USER MOD reduce.3.24.130724 H: found=0, std=0, add=824, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 825 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= -0.478 X(o=-0.48,f=-0.021) USER MOD Set 1.2: A 534 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 472 SER OG : rot 180:sc= 0 USER MOD Set 2.2: A 474 LYS NZ :NH3+ -127:sc= 0.596 (180deg=0.32) USER MOD Set 2.3: A 522 THR OG1 : rot -29:sc= -1.62! USER MOD Single : A 441 THR OG1 : rot 62:sc= 0.484 USER MOD Single : A 445 LYS NZ :NH3+ -161:sc= 0.00898 (180deg=-0.118) USER MOD Single : A 453 ASN : amide:sc= -0.902 K(o=-0.9,f=-3.7!) USER MOD Single : A 454 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 458 TYR OH : rot -145:sc= 0.841 USER MOD Single : A 461 HIS : no HE2:sc= 0.618 K(o=1.1,f=-3.7!) USER MOD Single : A 463 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 464 ASN : amide:sc=-0.00197 K(o=-0.002,f=-8.4!) USER MOD Single : A 473 THR OG1 : rot 180:sc= 0 USER MOD Single : A 478 TYR OH : rot -130:sc= 0.708 USER MOD Single : A 480 ASN : amide:sc= 0.245 K(o=0.24,f=-5.9!) USER MOD Single : A 482 THR OG1 : rot 180:sc= 0 USER MOD Single : A 484 TYR OH : rot 180:sc= 0 USER MOD Single : A 485 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 486 ASN : amide:sc= -1.78 K(o=-1.8,f=0) USER MOD Single : A 488 THR OG1 : rot 180:sc= 0 USER MOD Single : A 490 SER OG : rot 180:sc= 0 USER MOD Single : A 494 LYS NZ :NH3+ 169:sc= -0.0146 (180deg=-0.153) 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 44:sc= 0.148 USER MOD Single : A 504 THR OG1 : rot 180:sc= 0 USER MOD Single : A 506 THR OG1 : rot 180:sc= 0 USER MOD Single : A 507 GLN : amide:sc= 0.309 K(o=0.31,f=-0.68) USER MOD Single : A 510 MET CE :methyl -115:sc= -0.134 (180deg=-1.3) USER MOD Single : A 511 TYR OH : rot 37:sc= 0.761 USER MOD Single : A 516 THR OG1 : rot 180:sc= -0.0652 USER MOD Single : A 521 ASN : amide:sc= 0.592 K(o=0.59,f=-0.018) USER MOD Single : A 527 ASN : amide:sc= -0.0497 K(o=-0.05,f=-3.4!) USER MOD Single : A 529 ASN : amide:sc= -0.898 K(o=-0.9,f=-0.26) USER MOD Single : A 530 ASN : amide:sc= -3.56! C(o=-3.6!,f=-3.9!) USER MOD Single : A 531 ASN : amide:sc= 0.142 X(o=0.14,f=0.081) USER MOD Single : A 538 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 35 N PHE A 437 -7.427 13.370 16.105 1.00 43.13 N ATOM 36 CA PHE A 437 -6.743 13.179 14.820 1.00 45.02 C ATOM 37 C PHE A 437 -6.353 11.704 14.624 1.00 4.30 C ATOM 38 O PHE A 437 -5.762 11.086 15.511 1.00 71.41 O ATOM 39 CB PHE A 437 -5.489 14.063 14.734 1.00 13.34 C ATOM 40 CG PHE A 437 -5.771 15.545 14.822 1.00 34.10 C ATOM 41 CD1 PHE A 437 -6.031 16.287 13.678 1.00 62.32 C ATOM 42 CD2 PHE A 437 -5.772 16.195 16.049 1.00 35.45 C ATOM 43 CE1 PHE A 437 -6.287 17.643 13.756 1.00 20.15 C ATOM 44 CE2 PHE A 437 -6.028 17.550 16.131 1.00 54.50 C ATOM 45 CZ PHE A 437 -6.286 18.276 14.984 1.00 75.30 C ATOM 0 HA PHE A 437 -7.434 13.469 14.028 1.00 45.02 H new ATOM 0 HB2 PHE A 437 -4.806 13.786 15.537 1.00 13.34 H new ATOM 0 HB3 PHE A 437 -4.976 13.857 13.795 1.00 13.34 H new ATOM 0 HD1 PHE A 437 -6.033 15.799 12.715 1.00 62.32 H new ATOM 0 HD2 PHE A 437 -5.570 15.635 16.950 1.00 35.45 H new ATOM 0 HE1 PHE A 437 -6.488 18.207 12.857 1.00 20.15 H new ATOM 0 HE2 PHE A 437 -6.026 18.042 17.092 1.00 54.50 H new ATOM 0 HZ PHE A 437 -6.486 19.335 15.047 1.00 75.30 H new ATOM 55 N PRO A 438 -6.690 11.115 13.462 1.00 45.45 N ATOM 56 CA PRO A 438 -6.350 9.716 13.157 1.00 41.24 C ATOM 57 C PRO A 438 -4.857 9.505 12.871 1.00 71.13 C ATOM 58 O PRO A 438 -4.082 10.452 12.802 1.00 71.24 O ATOM 59 CB PRO A 438 -7.181 9.424 11.903 1.00 52.54 C ATOM 60 CG PRO A 438 -7.338 10.751 11.242 1.00 72.32 C ATOM 61 CD PRO A 438 -7.432 11.758 12.358 1.00 64.42 C ATOM 0 HA PRO A 438 -6.561 9.058 14.000 1.00 41.24 H new ATOM 0 HB2 PRO A 438 -6.677 8.712 11.249 1.00 52.54 H new ATOM 0 HB3 PRO A 438 -8.148 8.991 12.159 1.00 52.54 H new ATOM 0 HG2 PRO A 438 -6.490 10.966 10.592 1.00 72.32 H new ATOM 0 HG3 PRO A 438 -8.232 10.774 10.619 1.00 72.32 H new ATOM 0 HD2 PRO A 438 -6.987 12.712 12.077 1.00 64.42 H new ATOM 0 HD3 PRO A 438 -8.468 11.958 12.633 1.00 64.42 H new ATOM 69 N ASP A 439 -4.465 8.248 12.718 1.00 34.11 N ATOM 70 CA ASP A 439 -3.094 7.905 12.344 1.00 12.24 C ATOM 71 C ASP A 439 -3.110 6.733 11.351 1.00 2.13 C ATOM 72 O ASP A 439 -3.070 5.568 11.741 1.00 64.35 O ATOM 73 CB ASP A 439 -2.271 7.564 13.596 1.00 3.42 C ATOM 74 CG ASP A 439 -0.794 7.368 13.301 1.00 41.41 C ATOM 75 OD1 ASP A 439 -0.094 8.371 13.045 1.00 70.44 O ATOM 76 OD2 ASP A 439 -0.320 6.212 13.326 1.00 14.40 O ATOM 0 H ASP A 439 -5.078 7.443 12.847 1.00 34.11 H new ATOM 0 HA ASP A 439 -2.623 8.761 11.860 1.00 12.24 H new ATOM 0 HB2 ASP A 439 -2.387 8.363 14.328 1.00 3.42 H new ATOM 0 HB3 ASP A 439 -2.669 6.656 14.049 1.00 3.42 H new ATOM 81 N LEU A 440 -3.226 7.056 10.068 1.00 32.14 N ATOM 82 CA LEU A 440 -3.356 6.039 9.021 1.00 24.35 C ATOM 83 C LEU A 440 -1.984 5.622 8.473 1.00 75.44 C ATOM 84 O LEU A 440 -1.113 6.462 8.255 1.00 71.42 O ATOM 85 CB LEU A 440 -4.234 6.574 7.879 1.00 32.23 C ATOM 86 CG LEU A 440 -5.655 7.016 8.283 1.00 44.54 C ATOM 87 CD1 LEU A 440 -6.387 7.640 7.095 1.00 72.20 C ATOM 88 CD2 LEU A 440 -6.448 5.836 8.846 1.00 14.10 C ATOM 0 H LEU A 440 -3.233 8.016 9.723 1.00 32.14 H new ATOM 0 HA LEU A 440 -3.825 5.159 9.461 1.00 24.35 H new ATOM 0 HB2 LEU A 440 -3.726 7.422 7.420 1.00 32.23 H new ATOM 0 HB3 LEU A 440 -4.317 5.801 7.115 1.00 32.23 H new ATOM 0 HG LEU A 440 -5.567 7.772 9.063 1.00 44.54 H new ATOM 0 HD11 LEU A 440 -7.387 7.944 7.403 1.00 72.20 H new ATOM 0 HD12 LEU A 440 -5.834 8.512 6.744 1.00 72.20 H new ATOM 0 HD13 LEU A 440 -6.462 6.910 6.289 1.00 72.20 H new ATOM 0 HD21 LEU A 440 -7.448 6.169 9.125 1.00 14.10 H new ATOM 0 HD22 LEU A 440 -6.524 5.055 8.090 1.00 14.10 H new ATOM 0 HD23 LEU A 440 -5.939 5.442 9.725 1.00 14.10 H new ATOM 100 N THR A 441 -1.795 4.321 8.257 1.00 24.13 N ATOM 101 CA THR A 441 -0.538 3.810 7.694 1.00 33.12 C ATOM 102 C THR A 441 -0.757 2.550 6.850 1.00 50.14 C ATOM 103 O THR A 441 -1.816 1.916 6.913 1.00 61.43 O ATOM 104 CB THR A 441 0.507 3.504 8.794 1.00 51.24 C ATOM 105 OG1 THR A 441 1.756 3.119 8.201 1.00 41.31 O ATOM 106 CG2 THR A 441 0.025 2.405 9.733 1.00 64.22 C ATOM 0 H THR A 441 -2.489 3.602 8.461 1.00 24.13 H new ATOM 0 HA THR A 441 -0.156 4.604 7.052 1.00 33.12 H new ATOM 0 HB THR A 441 0.646 4.414 9.377 1.00 51.24 H new ATOM 0 HG1 THR A 441 2.104 3.859 7.661 1.00 41.31 H new ATOM 0 HG21 THR A 441 0.784 2.217 10.492 1.00 64.22 H new ATOM 0 HG22 THR A 441 -0.901 2.719 10.215 1.00 64.22 H new ATOM 0 HG23 THR A 441 -0.153 1.493 9.164 1.00 64.22 H new ATOM 114 N VAL A 442 0.256 2.196 6.063 1.00 24.34 N ATOM 115 CA VAL A 442 0.199 1.028 5.175 1.00 21.03 C ATOM 116 C VAL A 442 1.475 0.177 5.278 1.00 11.30 C ATOM 117 O VAL A 442 2.562 0.690 5.544 1.00 62.42 O ATOM 118 CB VAL A 442 -0.003 1.454 3.695 1.00 35.53 C ATOM 119 CG1 VAL A 442 -1.350 2.140 3.509 1.00 41.22 C ATOM 120 CG2 VAL A 442 1.131 2.368 3.238 1.00 74.13 C ATOM 0 H VAL A 442 1.138 2.706 6.020 1.00 24.34 H new ATOM 0 HA VAL A 442 -0.654 0.432 5.499 1.00 21.03 H new ATOM 0 HB VAL A 442 0.010 0.555 3.079 1.00 35.53 H new ATOM 0 HG11 VAL A 442 -1.470 2.430 2.465 1.00 41.22 H new ATOM 0 HG12 VAL A 442 -2.149 1.454 3.789 1.00 41.22 H new ATOM 0 HG13 VAL A 442 -1.396 3.028 4.139 1.00 41.22 H new ATOM 0 HG21 VAL A 442 0.971 2.655 2.199 1.00 74.13 H new ATOM 0 HG22 VAL A 442 1.152 3.261 3.862 1.00 74.13 H new ATOM 0 HG23 VAL A 442 2.081 1.841 3.326 1.00 74.13 H new ATOM 130 N GLU A 443 1.329 -1.128 5.072 1.00 23.05 N ATOM 131 CA GLU A 443 2.469 -2.057 5.065 1.00 44.34 C ATOM 132 C GLU A 443 2.442 -2.970 3.836 1.00 32.13 C ATOM 133 O GLU A 443 1.422 -3.591 3.536 1.00 72.11 O ATOM 134 CB GLU A 443 2.476 -2.907 6.347 1.00 5.04 C ATOM 135 CG GLU A 443 3.129 -2.217 7.539 1.00 25.53 C ATOM 136 CD GLU A 443 4.649 -2.321 7.525 1.00 64.43 C ATOM 137 OE1 GLU A 443 5.313 -1.436 6.947 1.00 11.20 O ATOM 138 OE2 GLU A 443 5.186 -3.288 8.110 1.00 14.13 O ATOM 0 H GLU A 443 0.427 -1.575 4.906 1.00 23.05 H new ATOM 0 HA GLU A 443 3.380 -1.460 5.024 1.00 44.34 H new ATOM 0 HB2 GLU A 443 1.449 -3.165 6.606 1.00 5.04 H new ATOM 0 HB3 GLU A 443 3.000 -3.842 6.149 1.00 5.04 H new ATOM 0 HG2 GLU A 443 2.842 -1.166 7.546 1.00 25.53 H new ATOM 0 HG3 GLU A 443 2.748 -2.657 8.461 1.00 25.53 H new ATOM 145 N ILE A 444 3.570 -3.045 3.136 1.00 50.23 N ATOM 146 CA ILE A 444 3.698 -3.905 1.952 1.00 54.44 C ATOM 147 C ILE A 444 4.587 -5.114 2.258 1.00 2.24 C ATOM 148 O ILE A 444 5.766 -4.964 2.581 1.00 40.32 O ATOM 149 CB ILE A 444 4.298 -3.142 0.740 1.00 43.31 C ATOM 150 CG1 ILE A 444 3.519 -1.844 0.474 1.00 33.33 C ATOM 151 CG2 ILE A 444 4.303 -4.032 -0.508 1.00 33.50 C ATOM 152 CD1 ILE A 444 4.105 -1.007 -0.645 1.00 1.14 C ATOM 0 H ILE A 444 4.414 -2.521 3.365 1.00 50.23 H new ATOM 0 HA ILE A 444 2.691 -4.234 1.694 1.00 54.44 H new ATOM 0 HB ILE A 444 5.328 -2.879 0.979 1.00 43.31 H new ATOM 0 HG12 ILE A 444 2.487 -2.093 0.229 1.00 33.33 H new ATOM 0 HG13 ILE A 444 3.495 -1.250 1.388 1.00 33.33 H new ATOM 0 HG21 ILE A 444 4.727 -3.480 -1.347 1.00 33.50 H new ATOM 0 HG22 ILE A 444 4.904 -4.921 -0.318 1.00 33.50 H new ATOM 0 HG23 ILE A 444 3.282 -4.328 -0.748 1.00 33.50 H new ATOM 0 HD11 ILE A 444 3.505 -0.106 -0.778 1.00 1.14 H new ATOM 0 HD12 ILE A 444 5.128 -0.728 -0.393 1.00 1.14 H new ATOM 0 HD13 ILE A 444 4.104 -1.584 -1.570 1.00 1.14 H new ATOM 164 N LYS A 445 4.014 -6.309 2.162 1.00 2.11 N ATOM 165 CA LYS A 445 4.747 -7.546 2.449 1.00 41.12 C ATOM 166 C LYS A 445 4.466 -8.632 1.396 1.00 3.20 C ATOM 167 O LYS A 445 3.326 -8.811 0.958 1.00 74.14 O ATOM 168 CB LYS A 445 4.389 -8.040 3.860 1.00 12.12 C ATOM 169 CG LYS A 445 5.122 -7.284 4.969 1.00 43.33 C ATOM 170 CD LYS A 445 4.565 -7.601 6.355 1.00 24.33 C ATOM 171 CE LYS A 445 5.503 -7.132 7.469 1.00 12.43 C ATOM 172 NZ LYS A 445 5.893 -5.702 7.328 1.00 75.22 N ATOM 0 H LYS A 445 3.042 -6.452 1.887 1.00 2.11 H new ATOM 0 HA LYS A 445 5.815 -7.332 2.405 1.00 41.12 H new ATOM 0 HB2 LYS A 445 3.314 -7.940 4.011 1.00 12.12 H new ATOM 0 HB3 LYS A 445 4.624 -9.102 3.936 1.00 12.12 H new ATOM 0 HG2 LYS A 445 6.182 -7.538 4.939 1.00 43.33 H new ATOM 0 HG3 LYS A 445 5.046 -6.212 4.786 1.00 43.33 H new ATOM 0 HD2 LYS A 445 3.593 -7.122 6.474 1.00 24.33 H new ATOM 0 HD3 LYS A 445 4.404 -8.675 6.444 1.00 24.33 H new ATOM 0 HE2 LYS A 445 5.017 -7.278 8.433 1.00 12.43 H new ATOM 0 HE3 LYS A 445 6.400 -7.751 7.467 1.00 12.43 H new ATOM 0 HZ1 LYS A 445 6.750 -5.519 7.887 1.00 75.22 H new ATOM 0 HZ2 LYS A 445 6.081 -5.490 6.327 1.00 75.22 H new ATOM 0 HZ3 LYS A 445 5.120 -5.096 7.671 1.00 75.22 H new ATOM 186 N GLY A 446 5.516 -9.358 1.007 1.00 23.12 N ATOM 187 CA GLY A 446 5.401 -10.381 -0.031 1.00 42.42 C ATOM 188 C GLY A 446 6.758 -10.824 -0.583 1.00 4.55 C ATOM 189 O GLY A 446 7.796 -10.576 0.039 1.00 53.41 O ATOM 0 H GLY A 446 6.454 -9.256 1.395 1.00 23.12 H new ATOM 0 HA2 GLY A 446 4.880 -11.247 0.376 1.00 42.42 H new ATOM 0 HA3 GLY A 446 4.790 -9.996 -0.848 1.00 42.42 H new ATOM 193 N PRO A 447 6.786 -11.490 -1.754 1.00 23.55 N ATOM 194 CA PRO A 447 8.041 -11.953 -2.381 1.00 11.44 C ATOM 195 C PRO A 447 8.871 -10.804 -2.990 1.00 31.20 C ATOM 196 O PRO A 447 8.421 -10.112 -3.904 1.00 12.32 O ATOM 197 CB PRO A 447 7.549 -12.910 -3.476 1.00 40.21 C ATOM 198 CG PRO A 447 6.188 -12.407 -3.831 1.00 64.14 C ATOM 199 CD PRO A 447 5.599 -11.857 -2.555 1.00 53.43 C ATOM 0 HA PRO A 447 8.711 -12.414 -1.656 1.00 11.44 H new ATOM 0 HB2 PRO A 447 8.214 -12.899 -4.340 1.00 40.21 H new ATOM 0 HB3 PRO A 447 7.510 -13.938 -3.116 1.00 40.21 H new ATOM 0 HG2 PRO A 447 6.246 -11.635 -4.598 1.00 64.14 H new ATOM 0 HG3 PRO A 447 5.568 -13.209 -4.232 1.00 64.14 H new ATOM 0 HD2 PRO A 447 4.962 -10.993 -2.747 1.00 53.43 H new ATOM 0 HD3 PRO A 447 4.985 -12.599 -2.045 1.00 53.43 H new ATOM 207 N ASP A 448 10.090 -10.614 -2.485 1.00 64.51 N ATOM 208 CA ASP A 448 10.969 -9.527 -2.946 1.00 23.31 C ATOM 209 C ASP A 448 11.808 -9.934 -4.176 1.00 54.10 C ATOM 210 O ASP A 448 12.396 -9.085 -4.846 1.00 51.33 O ATOM 211 CB ASP A 448 11.879 -9.069 -1.797 1.00 32.25 C ATOM 212 CG ASP A 448 12.703 -10.206 -1.215 1.00 12.25 C ATOM 213 OD1 ASP A 448 12.109 -11.124 -0.612 1.00 24.51 O ATOM 214 OD2 ASP A 448 13.943 -10.189 -1.363 1.00 51.54 O ATOM 0 H ASP A 448 10.497 -11.198 -1.754 1.00 64.51 H new ATOM 0 HA ASP A 448 10.334 -8.698 -3.258 1.00 23.31 H new ATOM 0 HB2 ASP A 448 12.548 -8.288 -2.158 1.00 32.25 H new ATOM 0 HB3 ASP A 448 11.269 -8.627 -1.009 1.00 32.25 H new ATOM 219 N VAL A 449 11.864 -11.234 -4.470 1.00 43.24 N ATOM 220 CA VAL A 449 12.575 -11.737 -5.658 1.00 60.45 C ATOM 221 C VAL A 449 11.670 -12.672 -6.478 1.00 42.42 C ATOM 222 O VAL A 449 11.243 -13.719 -5.990 1.00 61.41 O ATOM 223 CB VAL A 449 13.880 -12.490 -5.274 1.00 35.31 C ATOM 224 CG1 VAL A 449 14.599 -13.008 -6.521 1.00 20.14 C ATOM 225 CG2 VAL A 449 14.805 -11.592 -4.450 1.00 61.10 C ATOM 0 H VAL A 449 11.427 -11.962 -3.905 1.00 43.24 H new ATOM 0 HA VAL A 449 12.843 -10.869 -6.260 1.00 60.45 H new ATOM 0 HB VAL A 449 13.604 -13.348 -4.661 1.00 35.31 H new ATOM 0 HG11 VAL A 449 15.509 -13.531 -6.226 1.00 20.14 H new ATOM 0 HG12 VAL A 449 13.945 -13.694 -7.060 1.00 20.14 H new ATOM 0 HG13 VAL A 449 14.856 -12.169 -7.167 1.00 20.14 H new ATOM 0 HG21 VAL A 449 15.711 -12.141 -4.193 1.00 61.10 H new ATOM 0 HG22 VAL A 449 15.068 -10.709 -5.032 1.00 61.10 H new ATOM 0 HG23 VAL A 449 14.295 -11.286 -3.536 1.00 61.10 H new ATOM 235 N VAL A 450 11.379 -12.289 -7.725 1.00 45.20 N ATOM 236 CA VAL A 450 10.473 -13.062 -8.589 1.00 31.05 C ATOM 237 C VAL A 450 11.041 -13.248 -10.008 1.00 41.41 C ATOM 238 O VAL A 450 11.986 -12.567 -10.413 1.00 52.42 O ATOM 239 CB VAL A 450 9.074 -12.395 -8.690 1.00 33.11 C ATOM 240 CG1 VAL A 450 8.398 -12.336 -7.320 1.00 12.42 C ATOM 241 CG2 VAL A 450 9.179 -10.996 -9.302 1.00 54.34 C ATOM 0 H VAL A 450 11.757 -11.448 -8.162 1.00 45.20 H new ATOM 0 HA VAL A 450 10.374 -14.041 -8.120 1.00 31.05 H new ATOM 0 HB VAL A 450 8.457 -13.008 -9.347 1.00 33.11 H new ATOM 0 HG11 VAL A 450 7.420 -11.865 -7.417 1.00 12.42 H new ATOM 0 HG12 VAL A 450 8.277 -13.347 -6.930 1.00 12.42 H new ATOM 0 HG13 VAL A 450 9.015 -11.754 -6.635 1.00 12.42 H new ATOM 0 HG21 VAL A 450 8.186 -10.550 -9.362 1.00 54.34 H new ATOM 0 HG22 VAL A 450 9.820 -10.373 -8.678 1.00 54.34 H new ATOM 0 HG23 VAL A 450 9.606 -11.068 -10.302 1.00 54.34 H new ATOM 251 N GLY A 451 10.466 -14.189 -10.752 1.00 13.40 N ATOM 252 CA GLY A 451 10.881 -14.426 -12.132 1.00 41.44 C ATOM 253 C GLY A 451 9.998 -13.710 -13.152 1.00 34.21 C ATOM 254 O GLY A 451 8.887 -13.278 -12.836 1.00 44.41 O ATOM 0 H GLY A 451 9.715 -14.797 -10.425 1.00 13.40 H new ATOM 0 HA2 GLY A 451 11.912 -14.096 -12.257 1.00 41.44 H new ATOM 0 HA3 GLY A 451 10.863 -15.497 -12.332 1.00 41.44 H new ATOM 258 N VAL A 452 10.490 -13.590 -14.380 1.00 44.40 N ATOM 259 CA VAL A 452 9.746 -12.925 -15.452 1.00 4.23 C ATOM 260 C VAL A 452 8.549 -13.783 -15.917 1.00 41.33 C ATOM 261 O VAL A 452 8.644 -15.009 -15.999 1.00 12.32 O ATOM 262 CB VAL A 452 10.679 -12.602 -16.653 1.00 35.34 C ATOM 263 CG1 VAL A 452 11.135 -13.876 -17.363 1.00 75.44 C ATOM 264 CG2 VAL A 452 10.014 -11.634 -17.630 1.00 12.42 C ATOM 0 H VAL A 452 11.404 -13.945 -14.662 1.00 44.40 H new ATOM 0 HA VAL A 452 9.357 -11.988 -15.053 1.00 4.23 H new ATOM 0 HB VAL A 452 11.566 -12.111 -16.254 1.00 35.34 H new ATOM 0 HG11 VAL A 452 11.786 -13.614 -18.197 1.00 75.44 H new ATOM 0 HG12 VAL A 452 11.680 -14.508 -16.662 1.00 75.44 H new ATOM 0 HG13 VAL A 452 10.265 -14.416 -17.737 1.00 75.44 H new ATOM 0 HG21 VAL A 452 10.693 -11.429 -18.458 1.00 12.42 H new ATOM 0 HG22 VAL A 452 9.096 -12.079 -18.015 1.00 12.42 H new ATOM 0 HG23 VAL A 452 9.778 -10.703 -17.115 1.00 12.42 H new ATOM 274 N ASN A 453 7.418 -13.128 -16.186 1.00 71.45 N ATOM 275 CA ASN A 453 6.187 -13.806 -16.623 1.00 51.44 C ATOM 276 C ASN A 453 5.594 -14.721 -15.533 1.00 21.31 C ATOM 277 O ASN A 453 4.755 -15.580 -15.821 1.00 3.43 O ATOM 278 CB ASN A 453 6.440 -14.603 -17.909 1.00 34.42 C ATOM 279 CG ASN A 453 6.769 -13.705 -19.086 1.00 32.11 C ATOM 280 OD1 ASN A 453 6.277 -12.586 -19.188 1.00 1.32 O ATOM 281 ND2 ASN A 453 7.592 -14.187 -19.987 1.00 52.31 N ATOM 0 H ASN A 453 7.325 -12.115 -16.109 1.00 71.45 H new ATOM 0 HA ASN A 453 5.451 -13.027 -16.821 1.00 51.44 H new ATOM 0 HB2 ASN A 453 7.262 -15.301 -17.746 1.00 34.42 H new ATOM 0 HB3 ASN A 453 5.558 -15.199 -18.144 1.00 34.42 H new ATOM 0 HD21 ASN A 453 7.840 -13.627 -20.803 1.00 52.31 H new ATOM 0 HD22 ASN A 453 7.984 -15.122 -19.872 1.00 52.31 H new ATOM 288 N LYS A 454 6.014 -14.525 -14.283 1.00 55.11 N ATOM 289 CA LYS A 454 5.472 -15.292 -13.150 1.00 24.01 C ATOM 290 C LYS A 454 4.384 -14.500 -12.403 1.00 72.13 C ATOM 291 O LYS A 454 4.108 -13.348 -12.728 1.00 63.32 O ATOM 292 CB LYS A 454 6.593 -15.683 -12.176 1.00 1.43 C ATOM 293 CG LYS A 454 7.703 -16.523 -12.807 1.00 44.12 C ATOM 294 CD LYS A 454 7.172 -17.791 -13.476 1.00 12.24 C ATOM 295 CE LYS A 454 6.385 -18.671 -12.511 1.00 25.53 C ATOM 296 NZ LYS A 454 5.960 -19.945 -13.147 1.00 70.51 N ATOM 0 H LYS A 454 6.727 -13.843 -14.025 1.00 55.11 H new ATOM 0 HA LYS A 454 5.019 -16.197 -13.555 1.00 24.01 H new ATOM 0 HB2 LYS A 454 7.031 -14.776 -11.760 1.00 1.43 H new ATOM 0 HB3 LYS A 454 6.160 -16.239 -11.344 1.00 1.43 H new ATOM 0 HG2 LYS A 454 8.233 -15.922 -13.545 1.00 44.12 H new ATOM 0 HG3 LYS A 454 8.427 -16.797 -12.040 1.00 44.12 H new ATOM 0 HD2 LYS A 454 6.534 -17.516 -14.315 1.00 12.24 H new ATOM 0 HD3 LYS A 454 8.007 -18.360 -13.884 1.00 12.24 H new ATOM 0 HE2 LYS A 454 6.997 -18.888 -11.636 1.00 25.53 H new ATOM 0 HE3 LYS A 454 5.507 -18.130 -12.159 1.00 25.53 H new ATOM 0 HZ1 LYS A 454 5.428 -20.516 -12.459 1.00 70.51 H new ATOM 0 HZ2 LYS A 454 5.355 -19.739 -13.967 1.00 70.51 H new ATOM 0 HZ3 LYS A 454 6.799 -20.474 -13.460 1.00 70.51 H new ATOM 310 N LEU A 455 3.766 -15.126 -11.402 1.00 33.13 N ATOM 311 CA LEU A 455 2.713 -14.478 -10.609 1.00 52.24 C ATOM 312 C LEU A 455 3.146 -14.299 -9.144 1.00 40.41 C ATOM 313 O LEU A 455 3.610 -15.242 -8.506 1.00 1.30 O ATOM 314 CB LEU A 455 1.424 -15.310 -10.673 1.00 42.43 C ATOM 315 CG LEU A 455 0.192 -14.662 -10.018 1.00 44.11 C ATOM 316 CD1 LEU A 455 -0.169 -13.361 -10.731 1.00 31.41 C ATOM 317 CD2 LEU A 455 -0.995 -15.627 -10.015 1.00 54.33 C ATOM 0 H LEU A 455 3.974 -16.083 -11.118 1.00 33.13 H new ATOM 0 HA LEU A 455 2.532 -13.490 -11.032 1.00 52.24 H new ATOM 0 HB2 LEU A 455 1.194 -15.514 -11.719 1.00 42.43 H new ATOM 0 HB3 LEU A 455 1.607 -16.271 -10.193 1.00 42.43 H new ATOM 0 HG LEU A 455 0.438 -14.429 -8.982 1.00 44.11 H new ATOM 0 HD11 LEU A 455 -1.043 -12.916 -10.255 1.00 31.41 H new ATOM 0 HD12 LEU A 455 0.670 -12.668 -10.670 1.00 31.41 H new ATOM 0 HD13 LEU A 455 -0.393 -13.569 -11.777 1.00 31.41 H new ATOM 0 HD21 LEU A 455 -1.854 -15.146 -9.547 1.00 54.33 H new ATOM 0 HD22 LEU A 455 -1.246 -15.899 -11.040 1.00 54.33 H new ATOM 0 HD23 LEU A 455 -0.733 -16.525 -9.456 1.00 54.33 H new ATOM 329 N ALA A 456 2.988 -13.085 -8.619 1.00 73.22 N ATOM 330 CA ALA A 456 3.361 -12.785 -7.230 1.00 34.32 C ATOM 331 C ALA A 456 2.227 -12.071 -6.473 1.00 12.21 C ATOM 332 O ALA A 456 1.619 -11.132 -6.989 1.00 41.21 O ATOM 333 CB ALA A 456 4.630 -11.942 -7.207 1.00 70.35 C ATOM 0 H ALA A 456 2.605 -12.291 -9.131 1.00 73.22 H new ATOM 0 HA ALA A 456 3.545 -13.731 -6.720 1.00 34.32 H new ATOM 0 HB1 ALA A 456 4.902 -11.722 -6.175 1.00 70.35 H new ATOM 0 HB2 ALA A 456 5.440 -12.491 -7.687 1.00 70.35 H new ATOM 0 HB3 ALA A 456 4.457 -11.009 -7.743 1.00 70.35 H new ATOM 339 N GLU A 457 1.948 -12.522 -5.248 1.00 1.22 N ATOM 340 CA GLU A 457 0.909 -11.910 -4.403 1.00 72.31 C ATOM 341 C GLU A 457 1.513 -11.084 -3.260 1.00 54.52 C ATOM 342 O GLU A 457 2.345 -11.572 -2.492 1.00 42.42 O ATOM 343 CB GLU A 457 -0.022 -12.985 -3.819 1.00 31.40 C ATOM 344 CG GLU A 457 -1.041 -13.521 -4.816 1.00 54.04 C ATOM 345 CD GLU A 457 -1.860 -14.675 -4.263 1.00 60.15 C ATOM 346 OE1 GLU A 457 -1.302 -15.778 -4.088 1.00 5.02 O ATOM 347 OE2 GLU A 457 -3.076 -14.491 -4.020 1.00 24.42 O ATOM 0 H GLU A 457 2.427 -13.311 -4.814 1.00 1.22 H new ATOM 0 HA GLU A 457 0.335 -11.240 -5.043 1.00 72.31 H new ATOM 0 HB2 GLU A 457 0.582 -13.814 -3.449 1.00 31.40 H new ATOM 0 HB3 GLU A 457 -0.550 -12.568 -2.962 1.00 31.40 H new ATOM 0 HG2 GLU A 457 -1.712 -12.714 -5.111 1.00 54.04 H new ATOM 0 HG3 GLU A 457 -0.522 -13.849 -5.717 1.00 54.04 H new ATOM 354 N TYR A 458 1.062 -9.840 -3.140 1.00 14.44 N ATOM 355 CA TYR A 458 1.510 -8.938 -2.072 1.00 31.43 C ATOM 356 C TYR A 458 0.313 -8.461 -1.243 1.00 40.03 C ATOM 357 O TYR A 458 -0.818 -8.419 -1.737 1.00 3.23 O ATOM 358 CB TYR A 458 2.232 -7.717 -2.662 1.00 14.50 C ATOM 359 CG TYR A 458 3.443 -8.052 -3.514 1.00 41.21 C ATOM 360 CD1 TYR A 458 3.298 -8.441 -4.843 1.00 21.35 C ATOM 361 CD2 TYR A 458 4.731 -7.971 -2.994 1.00 55.24 C ATOM 362 CE1 TYR A 458 4.396 -8.742 -5.623 1.00 75.31 C ATOM 363 CE2 TYR A 458 5.834 -8.269 -3.770 1.00 62.12 C ATOM 364 CZ TYR A 458 5.662 -8.655 -5.084 1.00 1.21 C ATOM 365 OH TYR A 458 6.757 -8.952 -5.861 1.00 11.45 O ATOM 0 H TYR A 458 0.379 -9.425 -3.774 1.00 14.44 H new ATOM 0 HA TYR A 458 2.200 -9.489 -1.433 1.00 31.43 H new ATOM 0 HB2 TYR A 458 1.524 -7.149 -3.266 1.00 14.50 H new ATOM 0 HB3 TYR A 458 2.547 -7.067 -1.845 1.00 14.50 H new ATOM 0 HD1 TYR A 458 2.309 -8.508 -5.271 1.00 21.35 H new ATOM 0 HD2 TYR A 458 4.871 -7.670 -1.966 1.00 55.24 H new ATOM 0 HE1 TYR A 458 4.264 -9.044 -6.651 1.00 75.31 H new ATOM 0 HE2 TYR A 458 6.827 -8.200 -3.350 1.00 62.12 H new ATOM 0 HH TYR A 458 7.447 -9.374 -5.307 1.00 11.45 H new ATOM 375 N GLU A 459 0.560 -8.087 0.011 1.00 50.32 N ATOM 376 CA GLU A 459 -0.510 -7.607 0.891 1.00 20.54 C ATOM 377 C GLU A 459 -0.244 -6.182 1.376 1.00 31.55 C ATOM 378 O GLU A 459 0.827 -5.884 1.907 1.00 44.34 O ATOM 379 CB GLU A 459 -0.664 -8.508 2.123 1.00 3.24 C ATOM 380 CG GLU A 459 -0.970 -9.967 1.817 1.00 43.23 C ATOM 381 CD GLU A 459 -1.432 -10.728 3.051 1.00 74.32 C ATOM 382 OE1 GLU A 459 -0.879 -10.484 4.148 1.00 0.55 O ATOM 383 OE2 GLU A 459 -2.345 -11.573 2.928 1.00 54.25 O ATOM 0 H GLU A 459 1.485 -8.106 0.441 1.00 50.32 H new ATOM 0 HA GLU A 459 -1.425 -7.627 0.299 1.00 20.54 H new ATOM 0 HB2 GLU A 459 0.255 -8.460 2.707 1.00 3.24 H new ATOM 0 HB3 GLU A 459 -1.461 -8.109 2.750 1.00 3.24 H new ATOM 0 HG2 GLU A 459 -1.741 -10.021 1.049 1.00 43.23 H new ATOM 0 HG3 GLU A 459 -0.080 -10.446 1.409 1.00 43.23 H new ATOM 390 N VAL A 460 -1.229 -5.311 1.192 1.00 1.34 N ATOM 391 CA VAL A 460 -1.211 -3.982 1.793 1.00 30.12 C ATOM 392 C VAL A 460 -2.027 -3.992 3.091 1.00 43.43 C ATOM 393 O VAL A 460 -3.247 -4.162 3.071 1.00 30.42 O ATOM 394 CB VAL A 460 -1.800 -2.913 0.836 1.00 33.20 C ATOM 395 CG1 VAL A 460 -1.615 -1.508 1.410 1.00 64.20 C ATOM 396 CG2 VAL A 460 -1.178 -3.020 -0.554 1.00 32.01 C ATOM 0 H VAL A 460 -2.056 -5.503 0.627 1.00 1.34 H new ATOM 0 HA VAL A 460 -0.172 -3.725 1.998 1.00 30.12 H new ATOM 0 HB VAL A 460 -2.869 -3.101 0.740 1.00 33.20 H new ATOM 0 HG11 VAL A 460 -2.036 -0.775 0.721 1.00 64.20 H new ATOM 0 HG12 VAL A 460 -2.125 -1.437 2.371 1.00 64.20 H new ATOM 0 HG13 VAL A 460 -0.552 -1.308 1.548 1.00 64.20 H new ATOM 0 HG21 VAL A 460 -1.609 -2.259 -1.205 1.00 32.01 H new ATOM 0 HG22 VAL A 460 -0.101 -2.869 -0.483 1.00 32.01 H new ATOM 0 HG23 VAL A 460 -1.380 -4.008 -0.968 1.00 32.01 H new ATOM 406 N HIS A 461 -1.353 -3.822 4.221 1.00 3.21 N ATOM 407 CA HIS A 461 -2.028 -3.773 5.519 1.00 4.15 C ATOM 408 C HIS A 461 -2.326 -2.323 5.911 1.00 10.32 C ATOM 409 O HIS A 461 -1.418 -1.556 6.226 1.00 53.22 O ATOM 410 CB HIS A 461 -1.183 -4.469 6.599 1.00 41.10 C ATOM 411 CG HIS A 461 -1.130 -5.963 6.449 1.00 64.54 C ATOM 412 ND1 HIS A 461 -1.726 -6.826 7.343 1.00 72.12 N ATOM 413 CD2 HIS A 461 -0.553 -6.749 5.505 1.00 25.00 C ATOM 414 CE1 HIS A 461 -1.519 -8.070 6.959 1.00 55.50 C ATOM 415 NE2 HIS A 461 -0.813 -8.055 5.847 1.00 31.32 N ATOM 0 H HIS A 461 -0.340 -3.715 4.269 1.00 3.21 H new ATOM 0 HA HIS A 461 -2.974 -4.307 5.436 1.00 4.15 H new ATOM 0 HB2 HIS A 461 -0.168 -4.072 6.566 1.00 41.10 H new ATOM 0 HB3 HIS A 461 -1.589 -4.225 7.580 1.00 41.10 H new ATOM 0 HD1 HIS A 461 -2.247 -6.545 8.174 1.00 72.12 H new ATOM 0 HD2 HIS A 461 0.006 -6.411 4.645 1.00 25.00 H new ATOM 0 HE1 HIS A 461 -1.870 -8.954 7.471 1.00 55.50 H new ATOM 424 N VAL A 462 -3.604 -1.959 5.872 1.00 41.34 N ATOM 425 CA VAL A 462 -4.033 -0.588 6.142 1.00 24.33 C ATOM 426 C VAL A 462 -4.694 -0.506 7.520 1.00 2.53 C ATOM 427 O VAL A 462 -5.602 -1.273 7.837 1.00 63.34 O ATOM 428 CB VAL A 462 -5.002 -0.072 5.043 1.00 5.13 C ATOM 429 CG1 VAL A 462 -4.371 -0.240 3.663 1.00 21.30 C ATOM 430 CG2 VAL A 462 -6.359 -0.781 5.097 1.00 24.34 C ATOM 0 H VAL A 462 -4.367 -2.599 5.654 1.00 41.34 H new ATOM 0 HA VAL A 462 -3.150 0.051 6.133 1.00 24.33 H new ATOM 0 HB VAL A 462 -5.179 0.987 5.232 1.00 5.13 H new ATOM 0 HG11 VAL A 462 -5.060 0.125 2.901 1.00 21.30 H new ATOM 0 HG12 VAL A 462 -3.443 0.329 3.616 1.00 21.30 H new ATOM 0 HG13 VAL A 462 -4.160 -1.294 3.486 1.00 21.30 H new ATOM 0 HG21 VAL A 462 -7.005 -0.390 4.311 1.00 24.34 H new ATOM 0 HG22 VAL A 462 -6.216 -1.852 4.950 1.00 24.34 H new ATOM 0 HG23 VAL A 462 -6.822 -0.607 6.068 1.00 24.34 H new ATOM 440 N LYS A 463 -4.218 0.407 8.351 1.00 73.10 N ATOM 441 CA LYS A 463 -4.689 0.493 9.734 1.00 74.51 C ATOM 442 C LYS A 463 -4.773 1.936 10.244 1.00 32.23 C ATOM 443 O LYS A 463 -4.002 2.808 9.833 1.00 14.41 O ATOM 444 CB LYS A 463 -3.775 -0.329 10.649 1.00 13.33 C ATOM 445 CG LYS A 463 -2.290 -0.113 10.386 1.00 55.23 C ATOM 446 CD LYS A 463 -1.435 -0.587 11.555 1.00 13.33 C ATOM 447 CE LYS A 463 -1.539 -2.092 11.758 1.00 24.11 C ATOM 448 NZ LYS A 463 -0.729 -2.558 12.915 1.00 53.51 N ATOM 0 H LYS A 463 -3.510 1.097 8.100 1.00 73.10 H new ATOM 0 HA LYS A 463 -5.701 0.087 9.752 1.00 74.51 H new ATOM 0 HB2 LYS A 463 -3.992 -0.076 11.687 1.00 13.33 H new ATOM 0 HB3 LYS A 463 -4.007 -1.387 10.524 1.00 13.33 H new ATOM 0 HG2 LYS A 463 -1.999 -0.648 9.482 1.00 55.23 H new ATOM 0 HG3 LYS A 463 -2.103 0.945 10.204 1.00 55.23 H new ATOM 0 HD2 LYS A 463 -0.394 -0.315 11.378 1.00 13.33 H new ATOM 0 HD3 LYS A 463 -1.748 -0.075 12.465 1.00 13.33 H new ATOM 0 HE2 LYS A 463 -2.583 -2.365 11.913 1.00 24.11 H new ATOM 0 HE3 LYS A 463 -1.207 -2.603 10.854 1.00 24.11 H new ATOM 0 HZ1 LYS A 463 -0.829 -3.588 13.016 1.00 53.51 H new ATOM 0 HZ2 LYS A 463 0.271 -2.321 12.756 1.00 53.51 H new ATOM 0 HZ3 LYS A 463 -1.062 -2.091 13.782 1.00 53.51 H new ATOM 462 N ASN A 464 -5.726 2.166 11.143 1.00 2.23 N ATOM 463 CA ASN A 464 -5.882 3.450 11.825 1.00 45.13 C ATOM 464 C ASN A 464 -5.397 3.317 13.274 1.00 14.43 C ATOM 465 O ASN A 464 -5.848 2.440 14.001 1.00 14.31 O ATOM 466 CB ASN A 464 -7.365 3.850 11.805 1.00 52.02 C ATOM 467 CG ASN A 464 -7.621 5.272 12.276 1.00 44.35 C ATOM 468 OD1 ASN A 464 -6.870 5.838 13.071 1.00 13.33 O ATOM 469 ND2 ASN A 464 -8.699 5.857 11.798 1.00 35.44 N ATOM 0 H ASN A 464 -6.414 1.466 11.421 1.00 2.23 H new ATOM 0 HA ASN A 464 -5.293 4.215 11.320 1.00 45.13 H new ATOM 0 HB2 ASN A 464 -7.749 3.738 10.791 1.00 52.02 H new ATOM 0 HB3 ASN A 464 -7.926 3.161 12.436 1.00 52.02 H new ATOM 0 HD21 ASN A 464 -8.933 6.807 12.085 1.00 35.44 H new ATOM 0 HD22 ASN A 464 -9.300 5.360 11.141 1.00 35.44 H new ATOM 476 N LEU A 465 -4.501 4.199 13.701 1.00 21.11 N ATOM 477 CA LEU A 465 -3.931 4.120 15.053 1.00 43.42 C ATOM 478 C LEU A 465 -4.266 5.368 15.889 1.00 50.04 C ATOM 479 O LEU A 465 -3.761 5.534 16.997 1.00 41.14 O ATOM 480 CB LEU A 465 -2.407 3.936 14.961 1.00 72.34 C ATOM 481 CG LEU A 465 -1.934 2.723 14.136 1.00 3.01 C ATOM 482 CD1 LEU A 465 -0.409 2.642 14.114 1.00 74.11 C ATOM 483 CD2 LEU A 465 -2.536 1.425 14.673 1.00 35.31 C ATOM 0 H LEU A 465 -4.151 4.975 13.139 1.00 21.11 H new ATOM 0 HA LEU A 465 -4.375 3.261 15.556 1.00 43.42 H new ATOM 0 HB2 LEU A 465 -1.975 4.838 14.528 1.00 72.34 H new ATOM 0 HB3 LEU A 465 -2.008 3.844 15.971 1.00 72.34 H new ATOM 0 HG LEU A 465 -2.283 2.858 13.112 1.00 3.01 H new ATOM 0 HD11 LEU A 465 -0.099 1.778 13.526 1.00 74.11 H new ATOM 0 HD12 LEU A 465 -0.003 3.550 13.668 1.00 74.11 H new ATOM 0 HD13 LEU A 465 -0.035 2.540 15.133 1.00 74.11 H new ATOM 0 HD21 LEU A 465 -2.186 0.586 14.072 1.00 35.31 H new ATOM 0 HD22 LEU A 465 -2.229 1.283 15.709 1.00 35.31 H new ATOM 0 HD23 LEU A 465 -3.623 1.479 14.621 1.00 35.31 H new ATOM 495 N GLY A 466 -5.140 6.223 15.363 1.00 1.52 N ATOM 496 CA GLY A 466 -5.487 7.471 16.046 1.00 43.40 C ATOM 497 C GLY A 466 -6.641 7.330 17.038 1.00 1.33 C ATOM 498 O GLY A 466 -6.849 8.200 17.882 1.00 75.01 O ATOM 0 H GLY A 466 -5.618 6.078 14.474 1.00 1.52 H new ATOM 0 HA2 GLY A 466 -4.609 7.841 16.575 1.00 43.40 H new ATOM 0 HA3 GLY A 466 -5.750 8.221 15.301 1.00 43.40 H new ATOM 502 N GLY A 467 -7.399 6.236 16.936 1.00 24.12 N ATOM 503 CA GLY A 467 -8.538 6.022 17.835 1.00 44.42 C ATOM 504 C GLY A 467 -9.813 6.744 17.387 1.00 34.20 C ATOM 505 O GLY A 467 -10.751 6.922 18.170 1.00 51.15 O ATOM 0 H GLY A 467 -7.250 5.494 16.252 1.00 24.12 H new ATOM 0 HA2 GLY A 467 -8.740 4.953 17.904 1.00 44.42 H new ATOM 0 HA3 GLY A 467 -8.270 6.361 18.836 1.00 44.42 H new ATOM 509 N ILE A 468 -9.842 7.152 16.121 1.00 0.24 N ATOM 510 CA ILE A 468 -10.999 7.843 15.530 1.00 61.24 C ATOM 511 C ILE A 468 -11.340 7.264 14.144 1.00 21.01 C ATOM 512 O ILE A 468 -10.448 7.032 13.328 1.00 24.23 O ATOM 513 CB ILE A 468 -10.731 9.372 15.417 1.00 25.22 C ATOM 514 CG1 ILE A 468 -11.752 10.054 14.486 1.00 65.15 C ATOM 515 CG2 ILE A 468 -9.304 9.635 14.945 1.00 21.14 C ATOM 516 CD1 ILE A 468 -11.546 11.549 14.338 1.00 71.24 C ATOM 0 H ILE A 468 -9.068 7.016 15.471 1.00 0.24 H new ATOM 0 HA ILE A 468 -11.852 7.685 16.190 1.00 61.24 H new ATOM 0 HB ILE A 468 -10.850 9.806 16.410 1.00 25.22 H new ATOM 0 HG12 ILE A 468 -11.697 9.590 13.501 1.00 65.15 H new ATOM 0 HG13 ILE A 468 -12.756 9.872 14.869 1.00 65.15 H new ATOM 0 HG21 ILE A 468 -9.137 10.710 14.873 1.00 21.14 H new ATOM 0 HG22 ILE A 468 -8.600 9.206 15.658 1.00 21.14 H new ATOM 0 HG23 ILE A 468 -9.154 9.178 13.967 1.00 21.14 H new ATOM 0 HD11 ILE A 468 -12.303 11.956 13.668 1.00 71.24 H new ATOM 0 HD12 ILE A 468 -11.631 12.026 15.314 1.00 71.24 H new ATOM 0 HD13 ILE A 468 -10.555 11.741 13.925 1.00 71.24 H new ATOM 528 N GLY A 469 -12.631 7.037 13.890 1.00 0.24 N ATOM 529 CA GLY A 469 -13.067 6.428 12.632 1.00 51.42 C ATOM 530 C GLY A 469 -12.919 7.349 11.419 1.00 32.21 C ATOM 531 O GLY A 469 -13.324 8.512 11.459 1.00 70.50 O ATOM 0 H GLY A 469 -13.388 7.264 14.535 1.00 0.24 H new ATOM 0 HA2 GLY A 469 -12.490 5.519 12.460 1.00 51.42 H new ATOM 0 HA3 GLY A 469 -14.111 6.130 12.726 1.00 51.42 H new ATOM 535 N VAL A 470 -12.346 6.819 10.337 1.00 64.23 N ATOM 536 CA VAL A 470 -12.102 7.594 9.112 1.00 21.21 C ATOM 537 C VAL A 470 -12.661 6.885 7.858 1.00 2.13 C ATOM 538 O VAL A 470 -12.187 5.815 7.473 1.00 3.42 O ATOM 539 CB VAL A 470 -10.587 7.849 8.906 1.00 31.30 C ATOM 540 CG1 VAL A 470 -10.334 8.655 7.632 1.00 60.22 C ATOM 541 CG2 VAL A 470 -9.991 8.558 10.120 1.00 12.22 C ATOM 0 H VAL A 470 -12.039 5.848 10.281 1.00 64.23 H new ATOM 0 HA VAL A 470 -12.622 8.544 9.240 1.00 21.21 H new ATOM 0 HB VAL A 470 -10.095 6.883 8.796 1.00 31.30 H new ATOM 0 HG11 VAL A 470 -9.263 8.819 7.512 1.00 60.22 H new ATOM 0 HG12 VAL A 470 -10.715 8.105 6.772 1.00 60.22 H new ATOM 0 HG13 VAL A 470 -10.843 9.616 7.703 1.00 60.22 H new ATOM 0 HG21 VAL A 470 -8.927 8.728 9.956 1.00 12.22 H new ATOM 0 HG22 VAL A 470 -10.493 9.514 10.266 1.00 12.22 H new ATOM 0 HG23 VAL A 470 -10.127 7.938 11.006 1.00 12.22 H new ATOM 551 N PRO A 471 -13.683 7.478 7.208 1.00 31.21 N ATOM 552 CA PRO A 471 -14.226 6.975 5.929 1.00 73.10 C ATOM 553 C PRO A 471 -13.395 7.427 4.709 1.00 62.11 C ATOM 554 O PRO A 471 -13.594 6.956 3.588 1.00 63.12 O ATOM 555 CB PRO A 471 -15.620 7.605 5.887 1.00 52.24 C ATOM 556 CG PRO A 471 -15.469 8.899 6.619 1.00 23.21 C ATOM 557 CD PRO A 471 -14.418 8.674 7.681 1.00 31.24 C ATOM 0 HA PRO A 471 -14.221 5.886 5.879 1.00 73.10 H new ATOM 0 HB2 PRO A 471 -15.952 7.766 4.861 1.00 52.24 H new ATOM 0 HB3 PRO A 471 -16.360 6.963 6.365 1.00 52.24 H new ATOM 0 HG2 PRO A 471 -15.168 9.696 5.939 1.00 23.21 H new ATOM 0 HG3 PRO A 471 -16.415 9.203 7.068 1.00 23.21 H new ATOM 0 HD2 PRO A 471 -13.758 9.536 7.779 1.00 31.24 H new ATOM 0 HD3 PRO A 471 -14.868 8.505 8.659 1.00 31.24 H new ATOM 565 N SER A 472 -12.465 8.344 4.956 1.00 61.22 N ATOM 566 CA SER A 472 -11.690 9.030 3.905 1.00 65.34 C ATOM 567 C SER A 472 -10.505 8.202 3.369 1.00 31.34 C ATOM 568 O SER A 472 -9.689 8.709 2.595 1.00 51.30 O ATOM 569 CB SER A 472 -11.170 10.371 4.446 1.00 42.32 C ATOM 570 OG SER A 472 -12.232 11.189 4.912 1.00 44.11 O ATOM 0 H SER A 472 -12.219 8.642 5.900 1.00 61.22 H new ATOM 0 HA SER A 472 -12.370 9.181 3.067 1.00 65.34 H new ATOM 0 HB2 SER A 472 -10.466 10.189 5.258 1.00 42.32 H new ATOM 0 HB3 SER A 472 -10.623 10.894 3.661 1.00 42.32 H new ATOM 0 HG SER A 472 -11.869 12.034 5.251 1.00 44.11 H new ATOM 576 N THR A 473 -10.428 6.923 3.724 1.00 34.33 N ATOM 577 CA THR A 473 -9.197 6.142 3.519 1.00 22.41 C ATOM 578 C THR A 473 -9.140 5.479 2.129 1.00 34.14 C ATOM 579 O THR A 473 -9.757 4.447 1.877 1.00 63.12 O ATOM 580 CB THR A 473 -9.057 5.045 4.606 1.00 13.13 C ATOM 581 OG1 THR A 473 -9.005 5.647 5.912 1.00 70.25 O ATOM 582 CG2 THR A 473 -7.805 4.197 4.389 1.00 72.32 C ATOM 0 H THR A 473 -11.193 6.402 4.152 1.00 34.33 H new ATOM 0 HA THR A 473 -8.371 6.849 3.591 1.00 22.41 H new ATOM 0 HB THR A 473 -9.929 4.395 4.532 1.00 13.13 H new ATOM 0 HG1 THR A 473 -8.918 4.947 6.592 1.00 70.25 H new ATOM 0 HG21 THR A 473 -7.739 3.439 5.169 1.00 72.32 H new ATOM 0 HG22 THR A 473 -7.859 3.711 3.415 1.00 72.32 H new ATOM 0 HG23 THR A 473 -6.922 4.835 4.428 1.00 72.32 H new ATOM 590 N LYS A 474 -8.383 6.109 1.227 1.00 22.25 N ATOM 591 CA LYS A 474 -8.171 5.601 -0.138 1.00 72.41 C ATOM 592 C LYS A 474 -6.697 5.211 -0.352 1.00 43.12 C ATOM 593 O LYS A 474 -5.809 6.062 -0.288 1.00 54.33 O ATOM 594 CB LYS A 474 -8.577 6.674 -1.158 1.00 3.20 C ATOM 595 CG LYS A 474 -10.018 7.152 -1.012 1.00 13.32 C ATOM 596 CD LYS A 474 -10.273 8.415 -1.829 1.00 51.30 C ATOM 597 CE LYS A 474 -9.485 9.607 -1.293 1.00 73.41 C ATOM 598 NZ LYS A 474 -9.820 9.910 0.125 1.00 24.30 N ATOM 0 H LYS A 474 -7.898 6.986 1.419 1.00 22.25 H new ATOM 0 HA LYS A 474 -8.787 4.713 -0.277 1.00 72.41 H new ATOM 0 HB2 LYS A 474 -7.909 7.529 -1.056 1.00 3.20 H new ATOM 0 HB3 LYS A 474 -8.436 6.277 -2.163 1.00 3.20 H new ATOM 0 HG2 LYS A 474 -10.698 6.364 -1.336 1.00 13.32 H new ATOM 0 HG3 LYS A 474 -10.233 7.347 0.039 1.00 13.32 H new ATOM 0 HD2 LYS A 474 -9.999 8.236 -2.869 1.00 51.30 H new ATOM 0 HD3 LYS A 474 -11.338 8.648 -1.815 1.00 51.30 H new ATOM 0 HE2 LYS A 474 -8.418 9.402 -1.377 1.00 73.41 H new ATOM 0 HE3 LYS A 474 -9.691 10.483 -1.908 1.00 73.41 H new ATOM 0 HZ1 LYS A 474 -10.084 10.912 0.213 1.00 24.30 H new ATOM 0 HZ2 LYS A 474 -10.617 9.314 0.428 1.00 24.30 H new ATOM 0 HZ3 LYS A 474 -8.994 9.716 0.726 1.00 24.30 H new ATOM 612 N VAL A 475 -6.443 3.934 -0.620 1.00 15.03 N ATOM 613 CA VAL A 475 -5.070 3.411 -0.709 1.00 0.31 C ATOM 614 C VAL A 475 -4.635 3.176 -2.164 1.00 5.11 C ATOM 615 O VAL A 475 -5.365 2.575 -2.946 1.00 40.15 O ATOM 616 CB VAL A 475 -4.948 2.084 0.077 1.00 53.44 C ATOM 617 CG1 VAL A 475 -3.508 1.570 0.073 1.00 71.15 C ATOM 618 CG2 VAL A 475 -5.461 2.269 1.504 1.00 43.33 C ATOM 0 H VAL A 475 -7.168 3.235 -0.781 1.00 15.03 H new ATOM 0 HA VAL A 475 -4.414 4.165 -0.274 1.00 0.31 H new ATOM 0 HB VAL A 475 -5.564 1.333 -0.418 1.00 53.44 H new ATOM 0 HG11 VAL A 475 -3.453 0.636 0.633 1.00 71.15 H new ATOM 0 HG12 VAL A 475 -3.186 1.397 -0.954 1.00 71.15 H new ATOM 0 HG13 VAL A 475 -2.856 2.310 0.537 1.00 71.15 H new ATOM 0 HG21 VAL A 475 -5.370 1.329 2.048 1.00 43.33 H new ATOM 0 HG22 VAL A 475 -4.872 3.037 2.006 1.00 43.33 H new ATOM 0 HG23 VAL A 475 -6.507 2.574 1.478 1.00 43.33 H new ATOM 628 N ARG A 476 -3.435 3.643 -2.513 1.00 12.21 N ATOM 629 CA ARG A 476 -2.878 3.452 -3.864 1.00 15.30 C ATOM 630 C ARG A 476 -1.629 2.556 -3.846 1.00 25.52 C ATOM 631 O ARG A 476 -0.901 2.505 -2.856 1.00 25.45 O ATOM 632 CB ARG A 476 -2.488 4.797 -4.493 1.00 44.55 C ATOM 633 CG ARG A 476 -3.648 5.652 -5.000 1.00 55.55 C ATOM 634 CD ARG A 476 -3.113 6.888 -5.713 1.00 41.45 C ATOM 635 NE ARG A 476 -4.142 7.690 -6.370 1.00 64.44 N ATOM 636 CZ ARG A 476 -3.865 8.659 -7.206 1.00 5.34 C ATOM 637 NH1 ARG A 476 -2.632 8.937 -7.500 1.00 32.21 N ATOM 638 NH2 ARG A 476 -4.810 9.355 -7.750 1.00 63.35 N ATOM 0 H ARG A 476 -2.824 4.159 -1.880 1.00 12.21 H new ATOM 0 HA ARG A 476 -3.660 2.972 -4.453 1.00 15.30 H new ATOM 0 HB2 ARG A 476 -1.931 5.374 -3.755 1.00 44.55 H new ATOM 0 HB3 ARG A 476 -1.811 4.605 -5.325 1.00 44.55 H new ATOM 0 HG2 ARG A 476 -4.269 5.070 -5.681 1.00 55.55 H new ATOM 0 HG3 ARG A 476 -4.283 5.950 -4.165 1.00 55.55 H new ATOM 0 HD2 ARG A 476 -2.587 7.512 -4.990 1.00 41.45 H new ATOM 0 HD3 ARG A 476 -2.380 6.576 -6.457 1.00 41.45 H new ATOM 0 HE ARG A 476 -5.121 7.486 -6.168 1.00 64.44 H new ATOM 0 HH11 ARG A 476 -1.874 8.400 -7.079 1.00 32.21 H new ATOM 0 HH12 ARG A 476 -2.421 9.693 -8.152 1.00 32.21 H new ATOM 0 HH21 ARG A 476 -5.785 9.152 -7.529 1.00 63.35 H new ATOM 0 HH22 ARG A 476 -4.580 10.107 -8.400 1.00 63.35 H new ATOM 652 N VAL A 477 -1.386 1.865 -4.964 1.00 51.24 N ATOM 653 CA VAL A 477 -0.161 1.072 -5.155 1.00 24.54 C ATOM 654 C VAL A 477 0.608 1.536 -6.408 1.00 12.44 C ATOM 655 O VAL A 477 0.047 1.600 -7.506 1.00 62.22 O ATOM 656 CB VAL A 477 -0.479 -0.442 -5.286 1.00 75.44 C ATOM 657 CG1 VAL A 477 0.779 -1.248 -5.614 1.00 55.13 C ATOM 658 CG2 VAL A 477 -1.135 -0.966 -4.009 1.00 71.54 C ATOM 0 H VAL A 477 -2.025 1.837 -5.758 1.00 51.24 H new ATOM 0 HA VAL A 477 0.459 1.228 -4.272 1.00 24.54 H new ATOM 0 HB VAL A 477 -1.179 -0.565 -6.112 1.00 75.44 H new ATOM 0 HG11 VAL A 477 0.523 -2.304 -5.699 1.00 55.13 H new ATOM 0 HG12 VAL A 477 1.199 -0.899 -6.558 1.00 55.13 H new ATOM 0 HG13 VAL A 477 1.513 -1.116 -4.819 1.00 55.13 H new ATOM 0 HG21 VAL A 477 -1.350 -2.029 -4.120 1.00 71.54 H new ATOM 0 HG22 VAL A 477 -0.460 -0.819 -3.166 1.00 71.54 H new ATOM 0 HG23 VAL A 477 -2.064 -0.425 -3.828 1.00 71.54 H new ATOM 668 N TYR A 478 1.889 1.856 -6.234 1.00 21.41 N ATOM 669 CA TYR A 478 2.748 2.306 -7.341 1.00 53.04 C ATOM 670 C TYR A 478 3.889 1.315 -7.616 1.00 5.33 C ATOM 671 O TYR A 478 4.499 0.784 -6.691 1.00 74.15 O ATOM 672 CB TYR A 478 3.359 3.680 -7.026 1.00 52.25 C ATOM 673 CG TYR A 478 2.348 4.795 -6.839 1.00 71.23 C ATOM 674 CD1 TYR A 478 1.746 5.403 -7.935 1.00 62.44 C ATOM 675 CD2 TYR A 478 2.011 5.255 -5.568 1.00 13.12 C ATOM 676 CE1 TYR A 478 0.842 6.435 -7.773 1.00 64.40 C ATOM 677 CE2 TYR A 478 1.104 6.283 -5.399 1.00 10.42 C ATOM 678 CZ TYR A 478 0.523 6.870 -6.503 1.00 34.11 C ATOM 679 OH TYR A 478 -0.373 7.905 -6.340 1.00 20.10 O ATOM 0 H TYR A 478 2.363 1.813 -5.332 1.00 21.41 H new ATOM 0 HA TYR A 478 2.115 2.370 -8.226 1.00 53.04 H new ATOM 0 HB2 TYR A 478 3.959 3.597 -6.120 1.00 52.25 H new ATOM 0 HB3 TYR A 478 4.037 3.955 -7.834 1.00 52.25 H new ATOM 0 HD1 TYR A 478 1.989 5.062 -8.931 1.00 62.44 H new ATOM 0 HD2 TYR A 478 2.466 4.800 -4.701 1.00 13.12 H new ATOM 0 HE1 TYR A 478 0.387 6.899 -8.636 1.00 64.40 H new ATOM 0 HE2 TYR A 478 0.851 6.625 -4.406 1.00 10.42 H new ATOM 0 HH TYR A 478 0.009 8.576 -5.737 1.00 20.10 H new ATOM 689 N ILE A 479 4.169 1.077 -8.893 1.00 50.20 N ATOM 690 CA ILE A 479 5.339 0.295 -9.309 1.00 22.21 C ATOM 691 C ILE A 479 6.316 1.188 -10.090 1.00 12.30 C ATOM 692 O ILE A 479 6.038 1.578 -11.227 1.00 54.14 O ATOM 693 CB ILE A 479 4.929 -0.922 -10.181 1.00 22.31 C ATOM 694 CG1 ILE A 479 3.942 -1.823 -9.415 1.00 45.41 C ATOM 695 CG2 ILE A 479 6.162 -1.719 -10.610 1.00 33.53 C ATOM 696 CD1 ILE A 479 3.453 -3.018 -10.210 1.00 51.50 C ATOM 0 H ILE A 479 3.599 1.416 -9.668 1.00 50.20 H new ATOM 0 HA ILE A 479 5.826 -0.082 -8.410 1.00 22.21 H new ATOM 0 HB ILE A 479 4.434 -0.551 -11.078 1.00 22.31 H new ATOM 0 HG12 ILE A 479 4.423 -2.178 -8.503 1.00 45.41 H new ATOM 0 HG13 ILE A 479 3.082 -1.226 -9.110 1.00 45.41 H new ATOM 0 HG21 ILE A 479 5.853 -2.568 -11.220 1.00 33.53 H new ATOM 0 HG22 ILE A 479 6.826 -1.078 -11.190 1.00 33.53 H new ATOM 0 HG23 ILE A 479 6.687 -2.080 -9.726 1.00 33.53 H new ATOM 0 HD11 ILE A 479 2.763 -3.602 -9.601 1.00 51.50 H new ATOM 0 HD12 ILE A 479 2.942 -2.673 -11.109 1.00 51.50 H new ATOM 0 HD13 ILE A 479 4.303 -3.640 -10.492 1.00 51.50 H new ATOM 708 N ASN A 480 7.449 1.520 -9.465 1.00 24.30 N ATOM 709 CA ASN A 480 8.419 2.476 -10.032 1.00 73.32 C ATOM 710 C ASN A 480 7.762 3.834 -10.350 1.00 20.31 C ATOM 711 O ASN A 480 8.139 4.515 -11.305 1.00 45.11 O ATOM 712 CB ASN A 480 9.089 1.896 -11.291 1.00 23.53 C ATOM 713 CG ASN A 480 10.046 0.765 -10.969 1.00 44.40 C ATOM 714 OD1 ASN A 480 10.588 0.685 -9.872 1.00 40.35 O ATOM 715 ND2 ASN A 480 10.290 -0.106 -11.927 1.00 53.20 N ATOM 0 H ASN A 480 7.723 1.140 -8.559 1.00 24.30 H new ATOM 0 HA ASN A 480 9.186 2.646 -9.276 1.00 73.32 H new ATOM 0 HB2 ASN A 480 8.320 1.534 -11.974 1.00 23.53 H new ATOM 0 HB3 ASN A 480 9.629 2.688 -11.809 1.00 23.53 H new ATOM 0 HD21 ASN A 480 10.944 -0.872 -11.766 1.00 53.20 H new ATOM 0 HD22 ASN A 480 9.824 -0.015 -12.830 1.00 53.20 H new ATOM 722 N GLY A 481 6.798 4.236 -9.520 1.00 4.33 N ATOM 723 CA GLY A 481 6.093 5.502 -9.728 1.00 43.21 C ATOM 724 C GLY A 481 4.869 5.382 -10.640 1.00 13.40 C ATOM 725 O GLY A 481 4.116 6.345 -10.808 1.00 55.30 O ATOM 0 H GLY A 481 6.489 3.708 -8.704 1.00 4.33 H new ATOM 0 HA2 GLY A 481 5.778 5.895 -8.762 1.00 43.21 H new ATOM 0 HA3 GLY A 481 6.785 6.227 -10.157 1.00 43.21 H new ATOM 729 N THR A 482 4.669 4.207 -11.236 1.00 1.24 N ATOM 730 CA THR A 482 3.514 3.962 -12.118 1.00 14.23 C ATOM 731 C THR A 482 2.329 3.373 -11.336 1.00 65.04 C ATOM 732 O THR A 482 2.468 2.347 -10.674 1.00 31.44 O ATOM 733 CB THR A 482 3.880 2.996 -13.276 1.00 64.41 C ATOM 734 OG1 THR A 482 4.954 3.542 -14.056 1.00 74.20 O ATOM 735 CG2 THR A 482 2.679 2.730 -14.181 1.00 21.25 C ATOM 0 H THR A 482 5.289 3.405 -11.128 1.00 1.24 H new ATOM 0 HA THR A 482 3.228 4.928 -12.533 1.00 14.23 H new ATOM 0 HB THR A 482 4.192 2.051 -12.832 1.00 64.41 H new ATOM 0 HG1 THR A 482 5.178 2.924 -14.783 1.00 74.20 H new ATOM 0 HG21 THR A 482 2.970 2.050 -14.981 1.00 21.25 H new ATOM 0 HG22 THR A 482 1.876 2.281 -13.597 1.00 21.25 H new ATOM 0 HG23 THR A 482 2.333 3.670 -14.611 1.00 21.25 H new ATOM 743 N LEU A 483 1.168 4.022 -11.418 1.00 51.04 N ATOM 744 CA LEU A 483 -0.033 3.565 -10.702 1.00 53.35 C ATOM 745 C LEU A 483 -0.494 2.178 -11.195 1.00 54.12 C ATOM 746 O LEU A 483 -0.766 1.980 -12.382 1.00 13.34 O ATOM 747 CB LEU A 483 -1.168 4.589 -10.863 1.00 34.15 C ATOM 748 CG LEU A 483 -2.467 4.260 -10.102 1.00 14.02 C ATOM 749 CD1 LEU A 483 -2.208 4.159 -8.599 1.00 54.33 C ATOM 750 CD2 LEU A 483 -3.543 5.306 -10.394 1.00 30.33 C ATOM 0 H LEU A 483 1.029 4.867 -11.972 1.00 51.04 H new ATOM 0 HA LEU A 483 0.223 3.475 -9.646 1.00 53.35 H new ATOM 0 HB2 LEU A 483 -0.807 5.562 -10.528 1.00 34.15 H new ATOM 0 HB3 LEU A 483 -1.402 4.683 -11.923 1.00 34.15 H new ATOM 0 HG LEU A 483 -2.826 3.291 -10.450 1.00 14.02 H new ATOM 0 HD11 LEU A 483 -3.140 3.926 -8.084 1.00 54.33 H new ATOM 0 HD12 LEU A 483 -1.481 3.370 -8.407 1.00 54.33 H new ATOM 0 HD13 LEU A 483 -1.818 5.109 -8.232 1.00 54.33 H new ATOM 0 HD21 LEU A 483 -4.452 5.055 -9.847 1.00 30.33 H new ATOM 0 HD22 LEU A 483 -3.190 6.288 -10.080 1.00 30.33 H new ATOM 0 HD23 LEU A 483 -3.755 5.321 -11.463 1.00 30.33 H new ATOM 762 N TYR A 484 -0.577 1.223 -10.267 1.00 70.25 N ATOM 763 CA TYR A 484 -0.966 -0.158 -10.592 1.00 63.21 C ATOM 764 C TYR A 484 -2.434 -0.453 -10.219 1.00 33.00 C ATOM 765 O TYR A 484 -3.174 -1.043 -11.007 1.00 43.13 O ATOM 766 CB TYR A 484 -0.026 -1.128 -9.855 1.00 44.40 C ATOM 767 CG TYR A 484 -0.430 -2.589 -9.939 1.00 65.23 C ATOM 768 CD1 TYR A 484 -0.206 -3.335 -11.093 1.00 5.23 C ATOM 769 CD2 TYR A 484 -1.040 -3.221 -8.861 1.00 61.20 C ATOM 770 CE1 TYR A 484 -0.575 -4.664 -11.164 1.00 24.03 C ATOM 771 CE2 TYR A 484 -1.411 -4.548 -8.928 1.00 11.14 C ATOM 772 CZ TYR A 484 -1.177 -5.265 -10.081 1.00 55.31 C ATOM 773 OH TYR A 484 -1.550 -6.588 -10.148 1.00 64.02 O ATOM 0 H TYR A 484 -0.380 1.378 -9.278 1.00 70.25 H new ATOM 0 HA TYR A 484 -0.879 -0.292 -11.670 1.00 63.21 H new ATOM 0 HB2 TYR A 484 0.979 -1.019 -10.263 1.00 44.40 H new ATOM 0 HB3 TYR A 484 0.023 -0.838 -8.805 1.00 44.40 H new ATOM 0 HD1 TYR A 484 0.264 -2.867 -11.946 1.00 5.23 H new ATOM 0 HD2 TYR A 484 -1.227 -2.663 -7.955 1.00 61.20 H new ATOM 0 HE1 TYR A 484 -0.392 -5.230 -12.066 1.00 24.03 H new ATOM 0 HE2 TYR A 484 -1.883 -5.023 -8.080 1.00 11.14 H new ATOM 0 HH TYR A 484 -1.959 -6.856 -9.299 1.00 64.02 H new ATOM 783 N LYS A 485 -2.848 -0.037 -9.021 1.00 31.22 N ATOM 784 CA LYS A 485 -4.229 -0.246 -8.550 1.00 41.53 C ATOM 785 C LYS A 485 -4.485 0.525 -7.241 1.00 71.54 C ATOM 786 O LYS A 485 -3.542 0.896 -6.542 1.00 10.22 O ATOM 787 CB LYS A 485 -4.510 -1.756 -8.364 1.00 54.34 C ATOM 788 CG LYS A 485 -5.912 -2.073 -7.838 1.00 24.41 C ATOM 789 CD LYS A 485 -6.350 -3.509 -8.136 1.00 10.44 C ATOM 790 CE LYS A 485 -5.414 -4.556 -7.541 1.00 23.11 C ATOM 791 NZ LYS A 485 -5.964 -5.933 -7.695 1.00 62.15 N ATOM 0 H LYS A 485 -2.249 0.449 -8.353 1.00 31.22 H new ATOM 0 HA LYS A 485 -4.913 0.141 -9.305 1.00 41.53 H new ATOM 0 HB2 LYS A 485 -4.370 -2.261 -9.320 1.00 54.34 H new ATOM 0 HB3 LYS A 485 -3.774 -2.169 -7.675 1.00 54.34 H new ATOM 0 HG2 LYS A 485 -5.936 -1.907 -6.761 1.00 24.41 H new ATOM 0 HG3 LYS A 485 -6.627 -1.381 -8.283 1.00 24.41 H new ATOM 0 HD2 LYS A 485 -7.355 -3.665 -7.744 1.00 10.44 H new ATOM 0 HD3 LYS A 485 -6.403 -3.650 -9.216 1.00 10.44 H new ATOM 0 HE2 LYS A 485 -4.441 -4.495 -8.029 1.00 23.11 H new ATOM 0 HE3 LYS A 485 -5.254 -4.343 -6.484 1.00 23.11 H new ATOM 0 HZ1 LYS A 485 -5.302 -6.620 -7.280 1.00 62.15 H new ATOM 0 HZ2 LYS A 485 -6.881 -5.997 -7.208 1.00 62.15 H new ATOM 0 HZ3 LYS A 485 -6.093 -6.144 -8.705 1.00 62.15 H new ATOM 805 N ASN A 486 -5.760 0.770 -6.915 1.00 1.55 N ATOM 806 CA ASN A 486 -6.114 1.488 -5.679 1.00 51.11 C ATOM 807 C ASN A 486 -7.474 1.030 -5.119 1.00 31.34 C ATOM 808 O ASN A 486 -8.331 0.543 -5.860 1.00 41.24 O ATOM 809 CB ASN A 486 -6.100 3.017 -5.902 1.00 1.30 C ATOM 810 CG ASN A 486 -7.276 3.562 -6.706 1.00 21.34 C ATOM 811 OD1 ASN A 486 -7.704 4.688 -6.492 1.00 53.55 O ATOM 812 ND2 ASN A 486 -7.798 2.794 -7.641 1.00 35.10 N ATOM 0 H ASN A 486 -6.559 0.486 -7.482 1.00 1.55 H new ATOM 0 HA ASN A 486 -5.355 1.243 -4.936 1.00 51.11 H new ATOM 0 HB2 ASN A 486 -6.084 3.511 -4.930 1.00 1.30 H new ATOM 0 HB3 ASN A 486 -5.175 3.286 -6.412 1.00 1.30 H new ATOM 0 HD21 ASN A 486 -8.576 3.135 -8.205 1.00 35.10 H new ATOM 0 HD22 ASN A 486 -7.424 1.859 -7.801 1.00 35.10 H new ATOM 819 N TRP A 487 -7.654 1.181 -3.805 1.00 52.44 N ATOM 820 CA TRP A 487 -8.888 0.758 -3.118 1.00 51.35 C ATOM 821 C TRP A 487 -9.449 1.881 -2.234 1.00 55.04 C ATOM 822 O TRP A 487 -8.696 2.669 -1.657 1.00 15.42 O ATOM 823 CB TRP A 487 -8.620 -0.464 -2.222 1.00 63.33 C ATOM 824 CG TRP A 487 -8.044 -1.653 -2.930 1.00 52.40 C ATOM 825 CD1 TRP A 487 -8.731 -2.663 -3.541 1.00 40.31 C ATOM 826 CD2 TRP A 487 -6.655 -1.964 -3.082 1.00 1.54 C ATOM 827 NE1 TRP A 487 -7.852 -3.581 -4.061 1.00 70.25 N ATOM 828 CE2 TRP A 487 -6.574 -3.174 -3.792 1.00 33.31 C ATOM 829 CE3 TRP A 487 -5.473 -1.334 -2.685 1.00 74.24 C ATOM 830 CZ2 TRP A 487 -5.356 -3.767 -4.115 1.00 54.12 C ATOM 831 CZ3 TRP A 487 -4.267 -1.924 -3.005 1.00 24.40 C ATOM 832 CH2 TRP A 487 -4.216 -3.131 -3.713 1.00 2.22 C ATOM 0 H TRP A 487 -6.957 1.596 -3.186 1.00 52.44 H new ATOM 0 HA TRP A 487 -9.612 0.507 -3.893 1.00 51.35 H new ATOM 0 HB2 TRP A 487 -7.938 -0.169 -1.425 1.00 63.33 H new ATOM 0 HB3 TRP A 487 -9.556 -0.760 -1.748 1.00 63.33 H new ATOM 0 HD1 TRP A 487 -9.807 -2.730 -3.606 1.00 40.31 H new ATOM 0 HE1 TRP A 487 -8.110 -4.429 -4.566 1.00 70.25 H new ATOM 0 HE3 TRP A 487 -5.502 -0.403 -2.138 1.00 74.24 H new ATOM 0 HZ2 TRP A 487 -5.314 -4.696 -4.664 1.00 54.12 H new ATOM 0 HZ3 TRP A 487 -3.346 -1.446 -2.704 1.00 24.40 H new ATOM 0 HH2 TRP A 487 -3.256 -3.568 -3.946 1.00 2.22 H new ATOM 843 N THR A 488 -10.772 1.939 -2.111 1.00 3.45 N ATOM 844 CA THR A 488 -11.424 2.874 -1.182 1.00 51.41 C ATOM 845 C THR A 488 -12.057 2.109 -0.013 1.00 14.32 C ATOM 846 O THR A 488 -12.951 1.288 -0.215 1.00 42.55 O ATOM 847 CB THR A 488 -12.525 3.705 -1.889 1.00 60.02 C ATOM 848 OG1 THR A 488 -11.985 4.353 -3.052 1.00 2.12 O ATOM 849 CG2 THR A 488 -13.113 4.755 -0.950 1.00 72.02 C ATOM 0 H THR A 488 -11.418 1.353 -2.640 1.00 3.45 H new ATOM 0 HA THR A 488 -10.654 3.552 -0.813 1.00 51.41 H new ATOM 0 HB THR A 488 -13.320 3.021 -2.186 1.00 60.02 H new ATOM 0 HG1 THR A 488 -12.689 4.874 -3.493 1.00 2.12 H new ATOM 0 HG21 THR A 488 -13.882 5.322 -1.474 1.00 72.02 H new ATOM 0 HG22 THR A 488 -13.553 4.262 -0.083 1.00 72.02 H new ATOM 0 HG23 THR A 488 -12.324 5.432 -0.621 1.00 72.02 H new ATOM 857 N VAL A 489 -11.601 2.381 1.210 1.00 61.44 N ATOM 858 CA VAL A 489 -12.104 1.677 2.400 1.00 45.33 C ATOM 859 C VAL A 489 -12.290 2.629 3.592 1.00 22.42 C ATOM 860 O VAL A 489 -11.905 3.797 3.548 1.00 44.00 O ATOM 861 CB VAL A 489 -11.160 0.517 2.833 1.00 23.54 C ATOM 862 CG1 VAL A 489 -11.045 -0.546 1.737 1.00 70.30 C ATOM 863 CG2 VAL A 489 -9.780 1.051 3.225 1.00 2.33 C ATOM 0 H VAL A 489 -10.886 3.081 1.407 1.00 61.44 H new ATOM 0 HA VAL A 489 -13.071 1.264 2.114 1.00 45.33 H new ATOM 0 HB VAL A 489 -11.600 0.042 3.710 1.00 23.54 H new ATOM 0 HG11 VAL A 489 -10.379 -1.342 2.070 1.00 70.30 H new ATOM 0 HG12 VAL A 489 -12.031 -0.961 1.528 1.00 70.30 H new ATOM 0 HG13 VAL A 489 -10.643 -0.092 0.831 1.00 70.30 H new ATOM 0 HG21 VAL A 489 -9.140 0.221 3.523 1.00 2.33 H new ATOM 0 HG22 VAL A 489 -9.334 1.566 2.374 1.00 2.33 H new ATOM 0 HG23 VAL A 489 -9.882 1.747 4.057 1.00 2.33 H new ATOM 873 N SER A 490 -12.893 2.112 4.660 1.00 34.51 N ATOM 874 CA SER A 490 -13.071 2.877 5.901 1.00 44.01 C ATOM 875 C SER A 490 -12.374 2.183 7.078 1.00 44.24 C ATOM 876 O SER A 490 -12.511 0.969 7.267 1.00 14.25 O ATOM 877 CB SER A 490 -14.564 3.049 6.214 1.00 3.42 C ATOM 878 OG SER A 490 -15.216 1.793 6.347 1.00 53.52 O ATOM 0 H SER A 490 -13.269 1.164 4.695 1.00 34.51 H new ATOM 0 HA SER A 490 -12.619 3.858 5.757 1.00 44.01 H new ATOM 0 HB2 SER A 490 -14.680 3.620 7.135 1.00 3.42 H new ATOM 0 HB3 SER A 490 -15.039 3.625 5.420 1.00 3.42 H new ATOM 0 HG SER A 490 -16.164 1.936 6.548 1.00 53.52 H new ATOM 884 N LEU A 491 -11.626 2.954 7.869 1.00 60.12 N ATOM 885 CA LEU A 491 -10.927 2.413 9.046 1.00 72.13 C ATOM 886 C LEU A 491 -11.420 3.075 10.341 1.00 61.35 C ATOM 887 O LEU A 491 -11.272 4.284 10.529 1.00 13.15 O ATOM 888 CB LEU A 491 -9.411 2.624 8.900 1.00 65.24 C ATOM 889 CG LEU A 491 -8.752 1.882 7.727 1.00 60.03 C ATOM 890 CD1 LEU A 491 -7.284 2.276 7.598 1.00 44.33 C ATOM 891 CD2 LEU A 491 -8.886 0.370 7.900 1.00 70.44 C ATOM 0 H LEU A 491 -11.486 3.953 7.720 1.00 60.12 H new ATOM 0 HA LEU A 491 -11.144 1.346 9.104 1.00 72.13 H new ATOM 0 HB2 LEU A 491 -9.219 3.691 8.787 1.00 65.24 H new ATOM 0 HB3 LEU A 491 -8.927 2.310 9.825 1.00 65.24 H new ATOM 0 HG LEU A 491 -9.268 2.169 6.811 1.00 60.03 H new ATOM 0 HD11 LEU A 491 -6.835 1.740 6.762 1.00 44.33 H new ATOM 0 HD12 LEU A 491 -7.209 3.349 7.423 1.00 44.33 H new ATOM 0 HD13 LEU A 491 -6.757 2.021 8.517 1.00 44.33 H new ATOM 0 HD21 LEU A 491 -8.413 -0.136 7.058 1.00 70.44 H new ATOM 0 HD22 LEU A 491 -8.400 0.065 8.827 1.00 70.44 H new ATOM 0 HD23 LEU A 491 -9.941 0.100 7.938 1.00 70.44 H new ATOM 903 N GLY A 492 -11.977 2.271 11.243 1.00 32.34 N ATOM 904 CA GLY A 492 -12.487 2.792 12.505 1.00 50.23 C ATOM 905 C GLY A 492 -11.407 2.983 13.570 1.00 63.53 C ATOM 906 O GLY A 492 -10.209 2.947 13.269 1.00 61.01 O ATOM 0 H GLY A 492 -12.086 1.264 11.124 1.00 32.34 H new ATOM 0 HA2 GLY A 492 -12.978 3.748 12.322 1.00 50.23 H new ATOM 0 HA3 GLY A 492 -13.247 2.112 12.889 1.00 50.23 H new ATOM 910 N PRO A 493 -11.803 3.188 14.838 1.00 24.11 N ATOM 911 CA PRO A 493 -10.853 3.387 15.943 1.00 12.04 C ATOM 912 C PRO A 493 -9.960 2.157 16.181 1.00 63.41 C ATOM 913 O PRO A 493 -10.419 1.137 16.696 1.00 2.15 O ATOM 914 CB PRO A 493 -11.762 3.655 17.156 1.00 45.23 C ATOM 915 CG PRO A 493 -13.077 3.056 16.787 1.00 41.54 C ATOM 916 CD PRO A 493 -13.203 3.234 15.298 1.00 40.25 C ATOM 0 HA PRO A 493 -10.154 4.198 15.739 1.00 12.04 H new ATOM 0 HB2 PRO A 493 -11.359 3.199 18.060 1.00 45.23 H new ATOM 0 HB3 PRO A 493 -11.855 4.723 17.352 1.00 45.23 H new ATOM 0 HG2 PRO A 493 -13.117 2.001 17.060 1.00 41.54 H new ATOM 0 HG3 PRO A 493 -13.894 3.552 17.311 1.00 41.54 H new ATOM 0 HD2 PRO A 493 -13.802 2.443 14.846 1.00 40.25 H new ATOM 0 HD3 PRO A 493 -13.680 4.180 15.044 1.00 40.25 H new ATOM 924 N LYS A 494 -8.690 2.261 15.775 1.00 65.51 N ATOM 925 CA LYS A 494 -7.713 1.166 15.928 1.00 71.10 C ATOM 926 C LYS A 494 -8.066 -0.038 15.032 1.00 13.20 C ATOM 927 O LYS A 494 -7.757 -1.186 15.357 1.00 62.01 O ATOM 928 CB LYS A 494 -7.608 0.734 17.404 1.00 65.42 C ATOM 929 CG LYS A 494 -7.125 1.835 18.347 1.00 13.43 C ATOM 930 CD LYS A 494 -5.689 2.261 18.043 1.00 72.10 C ATOM 931 CE LYS A 494 -5.195 3.336 19.011 1.00 63.54 C ATOM 932 NZ LYS A 494 -5.181 2.864 20.424 1.00 14.52 N ATOM 0 H LYS A 494 -8.308 3.098 15.334 1.00 65.51 H new ATOM 0 HA LYS A 494 -6.742 1.542 15.606 1.00 71.10 H new ATOM 0 HB2 LYS A 494 -8.585 0.387 17.740 1.00 65.42 H new ATOM 0 HB3 LYS A 494 -6.927 -0.114 17.475 1.00 65.42 H new ATOM 0 HG2 LYS A 494 -7.785 2.699 18.264 1.00 13.43 H new ATOM 0 HG3 LYS A 494 -7.188 1.484 19.377 1.00 13.43 H new ATOM 0 HD2 LYS A 494 -5.033 1.392 18.100 1.00 72.10 H new ATOM 0 HD3 LYS A 494 -5.631 2.638 17.022 1.00 72.10 H new ATOM 0 HE2 LYS A 494 -4.190 3.645 18.724 1.00 63.54 H new ATOM 0 HE3 LYS A 494 -5.834 4.215 18.931 1.00 63.54 H new ATOM 0 HZ1 LYS A 494 -4.670 3.551 21.014 1.00 14.52 H new ATOM 0 HZ2 LYS A 494 -6.158 2.771 20.769 1.00 14.52 H new ATOM 0 HZ3 LYS A 494 -4.706 1.940 20.477 1.00 14.52 H new ATOM 946 N GLU A 495 -8.684 0.240 13.886 1.00 22.22 N ATOM 947 CA GLU A 495 -9.124 -0.810 12.959 1.00 32.30 C ATOM 948 C GLU A 495 -8.076 -1.088 11.863 1.00 20.40 C ATOM 949 O GLU A 495 -7.344 -0.188 11.450 1.00 41.24 O ATOM 950 CB GLU A 495 -10.452 -0.396 12.311 1.00 31.23 C ATOM 951 CG GLU A 495 -11.080 -1.468 11.428 1.00 45.03 C ATOM 952 CD GLU A 495 -11.473 -2.709 12.213 1.00 34.51 C ATOM 953 OE1 GLU A 495 -10.636 -3.624 12.349 1.00 31.52 O ATOM 954 OE2 GLU A 495 -12.618 -2.763 12.715 1.00 25.40 O ATOM 0 H GLU A 495 -8.894 1.188 13.573 1.00 22.22 H new ATOM 0 HA GLU A 495 -9.254 -1.728 13.532 1.00 32.30 H new ATOM 0 HB2 GLU A 495 -11.159 -0.129 13.097 1.00 31.23 H new ATOM 0 HB3 GLU A 495 -10.287 0.500 11.713 1.00 31.23 H new ATOM 0 HG2 GLU A 495 -11.962 -1.058 10.936 1.00 45.03 H new ATOM 0 HG3 GLU A 495 -10.377 -1.746 10.643 1.00 45.03 H new ATOM 961 N GLU A 496 -8.026 -2.336 11.386 1.00 34.25 N ATOM 962 CA GLU A 496 -7.105 -2.722 10.305 1.00 12.03 C ATOM 963 C GLU A 496 -7.812 -3.576 9.238 1.00 12.54 C ATOM 964 O GLU A 496 -8.610 -4.459 9.558 1.00 62.34 O ATOM 965 CB GLU A 496 -5.906 -3.511 10.857 1.00 74.42 C ATOM 966 CG GLU A 496 -4.844 -3.818 9.795 1.00 73.32 C ATOM 967 CD GLU A 496 -3.839 -4.874 10.228 1.00 60.45 C ATOM 968 OE1 GLU A 496 -3.319 -4.792 11.359 1.00 32.41 O ATOM 969 OE2 GLU A 496 -3.560 -5.799 9.431 1.00 23.31 O ATOM 0 H GLU A 496 -8.611 -3.098 11.729 1.00 34.25 H new ATOM 0 HA GLU A 496 -6.754 -1.798 9.846 1.00 12.03 H new ATOM 0 HB2 GLU A 496 -5.447 -2.943 11.666 1.00 74.42 H new ATOM 0 HB3 GLU A 496 -6.262 -4.447 11.286 1.00 74.42 H new ATOM 0 HG2 GLU A 496 -5.339 -4.152 8.883 1.00 73.32 H new ATOM 0 HG3 GLU A 496 -4.311 -2.899 9.550 1.00 73.32 H new ATOM 976 N LYS A 497 -7.502 -3.312 7.969 1.00 22.33 N ATOM 977 CA LYS A 497 -8.011 -4.114 6.848 1.00 40.45 C ATOM 978 C LYS A 497 -6.844 -4.620 5.981 1.00 22.50 C ATOM 979 O LYS A 497 -5.869 -3.899 5.750 1.00 14.44 O ATOM 980 CB LYS A 497 -8.978 -3.286 5.984 1.00 0.23 C ATOM 981 CG LYS A 497 -10.173 -2.715 6.746 1.00 75.54 C ATOM 982 CD LYS A 497 -11.071 -3.803 7.332 1.00 43.34 C ATOM 983 CE LYS A 497 -11.739 -4.645 6.250 1.00 62.13 C ATOM 984 NZ LYS A 497 -12.630 -5.685 6.829 1.00 75.50 N ATOM 0 H LYS A 497 -6.895 -2.542 7.686 1.00 22.33 H new ATOM 0 HA LYS A 497 -8.550 -4.969 7.257 1.00 40.45 H new ATOM 0 HB2 LYS A 497 -8.426 -2.464 5.529 1.00 0.23 H new ATOM 0 HB3 LYS A 497 -9.346 -3.912 5.171 1.00 0.23 H new ATOM 0 HG2 LYS A 497 -9.813 -2.074 7.551 1.00 75.54 H new ATOM 0 HG3 LYS A 497 -10.760 -2.087 6.076 1.00 75.54 H new ATOM 0 HD2 LYS A 497 -10.479 -4.450 7.980 1.00 43.34 H new ATOM 0 HD3 LYS A 497 -11.837 -3.342 7.956 1.00 43.34 H new ATOM 0 HE2 LYS A 497 -12.317 -3.997 5.591 1.00 62.13 H new ATOM 0 HE3 LYS A 497 -10.974 -5.122 5.637 1.00 62.13 H new ATOM 0 HZ1 LYS A 497 -13.065 -6.236 6.062 1.00 75.50 H new ATOM 0 HZ2 LYS A 497 -12.074 -6.319 7.438 1.00 75.50 H new ATOM 0 HZ3 LYS A 497 -13.375 -5.229 7.393 1.00 75.50 H new ATOM 998 N VAL A 498 -6.938 -5.860 5.510 1.00 12.44 N ATOM 999 CA VAL A 498 -5.887 -6.450 4.669 1.00 41.04 C ATOM 1000 C VAL A 498 -6.300 -6.474 3.188 1.00 60.03 C ATOM 1001 O VAL A 498 -7.283 -7.119 2.815 1.00 74.12 O ATOM 1002 CB VAL A 498 -5.539 -7.889 5.129 1.00 25.40 C ATOM 1003 CG1 VAL A 498 -4.390 -8.466 4.297 1.00 53.14 C ATOM 1004 CG2 VAL A 498 -5.203 -7.916 6.620 1.00 43.41 C ATOM 0 H VAL A 498 -7.728 -6.479 5.693 1.00 12.44 H new ATOM 0 HA VAL A 498 -5.005 -5.820 4.778 1.00 41.04 H new ATOM 0 HB VAL A 498 -6.416 -8.517 4.970 1.00 25.40 H new ATOM 0 HG11 VAL A 498 -4.165 -9.476 4.639 1.00 53.14 H new ATOM 0 HG12 VAL A 498 -4.680 -8.495 3.247 1.00 53.14 H new ATOM 0 HG13 VAL A 498 -3.506 -7.838 4.412 1.00 53.14 H new ATOM 0 HG21 VAL A 498 -4.962 -8.936 6.920 1.00 43.41 H new ATOM 0 HG22 VAL A 498 -4.347 -7.269 6.812 1.00 43.41 H new ATOM 0 HG23 VAL A 498 -6.060 -7.562 7.193 1.00 43.41 H new ATOM 1014 N LEU A 499 -5.550 -5.758 2.354 1.00 62.34 N ATOM 1015 CA LEU A 499 -5.798 -5.717 0.907 1.00 3.54 C ATOM 1016 C LEU A 499 -4.734 -6.529 0.150 1.00 10.24 C ATOM 1017 O LEU A 499 -3.552 -6.477 0.485 1.00 21.31 O ATOM 1018 CB LEU A 499 -5.792 -4.261 0.418 1.00 14.03 C ATOM 1019 CG LEU A 499 -6.759 -3.316 1.160 1.00 13.20 C ATOM 1020 CD1 LEU A 499 -6.565 -1.872 0.706 1.00 14.31 C ATOM 1021 CD2 LEU A 499 -8.208 -3.754 0.955 1.00 42.32 C ATOM 0 H LEU A 499 -4.757 -5.192 2.655 1.00 62.34 H new ATOM 0 HA LEU A 499 -6.774 -6.160 0.710 1.00 3.54 H new ATOM 0 HB2 LEU A 499 -4.780 -3.867 0.512 1.00 14.03 H new ATOM 0 HB3 LEU A 499 -6.041 -4.250 -0.643 1.00 14.03 H new ATOM 0 HG LEU A 499 -6.532 -3.371 2.225 1.00 13.20 H new ATOM 0 HD11 LEU A 499 -7.258 -1.225 1.244 1.00 14.31 H new ATOM 0 HD12 LEU A 499 -5.542 -1.560 0.914 1.00 14.31 H new ATOM 0 HD13 LEU A 499 -6.756 -1.798 -0.365 1.00 14.31 H new ATOM 0 HD21 LEU A 499 -8.873 -3.073 1.487 1.00 42.32 H new ATOM 0 HD22 LEU A 499 -8.446 -3.737 -0.108 1.00 42.32 H new ATOM 0 HD23 LEU A 499 -8.340 -4.765 1.340 1.00 42.32 H new ATOM 1033 N THR A 500 -5.154 -7.279 -0.864 1.00 2.32 N ATOM 1034 CA THR A 500 -4.224 -8.103 -1.658 1.00 32.44 C ATOM 1035 C THR A 500 -4.234 -7.719 -3.137 1.00 11.41 C ATOM 1036 O THR A 500 -5.212 -7.171 -3.651 1.00 35.04 O ATOM 1037 CB THR A 500 -4.547 -9.617 -1.569 1.00 31.42 C ATOM 1038 OG1 THR A 500 -5.915 -9.862 -1.938 1.00 65.45 O ATOM 1039 CG2 THR A 500 -4.284 -10.170 -0.174 1.00 0.32 C ATOM 0 H THR A 500 -6.128 -7.339 -1.161 1.00 2.32 H new ATOM 0 HA THR A 500 -3.242 -7.910 -1.226 1.00 32.44 H new ATOM 0 HB THR A 500 -3.886 -10.131 -2.267 1.00 31.42 H new ATOM 0 HG1 THR A 500 -6.103 -10.822 -1.879 1.00 65.45 H new ATOM 0 HG21 THR A 500 -4.523 -11.233 -0.153 1.00 0.32 H new ATOM 0 HG22 THR A 500 -3.234 -10.029 0.081 1.00 0.32 H new ATOM 0 HG23 THR A 500 -4.907 -9.644 0.549 1.00 0.32 H new ATOM 1047 N PHE A 501 -3.130 -8.013 -3.816 1.00 12.14 N ATOM 1048 CA PHE A 501 -3.061 -7.898 -5.275 1.00 75.35 C ATOM 1049 C PHE A 501 -2.033 -8.881 -5.852 1.00 74.32 C ATOM 1050 O PHE A 501 -1.030 -9.199 -5.210 1.00 25.22 O ATOM 1051 CB PHE A 501 -2.737 -6.455 -5.706 1.00 51.32 C ATOM 1052 CG PHE A 501 -1.406 -5.927 -5.219 1.00 64.43 C ATOM 1053 CD1 PHE A 501 -1.288 -5.352 -3.963 1.00 14.44 C ATOM 1054 CD2 PHE A 501 -0.279 -5.991 -6.030 1.00 13.25 C ATOM 1055 CE1 PHE A 501 -0.076 -4.853 -3.526 1.00 73.22 C ATOM 1056 CE2 PHE A 501 0.935 -5.495 -5.595 1.00 25.32 C ATOM 1057 CZ PHE A 501 1.036 -4.924 -4.342 1.00 74.21 C ATOM 0 H PHE A 501 -2.266 -8.334 -3.380 1.00 12.14 H new ATOM 0 HA PHE A 501 -4.042 -8.154 -5.675 1.00 75.35 H new ATOM 0 HB2 PHE A 501 -2.755 -6.404 -6.795 1.00 51.32 H new ATOM 0 HB3 PHE A 501 -3.527 -5.797 -5.343 1.00 51.32 H new ATOM 0 HD1 PHE A 501 -2.153 -5.293 -3.319 1.00 14.44 H new ATOM 0 HD2 PHE A 501 -0.353 -6.434 -7.012 1.00 13.25 H new ATOM 0 HE1 PHE A 501 0.002 -4.407 -2.545 1.00 73.22 H new ATOM 0 HE2 PHE A 501 1.804 -5.554 -6.234 1.00 25.32 H new ATOM 0 HZ PHE A 501 1.983 -4.533 -4.000 1.00 74.21 H new ATOM 1067 N SER A 502 -2.295 -9.360 -7.064 1.00 20.34 N ATOM 1068 CA SER A 502 -1.417 -10.326 -7.736 1.00 61.34 C ATOM 1069 C SER A 502 -0.834 -9.733 -9.025 1.00 34.52 C ATOM 1070 O SER A 502 -1.558 -9.452 -9.982 1.00 42.21 O ATOM 1071 CB SER A 502 -2.188 -11.619 -8.042 1.00 43.13 C ATOM 1072 OG SER A 502 -3.418 -11.345 -8.697 1.00 33.31 O ATOM 0 H SER A 502 -3.115 -9.095 -7.609 1.00 20.34 H new ATOM 0 HA SER A 502 -0.589 -10.559 -7.067 1.00 61.34 H new ATOM 0 HB2 SER A 502 -1.577 -12.269 -8.668 1.00 43.13 H new ATOM 0 HB3 SER A 502 -2.380 -12.158 -7.114 1.00 43.13 H new ATOM 0 HG SER A 502 -3.276 -10.666 -9.389 1.00 33.31 H new ATOM 1078 N TRP A 503 0.480 -9.555 -9.046 1.00 71.32 N ATOM 1079 CA TRP A 503 1.163 -8.900 -10.166 1.00 14.23 C ATOM 1080 C TRP A 503 1.992 -9.897 -10.995 1.00 52.43 C ATOM 1081 O TRP A 503 2.678 -10.762 -10.446 1.00 64.44 O ATOM 1082 CB TRP A 503 2.057 -7.776 -9.624 1.00 70.44 C ATOM 1083 CG TRP A 503 2.865 -7.067 -10.673 1.00 2.30 C ATOM 1084 CD1 TRP A 503 2.404 -6.487 -11.820 1.00 50.43 C ATOM 1085 CD2 TRP A 503 4.280 -6.845 -10.654 1.00 1.11 C ATOM 1086 NE1 TRP A 503 3.447 -5.930 -12.520 1.00 72.11 N ATOM 1087 CE2 TRP A 503 4.607 -6.134 -11.823 1.00 24.22 C ATOM 1088 CE3 TRP A 503 5.300 -7.180 -9.760 1.00 52.24 C ATOM 1089 CZ2 TRP A 503 5.913 -5.754 -12.120 1.00 33.50 C ATOM 1090 CZ3 TRP A 503 6.594 -6.802 -10.056 1.00 24.03 C ATOM 1091 CH2 TRP A 503 6.891 -6.094 -11.228 1.00 73.02 C ATOM 0 H TRP A 503 1.103 -9.856 -8.296 1.00 71.32 H new ATOM 0 HA TRP A 503 0.408 -8.483 -10.832 1.00 14.23 H new ATOM 0 HB2 TRP A 503 1.431 -7.047 -9.110 1.00 70.44 H new ATOM 0 HB3 TRP A 503 2.736 -8.194 -8.881 1.00 70.44 H new ATOM 0 HD1 TRP A 503 1.370 -6.469 -12.132 1.00 50.43 H new ATOM 0 HE1 TRP A 503 3.369 -5.444 -13.413 1.00 72.11 H new ATOM 0 HE3 TRP A 503 5.080 -7.725 -8.854 1.00 52.24 H new ATOM 0 HZ2 TRP A 503 6.145 -5.210 -13.023 1.00 33.50 H new ATOM 0 HZ3 TRP A 503 7.391 -7.056 -9.373 1.00 24.03 H new ATOM 0 HH2 TRP A 503 7.913 -5.811 -11.431 1.00 73.02 H new ATOM 1102 N THR A 504 1.907 -9.774 -12.321 1.00 75.40 N ATOM 1103 CA THR A 504 2.710 -10.593 -13.239 1.00 62.43 C ATOM 1104 C THR A 504 3.727 -9.728 -14.002 1.00 4.12 C ATOM 1105 O THR A 504 3.376 -9.035 -14.961 1.00 44.03 O ATOM 1106 CB THR A 504 1.816 -11.347 -14.261 1.00 42.04 C ATOM 1107 OG1 THR A 504 0.939 -12.256 -13.574 1.00 12.03 O ATOM 1108 CG2 THR A 504 2.652 -12.121 -15.277 1.00 44.21 C ATOM 0 H THR A 504 1.287 -9.112 -12.788 1.00 75.40 H new ATOM 0 HA THR A 504 3.241 -11.324 -12.629 1.00 62.43 H new ATOM 0 HB THR A 504 1.230 -10.601 -14.798 1.00 42.04 H new ATOM 0 HG1 THR A 504 0.378 -12.725 -14.226 1.00 12.03 H new ATOM 0 HG21 THR A 504 1.992 -12.635 -15.975 1.00 44.21 H new ATOM 0 HG22 THR A 504 3.291 -11.429 -15.825 1.00 44.21 H new ATOM 0 HG23 THR A 504 3.271 -12.852 -14.757 1.00 44.21 H new ATOM 1116 N PRO A 505 5.004 -9.745 -13.577 1.00 61.41 N ATOM 1117 CA PRO A 505 6.068 -8.979 -14.243 1.00 64.35 C ATOM 1118 C PRO A 505 6.471 -9.572 -15.605 1.00 71.44 C ATOM 1119 O PRO A 505 7.381 -10.395 -15.693 1.00 42.21 O ATOM 1120 CB PRO A 505 7.232 -9.056 -13.246 1.00 43.52 C ATOM 1121 CG PRO A 505 7.005 -10.332 -12.505 1.00 11.13 C ATOM 1122 CD PRO A 505 5.510 -10.493 -12.407 1.00 42.42 C ATOM 0 HA PRO A 505 5.752 -7.962 -14.475 1.00 64.35 H new ATOM 0 HB2 PRO A 505 8.194 -9.060 -13.758 1.00 43.52 H new ATOM 0 HB3 PRO A 505 7.234 -8.200 -12.571 1.00 43.52 H new ATOM 0 HG2 PRO A 505 7.455 -11.174 -13.031 1.00 11.13 H new ATOM 0 HG3 PRO A 505 7.459 -10.295 -11.515 1.00 11.13 H new ATOM 0 HD2 PRO A 505 5.216 -11.542 -12.444 1.00 42.42 H new ATOM 0 HD3 PRO A 505 5.123 -10.086 -11.473 1.00 42.42 H new ATOM 1130 N THR A 506 5.786 -9.152 -16.667 1.00 2.10 N ATOM 1131 CA THR A 506 6.062 -9.653 -18.027 1.00 12.32 C ATOM 1132 C THR A 506 7.338 -9.050 -18.636 1.00 32.35 C ATOM 1133 O THR A 506 7.638 -9.274 -19.808 1.00 22.22 O ATOM 1134 CB THR A 506 4.876 -9.375 -18.980 1.00 13.22 C ATOM 1135 OG1 THR A 506 4.513 -7.985 -18.922 1.00 54.44 O ATOM 1136 CG2 THR A 506 3.673 -10.245 -18.626 1.00 35.25 C ATOM 0 H THR A 506 5.033 -8.465 -16.620 1.00 2.10 H new ATOM 0 HA THR A 506 6.208 -10.728 -17.920 1.00 12.32 H new ATOM 0 HB THR A 506 5.189 -9.623 -19.994 1.00 13.22 H new ATOM 0 HG1 THR A 506 3.763 -7.817 -19.530 1.00 54.44 H new ATOM 0 HG21 THR A 506 2.854 -10.029 -19.312 1.00 35.25 H new ATOM 0 HG22 THR A 506 3.948 -11.297 -18.708 1.00 35.25 H new ATOM 0 HG23 THR A 506 3.357 -10.031 -17.605 1.00 35.25 H new ATOM 1144 N GLN A 507 8.086 -8.290 -17.842 1.00 53.11 N ATOM 1145 CA GLN A 507 9.359 -7.719 -18.291 1.00 33.14 C ATOM 1146 C GLN A 507 10.379 -7.708 -17.141 1.00 32.34 C ATOM 1147 O GLN A 507 10.044 -7.342 -16.011 1.00 63.01 O ATOM 1148 CB GLN A 507 9.144 -6.295 -18.830 1.00 1.32 C ATOM 1149 CG GLN A 507 10.350 -5.728 -19.573 1.00 13.05 C ATOM 1150 CD GLN A 507 10.659 -6.477 -20.861 1.00 41.40 C ATOM 1151 OE1 GLN A 507 9.769 -7.000 -21.524 1.00 52.34 O ATOM 1152 NE2 GLN A 507 11.922 -6.544 -21.219 1.00 60.25 N ATOM 0 H GLN A 507 7.835 -8.053 -16.882 1.00 53.11 H new ATOM 0 HA GLN A 507 9.753 -8.340 -19.095 1.00 33.14 H new ATOM 0 HB2 GLN A 507 8.284 -6.296 -19.500 1.00 1.32 H new ATOM 0 HB3 GLN A 507 8.899 -5.635 -17.998 1.00 1.32 H new ATOM 0 HG2 GLN A 507 10.167 -4.679 -19.804 1.00 13.05 H new ATOM 0 HG3 GLN A 507 11.222 -5.764 -18.920 1.00 13.05 H new ATOM 0 HE21 GLN A 507 12.639 -6.099 -20.646 1.00 60.25 H new ATOM 0 HE22 GLN A 507 12.185 -7.041 -22.070 1.00 60.25 H new ATOM 1161 N GLU A 508 11.616 -8.107 -17.431 1.00 34.02 N ATOM 1162 CA GLU A 508 12.661 -8.218 -16.401 1.00 1.22 C ATOM 1163 C GLU A 508 13.215 -6.843 -15.982 1.00 61.11 C ATOM 1164 O GLU A 508 13.204 -5.887 -16.762 1.00 2.21 O ATOM 1165 CB GLU A 508 13.806 -9.125 -16.887 1.00 63.20 C ATOM 1166 CG GLU A 508 14.759 -8.489 -17.905 1.00 41.52 C ATOM 1167 CD GLU A 508 14.067 -7.980 -19.164 1.00 35.51 C ATOM 1168 OE1 GLU A 508 13.436 -8.790 -19.870 1.00 20.03 O ATOM 1169 OE2 GLU A 508 14.175 -6.767 -19.465 1.00 71.42 O ATOM 0 H GLU A 508 11.925 -8.360 -18.370 1.00 34.02 H new ATOM 0 HA GLU A 508 12.196 -8.666 -15.522 1.00 1.22 H new ATOM 0 HB2 GLU A 508 14.386 -9.445 -16.022 1.00 63.20 H new ATOM 0 HB3 GLU A 508 13.374 -10.022 -17.330 1.00 63.20 H new ATOM 0 HG2 GLU A 508 15.282 -7.660 -17.429 1.00 41.52 H new ATOM 0 HG3 GLU A 508 15.514 -9.222 -18.188 1.00 41.52 H new ATOM 1176 N GLY A 509 13.678 -6.745 -14.737 1.00 3.32 N ATOM 1177 CA GLY A 509 14.257 -5.499 -14.242 1.00 62.31 C ATOM 1178 C GLY A 509 13.999 -5.269 -12.758 1.00 53.34 C ATOM 1179 O GLY A 509 13.546 -6.173 -12.050 1.00 2.43 O ATOM 0 H GLY A 509 13.664 -7.506 -14.058 1.00 3.32 H new ATOM 0 HA2 GLY A 509 15.332 -5.509 -14.421 1.00 62.31 H new ATOM 0 HA3 GLY A 509 13.847 -4.664 -14.810 1.00 62.31 H new ATOM 1183 N MET A 510 14.295 -4.061 -12.281 1.00 32.22 N ATOM 1184 CA MET A 510 14.072 -3.708 -10.877 1.00 43.21 C ATOM 1185 C MET A 510 12.765 -2.912 -10.713 1.00 10.33 C ATOM 1186 O MET A 510 12.570 -1.880 -11.360 1.00 2.20 O ATOM 1187 CB MET A 510 15.256 -2.895 -10.340 1.00 31.31 C ATOM 1188 CG MET A 510 15.280 -2.800 -8.821 1.00 63.24 C ATOM 1189 SD MET A 510 15.353 -4.429 -8.050 1.00 62.21 S ATOM 1190 CE MET A 510 15.254 -4.002 -6.312 1.00 53.22 C ATOM 0 H MET A 510 14.690 -3.309 -12.845 1.00 32.22 H new ATOM 0 HA MET A 510 13.986 -4.631 -10.303 1.00 43.21 H new ATOM 0 HB2 MET A 510 16.185 -3.349 -10.684 1.00 31.31 H new ATOM 0 HB3 MET A 510 15.218 -1.890 -10.760 1.00 31.31 H new ATOM 0 HG2 MET A 510 16.141 -2.210 -8.507 1.00 63.24 H new ATOM 0 HG3 MET A 510 14.390 -2.274 -8.475 1.00 63.24 H new ATOM 0 HE1 MET A 510 16.185 -4.276 -5.816 1.00 53.22 H new ATOM 0 HE2 MET A 510 15.091 -2.929 -6.210 1.00 53.22 H new ATOM 0 HE3 MET A 510 14.426 -4.541 -5.852 1.00 53.22 H new ATOM 1200 N TYR A 511 11.868 -3.392 -9.855 1.00 71.30 N ATOM 1201 CA TYR A 511 10.569 -2.740 -9.648 1.00 63.45 C ATOM 1202 C TYR A 511 10.295 -2.481 -8.160 1.00 75.42 C ATOM 1203 O TYR A 511 10.106 -3.409 -7.377 1.00 74.33 O ATOM 1204 CB TYR A 511 9.446 -3.597 -10.250 1.00 71.43 C ATOM 1205 CG TYR A 511 9.597 -3.830 -11.742 1.00 42.04 C ATOM 1206 CD1 TYR A 511 10.345 -4.900 -12.221 1.00 14.14 C ATOM 1207 CD2 TYR A 511 9.003 -2.979 -12.669 1.00 61.42 C ATOM 1208 CE1 TYR A 511 10.498 -5.114 -13.576 1.00 61.34 C ATOM 1209 CE2 TYR A 511 9.155 -3.187 -14.026 1.00 43.53 C ATOM 1210 CZ TYR A 511 9.901 -4.256 -14.474 1.00 41.51 C ATOM 1211 OH TYR A 511 10.065 -4.461 -15.826 1.00 54.44 O ATOM 0 H TYR A 511 12.013 -4.229 -9.290 1.00 71.30 H new ATOM 0 HA TYR A 511 10.598 -1.775 -10.153 1.00 63.45 H new ATOM 0 HB2 TYR A 511 9.422 -4.560 -9.740 1.00 71.43 H new ATOM 0 HB3 TYR A 511 8.488 -3.112 -10.061 1.00 71.43 H new ATOM 0 HD1 TYR A 511 10.814 -5.575 -11.521 1.00 14.14 H new ATOM 0 HD2 TYR A 511 8.414 -2.143 -12.322 1.00 61.42 H new ATOM 0 HE1 TYR A 511 11.083 -5.950 -13.931 1.00 61.34 H new ATOM 0 HE2 TYR A 511 8.691 -2.515 -14.733 1.00 43.53 H new ATOM 0 HH TYR A 511 10.074 -5.423 -16.012 1.00 54.44 H new ATOM 1221 N ARG A 512 10.282 -1.209 -7.781 1.00 33.24 N ATOM 1222 CA ARG A 512 9.993 -0.810 -6.401 1.00 25.15 C ATOM 1223 C ARG A 512 8.506 -0.468 -6.223 1.00 54.04 C ATOM 1224 O ARG A 512 7.977 0.424 -6.890 1.00 51.43 O ATOM 1225 CB ARG A 512 10.862 0.393 -6.010 1.00 34.54 C ATOM 1226 CG ARG A 512 10.569 0.940 -4.615 1.00 13.14 C ATOM 1227 CD ARG A 512 11.482 2.109 -4.261 1.00 54.05 C ATOM 1228 NE ARG A 512 12.886 1.708 -4.163 1.00 53.42 N ATOM 1229 CZ ARG A 512 13.814 2.425 -3.586 1.00 75.12 C ATOM 1230 NH1 ARG A 512 13.538 3.588 -3.093 1.00 1.34 N ATOM 1231 NH2 ARG A 512 15.023 1.983 -3.519 1.00 51.15 N ATOM 0 H ARG A 512 10.469 -0.429 -8.411 1.00 33.24 H new ATOM 0 HA ARG A 512 10.227 -1.650 -5.747 1.00 25.15 H new ATOM 0 HB2 ARG A 512 11.911 0.103 -6.063 1.00 34.54 H new ATOM 0 HB3 ARG A 512 10.714 1.189 -6.740 1.00 34.54 H new ATOM 0 HG2 ARG A 512 9.529 1.262 -4.562 1.00 13.14 H new ATOM 0 HG3 ARG A 512 10.694 0.145 -3.879 1.00 13.14 H new ATOM 0 HD2 ARG A 512 11.381 2.888 -5.017 1.00 54.05 H new ATOM 0 HD3 ARG A 512 11.163 2.542 -3.313 1.00 54.05 H new ATOM 0 HE ARG A 512 13.157 0.813 -4.570 1.00 53.42 H new ATOM 0 HH11 ARG A 512 12.588 3.955 -3.152 1.00 1.34 H new ATOM 0 HH12 ARG A 512 14.270 4.139 -2.645 1.00 1.34 H new ATOM 0 HH21 ARG A 512 15.256 1.073 -3.916 1.00 51.15 H new ATOM 0 HH22 ARG A 512 15.747 2.543 -3.069 1.00 51.15 H new ATOM 1245 N ILE A 513 7.837 -1.184 -5.326 1.00 42.40 N ATOM 1246 CA ILE A 513 6.419 -0.957 -5.045 1.00 61.42 C ATOM 1247 C ILE A 513 6.225 -0.028 -3.832 1.00 51.21 C ATOM 1248 O ILE A 513 6.763 -0.273 -2.750 1.00 73.51 O ATOM 1249 CB ILE A 513 5.684 -2.299 -4.788 1.00 34.41 C ATOM 1250 CG1 ILE A 513 5.842 -3.236 -6.002 1.00 73.25 C ATOM 1251 CG2 ILE A 513 4.205 -2.058 -4.477 1.00 33.42 C ATOM 1252 CD1 ILE A 513 5.215 -4.604 -5.814 1.00 73.21 C ATOM 0 H ILE A 513 8.256 -1.933 -4.775 1.00 42.40 H new ATOM 0 HA ILE A 513 5.992 -0.475 -5.925 1.00 61.42 H new ATOM 0 HB ILE A 513 6.136 -2.779 -3.920 1.00 34.41 H new ATOM 0 HG12 ILE A 513 5.395 -2.760 -6.875 1.00 73.25 H new ATOM 0 HG13 ILE A 513 6.904 -3.361 -6.215 1.00 73.25 H new ATOM 0 HG21 ILE A 513 3.710 -3.013 -4.300 1.00 33.42 H new ATOM 0 HG22 ILE A 513 4.117 -1.434 -3.588 1.00 33.42 H new ATOM 0 HG23 ILE A 513 3.733 -1.555 -5.321 1.00 33.42 H new ATOM 0 HD11 ILE A 513 5.370 -5.202 -6.712 1.00 73.21 H new ATOM 0 HD12 ILE A 513 5.678 -5.102 -4.962 1.00 73.21 H new ATOM 0 HD13 ILE A 513 4.146 -4.492 -5.632 1.00 73.21 H new ATOM 1264 N ASN A 514 5.460 1.045 -4.027 1.00 5.25 N ATOM 1265 CA ASN A 514 5.156 2.003 -2.956 1.00 23.22 C ATOM 1266 C ASN A 514 3.641 2.185 -2.783 1.00 21.40 C ATOM 1267 O ASN A 514 2.925 2.445 -3.747 1.00 74.30 O ATOM 1268 CB ASN A 514 5.803 3.361 -3.254 1.00 22.32 C ATOM 1269 CG ASN A 514 7.317 3.308 -3.216 1.00 72.35 C ATOM 1270 OD1 ASN A 514 7.974 3.088 -4.229 1.00 73.41 O ATOM 1271 ND2 ASN A 514 7.884 3.506 -2.043 1.00 1.23 N ATOM 0 H ASN A 514 5.034 1.277 -4.924 1.00 5.25 H new ATOM 0 HA ASN A 514 5.565 1.601 -2.029 1.00 23.22 H new ATOM 0 HB2 ASN A 514 5.480 3.705 -4.237 1.00 22.32 H new ATOM 0 HB3 ASN A 514 5.451 4.094 -2.528 1.00 22.32 H new ATOM 0 HD21 ASN A 514 8.900 3.479 -1.957 1.00 1.23 H new ATOM 0 HD22 ASN A 514 7.307 3.686 -1.222 1.00 1.23 H new ATOM 1278 N ALA A 515 3.161 2.058 -1.550 1.00 4.14 N ATOM 1279 CA ALA A 515 1.735 2.245 -1.256 1.00 51.02 C ATOM 1280 C ALA A 515 1.501 3.498 -0.406 1.00 55.21 C ATOM 1281 O ALA A 515 2.332 3.858 0.433 1.00 34.45 O ATOM 1282 CB ALA A 515 1.161 1.022 -0.547 1.00 43.12 C ATOM 0 H ALA A 515 3.732 1.827 -0.737 1.00 4.14 H new ATOM 0 HA ALA A 515 1.221 2.374 -2.208 1.00 51.02 H new ATOM 0 HB1 ALA A 515 0.103 1.185 -0.340 1.00 43.12 H new ATOM 0 HB2 ALA A 515 1.275 0.145 -1.184 1.00 43.12 H new ATOM 0 HB3 ALA A 515 1.694 0.861 0.390 1.00 43.12 H new ATOM 1288 N THR A 516 0.369 4.158 -0.633 1.00 60.54 N ATOM 1289 CA THR A 516 -0.010 5.358 0.127 1.00 33.03 C ATOM 1290 C THR A 516 -1.441 5.244 0.654 1.00 64.32 C ATOM 1291 O THR A 516 -2.324 4.740 -0.038 1.00 75.02 O ATOM 1292 CB THR A 516 0.086 6.642 -0.739 1.00 13.30 C ATOM 1293 OG1 THR A 516 -0.760 6.532 -1.897 1.00 41.13 O ATOM 1294 CG2 THR A 516 1.523 6.904 -1.180 1.00 71.34 C ATOM 0 H THR A 516 -0.311 3.884 -1.342 1.00 60.54 H new ATOM 0 HA THR A 516 0.691 5.430 0.958 1.00 33.03 H new ATOM 0 HB THR A 516 -0.248 7.479 -0.126 1.00 13.30 H new ATOM 0 HG1 THR A 516 -0.690 7.350 -2.432 1.00 41.13 H new ATOM 0 HG21 THR A 516 1.558 7.810 -1.785 1.00 71.34 H new ATOM 0 HG22 THR A 516 2.156 7.029 -0.302 1.00 71.34 H new ATOM 0 HG23 THR A 516 1.882 6.060 -1.769 1.00 71.34 H new ATOM 1302 N VAL A 517 -1.677 5.714 1.879 1.00 60.12 N ATOM 1303 CA VAL A 517 -3.038 5.753 2.428 1.00 54.11 C ATOM 1304 C VAL A 517 -3.614 7.170 2.316 1.00 12.20 C ATOM 1305 O VAL A 517 -2.920 8.148 2.599 1.00 21.05 O ATOM 1306 CB VAL A 517 -3.072 5.279 3.906 1.00 32.43 C ATOM 1307 CG1 VAL A 517 -2.146 6.120 4.782 1.00 32.14 C ATOM 1308 CG2 VAL A 517 -4.496 5.292 4.454 1.00 63.34 C ATOM 0 H VAL A 517 -0.955 6.070 2.506 1.00 60.12 H new ATOM 0 HA VAL A 517 -3.651 5.067 1.843 1.00 54.11 H new ATOM 0 HB VAL A 517 -2.709 4.251 3.929 1.00 32.43 H new ATOM 0 HG11 VAL A 517 -2.194 5.762 5.810 1.00 32.14 H new ATOM 0 HG12 VAL A 517 -1.123 6.036 4.415 1.00 32.14 H new ATOM 0 HG13 VAL A 517 -2.460 7.163 4.746 1.00 32.14 H new ATOM 0 HG21 VAL A 517 -4.490 4.955 5.491 1.00 63.34 H new ATOM 0 HG22 VAL A 517 -4.896 6.305 4.403 1.00 63.34 H new ATOM 0 HG23 VAL A 517 -5.121 4.625 3.860 1.00 63.34 H new ATOM 1318 N ASP A 518 -4.894 7.259 1.936 1.00 60.54 N ATOM 1319 CA ASP A 518 -5.529 8.532 1.561 1.00 3.31 C ATOM 1320 C ASP A 518 -4.535 9.448 0.832 1.00 4.41 C ATOM 1321 O ASP A 518 -4.065 10.449 1.372 1.00 25.11 O ATOM 1322 CB ASP A 518 -6.163 9.233 2.776 1.00 11.55 C ATOM 1323 CG ASP A 518 -7.133 10.338 2.372 1.00 12.15 C ATOM 1324 OD1 ASP A 518 -7.438 10.465 1.160 1.00 64.31 O ATOM 1325 OD2 ASP A 518 -7.611 11.078 3.255 1.00 32.41 O ATOM 0 H ASP A 518 -5.519 6.455 1.879 1.00 60.54 H new ATOM 0 HA ASP A 518 -6.340 8.305 0.869 1.00 3.31 H new ATOM 0 HB2 ASP A 518 -6.689 8.496 3.383 1.00 11.55 H new ATOM 0 HB3 ASP A 518 -5.375 9.656 3.400 1.00 11.55 H new ATOM 1330 N GLU A 519 -4.216 9.066 -0.402 1.00 30.31 N ATOM 1331 CA GLU A 519 -3.221 9.766 -1.217 1.00 55.23 C ATOM 1332 C GLU A 519 -3.498 11.278 -1.279 1.00 3.05 C ATOM 1333 O GLU A 519 -2.591 12.094 -1.109 1.00 12.10 O ATOM 1334 CB GLU A 519 -3.211 9.150 -2.627 1.00 42.03 C ATOM 1335 CG GLU A 519 -2.033 9.563 -3.509 1.00 55.12 C ATOM 1336 CD GLU A 519 -2.121 10.989 -4.048 1.00 24.43 C ATOM 1337 OE1 GLU A 519 -3.112 11.313 -4.732 1.00 20.31 O ATOM 1338 OE2 GLU A 519 -1.186 11.781 -3.804 1.00 41.33 O ATOM 0 H GLU A 519 -4.639 8.263 -0.867 1.00 30.31 H new ATOM 0 HA GLU A 519 -2.240 9.646 -0.757 1.00 55.23 H new ATOM 0 HB2 GLU A 519 -3.210 8.064 -2.532 1.00 42.03 H new ATOM 0 HB3 GLU A 519 -4.137 9.425 -3.133 1.00 42.03 H new ATOM 0 HG2 GLU A 519 -1.112 9.460 -2.936 1.00 55.12 H new ATOM 0 HG3 GLU A 519 -1.964 8.873 -4.350 1.00 55.12 H new ATOM 1345 N GLU A 520 -4.758 11.640 -1.506 1.00 11.11 N ATOM 1346 CA GLU A 520 -5.161 13.048 -1.595 1.00 14.21 C ATOM 1347 C GLU A 520 -5.080 13.744 -0.228 1.00 45.51 C ATOM 1348 O GLU A 520 -5.067 14.974 -0.150 1.00 62.31 O ATOM 1349 CB GLU A 520 -6.594 13.157 -2.136 1.00 11.31 C ATOM 1350 CG GLU A 520 -6.826 12.387 -3.431 1.00 42.22 C ATOM 1351 CD GLU A 520 -8.170 12.699 -4.069 1.00 32.43 C ATOM 1352 OE1 GLU A 520 -9.185 12.084 -3.675 1.00 12.52 O ATOM 1353 OE2 GLU A 520 -8.215 13.564 -4.969 1.00 30.32 O ATOM 0 H GLU A 520 -5.523 10.978 -1.633 1.00 11.11 H new ATOM 0 HA GLU A 520 -4.471 13.544 -2.277 1.00 14.21 H new ATOM 0 HB2 GLU A 520 -7.287 12.791 -1.378 1.00 11.31 H new ATOM 0 HB3 GLU A 520 -6.830 14.208 -2.303 1.00 11.31 H new ATOM 0 HG2 GLU A 520 -6.030 12.624 -4.137 1.00 42.22 H new ATOM 0 HG3 GLU A 520 -6.764 11.318 -3.229 1.00 42.22 H new ATOM 1360 N ASN A 521 -5.025 12.941 0.834 1.00 44.22 N ATOM 1361 CA ASN A 521 -5.035 13.430 2.215 1.00 31.55 C ATOM 1362 C ASN A 521 -6.204 14.395 2.459 1.00 11.24 C ATOM 1363 O ASN A 521 -6.053 15.617 2.433 1.00 12.30 O ATOM 1364 CB ASN A 521 -3.694 14.072 2.596 1.00 53.33 C ATOM 1365 CG ASN A 521 -3.628 14.409 4.073 1.00 54.31 C ATOM 1366 OD1 ASN A 521 -3.865 15.543 4.482 1.00 13.32 O ATOM 1367 ND2 ASN A 521 -3.342 13.418 4.887 1.00 12.24 N ATOM 0 H ASN A 521 -4.972 11.925 0.761 1.00 44.22 H new ATOM 0 HA ASN A 521 -5.179 12.566 2.864 1.00 31.55 H new ATOM 0 HB2 ASN A 521 -2.881 13.392 2.342 1.00 53.33 H new ATOM 0 HB3 ASN A 521 -3.546 14.979 2.010 1.00 53.33 H new ATOM 0 HD21 ASN A 521 -3.311 13.578 5.894 1.00 12.24 H new ATOM 0 HD22 ASN A 521 -3.151 12.489 4.512 1.00 12.24 H new ATOM 1374 N THR A 522 -7.378 13.818 2.654 1.00 41.40 N ATOM 1375 CA THR A 522 -8.594 14.582 2.943 1.00 4.00 C ATOM 1376 C THR A 522 -8.868 14.622 4.450 1.00 54.12 C ATOM 1377 O THR A 522 -9.874 15.177 4.904 1.00 31.20 O ATOM 1378 CB THR A 522 -9.815 13.975 2.208 1.00 13.12 C ATOM 1379 OG1 THR A 522 -10.041 12.621 2.639 1.00 42.33 O ATOM 1380 CG2 THR A 522 -9.603 13.999 0.696 1.00 62.32 C ATOM 0 H THR A 522 -7.522 12.809 2.618 1.00 41.40 H new ATOM 0 HA THR A 522 -8.437 15.600 2.585 1.00 4.00 H new ATOM 0 HB THR A 522 -10.688 14.580 2.453 1.00 13.12 H new ATOM 0 HG1 THR A 522 -9.190 12.218 2.910 1.00 42.33 H new ATOM 0 HG21 THR A 522 -10.473 13.568 0.200 1.00 62.32 H new ATOM 0 HG22 THR A 522 -9.469 15.028 0.364 1.00 62.32 H new ATOM 0 HG23 THR A 522 -8.716 13.418 0.444 1.00 62.32 H new ATOM 1388 N VAL A 523 -7.960 14.026 5.221 1.00 0.51 N ATOM 1389 CA VAL A 523 -8.033 14.031 6.685 1.00 2.32 C ATOM 1390 C VAL A 523 -6.632 14.236 7.295 1.00 33.34 C ATOM 1391 O VAL A 523 -5.642 13.737 6.767 1.00 31.21 O ATOM 1392 CB VAL A 523 -8.656 12.714 7.223 1.00 22.10 C ATOM 1393 CG1 VAL A 523 -7.795 11.505 6.861 1.00 24.03 C ATOM 1394 CG2 VAL A 523 -8.882 12.791 8.731 1.00 63.33 C ATOM 0 H VAL A 523 -7.152 13.525 4.850 1.00 0.51 H new ATOM 0 HA VAL A 523 -8.676 14.860 6.981 1.00 2.32 H new ATOM 0 HB VAL A 523 -9.626 12.587 6.743 1.00 22.10 H new ATOM 0 HG11 VAL A 523 -8.258 10.599 7.252 1.00 24.03 H new ATOM 0 HG12 VAL A 523 -7.710 11.431 5.777 1.00 24.03 H new ATOM 0 HG13 VAL A 523 -6.802 11.622 7.296 1.00 24.03 H new ATOM 0 HG21 VAL A 523 -9.319 11.856 9.082 1.00 63.33 H new ATOM 0 HG22 VAL A 523 -7.929 12.957 9.234 1.00 63.33 H new ATOM 0 HG23 VAL A 523 -9.559 13.615 8.956 1.00 63.33 H new ATOM 1404 N VAL A 524 -6.548 14.994 8.384 1.00 71.51 N ATOM 1405 CA VAL A 524 -5.257 15.276 9.029 1.00 3.22 C ATOM 1406 C VAL A 524 -4.882 14.194 10.057 1.00 3.23 C ATOM 1407 O VAL A 524 -5.572 14.013 11.063 1.00 52.13 O ATOM 1408 CB VAL A 524 -5.269 16.659 9.729 1.00 5.01 C ATOM 1409 CG1 VAL A 524 -3.917 16.956 10.377 1.00 33.32 C ATOM 1410 CG2 VAL A 524 -5.652 17.757 8.736 1.00 72.23 C ATOM 0 H VAL A 524 -7.351 15.425 8.842 1.00 71.51 H new ATOM 0 HA VAL A 524 -4.509 15.279 8.236 1.00 3.22 H new ATOM 0 HB VAL A 524 -6.019 16.635 10.520 1.00 5.01 H new ATOM 0 HG11 VAL A 524 -3.952 17.932 10.861 1.00 33.32 H new ATOM 0 HG12 VAL A 524 -3.693 16.190 11.120 1.00 33.32 H new ATOM 0 HG13 VAL A 524 -3.140 16.958 9.613 1.00 33.32 H new ATOM 0 HG21 VAL A 524 -5.656 18.722 9.244 1.00 72.23 H new ATOM 0 HG22 VAL A 524 -4.929 17.779 7.921 1.00 72.23 H new ATOM 0 HG23 VAL A 524 -6.645 17.554 8.335 1.00 72.23 H new ATOM 1420 N GLU A 525 -3.789 13.475 9.798 1.00 65.44 N ATOM 1421 CA GLU A 525 -3.313 12.428 10.712 1.00 50.40 C ATOM 1422 C GLU A 525 -2.282 12.969 11.717 1.00 61.21 C ATOM 1423 O GLU A 525 -1.802 14.097 11.598 1.00 11.25 O ATOM 1424 CB GLU A 525 -2.689 11.250 9.937 1.00 14.23 C ATOM 1425 CG GLU A 525 -3.586 10.656 8.846 1.00 41.01 C ATOM 1426 CD GLU A 525 -3.413 11.328 7.488 1.00 40.10 C ATOM 1427 OE1 GLU A 525 -2.907 12.471 7.438 1.00 32.22 O ATOM 1428 OE2 GLU A 525 -3.762 10.702 6.468 1.00 3.12 O ATOM 0 H GLU A 525 -3.215 13.596 8.964 1.00 65.44 H new ATOM 0 HA GLU A 525 -4.187 12.078 11.261 1.00 50.40 H new ATOM 0 HB2 GLU A 525 -1.758 11.586 9.480 1.00 14.23 H new ATOM 0 HB3 GLU A 525 -2.431 10.463 10.645 1.00 14.23 H new ATOM 0 HG2 GLU A 525 -3.369 9.592 8.747 1.00 41.01 H new ATOM 0 HG3 GLU A 525 -4.628 10.742 9.156 1.00 41.01 H new ATOM 1435 N LEU A 526 -1.947 12.143 12.707 1.00 73.21 N ATOM 1436 CA LEU A 526 -0.951 12.494 13.727 1.00 13.23 C ATOM 1437 C LEU A 526 0.470 12.578 13.140 1.00 53.32 C ATOM 1438 O LEU A 526 1.312 13.331 13.635 1.00 71.44 O ATOM 1439 CB LEU A 526 -0.981 11.457 14.860 1.00 2.22 C ATOM 1440 CG LEU A 526 -2.304 11.371 15.638 1.00 12.04 C ATOM 1441 CD1 LEU A 526 -2.266 10.222 16.645 1.00 75.13 C ATOM 1442 CD2 LEU A 526 -2.601 12.698 16.339 1.00 3.30 C ATOM 0 H LEU A 526 -2.354 11.216 12.827 1.00 73.21 H new ATOM 0 HA LEU A 526 -1.209 13.479 14.115 1.00 13.23 H new ATOM 0 HB2 LEU A 526 -0.762 10.476 14.438 1.00 2.22 H new ATOM 0 HB3 LEU A 526 -0.180 11.688 15.562 1.00 2.22 H new ATOM 0 HG LEU A 526 -3.107 11.172 14.928 1.00 12.04 H new ATOM 0 HD11 LEU A 526 -3.212 10.180 17.184 1.00 75.13 H new ATOM 0 HD12 LEU A 526 -2.106 9.281 16.118 1.00 75.13 H new ATOM 0 HD13 LEU A 526 -1.452 10.384 17.352 1.00 75.13 H new ATOM 0 HD21 LEU A 526 -3.541 12.619 16.885 1.00 3.30 H new ATOM 0 HD22 LEU A 526 -1.795 12.930 17.036 1.00 3.30 H new ATOM 0 HD23 LEU A 526 -2.678 13.492 15.597 1.00 3.30 H new ATOM 1454 N ASN A 527 0.730 11.802 12.090 1.00 64.24 N ATOM 1455 CA ASN A 527 2.059 11.750 11.465 1.00 32.45 C ATOM 1456 C ASN A 527 1.956 11.650 9.933 1.00 62.24 C ATOM 1457 O ASN A 527 1.275 10.773 9.404 1.00 24.51 O ATOM 1458 CB ASN A 527 2.847 10.562 12.037 1.00 24.11 C ATOM 1459 CG ASN A 527 4.183 10.334 11.349 1.00 14.14 C ATOM 1460 OD1 ASN A 527 4.797 11.255 10.819 1.00 1.20 O ATOM 1461 ND2 ASN A 527 4.645 9.099 11.359 1.00 74.24 N ATOM 0 H ASN A 527 0.038 11.196 11.649 1.00 64.24 H new ATOM 0 HA ASN A 527 2.587 12.676 11.693 1.00 32.45 H new ATOM 0 HB2 ASN A 527 3.019 10.728 13.101 1.00 24.11 H new ATOM 0 HB3 ASN A 527 2.243 9.659 11.949 1.00 24.11 H new ATOM 0 HD21 ASN A 527 5.539 8.885 10.917 1.00 74.24 H new ATOM 0 HD22 ASN A 527 4.108 8.357 11.809 1.00 74.24 H new ATOM 1468 N GLU A 528 2.663 12.537 9.229 1.00 12.43 N ATOM 1469 CA GLU A 528 2.594 12.603 7.761 1.00 64.04 C ATOM 1470 C GLU A 528 3.537 11.584 7.103 1.00 14.32 C ATOM 1471 O GLU A 528 3.321 11.157 5.970 1.00 1.04 O ATOM 1472 CB GLU A 528 2.955 14.016 7.286 1.00 55.31 C ATOM 1473 CG GLU A 528 2.189 15.123 8.005 1.00 3.42 C ATOM 1474 CD GLU A 528 2.481 16.504 7.439 1.00 14.31 C ATOM 1475 OE1 GLU A 528 3.558 17.061 7.737 1.00 44.33 O ATOM 1476 OE2 GLU A 528 1.632 17.033 6.690 1.00 64.11 O ATOM 0 H GLU A 528 3.292 13.222 9.649 1.00 12.43 H new ATOM 0 HA GLU A 528 1.573 12.360 7.465 1.00 64.04 H new ATOM 0 HB2 GLU A 528 4.024 14.175 7.429 1.00 55.31 H new ATOM 0 HB3 GLU A 528 2.762 14.090 6.216 1.00 55.31 H new ATOM 0 HG2 GLU A 528 1.120 14.924 7.933 1.00 3.42 H new ATOM 0 HG3 GLU A 528 2.446 15.108 9.064 1.00 3.42 H new ATOM 1483 N ASN A 529 4.578 11.185 7.831 1.00 14.25 N ATOM 1484 CA ASN A 529 5.541 10.188 7.337 1.00 4.24 C ATOM 1485 C ASN A 529 4.978 8.759 7.493 1.00 11.23 C ATOM 1486 O ASN A 529 5.647 7.765 7.204 1.00 31.44 O ATOM 1487 CB ASN A 529 6.866 10.334 8.105 1.00 4.44 C ATOM 1488 CG ASN A 529 7.981 9.452 7.563 1.00 42.44 C ATOM 1489 OD1 ASN A 529 8.781 8.910 8.320 1.00 21.52 O ATOM 1490 ND2 ASN A 529 8.066 9.325 6.253 1.00 62.21 N ATOM 0 H ASN A 529 4.781 11.534 8.768 1.00 14.25 H new ATOM 0 HA ASN A 529 5.720 10.362 6.276 1.00 4.24 H new ATOM 0 HB2 ASN A 529 7.186 11.375 8.067 1.00 4.44 H new ATOM 0 HB3 ASN A 529 6.698 10.090 9.154 1.00 4.44 H new ATOM 0 HD21 ASN A 529 8.812 8.764 5.842 1.00 62.21 H new ATOM 0 HD22 ASN A 529 7.386 9.788 5.651 1.00 62.21 H new ATOM 1497 N ASN A 530 3.731 8.673 7.943 1.00 12.22 N ATOM 1498 CA ASN A 530 3.082 7.393 8.239 1.00 44.31 C ATOM 1499 C ASN A 530 2.303 6.856 7.018 1.00 22.22 C ATOM 1500 O ASN A 530 2.029 5.660 6.918 1.00 61.23 O ATOM 1501 CB ASN A 530 2.131 7.600 9.426 1.00 52.22 C ATOM 1502 CG ASN A 530 1.775 6.316 10.147 1.00 62.10 C ATOM 1503 OD1 ASN A 530 2.577 5.392 10.242 1.00 61.55 O ATOM 1504 ND2 ASN A 530 0.567 6.247 10.666 1.00 1.34 N ATOM 0 H ASN A 530 3.139 9.486 8.114 1.00 12.22 H new ATOM 0 HA ASN A 530 3.844 6.653 8.484 1.00 44.31 H new ATOM 0 HB2 ASN A 530 2.591 8.289 10.134 1.00 52.22 H new ATOM 0 HB3 ASN A 530 1.216 8.073 9.070 1.00 52.22 H new ATOM 0 HD21 ASN A 530 0.274 5.407 11.165 1.00 1.34 H new ATOM 0 HD22 ASN A 530 -0.075 7.033 10.569 1.00 1.34 H new ATOM 1511 N ASN A 531 1.979 7.750 6.084 1.00 42.12 N ATOM 1512 CA ASN A 531 1.097 7.430 4.948 1.00 62.51 C ATOM 1513 C ASN A 531 1.755 6.531 3.878 1.00 33.43 C ATOM 1514 O ASN A 531 1.057 5.822 3.151 1.00 72.44 O ATOM 1515 CB ASN A 531 0.620 8.733 4.289 1.00 22.20 C ATOM 1516 CG ASN A 531 -0.228 9.580 5.221 1.00 22.33 C ATOM 1517 OD1 ASN A 531 0.294 10.307 6.058 1.00 21.12 O ATOM 1518 ND2 ASN A 531 -1.536 9.519 5.061 1.00 24.32 N ATOM 0 H ASN A 531 2.315 8.713 6.088 1.00 42.12 H new ATOM 0 HA ASN A 531 0.261 6.864 5.359 1.00 62.51 H new ATOM 0 HB2 ASN A 531 1.486 9.311 3.965 1.00 22.20 H new ATOM 0 HB3 ASN A 531 0.044 8.494 3.395 1.00 22.20 H new ATOM 0 HD21 ASN A 531 -2.148 10.089 5.645 1.00 24.32 H new ATOM 0 HD22 ASN A 531 -1.935 8.902 4.354 1.00 24.32 H new ATOM 1525 N VAL A 532 3.084 6.562 3.776 1.00 12.42 N ATOM 1526 CA VAL A 532 3.791 5.875 2.676 1.00 35.32 C ATOM 1527 C VAL A 532 4.573 4.633 3.148 1.00 75.42 C ATOM 1528 O VAL A 532 5.149 4.621 4.236 1.00 23.42 O ATOM 1529 CB VAL A 532 4.769 6.846 1.961 1.00 54.34 C ATOM 1530 CG1 VAL A 532 5.431 6.175 0.755 1.00 15.32 C ATOM 1531 CG2 VAL A 532 4.044 8.128 1.547 1.00 44.55 C ATOM 0 H VAL A 532 3.695 7.049 4.432 1.00 12.42 H new ATOM 0 HA VAL A 532 3.018 5.541 1.983 1.00 35.32 H new ATOM 0 HB VAL A 532 5.558 7.112 2.664 1.00 54.34 H new ATOM 0 HG11 VAL A 532 6.110 6.879 0.274 1.00 15.32 H new ATOM 0 HG12 VAL A 532 5.990 5.300 1.087 1.00 15.32 H new ATOM 0 HG13 VAL A 532 4.665 5.867 0.044 1.00 15.32 H new ATOM 0 HG21 VAL A 532 4.745 8.797 1.047 1.00 44.55 H new ATOM 0 HG22 VAL A 532 3.229 7.882 0.866 1.00 44.55 H new ATOM 0 HG23 VAL A 532 3.641 8.620 2.432 1.00 44.55 H new ATOM 1541 N ALA A 533 4.589 3.591 2.308 1.00 12.32 N ATOM 1542 CA ALA A 533 5.392 2.381 2.557 1.00 22.12 C ATOM 1543 C ALA A 533 6.230 2.010 1.321 1.00 34.14 C ATOM 1544 O ALA A 533 5.773 2.159 0.186 1.00 43.44 O ATOM 1545 CB ALA A 533 4.491 1.218 2.956 1.00 23.00 C ATOM 0 H ALA A 533 4.051 3.559 1.442 1.00 12.32 H new ATOM 0 HA ALA A 533 6.076 2.592 3.379 1.00 22.12 H new ATOM 0 HB1 ALA A 533 5.099 0.332 3.136 1.00 23.00 H new ATOM 0 HB2 ALA A 533 3.946 1.475 3.864 1.00 23.00 H new ATOM 0 HB3 ALA A 533 3.783 1.014 2.153 1.00 23.00 H new ATOM 1551 N THR A 534 7.455 1.526 1.545 1.00 72.21 N ATOM 1552 CA THR A 534 8.378 1.181 0.446 1.00 13.23 C ATOM 1553 C THR A 534 8.760 -0.310 0.456 1.00 63.30 C ATOM 1554 O THR A 534 9.177 -0.843 1.482 1.00 23.41 O ATOM 1555 CB THR A 534 9.681 2.021 0.524 1.00 55.11 C ATOM 1556 OG1 THR A 534 9.371 3.425 0.506 1.00 62.32 O ATOM 1557 CG2 THR A 534 10.620 1.701 -0.635 1.00 74.13 C ATOM 0 H THR A 534 7.836 1.362 2.477 1.00 72.21 H new ATOM 0 HA THR A 534 7.845 1.405 -0.478 1.00 13.23 H new ATOM 0 HB THR A 534 10.180 1.765 1.458 1.00 55.11 H new ATOM 0 HG1 THR A 534 10.201 3.944 0.557 1.00 62.32 H new ATOM 0 HG21 THR A 534 11.522 2.306 -0.550 1.00 74.13 H new ATOM 0 HG22 THR A 534 10.888 0.645 -0.606 1.00 74.13 H new ATOM 0 HG23 THR A 534 10.122 1.923 -1.579 1.00 74.13 H new ATOM 1565 N PHE A 535 8.622 -0.975 -0.694 1.00 43.33 N ATOM 1566 CA PHE A 535 9.041 -2.380 -0.845 1.00 74.34 C ATOM 1567 C PHE A 535 9.636 -2.628 -2.247 1.00 2.55 C ATOM 1568 O PHE A 535 8.951 -2.475 -3.253 1.00 42.23 O ATOM 1569 CB PHE A 535 7.844 -3.313 -0.598 1.00 32.32 C ATOM 1570 CG PHE A 535 8.200 -4.780 -0.535 1.00 54.11 C ATOM 1571 CD1 PHE A 535 8.635 -5.350 0.654 1.00 63.13 C ATOM 1572 CD2 PHE A 535 8.091 -5.589 -1.657 1.00 64.15 C ATOM 1573 CE1 PHE A 535 8.956 -6.692 0.720 1.00 42.34 C ATOM 1574 CE2 PHE A 535 8.410 -6.932 -1.595 1.00 15.22 C ATOM 1575 CZ PHE A 535 8.843 -7.484 -0.406 1.00 73.13 C ATOM 0 H PHE A 535 8.223 -0.566 -1.539 1.00 43.33 H new ATOM 0 HA PHE A 535 9.815 -2.592 -0.107 1.00 74.34 H new ATOM 0 HB2 PHE A 535 7.363 -3.028 0.338 1.00 32.32 H new ATOM 0 HB3 PHE A 535 7.112 -3.163 -1.391 1.00 32.32 H new ATOM 0 HD1 PHE A 535 8.724 -4.736 1.538 1.00 63.13 H new ATOM 0 HD2 PHE A 535 7.753 -5.164 -2.590 1.00 64.15 H new ATOM 0 HE1 PHE A 535 9.295 -7.122 1.651 1.00 42.34 H new ATOM 0 HE2 PHE A 535 8.321 -7.550 -2.476 1.00 15.22 H new ATOM 0 HZ PHE A 535 9.093 -8.533 -0.356 1.00 73.13 H new ATOM 1585 N ASP A 536 10.912 -3.008 -2.308 1.00 22.51 N ATOM 1586 CA ASP A 536 11.601 -3.224 -3.592 1.00 63.42 C ATOM 1587 C ASP A 536 11.539 -4.698 -4.048 1.00 23.41 C ATOM 1588 O ASP A 536 11.699 -5.619 -3.243 1.00 24.21 O ATOM 1589 CB ASP A 536 13.059 -2.758 -3.485 1.00 3.23 C ATOM 1590 CG ASP A 536 13.832 -3.505 -2.410 1.00 2.41 C ATOM 1591 OD1 ASP A 536 13.504 -3.343 -1.214 1.00 44.41 O ATOM 1592 OD2 ASP A 536 14.761 -4.265 -2.752 1.00 30.43 O ATOM 0 H ASP A 536 11.494 -3.174 -1.487 1.00 22.51 H new ATOM 0 HA ASP A 536 11.083 -2.634 -4.348 1.00 63.42 H new ATOM 0 HB2 ASP A 536 13.553 -2.898 -4.446 1.00 3.23 H new ATOM 0 HB3 ASP A 536 13.081 -1.690 -3.268 1.00 3.23 H new ATOM 1597 N VAL A 537 11.292 -4.909 -5.345 1.00 11.33 N ATOM 1598 CA VAL A 537 11.212 -6.262 -5.922 1.00 55.23 C ATOM 1599 C VAL A 537 12.165 -6.426 -7.124 1.00 71.33 C ATOM 1600 O VAL A 537 12.229 -5.563 -8.003 1.00 62.01 O ATOM 1601 CB VAL A 537 9.767 -6.593 -6.382 1.00 74.45 C ATOM 1602 CG1 VAL A 537 9.682 -8.016 -6.935 1.00 51.11 C ATOM 1603 CG2 VAL A 537 8.772 -6.392 -5.239 1.00 51.31 C ATOM 0 H VAL A 537 11.143 -4.159 -6.020 1.00 11.33 H new ATOM 0 HA VAL A 537 11.511 -6.953 -5.133 1.00 55.23 H new ATOM 0 HB VAL A 537 9.503 -5.904 -7.184 1.00 74.45 H new ATOM 0 HG11 VAL A 537 8.659 -8.223 -7.250 1.00 51.11 H new ATOM 0 HG12 VAL A 537 10.352 -8.115 -7.789 1.00 51.11 H new ATOM 0 HG13 VAL A 537 9.974 -8.725 -6.160 1.00 51.11 H new ATOM 0 HG21 VAL A 537 7.766 -6.630 -5.586 1.00 51.31 H new ATOM 0 HG22 VAL A 537 9.034 -7.048 -4.409 1.00 51.31 H new ATOM 0 HG23 VAL A 537 8.805 -5.355 -4.906 1.00 51.31 H new ATOM 1613 N SER A 538 12.896 -7.542 -7.158 1.00 24.01 N ATOM 1614 CA SER A 538 13.811 -7.851 -8.271 1.00 55.31 C ATOM 1615 C SER A 538 13.218 -8.919 -9.200 1.00 64.15 C ATOM 1616 O SER A 538 12.829 -9.999 -8.750 1.00 25.32 O ATOM 1617 CB SER A 538 15.165 -8.338 -7.735 1.00 72.35 C ATOM 1618 OG SER A 538 16.057 -8.670 -8.794 1.00 54.31 O ATOM 0 H SER A 538 12.875 -8.253 -6.427 1.00 24.01 H new ATOM 0 HA SER A 538 13.954 -6.933 -8.841 1.00 55.31 H new ATOM 0 HB2 SER A 538 15.611 -7.563 -7.112 1.00 72.35 H new ATOM 0 HB3 SER A 538 15.013 -9.210 -7.099 1.00 72.35 H new ATOM 0 HG SER A 538 16.910 -8.975 -8.420 1.00 54.31 H new ATOM 1624 N VAL A 539 13.152 -8.613 -10.496 1.00 44.32 N ATOM 1625 CA VAL A 539 12.618 -9.550 -11.494 1.00 30.34 C ATOM 1626 C VAL A 539 13.733 -10.105 -12.399 1.00 5.14 C ATOM 1627 O VAL A 539 14.437 -9.350 -13.075 1.00 11.02 O ATOM 1628 CB VAL A 539 11.538 -8.875 -12.375 1.00 52.12 C ATOM 1629 CG1 VAL A 539 10.961 -9.861 -13.391 1.00 61.24 C ATOM 1630 CG2 VAL A 539 10.432 -8.284 -11.504 1.00 65.05 C ATOM 0 H VAL A 539 13.462 -7.722 -10.883 1.00 44.32 H new ATOM 0 HA VAL A 539 12.167 -10.374 -10.942 1.00 30.34 H new ATOM 0 HB VAL A 539 12.011 -8.064 -12.930 1.00 52.12 H new ATOM 0 HG11 VAL A 539 10.205 -9.360 -13.996 1.00 61.24 H new ATOM 0 HG12 VAL A 539 11.759 -10.226 -14.037 1.00 61.24 H new ATOM 0 HG13 VAL A 539 10.507 -10.701 -12.865 1.00 61.24 H new ATOM 0 HG21 VAL A 539 9.681 -7.813 -12.139 1.00 65.05 H new ATOM 0 HG22 VAL A 539 9.967 -9.077 -10.919 1.00 65.05 H new ATOM 0 HG23 VAL A 539 10.857 -7.539 -10.832 1.00 65.05 H new ATOM 1640 N VAL A 540 13.873 -11.430 -12.413 1.00 41.10 N ATOM 1641 CA VAL A 540 14.925 -12.099 -13.194 1.00 31.32 C ATOM 1642 C VAL A 540 14.353 -12.913 -14.373 1.00 33.32 C ATOM 1643 O VAL A 540 13.172 -13.256 -14.395 1.00 31.32 O ATOM 1644 CB VAL A 540 15.770 -13.038 -12.292 1.00 75.24 C ATOM 1645 CG1 VAL A 540 16.489 -12.241 -11.205 1.00 21.12 C ATOM 1646 CG2 VAL A 540 14.895 -14.129 -11.676 1.00 52.31 C ATOM 0 H VAL A 540 13.271 -12.068 -11.892 1.00 41.10 H new ATOM 0 HA VAL A 540 15.556 -11.309 -13.600 1.00 31.32 H new ATOM 0 HB VAL A 540 16.524 -13.520 -12.915 1.00 75.24 H new ATOM 0 HG11 VAL A 540 17.075 -12.919 -10.584 1.00 21.12 H new ATOM 0 HG12 VAL A 540 17.151 -11.509 -11.668 1.00 21.12 H new ATOM 0 HG13 VAL A 540 15.755 -11.726 -10.586 1.00 21.12 H new ATOM 0 HG21 VAL A 540 15.508 -14.775 -11.048 1.00 52.31 H new ATOM 0 HG22 VAL A 540 14.113 -13.670 -11.071 1.00 52.31 H new ATOM 0 HG23 VAL A 540 14.439 -14.721 -12.470 1.00 52.31 H new ATOM 1656 N LEU A 541 15.213 -13.235 -15.340 1.00 51.34 N ATOM 1657 CA LEU A 541 14.819 -14.020 -16.527 1.00 70.31 C ATOM 1658 C LEU A 541 14.814 -15.537 -16.249 1.00 54.21 C ATOM 1659 O LEU A 541 14.818 -16.348 -17.180 1.00 63.02 O ATOM 1660 CB LEU A 541 15.774 -13.718 -17.690 1.00 64.44 C ATOM 1661 CG LEU A 541 15.656 -12.311 -18.298 1.00 31.12 C ATOM 1662 CD1 LEU A 541 16.744 -12.081 -19.346 1.00 31.31 C ATOM 1663 CD2 LEU A 541 14.268 -12.104 -18.909 1.00 13.43 C ATOM 0 H LEU A 541 16.197 -12.965 -15.330 1.00 51.34 H new ATOM 0 HA LEU A 541 13.802 -13.727 -16.787 1.00 70.31 H new ATOM 0 HB2 LEU A 541 16.797 -13.859 -17.342 1.00 64.44 H new ATOM 0 HB3 LEU A 541 15.601 -14.451 -18.478 1.00 64.44 H new ATOM 0 HG LEU A 541 15.793 -11.582 -17.499 1.00 31.12 H new ATOM 0 HD11 LEU A 541 16.641 -11.079 -19.763 1.00 31.31 H new ATOM 0 HD12 LEU A 541 17.725 -12.182 -18.881 1.00 31.31 H new ATOM 0 HD13 LEU A 541 16.643 -12.818 -20.143 1.00 31.31 H new ATOM 0 HD21 LEU A 541 14.203 -11.103 -19.334 1.00 13.43 H new ATOM 0 HD22 LEU A 541 14.102 -12.843 -19.693 1.00 13.43 H new ATOM 0 HD23 LEU A 541 13.509 -12.219 -18.135 1.00 13.43 H new ATOM 1675 N GLU A 542 14.807 -15.908 -14.974 1.00 75.35 N ATOM 1676 CA GLU A 542 14.808 -17.320 -14.562 1.00 35.53 C ATOM 1677 C GLU A 542 13.824 -17.580 -13.395 1.00 34.22 C ATOM 1678 O GLU A 542 14.183 -17.327 -12.222 1.00 38.17 O ATOM 1679 CB GLU A 542 16.243 -17.748 -14.197 1.00 4.54 C ATOM 1680 CG GLU A 542 16.988 -16.746 -13.313 1.00 30.04 C ATOM 1681 CD GLU A 542 18.429 -17.146 -13.050 1.00 5.22 C ATOM 1682 OE1 GLU A 542 19.295 -16.880 -13.912 1.00 21.41 O ATOM 1683 OE2 GLU A 542 18.704 -17.735 -11.984 1.00 22.51 O ATOM 0 H GLU A 542 14.800 -15.249 -14.196 1.00 75.35 H new ATOM 0 HA GLU A 542 14.461 -17.926 -15.399 1.00 35.53 H new ATOM 0 HB2 GLU A 542 16.205 -18.710 -13.685 1.00 4.54 H new ATOM 0 HB3 GLU A 542 16.811 -17.898 -15.115 1.00 4.54 H new ATOM 0 HG2 GLU A 542 16.970 -15.766 -13.789 1.00 30.04 H new ATOM 0 HG3 GLU A 542 16.464 -16.649 -12.362 1.00 30.04 H new