A 453 4.707 18.975 9.337 1.00 0.00 H new ATOM 0 HB2 ASN A 453 5.868 21.729 8.888 1.00 0.00 H new ATOM 0 HB3 ASN A 453 4.430 21.449 9.850 1.00 0.00 H new ATOM 0 HD21 ASN A 453 7.468 21.586 12.023 1.00 0.00 H new ATOM 0 HD22 ASN A 453 6.893 22.597 10.693 1.00 0.00 H new ATOM 288 N LYS A 454 3.917 19.426 6.549 1.00 0.00 N ATOM 289 CA LYS A 454 2.876 19.614 5.546 1.00 0.00 C ATOM 290 C LYS A 454 2.092 18.328 5.319 1.00 0.00 C ATOM 291 O LYS A 454 2.623 17.229 5.474 1.00 0.00 O ATOM 292 CB LYS A 454 3.483 20.099 4.228 1.00 0.00 C ATOM 293 CG LYS A 454 4.046 21.513 4.278 1.00 0.00 C ATOM 294 CD LYS A 454 2.970 22.524 4.646 1.00 0.00 C ATOM 295 CE LYS A 454 1.858 22.553 3.609 1.00 0.00 C ATOM 296 NZ LYS A 454 0.798 23.537 3.958 1.00 0.00 N ATOM 0 H LYS A 454 4.638 18.754 6.287 1.00 0.00 H new ATOM 0 HA LYS A 454 2.187 20.372 5.919 1.00 0.00 H new ATOM 0 HB2 LYS A 454 4.279 19.414 3.935 1.00 0.00 H new ATOM 0 HB3 LYS A 454 2.720 20.052 3.451 1.00 0.00 H new ATOM 0 HG2 LYS A 454 4.855 21.559 5.007 1.00 0.00 H new ATOM 0 HG3 LYS A 454 4.474 21.771 3.309 1.00 0.00 H new ATOM 0 HD2 LYS A 454 2.553 22.275 5.622 1.00 0.00 H new ATOM 0 HD3 LYS A 454 3.415 23.515 4.733 1.00 0.00 H new ATOM 0 HE2 LYS A 454 2.277 22.802 2.634 1.00 0.00 H new ATOM 0 HE3 LYS A 454 1.417 21.560 3.522 1.00 0.00 H new ATOM 0 HZ1 LYS A 454 0.059 23.526 3.226 1.00 0.00 H new ATOM 0 HZ2 LYS A 454 0.380 23.285 4.876 1.00 0.00 H new ATOM 0 HZ3 LYS A 454 1.213 24.489 4.016 1.00 0.00 H new ATOM 310 N LEU A 455 0.822 18.472 4.953 1.00 0.00 N ATOM 311 CA LEU A 455 -0.064 17.326 4.792 1.00 0.00 C ATOM 312 C LEU A 455 0.002 16.771 3.375 1.00 0.00 C ATOM 313 O LEU A 455 -0.158 17.507 2.401 1.00 0.00 O ATOM 314 CB LEU A 455 -1.504 17.716 5.144 1.00 0.00 C ATOM 315 CG LEU A 455 -2.510 16.559 5.161 1.00 0.00 C ATOM 316 CD1 LEU A 455 -2.175 15.591 6.287 1.00 0.00 C ATOM 317 CD2 LEU A 455 -3.919 17.109 5.324 1.00 0.00 C ATOM 0 H LEU A 455 0.384 19.373 4.762 1.00 0.00 H new ATOM 0 HA LEU A 455 0.269 16.544 5.474 1.00 0.00 H new ATOM 0 HB2 LEU A 455 -1.505 18.191 6.125 1.00 0.00 H new ATOM 0 HB3 LEU A 455 -1.846 18.463 4.428 1.00 0.00 H new ATOM 0 HG LEU A 455 -2.454 16.017 4.217 1.00 0.00 H new ATOM 0 HD11 LEU A 455 -2.896 14.773 6.290 1.00 0.00 H new ATOM 0 HD12 LEU A 455 -1.172 15.191 6.136 1.00 0.00 H new ATOM 0 HD13 LEU A 455 -2.217 16.115 7.242 1.00 0.00 H new ATOM 0 HD21 LEU A 455 -4.632 16.285 5.336 1.00 0.00 H new ATOM 0 HD22 LEU A 455 -3.988 17.662 6.261 1.00 0.00 H new ATOM 0 HD23 LEU A 455 -4.148 17.775 4.492 1.00 0.00 H new ATOM 329 N ALA A 456 0.241 15.469 3.266 1.00 0.00 N ATOM 330 CA ALA A 456 0.291 14.805 1.969 1.00 0.00 C ATOM 331 C ALA A 456 -0.704 13.654 1.900 1.00 0.00 C ATOM 332 O ALA A 456 -0.931 12.957 2.891 1.00 0.00 O ATOM 333 CB ALA A 456 1.699 14.308 1.681 1.00 0.00 C ATOM 0 H ALA A 456 0.403 14.852 4.062 1.00 0.00 H new ATOM 0 HA ALA A 456 0.014 15.534 1.208 1.00 0.00 H new ATOM 0 HB1 ALA A 456 1.719 13.815 0.709 1.00 0.00 H new ATOM 0 HB2 ALA A 456 2.388 15.152 1.674 1.00 0.00 H new ATOM 0 HB3 ALA A 456 2.000 13.600 2.453 1.00 0.00 H new ATOM 339 N GLU A 457 -1.298 13.459 0.728 1.00 0.00 N ATOM 340 CA GLU A 457 -2.224 12.355 0.512 1.00 0.00 C ATOM 341 C GLU A 457 -1.602 11.279 -0.369 1.00 0.00 C ATOM 342 O GLU A 457 -0.949 11.581 -1.367 1.00 0.00 O ATOM 343 CB GLU A 457 -3.524 12.862 -0.116 1.00 0.00 C ATOM 344 CG GLU A 457 -4.501 13.481 0.873 1.00 0.00 C ATOM 345 CD GLU A 457 -5.668 14.111 0.167 1.00 0.00 C ATOM 346 OE1 GLU A 457 -5.711 14.054 -1.038 1.00 0.00 O ATOM 347 OE2 GLU A 457 -6.574 14.553 0.834 1.00 0.00 O ATOM 0 H GLU A 457 -1.154 14.053 -0.089 1.00 0.00 H new ATOM 0 HA GLU A 457 -2.448 11.913 1.483 1.00 0.00 H new ATOM 0 HB2 GLU A 457 -3.280 13.602 -0.879 1.00 0.00 H new ATOM 0 HB3 GLU A 457 -4.016 12.032 -0.623 1.00 0.00 H new ATOM 0 HG2 GLU A 457 -4.860 12.715 1.561 1.00 0.00 H new ATOM 0 HG3 GLU A 457 -3.987 14.232 1.473 1.00 0.00 H new ATOM 354 N TYR A 458 -1.810 10.021 0.007 1.00 0.00 N ATOM 355 CA TYR A 458 -1.305 8.896 -0.770 1.00 0.00 C ATOM 356 C TYR A 458 -2.403 7.874 -1.036 1.00 0.00 C ATOM 357 O TYR A 458 -3.398 7.814 -0.312 1.00 0.00 O ATOM 358 CB TYR A 458 -0.132 8.230 -0.049 1.00 0.00 C ATOM 359 CG TYR A 458 1.091 9.113 0.078 1.00 0.00 C ATOM 360 CD1 TYR A 458 1.230 9.987 1.146 1.00 0.00 C ATOM 361 CD2 TYR A 458 2.101 9.068 -0.870 1.00 0.00 C ATOM 362 CE1 TYR A 458 2.343 10.796 1.266 1.00 0.00 C ATOM 363 CE2 TYR A 458 3.219 9.872 -0.759 1.00 0.00 C ATOM 364 CZ TYR A 458 3.337 10.735 0.311 1.00 0.00 C ATOM 365 OH TYR A 458 4.449 11.537 0.427 1.00 0.00 O ATOM 0 H TYR A 458 -2.326 9.756 0.846 1.00 0.00 H new ATOM 0 HA TYR A 458 -0.958 9.282 -1.728 1.00 0.00 H new ATOM 0 HB2 TYR A 458 -0.455 7.928 0.947 1.00 0.00 H new ATOM 0 HB3 TYR A 458 0.142 7.321 -0.585 1.00 0.00 H new ATOM 0 HD1 TYR A 458 0.455 10.036 1.896 1.00 0.00 H new ATOM 0 HD2 TYR A 458 2.013 8.394 -1.709 1.00 0.00 H new ATOM 0 HE1 TYR A 458 2.435 11.473 2.103 1.00 0.00 H new ATOM 0 HE2 TYR A 458 3.997 9.825 -1.506 1.00 0.00 H new ATOM 0 HH TYR A 458 4.822 11.709 -0.463 1.00 0.00 H new ATOM 375 N GLU A 459 -2.216 7.070 -2.078 1.00 0.00 N ATOM 376 CA GLU A 459 -3.220 6.091 -2.479 1.00 0.00 C ATOM 377 C GLU A 459 -2.603 4.707 -2.646 1.00 0.00 C ATOM 378 O GLU A 459 -1.485 4.572 -3.144 1.00 0.00 O ATOM 379 CB GLU A 459 -3.900 6.523 -3.778 1.00 0.00 C ATOM 380 CG GLU A 459 -4.598 7.873 -3.703 1.00 0.00 C ATOM 381 CD GLU A 459 -5.242 8.230 -5.015 1.00 0.00 C ATOM 382 OE1 GLU A 459 -5.126 7.463 -5.939 1.00 0.00 O ATOM 383 OE2 GLU A 459 -5.943 9.214 -5.062 1.00 0.00 O ATOM 0 H GLU A 459 -1.378 7.077 -2.660 1.00 0.00 H new ATOM 0 HA GLU A 459 -3.969 6.038 -1.689 1.00 0.00 H new ATOM 0 HB2 GLU A 459 -3.153 6.557 -4.571 1.00 0.00 H new ATOM 0 HB3 GLU A 459 -4.630 5.765 -4.061 1.00 0.00 H new ATOM 0 HG2 GLU A 459 -5.354 7.850 -2.919 1.00 0.00 H new ATOM 0 HG3 GLU A 459 -3.877 8.643 -3.428 1.00 0.00 H new ATOM 390 N VAL A 460 -3.337 3.683 -2.227 1.00 0.00 N ATOM 391 CA VAL A 460 -2.956 2.304 -2.503 1.00 0.00 C ATOM 392 C VAL A 460 -3.948 1.638 -3.448 1.00 0.00 C ATOM 393 O VAL A 460 -5.138 1.543 -3.148 1.00 0.00 O ATOM 394 CB VAL A 460 -2.857 1.475 -1.209 1.00 0.00 C ATOM 395 CG1 VAL A 460 -2.383 0.062 -1.516 1.00 0.00 C ATOM 396 CG2 VAL A 460 -1.921 2.146 -0.216 1.00 0.00 C ATOM 0 H VAL A 460 -4.201 3.782 -1.694 1.00 0.00 H new ATOM 0 HA VAL A 460 -1.975 2.338 -2.976 1.00 0.00 H new ATOM 0 HB VAL A 460 -3.849 1.416 -0.762 1.00 0.00 H new ATOM 0 HG11 VAL A 460 -2.319 -0.509 -0.590 1.00 0.00 H new ATOM 0 HG12 VAL A 460 -3.090 -0.420 -2.192 1.00 0.00 H new ATOM 0 HG13 VAL A 460 -1.401 0.102 -1.986 1.00 0.00 H new ATOM 0 HG21 VAL A 460 -1.863 1.546 0.692 1.00 0.00 H new ATOM 0 HG22 VAL A 460 -0.928 2.235 -0.656 1.00 0.00 H new ATOM 0 HG23 VAL A 460 -2.300 3.138 0.028 1.00 0.00 H new ATOM 406 N HIS A 461 -3.450 1.176 -4.591 1.00 0.00 N ATOM 407 CA HIS A 461 -4.302 0.575 -5.610 1.00 0.00 C ATOM 408 C HIS A 461 -4.181 -0.943 -5.603 1.00 0.00 C ATOM 409 O HIS A 461 -3.162 -1.496 -6.015 1.00 0.00 O ATOM 410 CB HIS A 461 -3.953 1.120 -6.998 1.00 0.00 C ATOM 411 CG HIS A 461 -4.124 2.603 -7.122 1.00 0.00 C ATOM 412 ND1 HIS A 461 -5.362 3.203 -7.222 1.00 0.00 N ATOM 413 CD2 HIS A 461 -3.214 3.604 -7.162 1.00 0.00 C ATOM 414 CE1 HIS A 461 -5.204 4.512 -7.318 1.00 0.00 C ATOM 415 NE2 HIS A 461 -3.912 4.780 -7.283 1.00 0.00 N ATOM 0 H HIS A 461 -2.460 1.207 -4.834 1.00 0.00 H new ATOM 0 HA HIS A 461 -5.333 0.839 -5.376 1.00 0.00 H new ATOM 0 HB2 HIS A 461 -2.920 0.861 -7.231 1.00 0.00 H new ATOM 0 HB3 HIS A 461 -4.581 0.627 -7.741 1.00 0.00 H new ATOM 0 HD2 HIS A 461 -2.141 3.498 -7.109 1.00 0.00 H new ATOM 0 HE1 HIS A 461 -5.998 5.239 -7.410 1.00 0.00 H new ATOM 0 HE2 HIS A 461 -3.499 5.711 -7.337 1.00 0.00 H new ATOM 423 N VAL A 462 -5.228 -1.613 -5.132 1.00 0.00 N ATOM 424 CA VAL A 462 -5.176 -3.052 -4.897 1.00 0.00 C ATOM 425 C VAL A 462 -6.190 -3.788 -5.760 1.00 0.00 C ATOM 426 O VAL A 462 -7.365 -3.421 -5.806 1.00 0.00 O ATOM 427 CB VAL A 462 -5.432 -3.392 -3.416 1.00 0.00 C ATOM 428 CG1 VAL A 462 -4.706 -2.407 -2.510 1.00 0.00 C ATOM 429 CG2 VAL A 462 -6.924 -3.388 -3.119 1.00 0.00 C ATOM 0 H VAL A 462 -6.124 -1.182 -4.905 1.00 0.00 H new ATOM 0 HA VAL A 462 -4.171 -3.378 -5.166 1.00 0.00 H new ATOM 0 HB VAL A 462 -5.044 -4.392 -3.220 1.00 0.00 H new ATOM 0 HG11 VAL A 462 -4.898 -2.662 -1.468 1.00 0.00 H new ATOM 0 HG12 VAL A 462 -3.635 -2.456 -2.704 1.00 0.00 H new ATOM 0 HG13 VAL A 462 -5.065 -1.397 -2.709 1.00 0.00 H new ATOM 0 HG21 VAL A 462 -7.087 -3.630 -2.069 1.00 0.00 H new ATOM 0 HG22 VAL A 462 -7.335 -2.401 -3.332 1.00 0.00 H new ATOM 0 HG23 VAL A 462 -7.421 -4.130 -3.744 1.00 0.00 H new ATOM 439 N LYS A 463 -5.732 -4.831 -6.444 1.00 0.00 N ATOM 440 CA LYS A 463 -6.560 -5.531 -7.419 1.00 0.00 C ATOM 441 C LYS A 463 -6.259 -7.025 -7.425 1.00 0.00 C ATOM 442 O LYS A 463 -5.145 -7.445 -7.111 1.00 0.00 O ATOM 443 CB LYS A 463 -6.349 -4.947 -8.818 1.00 0.00 C ATOM 444 CG LYS A 463 -4.891 -4.836 -9.241 1.00 0.00 C ATOM 445 CD LYS A 463 -4.768 -4.419 -10.699 1.00 0.00 C ATOM 446 CE LYS A 463 -5.250 -2.993 -10.910 1.00 0.00 C ATOM 447 NZ LYS A 463 -4.303 -1.994 -10.344 1.00 0.00 N ATOM 0 H LYS A 463 -4.791 -5.211 -6.341 1.00 0.00 H new ATOM 0 HA LYS A 463 -7.602 -5.394 -7.131 1.00 0.00 H new ATOM 0 HB2 LYS A 463 -6.878 -5.568 -9.541 1.00 0.00 H new ATOM 0 HB3 LYS A 463 -6.802 -3.956 -8.857 1.00 0.00 H new ATOM 0 HG2 LYS A 463 -4.381 -4.109 -8.609 1.00 0.00 H new ATOM 0 HG3 LYS A 463 -4.393 -5.794 -9.091 1.00 0.00 H new ATOM 0 HD2 LYS A 463 -3.729 -4.504 -11.017 1.00 0.00 H new ATOM 0 HD3 LYS A 463 -5.349 -5.097 -11.323 1.00 0.00 H new ATOM 0 HE2 LYS A 463 -5.378 -2.808 -11.977 1.00 0.00 H new ATOM 0 HE3 LYS A 463 -6.228 -2.869 -10.446 1.00 0.00 H new ATOM 0 HZ1 LYS A 463 -4.598 -1.037 -10.626 1.00 0.00 H new ATOM 0 HZ2 LYS A 463 -4.303 -2.065 -9.306 1.00 0.00 H new ATOM 0 HZ3 LYS A 463 -3.345 -2.181 -10.704 1.00 0.00 H new ATOM 461 N ASN A 464 -7.259 -7.823 -7.784 1.00 0.00 N ATOM 462 CA ASN A 464 -7.064 -9.256 -7.972 1.00 0.00 C ATOM 463 C ASN A 464 -7.087 -9.625 -9.450 1.00 0.00 C ATOM 464 O ASN A 464 -7.895 -9.103 -10.217 1.00 0.00 O ATOM 465 CB ASN A 464 -8.105 -10.060 -7.214 1.00 0.00 C ATOM 466 CG ASN A 464 -7.760 -11.516 -7.074 1.00 0.00 C ATOM 467 OD1 ASN A 464 -6.927 -12.052 -7.814 1.00 0.00 O ATOM 468 ND2 ASN A 464 -8.455 -12.178 -6.184 1.00 0.00 N ATOM 0 H ASN A 464 -8.213 -7.502 -7.951 1.00 0.00 H new ATOM 0 HA ASN A 464 -6.082 -9.504 -7.570 1.00 0.00 H new ATOM 0 HB2 ASN A 464 -8.232 -9.629 -6.221 1.00 0.00 H new ATOM 0 HB3 ASN A 464 -9.063 -9.970 -7.725 1.00 0.00 H new ATOM 0 HD21 ASN A 464 -8.321 -13.183 -6.077 1.00 0.00 H new ATOM 0 HD22 ASN A 464 -9.131 -11.688 -5.597 1.00 0.00 H new ATOM 475 N LEU A 465 -6.196 -10.529 -9.842 1.00 0.00 N ATOM 476 CA LEU A 465 -5.990 -10.840 -11.251 1.00 0.00 C ATOM 477 C LEU A 465 -6.048 -12.341 -11.498 1.00 0.00 C ATOM 478 O LEU A 465 -5.824 -12.807 -12.616 1.00 0.00 O ATOM 479 CB LEU A 465 -4.646 -10.273 -11.728 1.00 0.00 C ATOM 480 CG LEU A 465 -4.495 -8.754 -11.593 1.00 0.00 C ATOM 481 CD1 LEU A 465 -3.060 -8.343 -11.893 1.00 0.00 C ATOM 482 CD2 LEU A 465 -5.462 -8.059 -12.539 1.00 0.00 C ATOM 0 H LEU A 465 -5.604 -11.060 -9.203 1.00 0.00 H new ATOM 0 HA LEU A 465 -6.794 -10.374 -11.821 1.00 0.00 H new ATOM 0 HB2 LEU A 465 -3.846 -10.753 -11.164 1.00 0.00 H new ATOM 0 HB3 LEU A 465 -4.506 -10.545 -12.774 1.00 0.00 H new ATOM 0 HG LEU A 465 -4.729 -8.456 -10.571 1.00 0.00 H new ATOM 0 HD11 LEU A 465 -2.963 -7.262 -11.794 1.00 0.00 H new ATOM 0 HD12 LEU A 465 -2.387 -8.833 -11.190 1.00 0.00 H new ATOM 0 HD13 LEU A 465 -2.802 -8.639 -12.910 1.00 0.00 H new ATOM 0 HD21 LEU A 465 -5.353 -6.979 -12.442 1.00 0.00 H new ATOM 0 HD22 LEU A 465 -5.243 -8.355 -13.565 1.00 0.00 H new ATOM 0 HD23 LEU A 465 -6.484 -8.345 -12.289 1.00 0.00 H new ATOM 494 N GLY A 466 -6.352 -13.098 -10.449 1.00 0.00 N ATOM 495 CA GLY A 466 -6.367 -14.553 -10.531 1.00 0.00 C ATOM 496 C GLY A 466 -7.728 -15.066 -10.981 1.00 0.00 C ATOM 497 O GLY A 466 -7.925 -16.271 -11.146 1.00 0.00 O ATOM 0 H GLY A 466 -6.592 -12.726 -9.530 1.00 0.00 H new ATOM 0 HA2 GLY A 466 -5.600 -14.888 -11.229 1.00 0.00 H new ATOM 0 HA3 GLY A 466 -6.119 -14.977 -9.558 1.00 0.00 H new ATOM 501 N GLY A 467 -8.666 -14.146 -11.179 1.00 0.00 N ATOM 502 CA GLY A 467 -10.019 -14.506 -11.583 1.00 0.00 C ATOM 503 C GLY A 467 -10.774 -15.181 -10.445 1.00 0.00 C ATOM 504 O GLY A 467 -11.750 -15.895 -10.672 1.00 0.00 O ATOM 0 H GLY A 467 -8.513 -13.144 -11.066 1.00 0.00 H new ATOM 0 HA2 GLY A 467 -10.557 -13.612 -11.899 1.00 0.00 H new ATOM 0 HA3 GLY A 467 -9.979 -15.175 -12.443 1.00 0.00 H new ATOM 508 N ILE A 468 -10.315 -14.949 -9.219 1.00 0.00 N ATOM 509 CA ILE A 468 -11.007 -15.447 -8.037 1.00 0.00 C ATOM 510 C ILE A 468 -11.290 -14.322 -7.050 1.00 0.00 C ATOM 511 O ILE A 468 -10.530 -13.358 -6.959 1.00 0.00 O ATOM 512 CB ILE A 468 -10.196 -16.546 -7.327 1.00 0.00 C ATOM 513 CG1 ILE A 468 -10.756 -16.805 -5.926 1.00 0.00 C ATOM 514 CG2 ILE A 468 -8.726 -16.158 -7.252 1.00 0.00 C ATOM 515 CD1 ILE A 468 -10.194 -18.040 -5.262 1.00 0.00 C ATOM 0 H ILE A 468 -9.467 -14.419 -9.019 1.00 0.00 H new ATOM 0 HA ILE A 468 -11.950 -15.871 -8.382 1.00 0.00 H new ATOM 0 HB ILE A 468 -10.280 -17.466 -7.906 1.00 0.00 H new ATOM 0 HG12 ILE A 468 -10.549 -15.940 -5.297 1.00 0.00 H new ATOM 0 HG13 ILE A 468 -11.840 -16.900 -5.990 1.00 0.00 H new ATOM 0 HG21 ILE A 468 -8.167 -16.946 -6.747 1.00 0.00 H new ATOM 0 HG22 ILE A 468 -8.333 -16.023 -8.260 1.00 0.00 H new ATOM 0 HG23 ILE A 468 -8.623 -15.227 -6.695 1.00 0.00 H new ATOM 0 HD11 ILE A 468 -10.639 -18.156 -4.274 1.00 0.00 H new ATOM 0 HD12 ILE A 468 -10.424 -18.916 -5.869 1.00 0.00 H new ATOM 0 HD13 ILE A 468 -9.113 -17.940 -5.164 1.00 0.00 H new ATOM 527 N GLY A 469 -12.388 -14.449 -6.311 1.00 0.00 N ATOM 528 CA GLY A 469 -12.765 -13.450 -5.320 1.00 0.00 C ATOM 529 C GLY A 469 -12.245 -13.824 -3.938 1.00 0.00 C ATOM 530 O GLY A 469 -12.649 -14.835 -3.364 1.00 0.00 O ATOM 0 H GLY A 469 -13.033 -15.236 -6.381 1.00 0.00 H new ATOM 0 HA2 GLY A 469 -12.368 -12.477 -5.610 1.00 0.00 H new ATOM 0 HA3 GLY A 469 -13.850 -13.355 -5.290 1.00 0.00 H new ATOM 534 N VAL A 470 -11.347 -13.001 -3.406 1.00 0.00 N ATOM 535 CA VAL A 470 -10.796 -13.223 -2.075 1.00 0.00 C ATOM 536 C VAL A 470 -11.397 -12.257 -1.062 1.00 0.00 C ATOM 537 O VAL A 470 -11.186 -11.047 -1.144 1.00 0.00 O ATOM 538 CB VAL A 470 -9.263 -13.074 -2.066 1.00 0.00 C ATOM 539 CG1 VAL A 470 -8.716 -13.278 -0.661 1.00 0.00 C ATOM 540 CG2 VAL A 470 -8.626 -14.063 -3.031 1.00 0.00 C ATOM 0 H VAL A 470 -10.985 -12.172 -3.878 1.00 0.00 H new ATOM 0 HA VAL A 470 -11.054 -14.244 -1.795 1.00 0.00 H new ATOM 0 HB VAL A 470 -9.014 -12.064 -2.391 1.00 0.00 H new ATOM 0 HG11 VAL A 470 -7.632 -13.169 -0.673 1.00 0.00 H new ATOM 0 HG12 VAL A 470 -9.148 -12.534 0.009 1.00 0.00 H new ATOM 0 HG13 VAL A 470 -8.976 -14.277 -0.311 1.00 0.00 H new ATOM 0 HG21 VAL A 470 -7.543 -13.944 -3.012 1.00 0.00 H new ATOM 0 HG22 VAL A 470 -8.885 -15.079 -2.734 1.00 0.00 H new ATOM 0 HG23 VAL A 470 -8.994 -13.875 -4.040 1.00 0.00 H new ATOM 550 N PRO A 471 -12.144 -12.799 -0.107 1.00 0.00 N ATOM 551 CA PRO A 471 -12.783 -11.985 0.921 1.00 0.00 C ATOM 552 C PRO A 471 -11.794 -11.602 2.014 1.00 0.00 C ATOM 553 O PRO A 471 -12.032 -10.669 2.780 1.00 0.00 O ATOM 554 CB PRO A 471 -13.914 -12.872 1.450 1.00 0.00 C ATOM 555 CG PRO A 471 -13.398 -14.262 1.300 1.00 0.00 C ATOM 556 CD PRO A 471 -12.561 -14.243 0.048 1.00 0.00 C ATOM 0 HA PRO A 471 -13.157 -11.036 0.537 1.00 0.00 H new ATOM 0 HB2 PRO A 471 -14.144 -12.644 2.491 1.00 0.00 H new ATOM 0 HB3 PRO A 471 -14.832 -12.726 0.881 1.00 0.00 H new ATOM 0 HG2 PRO A 471 -12.804 -14.557 2.165 1.00 0.00 H new ATOM 0 HG3 PRO A 471 -14.216 -14.978 1.216 1.00 0.00 H new ATOM 0 HD2 PRO A 471 -11.695 -14.898 0.140 1.00 0.00 H new ATOM 0 HD3 PRO A 471 -13.131 -14.586 -0.815 1.00 0.00 H new ATOM 564 N SER A 472 -10.682 -12.327 2.081 1.00 0.00 N ATOM 565 CA SER A 472 -9.819 -12.299 3.254 1.00 0.00 C ATOM 566 C SER A 472 -8.736 -11.236 3.115 1.00 0.00 C ATOM 567 O SER A 472 -7.782 -11.201 3.892 1.00 0.00 O ATOM 568 CB SER A 472 -9.193 -13.663 3.476 1.00 0.00 C ATOM 569 OG SER A 472 -8.344 -14.030 2.424 1.00 0.00 O ATOM 0 H SER A 472 -10.358 -12.942 1.335 1.00 0.00 H new ATOM 0 HA SER A 472 -10.431 -12.044 4.119 1.00 0.00 H new ATOM 0 HB2 SER A 472 -8.631 -13.656 4.410 1.00 0.00 H new ATOM 0 HB3 SER A 472 -9.980 -14.410 3.584 1.00 0.00 H new ATOM 0 HG SER A 472 -7.960 -14.913 2.606 1.00 0.00 H new ATOM 575 N THR A 473 -8.890 -10.368 2.120 1.00 0.00 N ATOM 576 CA THR A 473 -7.785 -9.547 1.642 1.00 0.00 C ATOM 577 C THR A 473 -7.539 -8.361 2.566 1.00 0.00 C ATOM 578 O THR A 473 -8.328 -7.416 2.604 1.00 0.00 O ATOM 579 CB THR A 473 -8.042 -9.028 0.215 1.00 0.00 C ATOM 580 OG1 THR A 473 -8.255 -10.137 -0.668 1.00 0.00 O ATOM 581 CG2 THR A 473 -6.859 -8.210 -0.277 1.00 0.00 C ATOM 0 H THR A 473 -9.771 -10.216 1.629 1.00 0.00 H new ATOM 0 HA THR A 473 -6.902 -10.186 1.633 1.00 0.00 H new ATOM 0 HB THR A 473 -8.927 -8.392 0.229 1.00 0.00 H new ATOM 0 HG1 THR A 473 -9.216 -10.315 -0.744 1.00 0.00 H new ATOM 0 HG21 THR A 473 -7.059 -7.852 -1.287 1.00 0.00 H new ATOM 0 HG22 THR A 473 -6.704 -7.359 0.386 1.00 0.00 H new ATOM 0 HG23 THR A 473 -5.964 -8.832 -0.283 1.00 0.00 H new ATOM 589 N LYS A 474 -6.441 -8.414 3.310 1.00 0.00 N ATOM 590 CA LYS A 474 -6.066 -7.325 4.204 1.00 0.00 C ATOM 591 C LYS A 474 -4.819 -6.608 3.706 1.00 0.00 C ATOM 592 O LYS A 474 -3.800 -7.237 3.423 1.00 0.00 O ATOM 593 CB LYS A 474 -5.839 -7.851 5.623 1.00 0.00 C ATOM 594 CG LYS A 474 -7.067 -8.486 6.262 1.00 0.00 C ATOM 595 CD LYS A 474 -6.765 -8.981 7.670 1.00 0.00 C ATOM 596 CE LYS A 474 -7.972 -9.674 8.284 1.00 0.00 C ATOM 597 NZ LYS A 474 -7.687 -10.174 9.657 1.00 0.00 N ATOM 0 H LYS A 474 -5.793 -9.202 3.312 1.00 0.00 H new ATOM 0 HA LYS A 474 -6.887 -6.609 4.219 1.00 0.00 H new ATOM 0 HB2 LYS A 474 -5.035 -8.586 5.601 1.00 0.00 H new ATOM 0 HB3 LYS A 474 -5.501 -7.028 6.253 1.00 0.00 H new ATOM 0 HG2 LYS A 474 -7.879 -7.759 6.296 1.00 0.00 H new ATOM 0 HG3 LYS A 474 -7.410 -9.318 5.647 1.00 0.00 H new ATOM 0 HD2 LYS A 474 -5.922 -9.672 7.642 1.00 0.00 H new ATOM 0 HD3 LYS A 474 -6.468 -8.141 8.297 1.00 0.00 H new ATOM 0 HE2 LYS A 474 -8.811 -8.979 8.318 1.00 0.00 H new ATOM 0 HE3 LYS A 474 -8.274 -10.507 7.650 1.00 0.00 H new ATOM 0 HZ1 LYS A 474 -8.535 -10.639 10.040 1.00 0.00 H new ATOM 0 HZ2 LYS A 474 -6.903 -10.856 9.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 474 -7.424 -9.376 10.270 1.00 0.00 H new ATOM 611 N VAL A 475 -4.906 -5.286 3.601 1.00 0.00 N ATOM 612 CA VAL A 475 -3.810 -4.487 3.063 1.00 0.00 C ATOM 613 C VAL A 475 -3.233 -3.560 4.125 1.00 0.00 C ATOM 614 O VAL A 475 -3.964 -2.817 4.778 1.00 0.00 O ATOM 615 CB VAL A 475 -4.264 -3.648 1.854 1.00 0.00 C ATOM 616 CG1 VAL A 475 -3.107 -2.817 1.318 1.00 0.00 C ATOM 617 CG2 VAL A 475 -4.823 -4.546 0.761 1.00 0.00 C ATOM 0 H VAL A 475 -5.724 -4.745 3.881 1.00 0.00 H new ATOM 0 HA VAL A 475 -3.040 -5.187 2.739 1.00 0.00 H new ATOM 0 HB VAL A 475 -5.053 -2.972 2.182 1.00 0.00 H new ATOM 0 HG11 VAL A 475 -3.445 -2.230 0.464 1.00 0.00 H new ATOM 0 HG12 VAL A 475 -2.748 -2.147 2.099 1.00 0.00 H new ATOM 0 HG13 VAL A 475 -2.298 -3.478 1.007 1.00 0.00 H new ATOM 0 HG21 VAL A 475 -5.139 -3.936 -0.085 1.00 0.00 H new ATOM 0 HG22 VAL A 475 -4.053 -5.246 0.436 1.00 0.00 H new ATOM 0 HG23 VAL A 475 -5.678 -5.100 1.148 1.00 0.00 H new ATOM 627 N ARG A 476 -1.915 -3.607 4.290 1.00 0.00 N ATOM 628 CA ARG A 476 -1.243 -2.815 5.315 1.00 0.00 C ATOM 629 C ARG A 476 -0.169 -1.926 4.704 1.00 0.00 C ATOM 630 O ARG A 476 0.395 -2.244 3.657 1.00 0.00 O ATOM 631 CB ARG A 476 -0.682 -3.681 6.433 1.00 0.00 C ATOM 632 CG ARG A 476 -1.727 -4.344 7.316 1.00 0.00 C ATOM 633 CD ARG A 476 -1.165 -5.157 8.423 1.00 0.00 C ATOM 634 NE ARG A 476 -2.158 -5.867 9.214 1.00 0.00 N ATOM 635 CZ ARG A 476 -2.799 -5.348 10.281 1.00 0.00 C ATOM 636 NH1 ARG A 476 -2.528 -4.136 10.710 1.00 0.00 N ATOM 637 NH2 ARG A 476 -3.692 -6.103 10.899 1.00 0.00 N ATOM 0 H ARG A 476 -1.291 -4.185 3.727 1.00 0.00 H new ATOM 0 HA ARG A 476 -1.995 -2.168 5.767 1.00 0.00 H new ATOM 0 HB2 ARG A 476 -0.055 -4.456 5.992 1.00 0.00 H new ATOM 0 HB3 ARG A 476 -0.036 -3.066 7.059 1.00 0.00 H new ATOM 0 HG2 ARG A 476 -2.371 -3.573 7.738 1.00 0.00 H new ATOM 0 HG3 ARG A 476 -2.357 -4.982 6.696 1.00 0.00 H new ATOM 0 HD2 ARG A 476 -0.465 -5.881 8.006 1.00 0.00 H new ATOM 0 HD3 ARG A 476 -0.593 -4.504 9.082 1.00 0.00 H new ATOM 0 HE ARG A 476 -2.385 -6.824 8.943 1.00 0.00 H new ATOM 0 HH11 ARG A 476 -1.823 -3.572 10.234 1.00 0.00 H new ATOM 0 HH12 ARG A 476 -3.022 -3.759 11.519 1.00 0.00 H new ATOM 0 HH21 ARG A 476 -3.879 -7.049 10.565 1.00 0.00 H new ATOM 0 HH22 ARG A 476 -4.194 -5.740 11.709 1.00 0.00 H new ATOM 651 N VAL A 477 0.109 -0.806 5.364 1.00 0.00 N ATOM 652 CA VAL A 477 1.143 0.116 4.908 1.00 0.00 C ATOM 653 C VAL A 477 2.130 0.435 6.023 1.00 0.00 C ATOM 654 O VAL A 477 1.733 0.721 7.153 1.00 0.00 O ATOM 655 CB VAL A 477 0.534 1.429 4.383 1.00 0.00 C ATOM 656 CG1 VAL A 477 1.634 2.425 4.041 1.00 0.00 C ATOM 657 CG2 VAL A 477 -0.339 1.165 3.166 1.00 0.00 C ATOM 0 H VAL A 477 -0.368 -0.515 6.217 1.00 0.00 H new ATOM 0 HA VAL A 477 1.671 -0.381 4.094 1.00 0.00 H new ATOM 0 HB VAL A 477 -0.090 1.856 5.168 1.00 0.00 H new ATOM 0 HG11 VAL A 477 1.187 3.348 3.671 1.00 0.00 H new ATOM 0 HG12 VAL A 477 2.222 2.639 4.934 1.00 0.00 H new ATOM 0 HG13 VAL A 477 2.282 2.002 3.273 1.00 0.00 H new ATOM 0 HG21 VAL A 477 -0.760 2.105 2.810 1.00 0.00 H new ATOM 0 HG22 VAL A 477 0.263 0.715 2.377 1.00 0.00 H new ATOM 0 HG23 VAL A 477 -1.147 0.485 3.438 1.00 0.00 H new ATOM 667 N TYR A 478 3.418 0.382 5.699 1.00 0.00 N ATOM 668 CA TYR A 478 4.465 0.613 6.687 1.00 0.00 C ATOM 669 C TYR A 478 5.341 1.796 6.294 1.00 0.00 C ATOM 670 O TYR A 478 5.560 2.055 5.112 1.00 0.00 O ATOM 671 CB TYR A 478 5.326 -0.642 6.857 1.00 0.00 C ATOM 672 CG TYR A 478 4.534 -1.887 7.190 1.00 0.00 C ATOM 673 CD1 TYR A 478 3.791 -2.541 6.219 1.00 0.00 C ATOM 674 CD2 TYR A 478 4.534 -2.406 8.477 1.00 0.00 C ATOM 675 CE1 TYR A 478 3.066 -3.679 6.518 1.00 0.00 C ATOM 676 CE2 TYR A 478 3.813 -3.543 8.787 1.00 0.00 C ATOM 677 CZ TYR A 478 3.079 -4.176 7.805 1.00 0.00 C ATOM 678 OH TYR A 478 2.360 -5.310 8.109 1.00 0.00 O ATOM 0 H TYR A 478 3.761 0.181 4.760 1.00 0.00 H new ATOM 0 HA TYR A 478 3.982 0.845 7.636 1.00 0.00 H new ATOM 0 HB2 TYR A 478 5.886 -0.814 5.938 1.00 0.00 H new ATOM 0 HB3 TYR A 478 6.056 -0.466 7.647 1.00 0.00 H new ATOM 0 HD1 TYR A 478 3.779 -2.154 5.211 1.00 0.00 H new ATOM 0 HD2 TYR A 478 5.107 -1.913 9.249 1.00 0.00 H new ATOM 0 HE1 TYR A 478 2.493 -4.176 5.749 1.00 0.00 H new ATOM 0 HE2 TYR A 478 3.824 -3.935 9.793 1.00 0.00 H new ATOM 0 HH TYR A 478 2.477 -5.527 9.057 1.00 0.00 H new ATOM 688 N ILE A 479 5.838 2.513 7.296 1.00 0.00 N ATOM 689 CA ILE A 479 6.833 3.555 7.071 1.00 0.00 C ATOM 690 C ILE A 479 8.122 3.260 7.824 1.00 0.00 C ATOM 691 O ILE A 479 8.135 3.204 9.054 1.00 0.00 O ATOM 692 CB ILE A 479 6.305 4.939 7.496 1.00 0.00 C ATOM 693 CG1 ILE A 479 5.058 5.306 6.688 1.00 0.00 C ATOM 694 CG2 ILE A 479 7.386 5.996 7.321 1.00 0.00 C ATOM 695 CD1 ILE A 479 4.396 6.590 7.135 1.00 0.00 C ATOM 0 H ILE A 479 5.568 2.392 8.272 1.00 0.00 H new ATOM 0 HA ILE A 479 7.039 3.567 6.001 1.00 0.00 H new ATOM 0 HB ILE A 479 6.032 4.897 8.550 1.00 0.00 H new ATOM 0 HG12 ILE A 479 5.331 5.396 5.637 1.00 0.00 H new ATOM 0 HG13 ILE A 479 4.337 4.492 6.761 1.00 0.00 H new ATOM 0 HG21 ILE A 479 6.997 6.968 7.625 1.00 0.00 H new ATOM 0 HG22 ILE A 479 8.248 5.741 7.937 1.00 0.00 H new ATOM 0 HG23 ILE A 479 7.688 6.038 6.275 1.00 0.00 H new ATOM 0 HD11 ILE A 479 3.520 6.783 6.515 1.00 0.00 H new ATOM 0 HD12 ILE A 479 4.090 6.498 8.177 1.00 0.00 H new ATOM 0 HD13 ILE A 479 5.100 7.416 7.035 1.00 0.00 H new ATOM 707 N ASN A 480 9.207 3.072 7.081 1.00 0.00 N ATOM 708 CA ASN A 480 10.496 2.740 7.676 1.00 0.00 C ATOM 709 C ASN A 480 10.390 1.510 8.567 1.00 0.00 C ATOM 710 O ASN A 480 10.973 1.465 9.650 1.00 0.00 O ATOM 711 CB ASN A 480 11.063 3.909 8.459 1.00 0.00 C ATOM 712 CG ASN A 480 11.475 5.072 7.599 1.00 0.00 C ATOM 713 OD1 ASN A 480 11.793 4.913 6.415 1.00 0.00 O ATOM 714 ND2 ASN A 480 11.550 6.227 8.211 1.00 0.00 N ATOM 0 H ASN A 480 9.219 3.144 6.064 1.00 0.00 H new ATOM 0 HA ASN A 480 11.180 2.515 6.858 1.00 0.00 H new ATOM 0 HB2 ASN A 480 10.318 4.247 9.179 1.00 0.00 H new ATOM 0 HB3 ASN A 480 11.926 3.567 9.030 1.00 0.00 H new ATOM 0 HD21 ASN A 480 11.884 7.050 7.709 1.00 0.00 H new ATOM 0 HD22 ASN A 480 11.275 6.304 9.190 1.00 0.00 H new ATOM 721 N GLY A 481 9.640 0.516 8.107 1.00 0.00 N ATOM 722 CA GLY A 481 9.567 -0.769 8.792 1.00 0.00 C ATOM 723 C GLY A 481 8.465 -0.770 9.844 1.00 0.00 C ATOM 724 O GLY A 481 8.102 -1.819 10.375 1.00 0.00 O ATOM 0 H GLY A 481 9.073 0.575 7.261 1.00 0.00 H new ATOM 0 HA2 GLY A 481 9.382 -1.561 8.066 1.00 0.00 H new ATOM 0 HA3 GLY A 481 10.525 -0.987 9.264 1.00 0.00 H new ATOM 728 N THR A 482 7.936 0.412 10.140 1.00 0.00 N ATOM 729 CA THR A 482 6.908 0.557 11.163 1.00 0.00 C ATOM 730 C THR A 482 5.515 0.597 10.544 1.00 0.00 C ATOM 731 O THR A 482 5.300 1.246 9.521 1.00 0.00 O ATOM 732 CB THR A 482 7.120 1.828 12.005 1.00 0.00 C ATOM 733 OG1 THR A 482 8.384 1.753 12.678 1.00 0.00 O ATOM 734 CG2 THR A 482 6.010 1.981 13.032 1.00 0.00 C ATOM 0 H THR A 482 8.203 1.285 9.685 1.00 0.00 H new ATOM 0 HA THR A 482 6.990 -0.315 11.813 1.00 0.00 H new ATOM 0 HB THR A 482 7.105 2.692 11.340 1.00 0.00 H new ATOM 0 HG1 THR A 482 8.519 2.563 13.212 1.00 0.00 H new ATOM 0 HG21 THR A 482 6.178 2.885 13.617 1.00 0.00 H new ATOM 0 HG22 THR A 482 5.049 2.052 12.522 1.00 0.00 H new ATOM 0 HG23 THR A 482 6.006 1.116 13.695 1.00 0.00 H new ATOM 742 N LEU A 483 4.574 -0.101 11.169 1.00 0.00 N ATOM 743 CA LEU A 483 3.198 -0.130 10.692 1.00 0.00 C ATOM 744 C LEU A 483 2.518 1.219 10.885 1.00 0.00 C ATOM 745 O LEU A 483 2.409 1.715 12.006 1.00 0.00 O ATOM 746 CB LEU A 483 2.410 -1.232 11.412 1.00 0.00 C ATOM 747 CG LEU A 483 0.934 -1.348 11.010 1.00 0.00 C ATOM 748 CD1 LEU A 483 0.821 -1.714 9.536 1.00 0.00 C ATOM 749 CD2 LEU A 483 0.251 -2.393 11.879 1.00 0.00 C ATOM 0 H LEU A 483 4.740 -0.655 12.009 1.00 0.00 H new ATOM 0 HA LEU A 483 3.216 -0.347 9.624 1.00 0.00 H new ATOM 0 HB2 LEU A 483 2.898 -2.188 11.223 1.00 0.00 H new ATOM 0 HB3 LEU A 483 2.465 -1.053 12.486 1.00 0.00 H new ATOM 0 HG LEU A 483 0.440 -0.388 11.162 1.00 0.00 H new ATOM 0 HD11 LEU A 483 -0.231 -1.794 9.261 1.00 0.00 H new ATOM 0 HD12 LEU A 483 1.297 -0.941 8.932 1.00 0.00 H new ATOM 0 HD13 LEU A 483 1.316 -2.669 9.359 1.00 0.00 H new ATOM 0 HD21 LEU A 483 -0.798 -2.475 11.593 1.00 0.00 H new ATOM 0 HD22 LEU A 483 0.741 -3.357 11.742 1.00 0.00 H new ATOM 0 HD23 LEU A 483 0.319 -2.097 12.926 1.00 0.00 H new ATOM 761 N TYR A 484 2.061 1.809 9.785 1.00 0.00 N ATOM 762 CA TYR A 484 1.459 3.135 9.822 1.00 0.00 C ATOM 763 C TYR A 484 -0.062 3.047 9.852 1.00 0.00 C ATOM 764 O TYR A 484 -0.721 3.802 10.566 1.00 0.00 O ATOM 765 CB TYR A 484 1.913 3.964 8.617 1.00 0.00 C ATOM 766 CG TYR A 484 1.067 5.192 8.365 1.00 0.00 C ATOM 767 CD1 TYR A 484 1.251 6.349 9.109 1.00 0.00 C ATOM 768 CD2 TYR A 484 0.090 5.193 7.381 1.00 0.00 C ATOM 769 CE1 TYR A 484 0.482 7.474 8.883 1.00 0.00 C ATOM 770 CE2 TYR A 484 -0.684 6.311 7.146 1.00 0.00 C ATOM 771 CZ TYR A 484 -0.485 7.451 7.899 1.00 0.00 C ATOM 772 OH TYR A 484 -1.253 8.570 7.669 1.00 0.00 O ATOM 0 H TYR A 484 2.097 1.388 8.856 1.00 0.00 H new ATOM 0 HA TYR A 484 1.792 3.627 10.736 1.00 0.00 H new ATOM 0 HB2 TYR A 484 2.947 4.272 8.769 1.00 0.00 H new ATOM 0 HB3 TYR A 484 1.896 3.334 7.728 1.00 0.00 H new ATOM 0 HD1 TYR A 484 2.009 6.370 9.878 1.00 0.00 H new ATOM 0 HD2 TYR A 484 -0.068 4.304 6.789 1.00 0.00 H new ATOM 0 HE1 TYR A 484 0.637 8.366 9.473 1.00 0.00 H new ATOM 0 HE2 TYR A 484 -1.442 6.294 6.377 1.00 0.00 H new ATOM 0 HH TYR A 484 -0.681 9.300 7.354 1.00 0.00 H new ATOM 782 N LYS A 485 -0.611 2.123 9.073 1.00 0.00 N ATOM 783 CA LYS A 485 -2.056 2.024 8.905 1.00 0.00 C ATOM 784 C LYS A 485 -2.446 0.704 8.253 1.00 0.00 C ATOM 785 O LYS A 485 -1.621 0.049 7.614 1.00 0.00 O ATOM 786 CB LYS A 485 -2.581 3.195 8.073 1.00 0.00 C ATOM 787 CG LYS A 485 -4.097 3.337 8.072 1.00 0.00 C ATOM 788 CD LYS A 485 -4.613 3.769 9.436 1.00 0.00 C ATOM 789 CE LYS A 485 -6.126 3.934 9.429 1.00 0.00 C ATOM 790 NZ LYS A 485 -6.648 4.336 10.763 1.00 0.00 N ATOM 0 H LYS A 485 -0.077 1.431 8.547 1.00 0.00 H new ATOM 0 HA LYS A 485 -2.509 2.062 9.896 1.00 0.00 H new ATOM 0 HB2 LYS A 485 -2.142 4.119 8.451 1.00 0.00 H new ATOM 0 HB3 LYS A 485 -2.239 3.077 7.045 1.00 0.00 H new ATOM 0 HG2 LYS A 485 -4.395 4.067 7.320 1.00 0.00 H new ATOM 0 HG3 LYS A 485 -4.553 2.387 7.792 1.00 0.00 H new ATOM 0 HD2 LYS A 485 -4.329 3.030 10.185 1.00 0.00 H new ATOM 0 HD3 LYS A 485 -4.144 4.710 9.723 1.00 0.00 H new ATOM 0 HE2 LYS A 485 -6.406 4.684 8.689 1.00 0.00 H new ATOM 0 HE3 LYS A 485 -6.592 2.997 9.125 1.00 0.00 H new ATOM 0 HZ1 LYS A 485 -7.682 4.438 10.715 1.00 0.00 H new ATOM 0 HZ2 LYS A 485 -6.404 3.609 11.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 485 -6.224 5.243 11.043 1.00 0.00 H new ATOM 804 N ASN A 486 -3.705 0.316 8.418 1.00 0.00 N ATOM 805 CA ASN A 486 -4.194 -0.949 7.883 1.00 0.00 C ATOM 806 C ASN A 486 -5.608 -0.805 7.335 1.00 0.00 C ATOM 807 O ASN A 486 -6.372 0.054 7.775 1.00 0.00 O ATOM 808 CB ASN A 486 -4.148 -2.048 8.929 1.00 0.00 C ATOM 809 CG ASN A 486 -5.071 -1.817 10.093 1.00 0.00 C ATOM 810 OD1 ASN A 486 -6.293 -1.956 9.977 1.00 0.00 O ATOM 811 ND2 ASN A 486 -4.502 -1.386 11.190 1.00 0.00 N ATOM 0 H ASN A 486 -4.407 0.860 8.919 1.00 0.00 H new ATOM 0 HA ASN A 486 -3.532 -1.229 7.064 1.00 0.00 H new ATOM 0 HB2 ASN A 486 -4.404 -2.997 8.457 1.00 0.00 H new ATOM 0 HB3 ASN A 486 -3.127 -2.141 9.300 1.00 0.00 H new ATOM 0 HD21 ASN A 486 -5.073 -1.147 12.001 1.00 0.00 H new ATOM 0 HD22 ASN A 486 -3.488 -1.289 11.234 1.00 0.00 H new ATOM 818 N TRP A 487 -5.952 -1.651 6.370 1.00 0.00 N ATOM 819 CA TRP A 487 -7.323 -1.740 5.879 1.00 0.00 C ATOM 820 C TRP A 487 -7.728 -3.188 5.636 1.00 0.00 C ATOM 821 O TRP A 487 -6.921 -4.000 5.186 1.00 0.00 O ATOM 822 CB TRP A 487 -7.481 -0.927 4.594 1.00 0.00 C ATOM 823 CG TRP A 487 -7.234 0.540 4.778 1.00 0.00 C ATOM 824 CD1 TRP A 487 -8.170 1.500 5.021 1.00 0.00 C ATOM 825 CD2 TRP A 487 -5.970 1.212 4.735 1.00 0.00 C ATOM 826 NE1 TRP A 487 -7.568 2.728 5.132 1.00 0.00 N ATOM 827 CE2 TRP A 487 -6.215 2.577 4.960 1.00 0.00 C ATOM 828 CE3 TRP A 487 -4.651 0.788 4.527 1.00 0.00 C ATOM 829 CZ2 TRP A 487 -5.200 3.520 4.983 1.00 0.00 C ATOM 830 CZ3 TRP A 487 -3.634 1.735 4.551 1.00 0.00 C ATOM 831 CH2 TRP A 487 -3.900 3.062 4.773 1.00 0.00 C ATOM 0 H TRP A 487 -5.299 -2.286 5.911 1.00 0.00 H new ATOM 0 HA TRP A 487 -7.981 -1.327 6.644 1.00 0.00 H new ATOM 0 HB2 TRP A 487 -6.791 -1.312 3.843 1.00 0.00 H new ATOM 0 HB3 TRP A 487 -8.489 -1.071 4.204 1.00 0.00 H new ATOM 0 HD1 TRP A 487 -9.231 1.320 5.113 1.00 0.00 H new ATOM 0 HE1 TRP A 487 -8.048 3.610 5.313 1.00 0.00 H new ATOM 0 HE3 TRP A 487 -4.429 -0.254 4.351 1.00 0.00 H new ATOM 0 HZ2 TRP A 487 -5.407 4.566 5.156 1.00 0.00 H new ATOM 0 HZ3 TRP A 487 -2.613 1.419 4.392 1.00 0.00 H new ATOM 0 HH2 TRP A 487 -3.083 3.769 4.785 1.00 0.00 H new ATOM 842 N THR A 488 -8.983 -3.503 5.937 1.00 0.00 N ATOM 843 CA THR A 488 -9.564 -4.783 5.550 1.00 0.00 C ATOM 844 C THR A 488 -10.570 -4.612 4.419 1.00 0.00 C ATOM 845 O THR A 488 -11.515 -3.831 4.528 1.00 0.00 O ATOM 846 CB THR A 488 -10.258 -5.472 6.740 1.00 0.00 C ATOM 847 OG1 THR A 488 -9.300 -5.718 7.778 1.00 0.00 O ATOM 848 CG2 THR A 488 -10.880 -6.791 6.306 1.00 0.00 C ATOM 0 H THR A 488 -9.618 -2.889 6.448 1.00 0.00 H new ATOM 0 HA THR A 488 -8.741 -5.410 5.208 1.00 0.00 H new ATOM 0 HB THR A 488 -11.046 -4.816 7.110 1.00 0.00 H new ATOM 0 HG1 THR A 488 -9.743 -6.155 8.535 1.00 0.00 H new ATOM 0 HG21 THR A 488 -11.365 -7.263 7.160 1.00 0.00 H new ATOM 0 HG22 THR A 488 -11.618 -6.606 5.526 1.00 0.00 H new ATOM 0 HG23 THR A 488 -10.102 -7.451 5.921 1.00 0.00 H new ATOM 856 N VAL A 489 -10.361 -5.348 3.332 1.00 0.00 N ATOM 857 CA VAL A 489 -11.233 -5.257 2.167 1.00 0.00 C ATOM 858 C VAL A 489 -11.497 -6.634 1.568 1.00 0.00 C ATOM 859 O VAL A 489 -10.839 -7.611 1.922 1.00 0.00 O ATOM 860 CB VAL A 489 -10.634 -4.343 1.082 1.00 0.00 C ATOM 861 CG1 VAL A 489 -10.461 -2.928 1.613 1.00 0.00 C ATOM 862 CG2 VAL A 489 -9.303 -4.895 0.595 1.00 0.00 C ATOM 0 H VAL A 489 -9.595 -6.014 3.234 1.00 0.00 H new ATOM 0 HA VAL A 489 -12.173 -4.827 2.512 1.00 0.00 H new ATOM 0 HB VAL A 489 -11.324 -4.313 0.239 1.00 0.00 H new ATOM 0 HG11 VAL A 489 -10.037 -2.296 0.833 1.00 0.00 H new ATOM 0 HG12 VAL A 489 -11.431 -2.531 1.914 1.00 0.00 H new ATOM 0 HG13 VAL A 489 -9.792 -2.941 2.473 1.00 0.00 H new ATOM 0 HG21 VAL A 489 -8.894 -4.236 -0.171 1.00 0.00 H new ATOM 0 HG22 VAL A 489 -8.606 -4.955 1.431 1.00 0.00 H new ATOM 0 HG23 VAL A 489 -9.453 -5.890 0.176 1.00 0.00 H new ATOM 872 N SER A 490 -12.466 -6.703 0.661 1.00 0.00 N ATOM 873 CA SER A 490 -12.690 -7.908 -0.128 1.00 0.00 C ATOM 874 C SER A 490 -12.589 -7.616 -1.618 1.00 0.00 C ATOM 875 O SER A 490 -13.006 -6.557 -2.084 1.00 0.00 O ATOM 876 CB SER A 490 -14.046 -8.503 0.204 1.00 0.00 C ATOM 877 OG SER A 490 -14.146 -8.866 1.552 1.00 0.00 O ATOM 0 H SER A 490 -13.109 -5.938 0.454 1.00 0.00 H new ATOM 0 HA SER A 490 -11.914 -8.630 0.125 1.00 0.00 H new ATOM 0 HB2 SER A 490 -14.827 -7.781 -0.035 1.00 0.00 H new ATOM 0 HB3 SER A 490 -14.220 -9.379 -0.421 1.00 0.00 H new ATOM 0 HG SER A 490 -13.332 -9.338 1.825 1.00 0.00 H new ATOM 883 N LEU A 491 -12.030 -8.563 -2.365 1.00 0.00 N ATOM 884 CA LEU A 491 -11.851 -8.400 -3.802 1.00 0.00 C ATOM 885 C LEU A 491 -12.438 -9.579 -4.568 1.00 0.00 C ATOM 886 O LEU A 491 -12.155 -10.736 -4.258 1.00 0.00 O ATOM 887 CB LEU A 491 -10.362 -8.237 -4.135 1.00 0.00 C ATOM 888 CG LEU A 491 -9.695 -6.987 -3.546 1.00 0.00 C ATOM 889 CD1 LEU A 491 -8.189 -7.051 -3.758 1.00 0.00 C ATOM 890 CD2 LEU A 491 -10.281 -5.743 -4.198 1.00 0.00 C ATOM 0 H LEU A 491 -11.693 -9.453 -1.997 1.00 0.00 H new ATOM 0 HA LEU A 491 -12.384 -7.501 -4.109 1.00 0.00 H new ATOM 0 HB2 LEU A 491 -9.828 -9.117 -3.778 1.00 0.00 H new ATOM 0 HB3 LEU A 491 -10.249 -8.213 -5.219 1.00 0.00 H new ATOM 0 HG LEU A 491 -9.886 -6.943 -2.474 1.00 0.00 H new ATOM 0 HD11 LEU A 491 -7.724 -6.160 -3.337 1.00 0.00 H new ATOM 0 HD12 LEU A 491 -7.789 -7.937 -3.264 1.00 0.00 H new ATOM 0 HD13 LEU A 491 -7.974 -7.103 -4.825 1.00 0.00 H new ATOM 0 HD21 LEU A 491 -9.807 -4.855 -3.779 1.00 0.00 H new ATOM 0 HD22 LEU A 491 -10.102 -5.777 -5.273 1.00 0.00 H new ATOM 0 HD23 LEU A 491 -11.354 -5.704 -4.010 1.00 0.00 H new ATOM 902 N GLY A 492 -13.259 -9.278 -5.569 1.00 0.00 N ATOM 903 CA GLY A 492 -13.762 -10.298 -6.480 1.00 0.00 C ATOM 904 C GLY A 492 -12.805 -10.520 -7.644 1.00 0.00 C ATOM 905 O GLY A 492 -11.758 -9.879 -7.729 1.00 0.00 O ATOM 0 H GLY A 492 -13.590 -8.334 -5.769 1.00 0.00 H new ATOM 0 HA2 GLY A 492 -13.904 -11.234 -5.939 1.00 0.00 H new ATOM 0 HA3 GLY A 492 -14.738 -9.999 -6.861 1.00 0.00 H new ATOM 909 N PRO A 493 -13.173 -11.430 -8.540 1.00 0.00 N ATOM 910 CA PRO A 493 -12.386 -11.683 -9.741 1.00 0.00 C ATOM 911 C PRO A 493 -12.206 -10.410 -10.561 1.00 0.00 C ATOM 912 O PRO A 493 -13.172 -9.867 -11.099 1.00 0.00 O ATOM 913 CB PRO A 493 -13.187 -12.748 -10.496 1.00 0.00 C ATOM 914 CG PRO A 493 -14.024 -13.396 -9.447 1.00 0.00 C ATOM 915 CD PRO A 493 -14.368 -12.298 -8.476 1.00 0.00 C ATOM 0 HA PRO A 493 -11.373 -12.019 -9.519 1.00 0.00 H new ATOM 0 HB2 PRO A 493 -13.803 -12.302 -11.277 1.00 0.00 H new ATOM 0 HB3 PRO A 493 -12.530 -13.469 -10.982 1.00 0.00 H new ATOM 0 HG2 PRO A 493 -14.924 -13.836 -9.878 1.00 0.00 H new ATOM 0 HG3 PRO A 493 -13.481 -14.202 -8.953 1.00 0.00 H new ATOM 0 HD2 PRO A 493 -15.273 -11.765 -8.769 1.00 0.00 H new ATOM 0 HD3 PRO A 493 -14.537 -12.683 -7.470 1.00 0.00 H new ATOM 923 N LYS A 494 -10.967 -9.941 -10.651 1.00 0.00 N ATOM 924 CA LYS A 494 -10.653 -8.758 -11.444 1.00 0.00 C ATOM 925 C LYS A 494 -11.326 -7.517 -10.870 1.00 0.00 C ATOM 926 O LYS A 494 -11.729 -6.620 -11.611 1.00 0.00 O ATOM 927 CB LYS A 494 -11.075 -8.960 -12.898 1.00 0.00 C ATOM 928 CG LYS A 494 -10.424 -10.156 -13.582 1.00 0.00 C ATOM 929 CD LYS A 494 -10.836 -10.250 -15.043 1.00 0.00 C ATOM 930 CE LYS A 494 -10.258 -11.493 -15.703 1.00 0.00 C ATOM 931 NZ LYS A 494 -10.640 -11.590 -17.138 1.00 0.00 N ATOM 0 H LYS A 494 -10.163 -10.362 -10.185 1.00 0.00 H new ATOM 0 HA LYS A 494 -9.574 -8.609 -11.408 1.00 0.00 H new ATOM 0 HB2 LYS A 494 -12.158 -9.080 -12.936 1.00 0.00 H new ATOM 0 HB3 LYS A 494 -10.834 -8.059 -13.462 1.00 0.00 H new ATOM 0 HG2 LYS A 494 -9.340 -10.071 -13.513 1.00 0.00 H new ATOM 0 HG3 LYS A 494 -10.706 -11.072 -13.063 1.00 0.00 H new ATOM 0 HD2 LYS A 494 -11.923 -10.270 -15.116 1.00 0.00 H new ATOM 0 HD3 LYS A 494 -10.497 -9.362 -15.576 1.00 0.00 H new ATOM 0 HE2 LYS A 494 -9.171 -11.477 -15.617 1.00 0.00 H new ATOM 0 HE3 LYS A 494 -10.607 -12.380 -15.174 1.00 0.00 H new ATOM 0 HZ1 LYS A 494 -10.226 -12.450 -17.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 494 -11.676 -11.631 -17.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 494 -10.285 -10.756 -17.649 1.00 0.00 H new ATOM 945 N GLU A 495 -11.445 -7.472 -9.547 1.00 0.00 N ATOM 946 CA GLU A 495 -11.975 -6.297 -8.867 1.00 0.00 C ATOM 947 C GLU A 495 -10.858 -5.458 -8.262 1.00 0.00 C ATOM 948 O GLU A 495 -9.862 -5.992 -7.771 1.00 0.00 O ATOM 949 CB GLU A 495 -12.968 -6.712 -7.777 1.00 0.00 C ATOM 950 CG GLU A 495 -13.642 -5.548 -7.065 1.00 0.00 C ATOM 951 CD GLU A 495 -14.727 -6.028 -6.142 1.00 0.00 C ATOM 952 OE1 GLU A 495 -14.975 -7.210 -6.111 1.00 0.00 O ATOM 953 OE2 GLU A 495 -15.232 -5.233 -5.385 1.00 0.00 O ATOM 0 H GLU A 495 -11.181 -8.236 -8.925 1.00 0.00 H new ATOM 0 HA GLU A 495 -12.494 -5.690 -9.609 1.00 0.00 H new ATOM 0 HB2 GLU A 495 -13.736 -7.343 -8.224 1.00 0.00 H new ATOM 0 HB3 GLU A 495 -12.445 -7.320 -7.039 1.00 0.00 H new ATOM 0 HG2 GLU A 495 -12.900 -4.987 -6.497 1.00 0.00 H new ATOM 0 HG3 GLU A 495 -14.064 -4.864 -7.801 1.00 0.00 H new ATOM 960 N GLU A 496 -11.026 -4.141 -8.300 1.00 0.00 N ATOM 961 CA GLU A 496 -10.015 -3.224 -7.787 1.00 0.00 C ATOM 962 C GLU A 496 -10.592 -2.314 -6.710 1.00 0.00 C ATOM 963 O GLU A 496 -11.725 -1.847 -6.819 1.00 0.00 O ATOM 964 CB GLU A 496 -9.427 -2.383 -8.923 1.00 0.00 C ATOM 965 CG GLU A 496 -8.351 -1.400 -8.487 1.00 0.00 C ATOM 966 CD GLU A 496 -7.799 -0.640 -9.660 1.00 0.00 C ATOM 967 OE1 GLU A 496 -8.312 -0.797 -10.741 1.00 0.00 O ATOM 968 OE2 GLU A 496 -6.938 0.184 -9.456 1.00 0.00 O ATOM 0 H GLU A 496 -11.854 -3.684 -8.681 1.00 0.00 H new ATOM 0 HA GLU A 496 -9.221 -3.822 -7.340 1.00 0.00 H new ATOM 0 HB2 GLU A 496 -9.007 -3.052 -9.674 1.00 0.00 H new ATOM 0 HB3 GLU A 496 -10.234 -1.830 -9.404 1.00 0.00 H new ATOM 0 HG2 GLU A 496 -8.766 -0.701 -7.761 1.00 0.00 H new ATOM 0 HG3 GLU A 496 -7.545 -1.937 -7.987 1.00 0.00 H new ATOM 975 N LYS A 497 -9.805 -2.067 -5.668 1.00 0.00 N ATOM 976 CA LYS A 497 -10.206 -1.151 -4.606 1.00 0.00 C ATOM 977 C LYS A 497 -9.128 -0.106 -4.343 1.00 0.00 C ATOM 978 O LYS A 497 -7.936 -0.386 -4.470 1.00 0.00 O ATOM 979 CB LYS A 497 -10.512 -1.922 -3.321 1.00 0.00 C ATOM 980 CG LYS A 497 -11.784 -2.758 -3.379 1.00 0.00 C ATOM 981 CD LYS A 497 -13.026 -1.881 -3.312 1.00 0.00 C ATOM 982 CE LYS A 497 -13.206 -1.278 -1.927 1.00 0.00 C ATOM 983 NZ LYS A 497 -14.347 -0.322 -1.881 1.00 0.00 N ATOM 0 H LYS A 497 -8.886 -2.488 -5.536 1.00 0.00 H new ATOM 0 HA LYS A 497 -11.109 -0.636 -4.934 1.00 0.00 H new ATOM 0 HB2 LYS A 497 -9.671 -2.577 -3.095 1.00 0.00 H new ATOM 0 HB3 LYS A 497 -10.594 -1.213 -2.497 1.00 0.00 H new ATOM 0 HG2 LYS A 497 -11.797 -3.341 -4.300 1.00 0.00 H new ATOM 0 HG3 LYS A 497 -11.793 -3.468 -2.552 1.00 0.00 H new ATOM 0 HD2 LYS A 497 -12.950 -1.083 -4.051 1.00 0.00 H new ATOM 0 HD3 LYS A 497 -13.905 -2.472 -3.570 1.00 0.00 H new ATOM 0 HE2 LYS A 497 -13.371 -2.076 -1.203 1.00 0.00 H new ATOM 0 HE3 LYS A 497 -12.290 -0.765 -1.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 497 -14.436 0.067 -0.920 1.00 0.00 H new ATOM 0 HZ2 LYS A 497 -14.178 0.453 -2.554 1.00 0.00 H new ATOM 0 HZ3 LYS A 497 -15.225 -0.817 -2.137 1.00 0.00 H new ATOM 997 N VAL A 498 -9.555 1.098 -3.980 1.00 0.00 N ATOM 998 CA VAL A 498 -8.629 2.197 -3.736 1.00 0.00 C ATOM 999 C VAL A 498 -8.611 2.585 -2.263 1.00 0.00 C ATOM 1000 O VAL A 498 -9.633 2.981 -1.703 1.00 0.00 O ATOM 1001 CB VAL A 498 -8.987 3.435 -4.579 1.00 0.00 C ATOM 1002 CG1 VAL A 498 -8.030 4.579 -4.280 1.00 0.00 C ATOM 1003 CG2 VAL A 498 -8.962 3.096 -6.062 1.00 0.00 C ATOM 0 H VAL A 498 -10.538 1.338 -3.848 1.00 0.00 H new ATOM 0 HA VAL A 498 -7.640 1.845 -4.027 1.00 0.00 H new ATOM 0 HB VAL A 498 -9.996 3.751 -4.314 1.00 0.00 H new ATOM 0 HG11 VAL A 498 -8.298 5.445 -4.885 1.00 0.00 H new ATOM 0 HG12 VAL A 498 -8.094 4.840 -3.224 1.00 0.00 H new ATOM 0 HG13 VAL A 498 -7.011 4.272 -4.517 1.00 0.00 H new ATOM 0 HG21 VAL A 498 -9.217 3.983 -6.642 1.00 0.00 H new ATOM 0 HG22 VAL A 498 -7.965 2.755 -6.340 1.00 0.00 H new ATOM 0 HG23 VAL A 498 -9.686 2.307 -6.267 1.00 0.00 H new ATOM 1013 N LEU A 499 -7.444 2.469 -1.640 1.00 0.00 N ATOM 1014 CA LEU A 499 -7.263 2.913 -0.263 1.00 0.00 C ATOM 1015 C LEU A 499 -6.526 4.244 -0.205 1.00 0.00 C ATOM 1016 O LEU A 499 -5.609 4.492 -0.988 1.00 0.00 O ATOM 1017 CB LEU A 499 -6.507 1.849 0.541 1.00 0.00 C ATOM 1018 CG LEU A 499 -7.110 0.439 0.488 1.00 0.00 C ATOM 1019 CD1 LEU A 499 -6.188 -0.550 1.186 1.00 0.00 C ATOM 1020 CD2 LEU A 499 -8.484 0.450 1.141 1.00 0.00 C ATOM 0 H LEU A 499 -6.608 2.071 -2.067 1.00 0.00 H new ATOM 0 HA LEU A 499 -8.249 3.057 0.178 1.00 0.00 H new ATOM 0 HB2 LEU A 499 -5.481 1.802 0.176 1.00 0.00 H new ATOM 0 HB3 LEU A 499 -6.461 2.168 1.582 1.00 0.00 H new ATOM 0 HG LEU A 499 -7.218 0.128 -0.551 1.00 0.00 H new ATOM 0 HD11 LEU A 499 -6.625 -1.548 1.143 1.00 0.00 H new ATOM 0 HD12 LEU A 499 -5.218 -0.557 0.688 1.00 0.00 H new ATOM 0 HD13 LEU A 499 -6.059 -0.255 2.227 1.00 0.00 H new ATOM 0 HD21 LEU A 499 -8.913 -0.551 1.104 1.00 0.00 H new ATOM 0 HD22 LEU A 499 -8.391 0.766 2.180 1.00 0.00 H new ATOM 0 HD23 LEU A 499 -9.135 1.143 0.608 1.00 0.00 H new ATOM 1032 N THR A 500 -6.930 5.099 0.727 1.00 0.00 N ATOM 1033 CA THR A 500 -6.280 6.390 0.918 1.00 0.00 C ATOM 1034 C THR A 500 -5.790 6.554 2.350 1.00 0.00 C ATOM 1035 O THR A 500 -6.343 5.962 3.277 1.00 0.00 O ATOM 1036 CB THR A 500 -7.226 7.555 0.574 1.00 0.00 C ATOM 1037 OG1 THR A 500 -8.432 7.438 1.340 1.00 0.00 O ATOM 1038 CG2 THR A 500 -7.569 7.546 -0.907 1.00 0.00 C ATOM 0 H THR A 500 -7.707 4.921 1.364 1.00 0.00 H new ATOM 0 HA THR A 500 -5.427 6.414 0.240 1.00 0.00 H new ATOM 0 HB THR A 500 -6.724 8.492 0.814 1.00 0.00 H new ATOM 0 HG1 THR A 500 -9.032 8.181 1.121 1.00 0.00 H new ATOM 0 HG21 THR A 500 -8.238 8.377 -1.130 1.00 0.00 H new ATOM 0 HG22 THR A 500 -6.655 7.648 -1.493 1.00 0.00 H new ATOM 0 HG23 THR A 500 -8.059 6.606 -1.161 1.00 0.00 H new ATOM 1046 N PHE A 501 -4.748 7.359 2.525 1.00 0.00 N ATOM 1047 CA PHE A 501 -4.344 7.814 3.849 1.00 0.00 C ATOM 1048 C PHE A 501 -3.607 9.144 3.776 1.00 0.00 C ATOM 1049 O PHE A 501 -3.048 9.497 2.738 1.00 0.00 O ATOM 1050 CB PHE A 501 -3.464 6.762 4.530 1.00 0.00 C ATOM 1051 CG PHE A 501 -2.179 6.486 3.804 1.00 0.00 C ATOM 1052 CD1 PHE A 501 -1.041 7.234 4.068 1.00 0.00 C ATOM 1053 CD2 PHE A 501 -2.105 5.477 2.854 1.00 0.00 C ATOM 1054 CE1 PHE A 501 0.140 6.980 3.400 1.00 0.00 C ATOM 1055 CE2 PHE A 501 -0.924 5.221 2.186 1.00 0.00 C ATOM 1056 CZ PHE A 501 0.200 5.974 2.459 1.00 0.00 C ATOM 0 H PHE A 501 -4.167 7.710 1.764 1.00 0.00 H new ATOM 0 HA PHE A 501 -5.248 7.959 4.441 1.00 0.00 H new ATOM 0 HB2 PHE A 501 -3.234 7.094 5.543 1.00 0.00 H new ATOM 0 HB3 PHE A 501 -4.027 5.833 4.619 1.00 0.00 H new ATOM 0 HD1 PHE A 501 -1.079 8.023 4.804 1.00 0.00 H new ATOM 0 HD2 PHE A 501 -2.981 4.885 2.635 1.00 0.00 H new ATOM 0 HE1 PHE A 501 1.019 7.570 3.615 1.00 0.00 H new ATOM 0 HE2 PHE A 501 -0.880 4.432 1.450 1.00 0.00 H new ATOM 0 HZ PHE A 501 1.124 5.776 1.937 1.00 0.00 H new ATOM 1066 N SER A 502 -3.610 9.880 4.883 1.00 0.00 N ATOM 1067 CA SER A 502 -2.998 11.202 4.926 1.00 0.00 C ATOM 1068 C SER A 502 -1.886 11.261 5.966 1.00 0.00 C ATOM 1069 O SER A 502 -2.079 10.867 7.116 1.00 0.00 O ATOM 1070 CB SER A 502 -4.048 12.255 5.216 1.00 0.00 C ATOM 1071 OG SER A 502 -5.002 12.344 4.192 1.00 0.00 O ATOM 0 H SER A 502 -4.030 9.582 5.763 1.00 0.00 H new ATOM 0 HA SER A 502 -2.555 11.402 3.950 1.00 0.00 H new ATOM 0 HB2 SER A 502 -4.547 12.020 6.156 1.00 0.00 H new ATOM 0 HB3 SER A 502 -3.564 13.223 5.345 1.00 0.00 H new ATOM 0 HG SER A 502 -5.662 13.033 4.418 1.00 0.00 H new ATOM 1077 N TRP A 503 -0.724 11.754 5.555 1.00 0.00 N ATOM 1078 CA TRP A 503 0.473 11.685 6.384 1.00 0.00 C ATOM 1079 C TRP A 503 1.160 13.041 6.474 1.00 0.00 C ATOM 1080 O TRP A 503 1.414 13.688 5.458 1.00 0.00 O ATOM 1081 CB TRP A 503 1.445 10.641 5.830 1.00 0.00 C ATOM 1082 CG TRP A 503 2.773 10.633 6.523 1.00 0.00 C ATOM 1083 CD1 TRP A 503 2.991 10.590 7.867 1.00 0.00 C ATOM 1084 CD2 TRP A 503 4.067 10.667 5.906 1.00 0.00 C ATOM 1085 NE1 TRP A 503 4.339 10.598 8.128 1.00 0.00 N ATOM 1086 CE2 TRP A 503 5.022 10.644 6.938 1.00 0.00 C ATOM 1087 CE3 TRP A 503 4.509 10.716 4.579 1.00 0.00 C ATOM 1088 CZ2 TRP A 503 6.384 10.668 6.691 1.00 0.00 C ATOM 1089 CZ3 TRP A 503 5.875 10.739 4.331 1.00 0.00 C ATOM 1090 CH2 TRP A 503 6.787 10.716 5.355 1.00 0.00 C ATOM 0 H TRP A 503 -0.585 12.206 4.651 1.00 0.00 H new ATOM 0 HA TRP A 503 0.168 11.391 7.388 1.00 0.00 H new ATOM 0 HB2 TRP A 503 0.993 9.653 5.917 1.00 0.00 H new ATOM 0 HB3 TRP A 503 1.600 10.828 4.767 1.00 0.00 H new ATOM 0 HD1 TRP A 503 2.216 10.555 8.618 1.00 0.00 H new ATOM 0 HE1 TRP A 503 4.764 10.574 9.055 1.00 0.00 H new ATOM 0 HE3 TRP A 503 3.801 10.736 3.764 1.00 0.00 H new ATOM 0 HZ2 TRP A 503 7.103 10.650 7.496 1.00 0.00 H new ATOM 0 HZ3 TRP A 503 6.227 10.776 3.310 1.00 0.00 H new ATOM 0 HH2 TRP A 503 7.842 10.735 5.123 1.00 0.00 H new ATOM 1101 N THR A 504 1.459 13.468 7.696 1.00 0.00 N ATOM 1102 CA THR A 504 2.220 14.691 7.917 1.00 0.00 C ATOM 1103 C THR A 504 3.543 14.399 8.614 1.00 0.00 C ATOM 1104 O THR A 504 3.573 14.087 9.805 1.00 0.00 O ATOM 1105 CB THR A 504 1.425 15.710 8.753 1.00 0.00 C ATOM 1106 OG1 THR A 504 0.219 16.062 8.061 1.00 0.00 O ATOM 1107 CG2 THR A 504 2.251 16.963 8.995 1.00 0.00 C ATOM 0 H THR A 504 1.185 12.983 8.551 1.00 0.00 H new ATOM 0 HA THR A 504 2.417 15.118 6.934 1.00 0.00 H new ATOM 0 HB THR A 504 1.182 15.258 9.714 1.00 0.00 H new ATOM 0 HG1 THR A 504 -0.287 16.709 8.595 1.00 0.00 H new ATOM 0 HG21 THR A 504 1.672 17.672 9.588 1.00 0.00 H new ATOM 0 HG22 THR A 504 3.162 16.700 9.532 1.00 0.00 H new ATOM 0 HG23 THR A 504 2.512 17.417 8.039 1.00 0.00 H new ATOM 1115 N PRO A 505 4.636 14.501 7.866 1.00 0.00 N ATOM 1116 CA PRO A 505 5.972 14.395 8.442 1.00 0.00 C ATOM 1117 C PRO A 505 6.340 15.655 9.216 1.00 0.00 C ATOM 1118 O PRO A 505 5.983 16.764 8.818 1.00 0.00 O ATOM 1119 CB PRO A 505 6.884 14.173 7.232 1.00 0.00 C ATOM 1120 CG PRO A 505 6.214 14.906 6.120 1.00 0.00 C ATOM 1121 CD PRO A 505 4.737 14.758 6.380 1.00 0.00 C ATOM 0 HA PRO A 505 6.056 13.586 9.168 1.00 0.00 H new ATOM 0 HB2 PRO A 505 7.887 14.559 7.415 1.00 0.00 H new ATOM 0 HB3 PRO A 505 6.988 13.113 7.003 1.00 0.00 H new ATOM 0 HG2 PRO A 505 6.508 15.956 6.107 1.00 0.00 H new ATOM 0 HG3 PRO A 505 6.487 14.487 5.152 1.00 0.00 H new ATOM 0 HD2 PRO A 505 4.192 15.658 6.095 1.00 0.00 H new ATOM 0 HD3 PRO A 505 4.314 13.934 5.805 1.00 0.00 H new ATOM 1129 N THR A 506 7.056 15.478 10.320 1.00 0.00 N ATOM 1130 CA THR A 506 7.468 16.600 11.154 1.00 0.00 C ATOM 1131 C THR A 506 8.984 16.749 11.166 1.00 0.00 C ATOM 1132 O THR A 506 9.513 17.782 11.578 1.00 0.00 O ATOM 1133 CB THR A 506 6.968 16.441 12.603 1.00 0.00 C ATOM 1134 OG1 THR A 506 7.454 15.207 13.146 1.00 0.00 O ATOM 1135 CG2 THR A 506 5.448 16.447 12.646 1.00 0.00 C ATOM 0 H THR A 506 7.364 14.566 10.659 1.00 0.00 H new ATOM 0 HA THR A 506 7.020 17.494 10.720 1.00 0.00 H new ATOM 0 HB THR A 506 7.341 17.277 13.194 1.00 0.00 H new ATOM 0 HG1 THR A 506 7.137 15.108 14.068 1.00 0.00 H new ATOM 0 HG21 THR A 506 5.113 16.334 13.677 1.00 0.00 H new ATOM 0 HG22 THR A 506 5.076 17.390 12.245 1.00 0.00 H new ATOM 0 HG23 THR A 506 5.064 15.622 12.047 1.00 0.00 H new ATOM 1143 N GLN A 507 9.679 15.713 10.709 1.00 0.00 N ATOM 1144 CA GLN A 507 11.136 15.737 10.643 1.00 0.00 C ATOM 1145 C GLN A 507 11.626 15.552 9.213 1.00 0.00 C ATOM 1146 O GLN A 507 11.100 14.724 8.469 1.00 0.00 O ATOM 1147 CB GLN A 507 11.731 14.648 11.539 1.00 0.00 C ATOM 1148 CG GLN A 507 11.495 14.864 13.024 1.00 0.00 C ATOM 1149 CD GLN A 507 12.054 13.735 13.869 1.00 0.00 C ATOM 1150 OE1 GLN A 507 12.647 12.787 13.350 1.00 0.00 O ATOM 1151 NE2 GLN A 507 11.862 13.829 15.181 1.00 0.00 N ATOM 0 H GLN A 507 9.257 14.845 10.378 1.00 0.00 H new ATOM 0 HA GLN A 507 11.467 16.713 10.997 1.00 0.00 H new ATOM 0 HB2 GLN A 507 11.307 13.686 11.252 1.00 0.00 H new ATOM 0 HB3 GLN A 507 12.804 14.591 11.358 1.00 0.00 H new ATOM 0 HG2 GLN A 507 11.954 15.804 13.329 1.00 0.00 H new ATOM 0 HG3 GLN A 507 10.425 14.957 13.209 1.00 0.00 H new ATOM 0 HE21 GLN A 507 11.365 14.632 15.568 1.00 0.00 H new ATOM 0 HE22 GLN A 507 12.211 13.098 15.801 1.00 0.00 H new ATOM 1160 N GLU A 508 12.635 16.327 8.833 1.00 0.00 N ATOM 1161 CA GLU A 508 13.236 16.210 7.510 1.00 0.00 C ATOM 1162 C GLU A 508 14.120 14.973 7.414 1.00 0.00 C ATOM 1163 O GLU A 508 14.844 14.643 8.353 1.00 0.00 O ATOM 1164 CB GLU A 508 14.046 17.465 7.176 1.00 0.00 C ATOM 1165 CG GLU A 508 14.933 17.331 5.948 1.00 0.00 C ATOM 1166 CD GLU A 508 15.720 18.589 5.700 1.00 0.00 C ATOM 1167 OE1 GLU A 508 16.498 18.956 6.548 1.00 0.00 O ATOM 1168 OE2 GLU A 508 15.625 19.123 4.620 1.00 0.00 O ATOM 0 H GLU A 508 13.055 17.045 9.424 1.00 0.00 H new ATOM 0 HA GLU A 508 12.429 16.108 6.785 1.00 0.00 H new ATOM 0 HB2 GLU A 508 13.358 18.297 7.024 1.00 0.00 H new ATOM 0 HB3 GLU A 508 14.669 17.720 8.033 1.00 0.00 H new ATOM 0 HG2 GLU A 508 15.617 16.492 6.081 1.00 0.00 H new ATOM 0 HG3 GLU A 508 14.319 17.106 5.076 1.00 0.00 H new ATOM 1175 N GLY A 509 14.059 14.296 6.274 1.00 0.00 N ATOM 1176 CA GLY A 509 14.793 13.051 6.081 1.00 0.00 C ATOM 1177 C GLY A 509 14.116 12.166 5.043 1.00 0.00 C ATOM 1178 O GLY A 509 13.029 12.481 4.559 1.00 0.00 O ATOM 0 H GLY A 509 13.508 14.589 5.467 1.00 0.00 H new ATOM 0 HA2 GLY A 509 15.812 13.272 5.764 1.00 0.00 H new ATOM 0 HA3 GLY A 509 14.862 12.516 7.028 1.00 0.00 H new ATOM 1182 N MET A 510 14.764 11.056 4.706 1.00 0.00 N ATOM 1183 CA MET A 510 14.202 10.097 3.762 1.00 0.00 C ATOM 1184 C MET A 510 13.270 9.116 4.465 1.00 0.00 C ATOM 1185 O MET A 510 13.643 8.493 5.459 1.00 0.00 O ATOM 1186 CB MET A 510 15.321 9.342 3.047 1.00 0.00 C ATOM 1187 CG MET A 510 16.236 10.222 2.208 1.00 0.00 C ATOM 1188 SD MET A 510 15.356 11.088 0.893 1.00 0.00 S ATOM 1189 CE MET A 510 14.936 9.726 -0.188 1.00 0.00 C ATOM 0 H MET A 510 15.680 10.798 5.073 1.00 0.00 H new ATOM 0 HA MET A 510 13.619 10.649 3.025 1.00 0.00 H new ATOM 0 HB2 MET A 510 15.922 8.818 3.790 1.00 0.00 H new ATOM 0 HB3 MET A 510 14.877 8.583 2.403 1.00 0.00 H new ATOM 0 HG2 MET A 510 16.724 10.951 2.854 1.00 0.00 H new ATOM 0 HG3 MET A 510 17.022 9.608 1.770 1.00 0.00 H new ATOM 0 HE1 MET A 510 15.293 9.938 -1.196 1.00 0.00 H new ATOM 0 HE2 MET A 510 15.404 8.813 0.179 1.00 0.00 H new ATOM 0 HE3 MET A 510 13.854 9.597 -0.207 1.00 0.00 H new ATOM 1199 N TYR A 511 12.056 8.985 3.941 1.00 0.00 N ATOM 1200 CA TYR A 511 11.093 8.028 4.473 1.00 0.00 C ATOM 1201 C TYR A 511 10.665 7.026 3.406 1.00 0.00 C ATOM 1202 O TYR A 511 10.322 7.407 2.286 1.00 0.00 O ATOM 1203 CB TYR A 511 9.868 8.754 5.031 1.00 0.00 C ATOM 1204 CG TYR A 511 10.169 9.637 6.221 1.00 0.00 C ATOM 1205 CD1 TYR A 511 10.646 10.928 6.050 1.00 0.00 C ATOM 1206 CD2 TYR A 511 9.973 9.177 7.515 1.00 0.00 C ATOM 1207 CE1 TYR A 511 10.924 11.738 7.134 1.00 0.00 C ATOM 1208 CE2 TYR A 511 10.247 9.978 8.607 1.00 0.00 C ATOM 1209 CZ TYR A 511 10.721 11.259 8.412 1.00 0.00 C ATOM 1210 OH TYR A 511 10.994 12.062 9.495 1.00 0.00 O ATOM 0 H TYR A 511 11.716 9.529 3.148 1.00 0.00 H new ATOM 0 HA TYR A 511 11.579 7.481 5.281 1.00 0.00 H new ATOM 0 HB2 TYR A 511 9.428 9.363 4.241 1.00 0.00 H new ATOM 0 HB3 TYR A 511 9.120 8.015 5.319 1.00 0.00 H new ATOM 0 HD1 TYR A 511 10.803 11.307 5.051 1.00 0.00 H new ATOM 0 HD2 TYR A 511 9.600 8.176 7.672 1.00 0.00 H new ATOM 0 HE1 TYR A 511 11.298 12.740 6.982 1.00 0.00 H new ATOM 0 HE2 TYR A 511 10.091 9.603 9.608 1.00 0.00 H new ATOM 0 HH TYR A 511 11.060 12.995 9.202 1.00 0.00 H new ATOM 1220 N ARG A 512 10.687 5.747 3.761 1.00 0.00 N ATOM 1221 CA ARG A 512 10.305 4.689 2.834 1.00 0.00 C ATOM 1222 C ARG A 512 8.918 4.148 3.158 1.00 0.00 C ATOM 1223 O ARG A 512 8.689 3.607 4.239 1.00 0.00 O ATOM 1224 CB ARG A 512 11.338 3.573 2.777 1.00 0.00 C ATOM 1225 CG ARG A 512 11.074 2.510 1.722 1.00 0.00 C ATOM 1226 CD ARG A 512 12.151 1.497 1.591 1.00 0.00 C ATOM 1227 NE ARG A 512 12.278 0.603 2.732 1.00 0.00 N ATOM 1228 CZ ARG A 512 13.277 -0.286 2.899 1.00 0.00 C ATOM 1229 NH1 ARG A 512 14.216 -0.430 1.989 1.00 0.00 N ATOM 1230 NH2 ARG A 512 13.276 -1.028 3.992 1.00 0.00 N ATOM 0 H ARG A 512 10.966 5.417 4.685 1.00 0.00 H new ATOM 0 HA ARG A 512 10.268 5.134 1.839 1.00 0.00 H new ATOM 0 HB2 ARG A 512 12.318 4.013 2.591 1.00 0.00 H new ATOM 0 HB3 ARG A 512 11.385 3.091 3.754 1.00 0.00 H new ATOM 0 HG2 ARG A 512 10.140 2.001 1.962 1.00 0.00 H new ATOM 0 HG3 ARG A 512 10.932 2.999 0.758 1.00 0.00 H new ATOM 0 HD2 ARG A 512 11.966 0.901 0.697 1.00 0.00 H new ATOM 0 HD3 ARG A 512 13.100 2.011 1.440 1.00 0.00 H new ATOM 0 HE ARG A 512 11.561 0.653 3.456 1.00 0.00 H new ATOM 0 HH11 ARG A 512 14.195 0.136 1.141 1.00 0.00 H new ATOM 0 HH12 ARG A 512 14.965 -1.108 2.132 1.00 0.00 H new ATOM 0 HH21 ARG A 512 12.532 -0.919 4.682 1.00 0.00 H new ATOM 0 HH22 ARG A 512 14.019 -1.710 4.146 1.00 0.00 H new ATOM 1244 N ILE A 513 7.995 4.296 2.214 1.00 0.00 N ATOM 1245 CA ILE A 513 6.632 3.806 2.389 1.00 0.00 C ATOM 1246 C ILE A 513 6.398 2.535 1.586 1.00 0.00 C ATOM 1247 O ILE A 513 6.530 2.529 0.362 1.00 0.00 O ATOM 1248 CB ILE A 513 5.593 4.864 1.976 1.00 0.00 C ATOM 1249 CG1 ILE A 513 5.762 6.135 2.813 1.00 0.00 C ATOM 1250 CG2 ILE A 513 4.184 4.310 2.120 1.00 0.00 C ATOM 1251 CD1 ILE A 513 4.924 7.298 2.332 1.00 0.00 C ATOM 0 H ILE A 513 8.166 4.752 1.318 1.00 0.00 H new ATOM 0 HA ILE A 513 6.510 3.588 3.450 1.00 0.00 H new ATOM 0 HB ILE A 513 5.755 5.119 0.929 1.00 0.00 H new ATOM 0 HG12 ILE A 513 5.501 5.915 3.848 1.00 0.00 H new ATOM 0 HG13 ILE A 513 6.812 6.428 2.804 1.00 0.00 H new ATOM 0 HG21 ILE A 513 3.462 5.071 1.824 1.00 0.00 H new ATOM 0 HG22 ILE A 513 4.070 3.434 1.481 1.00 0.00 H new ATOM 0 HG23 ILE A 513 4.008 4.028 3.158 1.00 0.00 H new ATOM 0 HD11 ILE A 513 5.097 8.162 2.974 1.00 0.00 H new ATOM 0 HD12 ILE A 513 5.200 7.546 1.307 1.00 0.00 H new ATOM 0 HD13 ILE A 513 3.869 7.026 2.367 1.00 0.00 H new ATOM 1263 N ASN A 514 6.049 1.458 2.281 1.00 0.00 N ATOM 1264 CA ASN A 514 5.792 0.178 1.632 1.00 0.00 C ATOM 1265 C ASN A 514 4.392 -0.332 1.952 1.00 0.00 C ATOM 1266 O ASN A 514 3.852 -0.059 3.024 1.00 0.00 O ATOM 1267 CB ASN A 514 6.828 -0.859 2.022 1.00 0.00 C ATOM 1268 CG ASN A 514 8.112 -0.753 1.246 1.00 0.00 C ATOM 1269 OD1 ASN A 514 8.567 0.346 0.909 1.00 0.00 O ATOM 1270 ND2 ASN A 514 8.654 -1.890 0.892 1.00 0.00 N ATOM 0 H ASN A 514 5.938 1.446 3.295 1.00 0.00 H new ATOM 0 HA ASN A 514 5.862 0.343 0.557 1.00 0.00 H new ATOM 0 HB2 ASN A 514 7.047 -0.759 3.085 1.00 0.00 H new ATOM 0 HB3 ASN A 514 6.407 -1.854 1.876 1.00 0.00 H new ATOM 0 HD21 ASN A 514 9.492 -1.896 0.311 1.00 0.00 H new ATOM 0 HD22 ASN A 514 8.238 -2.770 1.197 1.00 0.00 H new ATOM 1277 N ALA A 515 3.808 -1.071 1.015 1.00 0.00 N ATOM 1278 CA ALA A 515 2.506 -1.692 1.230 1.00 0.00 C ATOM 1279 C ALA A 515 2.556 -3.188 0.952 1.00 0.00 C ATOM 1280 O ALA A 515 3.213 -3.632 0.011 1.00 0.00 O ATOM 1281 CB ALA A 515 1.451 -1.022 0.362 1.00 0.00 C ATOM 0 H ALA A 515 4.216 -1.255 0.098 1.00 0.00 H new ATOM 0 HA ALA A 515 2.236 -1.556 2.277 1.00 0.00 H new ATOM 0 HB1 ALA A 515 0.484 -1.496 0.533 1.00 0.00 H new ATOM 0 HB2 ALA A 515 1.387 0.036 0.618 1.00 0.00 H new ATOM 0 HB3 ALA A 515 1.725 -1.125 -0.688 1.00 0.00 H new ATOM 1287 N THR A 516 1.859 -3.961 1.776 1.00 0.00 N ATOM 1288 CA THR A 516 1.734 -5.398 1.557 1.00 0.00 C ATOM 1289 C THR A 516 0.284 -5.847 1.670 1.00 0.00 C ATOM 1290 O THR A 516 -0.512 -5.236 2.382 1.00 0.00 O ATOM 1291 CB THR A 516 2.587 -6.199 2.556 1.00 0.00 C ATOM 1292 OG1 THR A 516 2.125 -5.951 3.890 1.00 0.00 O ATOM 1293 CG2 THR A 516 4.051 -5.798 2.449 1.00 0.00 C ATOM 0 H THR A 516 1.371 -3.617 2.603 1.00 0.00 H new ATOM 0 HA THR A 516 2.095 -5.594 0.547 1.00 0.00 H new ATOM 0 HB THR A 516 2.492 -7.259 2.322 1.00 0.00 H new ATOM 0 HG1 THR A 516 2.668 -6.463 4.525 1.00 0.00 H new ATOM 0 HG21 THR A 516 4.639 -6.375 3.163 1.00 0.00 H new ATOM 0 HG22 THR A 516 4.410 -5.996 1.439 1.00 0.00 H new ATOM 0 HG23 THR A 516 4.154 -4.735 2.668 1.00 0.00 H new ATOM 1301 N VAL A 517 -0.055 -6.920 0.961 1.00 0.00 N ATOM 1302 CA VAL A 517 -1.371 -7.534 1.084 1.00 0.00 C ATOM 1303 C VAL A 517 -1.259 -9.013 1.431 1.00 0.00 C ATOM 1304 O VAL A 517 -0.339 -9.698 0.986 1.00 0.00 O ATOM 1305 CB VAL A 517 -2.187 -7.382 -0.213 1.00 0.00 C ATOM 1306 CG1 VAL A 517 -1.462 -8.039 -1.378 1.00 0.00 C ATOM 1307 CG2 VAL A 517 -3.575 -7.985 -0.042 1.00 0.00 C ATOM 0 H VAL A 517 0.565 -7.382 0.295 1.00 0.00 H new ATOM 0 HA VAL A 517 -1.887 -7.013 1.891 1.00 0.00 H new ATOM 0 HB VAL A 517 -2.296 -6.319 -0.430 1.00 0.00 H new ATOM 0 HG11 VAL A 517 -2.053 -7.922 -2.287 1.00 0.00 H new ATOM 0 HG12 VAL A 517 -0.489 -7.566 -1.514 1.00 0.00 H new ATOM 0 HG13 VAL A 517 -1.324 -9.100 -1.169 1.00 0.00 H new ATOM 0 HG21 VAL A 517 -4.139 -7.869 -0.968 1.00 0.00 H new ATOM 0 HG22 VAL A 517 -3.484 -9.044 0.198 1.00 0.00 H new ATOM 0 HG23 VAL A 517 -4.097 -7.474 0.767 1.00 0.00 H new ATOM 1524 N VAL A 532 3.527 -6.904 -3.193 1.00 0.00 N ATOM 1525 CA VAL A 532 4.250 -5.935 -2.377 1.00 0.00 C ATOM 1526 C VAL A 532 4.678 -4.731 -3.204 1.00 0.00 C ATOM 1527 O VAL A 532 5.075 -4.869 -4.362 1.00 0.00 O ATOM 1528 CB VAL A 532 5.492 -6.563 -1.719 1.00 0.00 C ATOM 1529 CG1 VAL A 532 6.256 -5.518 -0.919 1.00 0.00 C ATOM 1530 CG2 VAL A 532 5.092 -7.729 -0.828 1.00 0.00 C ATOM 0 HA VAL A 532 3.564 -5.609 -1.595 1.00 0.00 H new ATOM 0 HB VAL A 532 6.145 -6.940 -2.506 1.00 0.00 H new ATOM 0 HG11 VAL A 532 7.131 -5.979 -0.461 1.00 0.00 H new ATOM 0 HG12 VAL A 532 6.575 -4.714 -1.582 1.00 0.00 H new ATOM 0 HG13 VAL A 532 5.610 -5.112 -0.141 1.00 0.00 H new ATOM 0 HG21 VAL A 532 5.983 -8.160 -0.371 1.00 0.00 H new ATOM 0 HG22 VAL A 532 4.419 -7.376 -0.047 1.00 0.00 H new ATOM 0 HG23 VAL A 532 4.587 -8.488 -1.426 1.00 0.00 H new ATOM 1540 N ALA A 533 4.598 -3.548 -2.605 1.00 0.00 N ATOM 1541 CA ALA A 533 4.945 -2.312 -3.297 1.00 0.00 C ATOM 1542 C ALA A 533 5.890 -1.458 -2.461 1.00 0.00 C ATOM 1543 O ALA A 533 5.673 -1.267 -1.264 1.00 0.00 O ATOM 1544 CB ALA A 533 3.688 -1.530 -3.647 1.00 0.00 C ATOM 0 H ALA A 533 4.295 -3.419 -1.640 1.00 0.00 H new ATOM 0 HA ALA A 533 5.462 -2.576 -4.220 1.00 0.00 H new ATOM 0 HB1 ALA A 533 3.964 -0.610 -4.163 1.00 0.00 H new ATOM 0 HB2 ALA A 533 3.053 -2.133 -4.295 1.00 0.00 H new ATOM 0 HB3 ALA A 533 3.146 -1.285 -2.734 1.00 0.00 H new ATOM 1550 N THR A 534 6.938 -0.948 -3.098 1.00 0.00 N ATOM 1551 CA THR A 534 7.898 -0.082 -2.422 1.00 0.00 C ATOM 1552 C THR A 534 7.894 1.317 -3.022 1.00 0.00 C ATOM 1553 O THR A 534 8.063 1.486 -4.230 1.00 0.00 O ATOM 1554 CB THR A 534 9.325 -0.657 -2.494 1.00 0.00 C ATOM 1555 OG1 THR A 534 9.369 -1.918 -1.815 1.00 0.00 O ATOM 1556 CG2 THR A 534 10.317 0.297 -1.848 1.00 0.00 C ATOM 0 H THR A 534 7.145 -1.119 -4.082 1.00 0.00 H new ATOM 0 HA THR A 534 7.591 -0.027 -1.378 1.00 0.00 H new ATOM 0 HB THR A 534 9.595 -0.791 -3.542 1.00 0.00 H new ATOM 0 HG1 THR A 534 10.277 -2.284 -1.862 1.00 0.00 H new ATOM 0 HG21 THR A 534 11.320 -0.125 -1.908 1.00 0.00 H new ATOM 0 HG22 THR A 534 10.294 1.254 -2.370 1.00 0.00 H new ATOM 0 HG23 THR A 534 10.049 0.448 -0.802 1.00 0.00 H new ATOM 1564 N PHE A 535 7.703 2.318 -2.171 1.00 0.00 N ATOM 1565 CA PHE A 535 7.751 3.711 -2.603 1.00 0.00 C ATOM 1566 C PHE A 535 8.640 4.541 -1.687 1.00 0.00 C ATOM 1567 O PHE A 535 8.489 4.513 -0.466 1.00 0.00 O ATOM 1568 CB PHE A 535 6.342 4.306 -2.648 1.00 0.00 C ATOM 1569 CG PHE A 535 6.287 5.688 -3.233 1.00 0.00 C ATOM 1570 CD1 PHE A 535 7.219 6.096 -4.174 1.00 0.00 C ATOM 1571 CD2 PHE A 535 5.301 6.582 -2.843 1.00 0.00 C ATOM 1572 CE1 PHE A 535 7.168 7.368 -4.712 1.00 0.00 C ATOM 1573 CE2 PHE A 535 5.248 7.854 -3.381 1.00 0.00 C ATOM 1574 CZ PHE A 535 6.183 8.247 -4.317 1.00 0.00 C ATOM 0 H PHE A 535 7.513 2.192 -1.177 1.00 0.00 H new ATOM 0 HA PHE A 535 8.178 3.735 -3.606 1.00 0.00 H new ATOM 0 HB2 PHE A 535 5.698 3.648 -3.232 1.00 0.00 H new ATOM 0 HB3 PHE A 535 5.936 4.333 -1.637 1.00 0.00 H new ATOM 0 HD1 PHE A 535 7.993 5.413 -4.490 1.00 0.00 H new ATOM 0 HD2 PHE A 535 4.566 6.281 -2.111 1.00 0.00 H new ATOM 0 HE1 PHE A 535 7.902 7.674 -5.443 1.00 0.00 H new ATOM 0 HE2 PHE A 535 4.475 8.540 -3.069 1.00 0.00 H new ATOM 0 HZ PHE A 535 6.143 9.240 -4.739 1.00 0.00 H new ATOM 1584 N ASP A 536 9.570 5.281 -2.285 1.00 0.00 N ATOM 1585 CA ASP A 536 10.484 6.123 -1.524 1.00 0.00 C ATOM 1586 C ASP A 536 10.049 7.582 -1.559 1.00 0.00 C ATOM 1587 O ASP A 536 9.859 8.157 -2.632 1.00 0.00 O ATOM 1588 CB ASP A 536 11.911 5.987 -2.060 1.00 0.00 C ATOM 1589 CG ASP A 536 12.958 6.756 -1.267 1.00 0.00 C ATOM 1590 OD1 ASP A 536 12.592 7.429 -0.334 1.00 0.00 O ATOM 1591 OD2 ASP A 536 14.125 6.541 -1.498 1.00 0.00 O ATOM 0 H ASP A 536 9.709 5.314 -3.295 1.00 0.00 H new ATOM 0 HA ASP A 536 10.461 5.786 -0.488 1.00 0.00 H new ATOM 0 HB2 ASP A 536 12.183 4.932 -2.069 1.00 0.00 H new ATOM 0 HB3 ASP A 536 11.932 6.331 -3.094 1.00 0.00 H new ATOM 1596 N VAL A 537 9.892 8.177 -0.381 1.00 0.00 N ATOM 1597 CA VAL A 537 9.471 9.569 -0.277 1.00 0.00 C ATOM 1598 C VAL A 537 10.504 10.400 0.474 1.00 0.00 C ATOM 1599 O VAL A 537 11.028 9.975 1.502 1.00 0.00 O ATOM 1600 CB VAL A 537 8.110 9.695 0.434 1.00 0.00 C ATOM 1601 CG1 VAL A 537 7.721 11.158 0.583 1.00 0.00 C ATOM 1602 CG2 VAL A 537 7.037 8.935 -0.331 1.00 0.00 C ATOM 0 H VAL A 537 10.050 7.716 0.515 1.00 0.00 H new ATOM 0 HA VAL A 537 9.375 9.947 -1.295 1.00 0.00 H new ATOM 0 HB VAL A 537 8.199 9.258 1.429 1.00 0.00 H new ATOM 0 HG11 VAL A 537 6.757 11.229 1.087 1.00 0.00 H new ATOM 0 HG12 VAL A 537 8.477 11.677 1.171 1.00 0.00 H new ATOM 0 HG13 VAL A 537 7.649 11.618 -0.403 1.00 0.00 H new ATOM 0 HG21 VAL A 537 6.082 9.035 0.185 1.00 0.00 H new ATOM 0 HG22 VAL A 537 6.949 9.344 -1.338 1.00 0.00 H new ATOM 0 HG23 VAL A 537 7.309 7.881 -0.390 1.00 0.00 H new ATOM 1612 N SER A 538 10.790 11.588 -0.047 1.00 0.00 N ATOM 1613 CA SER A 538 11.716 12.508 0.605 1.00 0.00 C ATOM 1614 C SER A 538 10.971 13.649 1.284 1.00 0.00 C ATOM 1615 O SER A 538 10.154 14.328 0.663 1.00 0.00 O ATOM 1616 CB SER A 538 12.709 13.051 -0.405 1.00 0.00 C ATOM 1617 OG SER A 538 13.559 14.012 0.158 1.00 0.00 O ATOM 0 H SER A 538 10.394 11.937 -0.920 1.00 0.00 H new ATOM 0 HA SER A 538 12.258 11.958 1.374 1.00 0.00 H new ATOM 0 HB2 SER A 538 13.304 12.230 -0.805 1.00 0.00 H new ATOM 0 HB3 SER A 538 12.169 13.491 -1.243 1.00 0.00 H new ATOM 0 HG SER A 538 14.330 13.567 0.568 1.00 0.00 H new ATOM 1623 N VAL A 539 11.259 13.857 2.564 1.00 0.00 N ATOM 1624 CA VAL A 539 10.716 14.995 3.296 1.00 0.00 C ATOM 1625 C VAL A 539 11.749 16.108 3.427 1.00 0.00 C ATOM 1626 O VAL A 539 12.867 15.880 3.889 1.00 0.00 O ATOM 1627 CB VAL A 539 10.236 14.586 4.702 1.00 0.00 C ATOM 1628 CG1 VAL A 539 9.730 15.800 5.465 1.00 0.00 C ATOM 1629 CG2 VAL A 539 9.149 13.527 4.605 1.00 0.00 C ATOM 0 H VAL A 539 11.866 13.252 3.117 1.00 0.00 H new ATOM 0 HA VAL A 539 9.863 15.359 2.723 1.00 0.00 H new ATOM 0 HB VAL A 539 11.081 14.164 5.247 1.00 0.00 H new ATOM 0 HG11 VAL A 539 9.395 15.493 6.456 1.00 0.00 H new ATOM 0 HG12 VAL A 539 10.534 16.529 5.564 1.00 0.00 H new ATOM 0 HG13 VAL A 539 8.898 16.249 4.923 1.00 0.00 H new ATOM 0 HG21 VAL A 539 8.821 13.249 5.607 1.00 0.00 H new ATOM 0 HG22 VAL A 539 8.303 13.924 4.043 1.00 0.00 H new ATOM 0 HG23 VAL A 539 9.542 12.648 4.095 1.00 0.00 H new ATOM 1639 N VAL A 540 11.366 17.313 3.019 1.00 0.00 N ATOM 1640 CA VAL A 540 12.287 18.446 3.008 1.00 0.00 C ATOM 1641 C VAL A 540 11.748 19.600 3.845 1.00 0.00 C ATOM 1642 O VAL A 540 10.550 19.677 4.116 1.00 0.00 O ATOM 1643 CB VAL A 540 12.551 18.943 1.574 1.00 0.00 C ATOM 1644 CG1 VAL A 540 13.227 17.859 0.750 1.00 0.00 C ATOM 1645 CG2 VAL A 540 11.252 19.381 0.914 1.00 0.00 C ATOM 0 H VAL A 540 10.425 17.531 2.692 1.00 0.00 H new ATOM 0 HA VAL A 540 13.225 18.096 3.439 1.00 0.00 H new ATOM 0 HB VAL A 540 13.219 19.803 1.626 1.00 0.00 H new ATOM 0 HG11 VAL A 540 13.406 18.228 -0.260 1.00 0.00 H new ATOM 0 HG12 VAL A 540 14.177 17.590 1.212 1.00 0.00 H new ATOM 0 HG13 VAL A 540 12.583 16.980 0.707 1.00 0.00 H new ATOM 0 HG21 VAL A 540 11.458 19.729 -0.098 1.00 0.00 H new ATOM 0 HG22 VAL A 540 10.562 18.538 0.875 1.00 0.00 H new ATOM 0 HG23 VAL A 540 10.805 20.190 1.492 1.00 0.00 H new ATOM 1655 N LEU A 541 12.642 20.494 4.252 1.00 0.00 N ATOM 1656 CA LEU A 541 12.259 21.651 5.052 1.00 0.00 C ATOM 1657 C LEU A 541 11.793 22.802 4.167 1.00 0.00 C ATOM 1658 O LEU A 541 11.436 23.870 4.661 1.00 0.00 O ATOM 1659 CB LEU A 541 13.430 22.098 5.934 1.00 0.00 C ATOM 1660 CG LEU A 541 13.902 21.064 6.965 1.00 0.00 C ATOM 1661 CD1 LEU A 541 15.158 21.561 7.668 1.00 0.00 C ATOM 1662 CD2 LEU A 541 12.790 20.805 7.971 1.00 0.00 C ATOM 0 H LEU A 541 13.638 20.439 4.041 1.00 0.00 H new ATOM 0 HA LEU A 541 11.426 21.359 5.692 1.00 0.00 H new ATOM 0 HB2 LEU A 541 14.271 22.356 5.291 1.00 0.00 H new ATOM 0 HB3 LEU A 541 13.141 23.007 6.461 1.00 0.00 H new ATOM 0 HG LEU A 541 14.142 20.130 6.457 1.00 0.00 H new ATOM 0 HD11 LEU A 541 15.484 20.820 8.397 1.00 0.00 H new ATOM 0 HD12 LEU A 541 15.948 21.719 6.933 1.00 0.00 H new ATOM 0 HD13 LEU A 541 14.942 22.500 8.177 1.00 0.00 H new ATOM 0 HD21 LEU A 541 13.126 20.071 8.703 1.00 0.00 H new ATOM 0 HD22 LEU A 541 12.536 21.735 8.480 1.00 0.00 H new ATOM 0 HD23 LEU A 541 11.911 20.424 7.451 1.00 0.00 H new