USER MOD reduce.3.24.130724 H: found=0, std=0, add=715, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 715 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 514 ASN : amide:sc= -0.135 K(o=-0.31,f=2.2) USER MOD Set 1.2: A 534 THR OG1 : rot 180:sc= -0.176 USER MOD Single : A 441 THR OG1 : rot 170:sc= -0.751 USER MOD Single : A 445 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 453 ASN : amide:sc= -0.0185 X(o=-0.018,f=-0.099) USER MOD Single : A 454 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 458 TYR OH : rot -158:sc= 0.518 USER MOD Single : A 461 HIS : no HD1:sc= -0.15 K(o=-0.15,f=-2.1!) USER MOD Single : A 463 LYS NZ :NH3+ -171:sc= 0.831 (180deg=0.695) USER MOD Single : A 464 ASN : amide:sc= 0.231! C(o=0.23!,f=-17!) USER MOD Single : A 472 SER OG : rot 180:sc= 0 USER MOD Single : A 473 THR OG1 : rot 93:sc= 0.0975 USER MOD Single : A 474 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 478 TYR OH : rot 180:sc= 0 USER MOD Single : A 480 ASN : amide:sc= 0.653 K(o=0.65,f=-4.4!) USER MOD Single : A 482 THR OG1 : rot 180:sc= 0 USER MOD Single : A 484 TYR OH : rot 141:sc= -1.18 USER MOD Single : A 485 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 486 ASN : amide:sc= -0.115 K(o=-0.12,f=-0.73) 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 497 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 500 THR OG1 : rot 180:sc= 0 USER MOD Single : A 502 SER OG : rot 180:sc= 0 USER MOD Single : A 504 THR OG1 : rot 180:sc= -0.492 USER MOD Single : A 506 THR OG1 : rot 180:sc= 0 USER MOD Single : A 507 GLN : amide:sc= 0 K(o=0,f=-0.79) USER MOD Single : A 510 MET CE :methyl -165:sc= -0.018 (180deg=-0.268) USER MOD Single : A 511 TYR OH : rot 15:sc= 0.404 USER MOD Single : A 516 THR OG1 : rot 180:sc= 0 USER MOD Single : A 538 SER OG : rot 84:sc= 0.0103 USER MOD ----------------------------------------------------------------- ATOM 55 N PRO A 438 -5.149 -17.079 -6.471 1.00 0.00 N ATOM 56 CA PRO A 438 -5.340 -15.636 -6.557 1.00 0.00 C ATOM 57 C PRO A 438 -4.154 -14.965 -7.238 1.00 0.00 C ATOM 58 O PRO A 438 -3.101 -15.577 -7.418 1.00 0.00 O ATOM 59 CB PRO A 438 -5.497 -15.191 -5.101 1.00 0.00 C ATOM 60 CG PRO A 438 -5.884 -16.434 -4.373 1.00 0.00 C ATOM 61 CD PRO A 438 -5.176 -17.553 -5.088 1.00 0.00 C ATOM 0 HA PRO A 438 -6.205 -15.359 -7.160 1.00 0.00 H new ATOM 0 HB2 PRO A 438 -4.568 -14.775 -4.710 1.00 0.00 H new ATOM 0 HB3 PRO A 438 -6.260 -14.418 -5.002 1.00 0.00 H new ATOM 0 HG2 PRO A 438 -5.585 -16.385 -3.326 1.00 0.00 H new ATOM 0 HG3 PRO A 438 -6.964 -16.579 -4.389 1.00 0.00 H new ATOM 0 HD2 PRO A 438 -4.172 -17.715 -4.695 1.00 0.00 H new ATOM 0 HD3 PRO A 438 -5.711 -18.498 -4.993 1.00 0.00 H new ATOM 69 N ASP A 439 -4.331 -13.702 -7.612 1.00 0.00 N ATOM 70 CA ASP A 439 -3.208 -12.846 -7.977 1.00 0.00 C ATOM 71 C ASP A 439 -3.407 -11.427 -7.462 1.00 0.00 C ATOM 72 O ASP A 439 -3.697 -10.512 -8.234 1.00 0.00 O ATOM 73 CB ASP A 439 -3.015 -12.832 -9.495 1.00 0.00 C ATOM 74 CG ASP A 439 -1.738 -12.143 -9.960 1.00 0.00 C ATOM 75 OD1 ASP A 439 -0.980 -11.714 -9.123 1.00 0.00 O ATOM 76 OD2 ASP A 439 -1.457 -12.190 -11.134 1.00 0.00 O ATOM 0 H ASP A 439 -5.243 -13.248 -7.670 1.00 0.00 H new ATOM 0 HA ASP A 439 -2.312 -13.256 -7.510 1.00 0.00 H new ATOM 0 HB2 ASP A 439 -3.012 -13.860 -9.858 1.00 0.00 H new ATOM 0 HB3 ASP A 439 -3.870 -12.334 -9.953 1.00 0.00 H new ATOM 81 N LEU A 440 -3.251 -11.248 -6.154 1.00 0.00 N ATOM 82 CA LEU A 440 -3.459 -9.948 -5.527 1.00 0.00 C ATOM 83 C LEU A 440 -2.246 -9.048 -5.714 1.00 0.00 C ATOM 84 O LEU A 440 -1.105 -9.511 -5.686 1.00 0.00 O ATOM 85 CB LEU A 440 -3.770 -10.125 -4.036 1.00 0.00 C ATOM 86 CG LEU A 440 -5.053 -10.905 -3.722 1.00 0.00 C ATOM 87 CD1 LEU A 440 -5.176 -11.125 -2.222 1.00 0.00 C ATOM 88 CD2 LEU A 440 -6.256 -10.141 -4.257 1.00 0.00 C ATOM 0 H LEU A 440 -2.981 -11.989 -5.507 1.00 0.00 H new ATOM 0 HA LEU A 440 -4.310 -9.468 -6.011 1.00 0.00 H new ATOM 0 HB2 LEU A 440 -2.930 -10.635 -3.565 1.00 0.00 H new ATOM 0 HB3 LEU A 440 -3.842 -9.139 -3.577 1.00 0.00 H new ATOM 0 HG LEU A 440 -5.014 -11.881 -4.207 1.00 0.00 H new ATOM 0 HD11 LEU A 440 -6.090 -11.680 -2.009 1.00 0.00 H new ATOM 0 HD12 LEU A 440 -4.316 -11.692 -1.866 1.00 0.00 H new ATOM 0 HD13 LEU A 440 -5.210 -10.161 -1.714 1.00 0.00 H new ATOM 0 HD21 LEU A 440 -7.168 -10.695 -4.034 1.00 0.00 H new ATOM 0 HD22 LEU A 440 -6.303 -9.160 -3.785 1.00 0.00 H new ATOM 0 HD23 LEU A 440 -6.160 -10.020 -5.336 1.00 0.00 H new ATOM 100 N THR A 441 -2.498 -7.757 -5.906 1.00 0.00 N ATOM 101 CA THR A 441 -1.425 -6.781 -6.066 1.00 0.00 C ATOM 102 C THR A 441 -1.597 -5.612 -5.106 1.00 0.00 C ATOM 103 O THR A 441 -2.682 -5.396 -4.564 1.00 0.00 O ATOM 104 CB THR A 441 -1.359 -6.244 -7.507 1.00 0.00 C ATOM 105 OG1 THR A 441 -2.537 -5.477 -7.787 1.00 0.00 O ATOM 106 CG2 THR A 441 -1.258 -7.392 -8.500 1.00 0.00 C ATOM 0 H THR A 441 -3.437 -7.362 -5.955 1.00 0.00 H new ATOM 0 HA THR A 441 -0.493 -7.299 -5.839 1.00 0.00 H new ATOM 0 HB THR A 441 -0.475 -5.614 -7.605 1.00 0.00 H new ATOM 0 HG1 THR A 441 -2.425 -5.004 -8.638 1.00 0.00 H new ATOM 0 HG21 THR A 441 -1.212 -6.993 -9.514 1.00 0.00 H new ATOM 0 HG22 THR A 441 -0.357 -7.971 -8.297 1.00 0.00 H new ATOM 0 HG23 THR A 441 -2.132 -8.036 -8.402 1.00 0.00 H new ATOM 114 N VAL A 442 -0.523 -4.860 -4.900 1.00 0.00 N ATOM 115 CA VAL A 442 -0.618 -3.532 -4.303 1.00 0.00 C ATOM 116 C VAL A 442 0.172 -2.508 -5.106 1.00 0.00 C ATOM 117 O VAL A 442 1.155 -2.846 -5.765 1.00 0.00 O ATOM 118 CB VAL A 442 -0.115 -3.530 -2.847 1.00 0.00 C ATOM 119 CG1 VAL A 442 -0.987 -4.422 -1.979 1.00 0.00 C ATOM 120 CG2 VAL A 442 1.336 -3.984 -2.784 1.00 0.00 C ATOM 0 H VAL A 442 0.426 -5.147 -5.138 1.00 0.00 H new ATOM 0 HA VAL A 442 -1.673 -3.258 -4.313 1.00 0.00 H new ATOM 0 HB VAL A 442 -0.176 -2.511 -2.465 1.00 0.00 H new ATOM 0 HG11 VAL A 442 -0.616 -4.408 -0.954 1.00 0.00 H new ATOM 0 HG12 VAL A 442 -2.014 -4.057 -1.998 1.00 0.00 H new ATOM 0 HG13 VAL A 442 -0.958 -5.442 -2.361 1.00 0.00 H new ATOM 0 HG21 VAL A 442 1.675 -3.977 -1.748 1.00 0.00 H new ATOM 0 HG22 VAL A 442 1.419 -4.994 -3.186 1.00 0.00 H new ATOM 0 HG23 VAL A 442 1.955 -3.307 -3.373 1.00 0.00 H new ATOM 130 N GLU A 443 -0.262 -1.254 -5.046 1.00 0.00 N ATOM 131 CA GLU A 443 0.461 -0.161 -5.687 1.00 0.00 C ATOM 132 C GLU A 443 0.465 1.085 -4.810 1.00 0.00 C ATOM 133 O GLU A 443 -0.560 1.458 -4.242 1.00 0.00 O ATOM 134 CB GLU A 443 -0.151 0.158 -7.052 1.00 0.00 C ATOM 135 CG GLU A 443 -0.165 -1.013 -8.025 1.00 0.00 C ATOM 136 CD GLU A 443 -0.785 -0.624 -9.337 1.00 0.00 C ATOM 137 OE1 GLU A 443 -1.038 0.540 -9.532 1.00 0.00 O ATOM 138 OE2 GLU A 443 -0.903 -1.474 -10.190 1.00 0.00 O ATOM 0 H GLU A 443 -1.112 -0.969 -4.560 1.00 0.00 H new ATOM 0 HA GLU A 443 1.493 -0.481 -5.829 1.00 0.00 H new ATOM 0 HB2 GLU A 443 -1.174 0.505 -6.906 1.00 0.00 H new ATOM 0 HB3 GLU A 443 0.404 0.981 -7.502 1.00 0.00 H new ATOM 0 HG2 GLU A 443 0.854 -1.363 -8.191 1.00 0.00 H new ATOM 0 HG3 GLU A 443 -0.720 -1.844 -7.590 1.00 0.00 H new ATOM 145 N ILE A 444 1.625 1.723 -4.705 1.00 0.00 N ATOM 146 CA ILE A 444 1.743 2.983 -3.982 1.00 0.00 C ATOM 147 C ILE A 444 1.987 4.145 -4.936 1.00 0.00 C ATOM 148 O ILE A 444 2.936 4.127 -5.721 1.00 0.00 O ATOM 149 CB ILE A 444 2.879 2.936 -2.944 1.00 0.00 C ATOM 150 CG1 ILE A 444 2.628 1.821 -1.928 1.00 0.00 C ATOM 151 CG2 ILE A 444 3.016 4.279 -2.243 1.00 0.00 C ATOM 152 CD1 ILE A 444 3.795 1.564 -1.002 1.00 0.00 C ATOM 0 H ILE A 444 2.498 1.388 -5.112 1.00 0.00 H new ATOM 0 HA ILE A 444 0.797 3.136 -3.463 1.00 0.00 H new ATOM 0 HB ILE A 444 3.814 2.724 -3.463 1.00 0.00 H new ATOM 0 HG12 ILE A 444 1.752 2.077 -1.331 1.00 0.00 H new ATOM 0 HG13 ILE A 444 2.392 0.901 -2.463 1.00 0.00 H new ATOM 0 HG21 ILE A 444 3.824 4.228 -1.513 1.00 0.00 H new ATOM 0 HG22 ILE A 444 3.240 5.052 -2.978 1.00 0.00 H new ATOM 0 HG23 ILE A 444 2.082 4.521 -1.735 1.00 0.00 H new ATOM 0 HD11 ILE A 444 3.541 0.760 -0.311 1.00 0.00 H new ATOM 0 HD12 ILE A 444 4.668 1.276 -1.588 1.00 0.00 H new ATOM 0 HD13 ILE A 444 4.019 2.470 -0.439 1.00 0.00 H new ATOM 164 N LYS A 445 1.125 5.153 -4.866 1.00 0.00 N ATOM 165 CA LYS A 445 1.285 6.356 -5.674 1.00 0.00 C ATOM 166 C LYS A 445 1.011 7.611 -4.855 1.00 0.00 C ATOM 167 O LYS A 445 0.199 7.596 -3.931 1.00 0.00 O ATOM 168 CB LYS A 445 0.359 6.309 -6.890 1.00 0.00 C ATOM 169 CG LYS A 445 0.711 5.234 -7.909 1.00 0.00 C ATOM 170 CD LYS A 445 -0.229 5.275 -9.105 1.00 0.00 C ATOM 171 CE LYS A 445 0.094 4.171 -10.102 1.00 0.00 C ATOM 172 NZ LYS A 445 -0.831 4.185 -11.266 1.00 0.00 N ATOM 0 H LYS A 445 0.307 5.161 -4.257 1.00 0.00 H new ATOM 0 HA LYS A 445 2.319 6.393 -6.017 1.00 0.00 H new ATOM 0 HB2 LYS A 445 -0.663 6.146 -6.547 1.00 0.00 H new ATOM 0 HB3 LYS A 445 0.379 7.281 -7.384 1.00 0.00 H new ATOM 0 HG2 LYS A 445 1.738 5.373 -8.246 1.00 0.00 H new ATOM 0 HG3 LYS A 445 0.660 4.253 -7.437 1.00 0.00 H new ATOM 0 HD2 LYS A 445 -1.259 5.170 -8.764 1.00 0.00 H new ATOM 0 HD3 LYS A 445 -0.153 6.245 -9.596 1.00 0.00 H new ATOM 0 HE2 LYS A 445 1.120 4.287 -10.452 1.00 0.00 H new ATOM 0 HE3 LYS A 445 0.035 3.203 -9.604 1.00 0.00 H new ATOM 0 HZ1 LYS A 445 -0.577 3.418 -11.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 445 -1.807 4.048 -10.935 1.00 0.00 H new ATOM 0 HZ3 LYS A 445 -0.757 5.098 -11.758 1.00 0.00 H new ATOM 186 N GLY A 446 1.696 8.696 -5.200 1.00 0.00 N ATOM 187 CA GLY A 446 1.475 9.981 -4.546 1.00 0.00 C ATOM 188 C GLY A 446 2.701 10.879 -4.666 1.00 0.00 C ATOM 189 O GLY A 446 3.584 10.631 -5.488 1.00 0.00 O ATOM 0 H GLY A 446 2.409 8.711 -5.929 1.00 0.00 H new ATOM 0 HA2 GLY A 446 0.613 10.476 -4.993 1.00 0.00 H new ATOM 0 HA3 GLY A 446 1.240 9.821 -3.494 1.00 0.00 H new ATOM 193 N PRO A 447 2.747 11.921 -3.844 1.00 0.00 N ATOM 194 CA PRO A 447 3.841 12.884 -3.889 1.00 0.00 C ATOM 195 C PRO A 447 5.189 12.197 -3.710 1.00 0.00 C ATOM 196 O PRO A 447 5.341 11.321 -2.857 1.00 0.00 O ATOM 197 CB PRO A 447 3.532 13.856 -2.747 1.00 0.00 C ATOM 198 CG PRO A 447 2.052 13.778 -2.584 1.00 0.00 C ATOM 199 CD PRO A 447 1.693 12.345 -2.878 1.00 0.00 C ATOM 0 HA PRO A 447 3.913 13.396 -4.849 1.00 0.00 H new ATOM 0 HB2 PRO A 447 4.048 13.570 -1.831 1.00 0.00 H new ATOM 0 HB3 PRO A 447 3.852 14.869 -2.990 1.00 0.00 H new ATOM 0 HG2 PRO A 447 1.752 14.059 -1.574 1.00 0.00 H new ATOM 0 HG3 PRO A 447 1.545 14.459 -3.268 1.00 0.00 H new ATOM 0 HD2 PRO A 447 1.704 11.734 -1.976 1.00 0.00 H new ATOM 0 HD3 PRO A 447 0.695 12.260 -3.308 1.00 0.00 H new ATOM 207 N ASP A 448 6.165 12.598 -4.517 1.00 0.00 N ATOM 208 CA ASP A 448 7.526 12.092 -4.384 1.00 0.00 C ATOM 209 C ASP A 448 8.324 12.915 -3.382 1.00 0.00 C ATOM 210 O ASP A 448 9.132 12.376 -2.624 1.00 0.00 O ATOM 211 CB ASP A 448 8.232 12.089 -5.742 1.00 0.00 C ATOM 212 CG ASP A 448 7.623 11.137 -6.764 1.00 0.00 C ATOM 213 OD1 ASP A 448 7.549 9.963 -6.485 1.00 0.00 O ATOM 214 OD2 ASP A 448 7.098 11.608 -7.745 1.00 0.00 O ATOM 0 H ASP A 448 6.039 13.273 -5.271 1.00 0.00 H new ATOM 0 HA ASP A 448 7.466 11.069 -4.014 1.00 0.00 H new ATOM 0 HB2 ASP A 448 8.215 13.100 -6.149 1.00 0.00 H new ATOM 0 HB3 ASP A 448 9.279 11.823 -5.594 1.00 0.00 H new ATOM 219 N VAL A 449 8.095 14.224 -3.383 1.00 0.00 N ATOM 220 CA VAL A 449 8.705 15.109 -2.397 1.00 0.00 C ATOM 221 C VAL A 449 7.650 15.919 -1.657 1.00 0.00 C ATOM 222 O VAL A 449 6.750 16.495 -2.270 1.00 0.00 O ATOM 223 CB VAL A 449 9.714 16.072 -3.051 1.00 0.00 C ATOM 224 CG1 VAL A 449 10.312 17.004 -2.009 1.00 0.00 C ATOM 225 CG2 VAL A 449 10.811 15.294 -3.759 1.00 0.00 C ATOM 0 H VAL A 449 7.491 14.696 -4.056 1.00 0.00 H new ATOM 0 HA VAL A 449 9.233 14.472 -1.687 1.00 0.00 H new ATOM 0 HB VAL A 449 9.186 16.674 -3.790 1.00 0.00 H new ATOM 0 HG11 VAL A 449 11.023 17.677 -2.488 1.00 0.00 H new ATOM 0 HG12 VAL A 449 9.517 17.587 -1.543 1.00 0.00 H new ATOM 0 HG13 VAL A 449 10.825 16.417 -1.248 1.00 0.00 H new ATOM 0 HG21 VAL A 449 11.515 15.990 -4.215 1.00 0.00 H new ATOM 0 HG22 VAL A 449 11.336 14.668 -3.038 1.00 0.00 H new ATOM 0 HG23 VAL A 449 10.370 14.665 -4.532 1.00 0.00 H new ATOM 235 N VAL A 450 7.763 15.963 -0.334 1.00 0.00 N ATOM 236 CA VAL A 450 6.830 16.719 0.491 1.00 0.00 C ATOM 237 C VAL A 450 7.567 17.628 1.466 1.00 0.00 C ATOM 238 O VAL A 450 8.690 17.334 1.874 1.00 0.00 O ATOM 239 CB VAL A 450 5.893 15.787 1.282 1.00 0.00 C ATOM 240 CG1 VAL A 450 5.052 14.944 0.333 1.00 0.00 C ATOM 241 CG2 VAL A 450 6.694 14.893 2.217 1.00 0.00 C ATOM 0 H VAL A 450 8.494 15.482 0.191 1.00 0.00 H new ATOM 0 HA VAL A 450 6.234 17.328 -0.188 1.00 0.00 H new ATOM 0 HB VAL A 450 5.224 16.403 1.882 1.00 0.00 H new ATOM 0 HG11 VAL A 450 4.396 14.292 0.910 1.00 0.00 H new ATOM 0 HG12 VAL A 450 4.450 15.598 -0.298 1.00 0.00 H new ATOM 0 HG13 VAL A 450 5.707 14.338 -0.293 1.00 0.00 H new ATOM 0 HG21 VAL A 450 6.015 14.241 2.768 1.00 0.00 H new ATOM 0 HG22 VAL A 450 7.387 14.286 1.635 1.00 0.00 H new ATOM 0 HG23 VAL A 450 7.254 15.510 2.919 1.00 0.00 H new ATOM 251 N GLY A 451 6.927 18.732 1.836 1.00 0.00 N ATOM 252 CA GLY A 451 7.494 19.655 2.812 1.00 0.00 C ATOM 253 C GLY A 451 7.290 19.145 4.233 1.00 0.00 C ATOM 254 O GLY A 451 6.409 18.323 4.488 1.00 0.00 O ATOM 0 H GLY A 451 6.015 19.009 1.474 1.00 0.00 H new ATOM 0 HA2 GLY A 451 8.559 19.785 2.618 1.00 0.00 H new ATOM 0 HA3 GLY A 451 7.029 20.635 2.704 1.00 0.00 H new ATOM 258 N VAL A 452 8.109 19.637 5.157 1.00 0.00 N ATOM 259 CA VAL A 452 8.025 19.225 6.553 1.00 0.00 C ATOM 260 C VAL A 452 6.823 19.857 7.243 1.00 0.00 C ATOM 261 O VAL A 452 6.551 21.045 7.072 1.00 0.00 O ATOM 262 CB VAL A 452 9.303 19.595 7.329 1.00 0.00 C ATOM 263 CG1 VAL A 452 9.318 21.082 7.652 1.00 0.00 C ATOM 264 CG2 VAL A 452 9.409 18.774 8.605 1.00 0.00 C ATOM 0 H VAL A 452 8.839 20.322 4.963 1.00 0.00 H new ATOM 0 HA VAL A 452 7.911 18.141 6.554 1.00 0.00 H new ATOM 0 HB VAL A 452 10.164 19.369 6.701 1.00 0.00 H new ATOM 0 HG11 VAL A 452 10.228 21.326 8.200 1.00 0.00 H new ATOM 0 HG12 VAL A 452 9.288 21.656 6.726 1.00 0.00 H new ATOM 0 HG13 VAL A 452 8.449 21.331 8.262 1.00 0.00 H new ATOM 0 HG21 VAL A 452 10.318 19.049 9.140 1.00 0.00 H new ATOM 0 HG22 VAL A 452 8.543 18.970 9.237 1.00 0.00 H new ATOM 0 HG23 VAL A 452 9.442 17.714 8.354 1.00 0.00 H new ATOM 274 N ASN A 453 6.106 19.054 8.022 1.00 0.00 N ATOM 275 CA ASN A 453 4.882 19.511 8.671 1.00 0.00 C ATOM 276 C ASN A 453 3.828 19.901 7.645 1.00 0.00 C ATOM 277 O ASN A 453 2.910 20.666 7.944 1.00 0.00 O ATOM 278 CB ASN A 453 5.152 20.669 9.613 1.00 0.00 C ATOM 279 CG ASN A 453 5.951 20.288 10.829 1.00 0.00 C ATOM 280 OD1 ASN A 453 5.564 19.403 11.600 1.00 0.00 O ATOM 281 ND2 ASN A 453 7.024 21.005 11.046 1.00 0.00 N ATOM 0 H ASN A 453 6.351 18.084 8.219 1.00 0.00 H new ATOM 0 HA ASN A 453 4.499 18.677 9.259 1.00 0.00 H new ATOM 0 HB2 ASN A 453 5.684 21.450 9.070 1.00 0.00 H new ATOM 0 HB3 ASN A 453 4.201 21.094 9.933 1.00 0.00 H new ATOM 0 HD21 ASN A 453 7.584 20.845 11.884 1.00 0.00 H new ATOM 0 HD22 ASN A 453 7.301 21.724 10.378 1.00 0.00 H new ATOM 288 N LYS A 454 3.963 19.372 6.434 1.00 0.00 N ATOM 289 CA LYS A 454 2.994 19.625 5.374 1.00 0.00 C ATOM 290 C LYS A 454 2.188 18.371 5.054 1.00 0.00 C ATOM 291 O LYS A 454 2.751 17.294 4.859 1.00 0.00 O ATOM 292 CB LYS A 454 3.697 20.134 4.115 1.00 0.00 C ATOM 293 CG LYS A 454 4.328 21.511 4.261 1.00 0.00 C ATOM 294 CD LYS A 454 3.282 22.569 4.582 1.00 0.00 C ATOM 295 CE LYS A 454 2.122 22.517 3.599 1.00 0.00 C ATOM 296 NZ LYS A 454 1.171 23.643 3.805 1.00 0.00 N ATOM 0 H LYS A 454 4.736 18.764 6.162 1.00 0.00 H new ATOM 0 HA LYS A 454 2.305 20.392 5.728 1.00 0.00 H new ATOM 0 HB2 LYS A 454 4.471 19.421 3.832 1.00 0.00 H new ATOM 0 HB3 LYS A 454 2.977 20.163 3.298 1.00 0.00 H new ATOM 0 HG2 LYS A 454 5.078 21.487 5.051 1.00 0.00 H new ATOM 0 HG3 LYS A 454 4.845 21.776 3.339 1.00 0.00 H new ATOM 0 HD2 LYS A 454 2.909 22.419 5.595 1.00 0.00 H new ATOM 0 HD3 LYS A 454 3.741 23.557 4.554 1.00 0.00 H new ATOM 0 HE2 LYS A 454 2.508 22.549 2.580 1.00 0.00 H new ATOM 0 HE3 LYS A 454 1.594 21.570 3.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 454 0.395 23.572 3.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 454 0.784 23.598 4.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 454 1.669 24.546 3.674 1.00 0.00 H new ATOM 310 N LEU A 455 0.869 18.519 5.001 1.00 0.00 N ATOM 311 CA LEU A 455 -0.023 17.381 4.815 1.00 0.00 C ATOM 312 C LEU A 455 0.009 16.887 3.374 1.00 0.00 C ATOM 313 O LEU A 455 -0.194 17.661 2.437 1.00 0.00 O ATOM 314 CB LEU A 455 -1.452 17.758 5.220 1.00 0.00 C ATOM 315 CG LEU A 455 -2.454 16.596 5.232 1.00 0.00 C ATOM 316 CD1 LEU A 455 -2.080 15.596 6.319 1.00 0.00 C ATOM 317 CD2 LEU A 455 -3.859 17.137 5.457 1.00 0.00 C ATOM 0 H LEU A 455 0.393 19.417 5.084 1.00 0.00 H new ATOM 0 HA LEU A 455 0.323 16.569 5.455 1.00 0.00 H new ATOM 0 HB2 LEU A 455 -1.425 18.204 6.214 1.00 0.00 H new ATOM 0 HB3 LEU A 455 -1.817 18.524 4.536 1.00 0.00 H new ATOM 0 HG LEU A 455 -2.426 16.082 4.271 1.00 0.00 H new ATOM 0 HD11 LEU A 455 -2.797 14.775 6.320 1.00 0.00 H new ATOM 0 HD12 LEU A 455 -1.081 15.205 6.126 1.00 0.00 H new ATOM 0 HD13 LEU A 455 -2.095 16.091 7.290 1.00 0.00 H new ATOM 0 HD21 LEU A 455 -4.570 16.311 5.465 1.00 0.00 H new ATOM 0 HD22 LEU A 455 -3.899 17.660 6.413 1.00 0.00 H new ATOM 0 HD23 LEU A 455 -4.116 17.828 4.654 1.00 0.00 H new ATOM 329 N ALA A 456 0.260 15.594 3.203 1.00 0.00 N ATOM 330 CA ALA A 456 0.307 14.990 1.876 1.00 0.00 C ATOM 331 C ALA A 456 -0.675 13.831 1.764 1.00 0.00 C ATOM 332 O ALA A 456 -0.915 13.113 2.735 1.00 0.00 O ATOM 333 CB ALA A 456 1.718 14.527 1.552 1.00 0.00 C ATOM 0 H ALA A 456 0.434 14.942 3.968 1.00 0.00 H new ATOM 0 HA ALA A 456 0.014 15.749 1.150 1.00 0.00 H new ATOM 0 HB1 ALA A 456 1.735 14.079 0.559 1.00 0.00 H new ATOM 0 HB2 ALA A 456 2.396 15.380 1.577 1.00 0.00 H new ATOM 0 HB3 ALA A 456 2.037 13.789 2.288 1.00 0.00 H new ATOM 339 N GLU A 457 -1.238 13.652 0.574 1.00 0.00 N ATOM 340 CA GLU A 457 -2.199 12.581 0.337 1.00 0.00 C ATOM 341 C GLU A 457 -1.599 11.487 -0.536 1.00 0.00 C ATOM 342 O GLU A 457 -0.994 11.766 -1.572 1.00 0.00 O ATOM 343 CB GLU A 457 -3.468 13.137 -0.314 1.00 0.00 C ATOM 344 CG GLU A 457 -4.510 13.644 0.670 1.00 0.00 C ATOM 345 CD GLU A 457 -5.557 14.475 -0.019 1.00 0.00 C ATOM 346 OE1 GLU A 457 -6.174 13.979 -0.930 1.00 0.00 O ATOM 347 OE2 GLU A 457 -5.816 15.564 0.436 1.00 0.00 O ATOM 0 H GLU A 457 -1.046 14.234 -0.241 1.00 0.00 H new ATOM 0 HA GLU A 457 -2.457 12.144 1.301 1.00 0.00 H new ATOM 0 HB2 GLU A 457 -3.191 13.952 -0.983 1.00 0.00 H new ATOM 0 HB3 GLU A 457 -3.917 12.358 -0.930 1.00 0.00 H new ATOM 0 HG2 GLU A 457 -4.984 12.798 1.168 1.00 0.00 H new ATOM 0 HG3 GLU A 457 -4.023 14.238 1.444 1.00 0.00 H new ATOM 354 N TYR A 458 -1.769 10.239 -0.112 1.00 0.00 N ATOM 355 CA TYR A 458 -1.248 9.099 -0.857 1.00 0.00 C ATOM 356 C TYR A 458 -2.333 8.061 -1.103 1.00 0.00 C ATOM 357 O TYR A 458 -3.329 8.004 -0.380 1.00 0.00 O ATOM 358 CB TYR A 458 -0.073 8.462 -0.110 1.00 0.00 C ATOM 359 CG TYR A 458 1.172 9.319 -0.087 1.00 0.00 C ATOM 360 CD1 TYR A 458 1.355 10.284 0.893 1.00 0.00 C ATOM 361 CD2 TYR A 458 2.165 9.158 -1.042 1.00 0.00 C ATOM 362 CE1 TYR A 458 2.491 11.070 0.919 1.00 0.00 C ATOM 363 CE2 TYR A 458 3.306 9.937 -1.024 1.00 0.00 C ATOM 364 CZ TYR A 458 3.465 10.893 -0.040 1.00 0.00 C ATOM 365 OH TYR A 458 4.600 11.669 -0.019 1.00 0.00 O ATOM 0 H TYR A 458 -2.264 9.991 0.745 1.00 0.00 H new ATOM 0 HA TYR A 458 -0.898 9.464 -1.823 1.00 0.00 H new ATOM 0 HB2 TYR A 458 -0.377 8.252 0.915 1.00 0.00 H new ATOM 0 HB3 TYR A 458 0.165 7.505 -0.574 1.00 0.00 H new ATOM 0 HD1 TYR A 458 0.596 10.423 1.649 1.00 0.00 H new ATOM 0 HD2 TYR A 458 2.044 8.411 -1.813 1.00 0.00 H new ATOM 0 HE1 TYR A 458 2.615 11.819 1.687 1.00 0.00 H new ATOM 0 HE2 TYR A 458 4.069 9.799 -1.775 1.00 0.00 H new ATOM 0 HH TYR A 458 5.007 11.677 -0.910 1.00 0.00 H new ATOM 375 N GLU A 459 -2.138 7.238 -2.128 1.00 0.00 N ATOM 376 CA GLU A 459 -3.145 6.264 -2.534 1.00 0.00 C ATOM 377 C GLU A 459 -2.537 4.877 -2.694 1.00 0.00 C ATOM 378 O GLU A 459 -1.424 4.732 -3.200 1.00 0.00 O ATOM 379 CB GLU A 459 -3.816 6.699 -3.838 1.00 0.00 C ATOM 380 CG GLU A 459 -4.458 8.079 -3.786 1.00 0.00 C ATOM 381 CD GLU A 459 -5.114 8.426 -5.094 1.00 0.00 C ATOM 382 OE1 GLU A 459 -5.038 7.635 -6.003 1.00 0.00 O ATOM 383 OE2 GLU A 459 -5.786 9.429 -5.150 1.00 0.00 O ATOM 0 H GLU A 459 -1.290 7.226 -2.694 1.00 0.00 H new ATOM 0 HA GLU A 459 -3.899 6.216 -1.748 1.00 0.00 H new ATOM 0 HB2 GLU A 459 -3.073 6.687 -4.636 1.00 0.00 H new ATOM 0 HB3 GLU A 459 -4.579 5.967 -4.102 1.00 0.00 H new ATOM 0 HG2 GLU A 459 -5.198 8.108 -2.986 1.00 0.00 H new ATOM 0 HG3 GLU A 459 -3.701 8.826 -3.547 1.00 0.00 H new ATOM 390 N VAL A 460 -3.274 3.860 -2.262 1.00 0.00 N ATOM 391 CA VAL A 460 -2.900 2.476 -2.529 1.00 0.00 C ATOM 392 C VAL A 460 -3.881 1.817 -3.489 1.00 0.00 C ATOM 393 O VAL A 460 -5.075 1.724 -3.206 1.00 0.00 O ATOM 394 CB VAL A 460 -2.833 1.651 -1.230 1.00 0.00 C ATOM 395 CG1 VAL A 460 -2.379 0.228 -1.526 1.00 0.00 C ATOM 396 CG2 VAL A 460 -1.898 2.309 -0.228 1.00 0.00 C ATOM 0 H VAL A 460 -4.134 3.968 -1.725 1.00 0.00 H new ATOM 0 HA VAL A 460 -1.911 2.498 -2.986 1.00 0.00 H new ATOM 0 HB VAL A 460 -3.832 1.612 -0.795 1.00 0.00 H new ATOM 0 HG11 VAL A 460 -2.337 -0.341 -0.597 1.00 0.00 H new ATOM 0 HG12 VAL A 460 -3.085 -0.244 -2.210 1.00 0.00 H new ATOM 0 HG13 VAL A 460 -1.390 0.249 -1.983 1.00 0.00 H new ATOM 0 HG21 VAL A 460 -1.863 1.712 0.683 1.00 0.00 H new ATOM 0 HG22 VAL A 460 -0.897 2.378 -0.655 1.00 0.00 H new ATOM 0 HG23 VAL A 460 -2.262 3.309 0.007 1.00 0.00 H new ATOM 406 N HIS A 461 -3.369 1.359 -4.627 1.00 0.00 N ATOM 407 CA HIS A 461 -4.205 0.745 -5.651 1.00 0.00 C ATOM 408 C HIS A 461 -4.015 -0.766 -5.684 1.00 0.00 C ATOM 409 O HIS A 461 -2.971 -1.261 -6.109 1.00 0.00 O ATOM 410 CB HIS A 461 -3.899 1.342 -7.029 1.00 0.00 C ATOM 411 CG HIS A 461 -4.125 2.819 -7.108 1.00 0.00 C ATOM 412 ND1 HIS A 461 -5.385 3.376 -7.173 1.00 0.00 N ATOM 413 CD2 HIS A 461 -3.253 3.854 -7.134 1.00 0.00 C ATOM 414 CE1 HIS A 461 -5.277 4.692 -7.234 1.00 0.00 C ATOM 415 NE2 HIS A 461 -3.994 5.007 -7.211 1.00 0.00 N ATOM 0 H HIS A 461 -2.378 1.402 -4.863 1.00 0.00 H new ATOM 0 HA HIS A 461 -5.244 0.955 -5.398 1.00 0.00 H new ATOM 0 HB2 HIS A 461 -2.862 1.128 -7.286 1.00 0.00 H new ATOM 0 HB3 HIS A 461 -4.521 0.848 -7.776 1.00 0.00 H new ATOM 0 HD2 HIS A 461 -2.176 3.785 -7.100 1.00 0.00 H new ATOM 0 HE1 HIS A 461 -6.098 5.391 -7.293 1.00 0.00 H new ATOM 0 HE2 HIS A 461 -3.615 5.954 -7.245 1.00 0.00 H new ATOM 423 N VAL A 462 -5.032 -1.495 -5.236 1.00 0.00 N ATOM 424 CA VAL A 462 -4.922 -2.939 -5.063 1.00 0.00 C ATOM 425 C VAL A 462 -5.881 -3.678 -5.989 1.00 0.00 C ATOM 426 O VAL A 462 -7.059 -3.333 -6.080 1.00 0.00 O ATOM 427 CB VAL A 462 -5.203 -3.358 -3.609 1.00 0.00 C ATOM 428 CG1 VAL A 462 -4.312 -2.583 -2.650 1.00 0.00 C ATOM 429 CG2 VAL A 462 -6.669 -3.139 -3.265 1.00 0.00 C ATOM 0 H VAL A 462 -5.942 -1.109 -4.986 1.00 0.00 H new ATOM 0 HA VAL A 462 -3.896 -3.208 -5.316 1.00 0.00 H new ATOM 0 HB VAL A 462 -4.979 -4.420 -3.508 1.00 0.00 H new ATOM 0 HG11 VAL A 462 -4.524 -2.892 -1.626 1.00 0.00 H new ATOM 0 HG12 VAL A 462 -3.266 -2.785 -2.881 1.00 0.00 H new ATOM 0 HG13 VAL A 462 -4.507 -1.516 -2.755 1.00 0.00 H new ATOM 0 HG21 VAL A 462 -6.850 -3.441 -2.233 1.00 0.00 H new ATOM 0 HG22 VAL A 462 -6.917 -2.084 -3.383 1.00 0.00 H new ATOM 0 HG23 VAL A 462 -7.292 -3.735 -3.932 1.00 0.00 H new ATOM 439 N LYS A 463 -5.369 -4.694 -6.673 1.00 0.00 N ATOM 440 CA LYS A 463 -6.130 -5.380 -7.710 1.00 0.00 C ATOM 441 C LYS A 463 -6.308 -6.856 -7.377 1.00 0.00 C ATOM 442 O LYS A 463 -5.553 -7.421 -6.585 1.00 0.00 O ATOM 443 CB LYS A 463 -5.442 -5.227 -9.067 1.00 0.00 C ATOM 444 CG LYS A 463 -5.315 -3.788 -9.548 1.00 0.00 C ATOM 445 CD LYS A 463 -4.445 -3.695 -10.793 1.00 0.00 C ATOM 446 CE LYS A 463 -4.489 -2.299 -11.398 1.00 0.00 C ATOM 447 NZ LYS A 463 -3.751 -1.310 -10.566 1.00 0.00 N ATOM 0 H LYS A 463 -4.429 -5.062 -6.528 1.00 0.00 H new ATOM 0 HA LYS A 463 -7.117 -4.920 -7.759 1.00 0.00 H new ATOM 0 HB2 LYS A 463 -4.446 -5.667 -9.008 1.00 0.00 H new ATOM 0 HB3 LYS A 463 -5.999 -5.798 -9.810 1.00 0.00 H new ATOM 0 HG2 LYS A 463 -6.305 -3.386 -9.763 1.00 0.00 H new ATOM 0 HG3 LYS A 463 -4.886 -3.174 -8.756 1.00 0.00 H new ATOM 0 HD2 LYS A 463 -3.416 -3.951 -10.540 1.00 0.00 H new ATOM 0 HD3 LYS A 463 -4.783 -4.423 -11.530 1.00 0.00 H new ATOM 0 HE2 LYS A 463 -4.059 -2.324 -12.399 1.00 0.00 H new ATOM 0 HE3 LYS A 463 -5.526 -1.982 -11.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 463 -3.930 -0.351 -10.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 463 -4.074 -1.376 -9.580 1.00 0.00 H new ATOM 0 HZ3 LYS A 463 -2.732 -1.511 -10.610 1.00 0.00 H new ATOM 461 N ASN A 464 -7.311 -7.478 -7.989 1.00 0.00 N ATOM 462 CA ASN A 464 -7.314 -8.924 -8.176 1.00 0.00 C ATOM 463 C ASN A 464 -7.168 -9.289 -9.648 1.00 0.00 C ATOM 464 O ASN A 464 -7.978 -8.883 -10.482 1.00 0.00 O ATOM 465 CB ASN A 464 -8.571 -9.555 -7.604 1.00 0.00 C ATOM 466 CG ASN A 464 -8.635 -11.046 -7.784 1.00 0.00 C ATOM 467 OD1 ASN A 464 -7.975 -11.615 -8.661 1.00 0.00 O ATOM 468 ND2 ASN A 464 -9.489 -11.671 -7.013 1.00 0.00 N ATOM 0 H ASN A 464 -8.132 -7.003 -8.364 1.00 0.00 H new ATOM 0 HA ASN A 464 -6.455 -9.320 -7.634 1.00 0.00 H new ATOM 0 HB2 ASN A 464 -8.631 -9.323 -6.541 1.00 0.00 H new ATOM 0 HB3 ASN A 464 -9.442 -9.103 -8.079 1.00 0.00 H new ATOM 0 HD21 ASN A 464 -9.634 -12.675 -7.122 1.00 0.00 H new ATOM 0 HD22 ASN A 464 -10.009 -11.154 -6.304 1.00 0.00 H new ATOM 475 N LEU A 465 -6.128 -10.054 -9.962 1.00 0.00 N ATOM 476 CA LEU A 465 -5.836 -10.423 -11.342 1.00 0.00 C ATOM 477 C LEU A 465 -5.930 -11.930 -11.541 1.00 0.00 C ATOM 478 O LEU A 465 -5.701 -12.436 -12.639 1.00 0.00 O ATOM 479 CB LEU A 465 -4.444 -9.917 -11.742 1.00 0.00 C ATOM 480 CG LEU A 465 -4.191 -8.427 -11.480 1.00 0.00 C ATOM 481 CD1 LEU A 465 -2.743 -8.081 -11.800 1.00 0.00 C ATOM 482 CD2 LEU A 465 -5.144 -7.594 -12.323 1.00 0.00 C ATOM 0 H LEU A 465 -5.472 -10.431 -9.278 1.00 0.00 H new ATOM 0 HA LEU A 465 -6.582 -9.953 -11.983 1.00 0.00 H new ATOM 0 HB2 LEU A 465 -3.695 -10.497 -11.202 1.00 0.00 H new ATOM 0 HB3 LEU A 465 -4.295 -10.113 -12.804 1.00 0.00 H new ATOM 0 HG LEU A 465 -4.370 -8.206 -10.428 1.00 0.00 H new ATOM 0 HD11 LEU A 465 -2.572 -7.021 -11.611 1.00 0.00 H new ATOM 0 HD12 LEU A 465 -2.080 -8.674 -11.170 1.00 0.00 H new ATOM 0 HD13 LEU A 465 -2.540 -8.300 -12.848 1.00 0.00 H new ATOM 0 HD21 LEU A 465 -4.964 -6.535 -12.137 1.00 0.00 H new ATOM 0 HD22 LEU A 465 -4.979 -7.810 -13.379 1.00 0.00 H new ATOM 0 HD23 LEU A 465 -6.173 -7.839 -12.059 1.00 0.00 H new ATOM 494 N GLY A 466 -6.271 -12.644 -10.473 1.00 0.00 N ATOM 495 CA GLY A 466 -6.423 -14.092 -10.535 1.00 0.00 C ATOM 496 C GLY A 466 -7.861 -14.482 -10.849 1.00 0.00 C ATOM 497 O GLY A 466 -8.129 -15.601 -11.289 1.00 0.00 O ATOM 0 H GLY A 466 -6.448 -12.242 -9.553 1.00 0.00 H new ATOM 0 HA2 GLY A 466 -5.759 -14.498 -11.298 1.00 0.00 H new ATOM 0 HA3 GLY A 466 -6.123 -14.533 -9.584 1.00 0.00 H new ATOM 501 N GLY A 467 -8.784 -13.554 -10.624 1.00 0.00 N ATOM 502 CA GLY A 467 -10.179 -13.753 -10.994 1.00 0.00 C ATOM 503 C GLY A 467 -10.875 -14.703 -10.028 1.00 0.00 C ATOM 504 O GLY A 467 -11.817 -15.404 -10.400 1.00 0.00 O ATOM 0 H GLY A 467 -8.590 -12.654 -10.186 1.00 0.00 H new ATOM 0 HA2 GLY A 467 -10.697 -12.794 -11.001 1.00 0.00 H new ATOM 0 HA3 GLY A 467 -10.236 -14.153 -12.006 1.00 0.00 H new ATOM 508 N ILE A 468 -10.407 -14.722 -8.784 1.00 0.00 N ATOM 509 CA ILE A 468 -11.053 -15.500 -7.734 1.00 0.00 C ATOM 510 C ILE A 468 -11.336 -14.642 -6.508 1.00 0.00 C ATOM 511 O ILE A 468 -10.490 -13.860 -6.077 1.00 0.00 O ATOM 512 CB ILE A 468 -10.196 -16.708 -7.317 1.00 0.00 C ATOM 513 CG1 ILE A 468 -10.882 -17.487 -6.191 1.00 0.00 C ATOM 514 CG2 ILE A 468 -8.811 -16.254 -6.885 1.00 0.00 C ATOM 515 CD1 ILE A 468 -10.260 -18.837 -5.916 1.00 0.00 C ATOM 0 H ILE A 468 -9.582 -14.207 -8.479 1.00 0.00 H new ATOM 0 HA ILE A 468 -11.995 -15.861 -8.146 1.00 0.00 H new ATOM 0 HB ILE A 468 -10.088 -17.369 -8.177 1.00 0.00 H new ATOM 0 HG12 ILE A 468 -10.852 -16.891 -5.279 1.00 0.00 H new ATOM 0 HG13 ILE A 468 -11.932 -17.627 -6.446 1.00 0.00 H new ATOM 0 HG21 ILE A 468 -8.218 -17.121 -6.593 1.00 0.00 H new ATOM 0 HG22 ILE A 468 -8.321 -15.742 -7.713 1.00 0.00 H new ATOM 0 HG23 ILE A 468 -8.899 -15.573 -6.038 1.00 0.00 H new ATOM 0 HD11 ILE A 468 -10.800 -19.328 -5.107 1.00 0.00 H new ATOM 0 HD12 ILE A 468 -10.314 -19.452 -6.814 1.00 0.00 H new ATOM 0 HD13 ILE A 468 -9.217 -18.705 -5.629 1.00 0.00 H new ATOM 527 N GLY A 469 -12.533 -14.792 -5.950 1.00 0.00 N ATOM 528 CA GLY A 469 -12.964 -13.971 -4.825 1.00 0.00 C ATOM 529 C GLY A 469 -12.170 -14.302 -3.567 1.00 0.00 C ATOM 530 O GLY A 469 -12.157 -15.446 -3.112 1.00 0.00 O ATOM 0 H GLY A 469 -13.223 -15.476 -6.260 1.00 0.00 H new ATOM 0 HA2 GLY A 469 -12.838 -12.917 -5.071 1.00 0.00 H new ATOM 0 HA3 GLY A 469 -14.026 -14.131 -4.641 1.00 0.00 H new ATOM 534 N VAL A 470 -11.510 -13.293 -3.007 1.00 0.00 N ATOM 535 CA VAL A 470 -10.828 -13.441 -1.727 1.00 0.00 C ATOM 536 C VAL A 470 -11.351 -12.439 -0.706 1.00 0.00 C ATOM 537 O VAL A 470 -11.141 -11.234 -0.840 1.00 0.00 O ATOM 538 CB VAL A 470 -9.305 -13.263 -1.874 1.00 0.00 C ATOM 539 CG1 VAL A 470 -8.622 -13.387 -0.521 1.00 0.00 C ATOM 540 CG2 VAL A 470 -8.740 -14.283 -2.850 1.00 0.00 C ATOM 0 H VAL A 470 -11.433 -12.364 -3.420 1.00 0.00 H new ATOM 0 HA VAL A 470 -11.033 -14.453 -1.377 1.00 0.00 H new ATOM 0 HB VAL A 470 -9.112 -12.265 -2.269 1.00 0.00 H new ATOM 0 HG11 VAL A 470 -7.547 -13.259 -0.643 1.00 0.00 H new ATOM 0 HG12 VAL A 470 -9.005 -12.619 0.152 1.00 0.00 H new ATOM 0 HG13 VAL A 470 -8.824 -14.372 -0.100 1.00 0.00 H new ATOM 0 HG21 VAL A 470 -7.663 -14.142 -2.941 1.00 0.00 H new ATOM 0 HG22 VAL A 470 -8.944 -15.289 -2.484 1.00 0.00 H new ATOM 0 HG23 VAL A 470 -9.207 -14.150 -3.826 1.00 0.00 H new ATOM 550 N PRO A 471 -12.033 -12.945 0.316 1.00 0.00 N ATOM 551 CA PRO A 471 -12.599 -12.095 1.356 1.00 0.00 C ATOM 552 C PRO A 471 -11.535 -11.670 2.360 1.00 0.00 C ATOM 553 O PRO A 471 -11.726 -10.717 3.115 1.00 0.00 O ATOM 554 CB PRO A 471 -13.685 -12.961 1.998 1.00 0.00 C ATOM 555 CG PRO A 471 -13.181 -14.357 1.857 1.00 0.00 C ATOM 556 CD PRO A 471 -12.438 -14.381 0.548 1.00 0.00 C ATOM 0 HA PRO A 471 -13.003 -11.162 0.964 1.00 0.00 H new ATOM 0 HB2 PRO A 471 -13.836 -12.697 3.045 1.00 0.00 H new ATOM 0 HB3 PRO A 471 -14.644 -12.832 1.496 1.00 0.00 H new ATOM 0 HG2 PRO A 471 -12.526 -14.624 2.686 1.00 0.00 H new ATOM 0 HG3 PRO A 471 -14.002 -15.074 1.856 1.00 0.00 H new ATOM 0 HD2 PRO A 471 -11.568 -15.036 0.598 1.00 0.00 H new ATOM 0 HD3 PRO A 471 -13.069 -14.751 -0.260 1.00 0.00 H new ATOM 564 N SER A 472 -10.414 -12.385 2.363 1.00 0.00 N ATOM 565 CA SER A 472 -9.482 -12.342 3.485 1.00 0.00 C ATOM 566 C SER A 472 -8.471 -11.215 3.318 1.00 0.00 C ATOM 567 O SER A 472 -7.487 -11.137 4.052 1.00 0.00 O ATOM 568 CB SER A 472 -8.772 -13.673 3.624 1.00 0.00 C ATOM 569 OG SER A 472 -9.666 -14.724 3.866 1.00 0.00 O ATOM 0 H SER A 472 -10.129 -13.001 1.601 1.00 0.00 H new ATOM 0 HA SER A 472 -10.052 -12.148 4.394 1.00 0.00 H new ATOM 0 HB2 SER A 472 -8.208 -13.879 2.714 1.00 0.00 H new ATOM 0 HB3 SER A 472 -8.051 -13.616 4.440 1.00 0.00 H new ATOM 0 HG SER A 472 -9.169 -15.564 3.948 1.00 0.00 H new ATOM 575 N THR A 473 -8.719 -10.343 2.345 1.00 0.00 N ATOM 576 CA THR A 473 -7.682 -9.461 1.825 1.00 0.00 C ATOM 577 C THR A 473 -7.470 -8.260 2.739 1.00 0.00 C ATOM 578 O THR A 473 -8.312 -7.366 2.811 1.00 0.00 O ATOM 579 CB THR A 473 -8.023 -8.962 0.409 1.00 0.00 C ATOM 580 OG1 THR A 473 -8.181 -10.083 -0.470 1.00 0.00 O ATOM 581 CG2 THR A 473 -6.919 -8.059 -0.118 1.00 0.00 C ATOM 0 H THR A 473 -9.630 -10.229 1.901 1.00 0.00 H new ATOM 0 HA THR A 473 -6.764 -10.047 1.782 1.00 0.00 H new ATOM 0 HB THR A 473 -8.952 -8.394 0.454 1.00 0.00 H new ATOM 0 HG1 THR A 473 -9.125 -10.345 -0.500 1.00 0.00 H new ATOM 0 HG21 THR A 473 -7.177 -7.716 -1.120 1.00 0.00 H new ATOM 0 HG22 THR A 473 -6.806 -7.199 0.542 1.00 0.00 H new ATOM 0 HG23 THR A 473 -5.982 -8.614 -0.155 1.00 0.00 H new ATOM 589 N LYS A 474 -6.338 -8.246 3.435 1.00 0.00 N ATOM 590 CA LYS A 474 -5.969 -7.111 4.274 1.00 0.00 C ATOM 591 C LYS A 474 -4.798 -6.343 3.677 1.00 0.00 C ATOM 592 O LYS A 474 -3.759 -6.923 3.359 1.00 0.00 O ATOM 593 CB LYS A 474 -5.625 -7.582 5.688 1.00 0.00 C ATOM 594 CG LYS A 474 -6.783 -8.227 6.436 1.00 0.00 C ATOM 595 CD LYS A 474 -6.360 -8.681 7.825 1.00 0.00 C ATOM 596 CE LYS A 474 -7.485 -9.420 8.534 1.00 0.00 C ATOM 597 NZ LYS A 474 -7.089 -9.859 9.899 1.00 0.00 N ATOM 0 H LYS A 474 -5.660 -9.008 3.435 1.00 0.00 H new ATOM 0 HA LYS A 474 -6.826 -6.439 4.323 1.00 0.00 H new ATOM 0 HB2 LYS A 474 -4.803 -8.296 5.630 1.00 0.00 H new ATOM 0 HB3 LYS A 474 -5.266 -6.729 6.264 1.00 0.00 H new ATOM 0 HG2 LYS A 474 -7.606 -7.517 6.518 1.00 0.00 H new ATOM 0 HG3 LYS A 474 -7.154 -9.081 5.869 1.00 0.00 H new ATOM 0 HD2 LYS A 474 -5.488 -9.331 7.747 1.00 0.00 H new ATOM 0 HD3 LYS A 474 -6.061 -7.816 8.417 1.00 0.00 H new ATOM 0 HE2 LYS A 474 -8.359 -8.772 8.601 1.00 0.00 H new ATOM 0 HE3 LYS A 474 -7.777 -10.289 7.944 1.00 0.00 H new ATOM 0 HZ1 LYS A 474 -7.884 -10.358 10.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 474 -6.271 -10.498 9.835 1.00 0.00 H new ATOM 0 HZ3 LYS A 474 -6.835 -9.028 10.471 1.00 0.00 H new ATOM 611 N VAL A 475 -4.970 -5.034 3.526 1.00 0.00 N ATOM 612 CA VAL A 475 -3.955 -4.194 2.904 1.00 0.00 C ATOM 613 C VAL A 475 -3.355 -3.216 3.907 1.00 0.00 C ATOM 614 O VAL A 475 -4.079 -2.470 4.569 1.00 0.00 O ATOM 615 CB VAL A 475 -4.529 -3.403 1.713 1.00 0.00 C ATOM 616 CG1 VAL A 475 -3.456 -2.518 1.095 1.00 0.00 C ATOM 617 CG2 VAL A 475 -5.101 -4.351 0.670 1.00 0.00 C ATOM 0 H VAL A 475 -5.805 -4.532 3.827 1.00 0.00 H new ATOM 0 HA VAL A 475 -3.174 -4.863 2.543 1.00 0.00 H new ATOM 0 HB VAL A 475 -5.334 -2.766 2.079 1.00 0.00 H new ATOM 0 HG11 VAL A 475 -3.879 -1.966 0.255 1.00 0.00 H new ATOM 0 HG12 VAL A 475 -3.089 -1.815 1.843 1.00 0.00 H new ATOM 0 HG13 VAL A 475 -2.631 -3.138 0.744 1.00 0.00 H new ATOM 0 HG21 VAL A 475 -5.502 -3.775 -0.164 1.00 0.00 H new ATOM 0 HG22 VAL A 475 -4.314 -5.013 0.309 1.00 0.00 H new ATOM 0 HG23 VAL A 475 -5.898 -4.946 1.117 1.00 0.00 H new ATOM 627 N ARG A 476 -2.032 -3.227 4.018 1.00 0.00 N ATOM 628 CA ARG A 476 -1.344 -2.484 5.066 1.00 0.00 C ATOM 629 C ARG A 476 -0.253 -1.594 4.486 1.00 0.00 C ATOM 630 O ARG A 476 0.289 -1.877 3.417 1.00 0.00 O ATOM 631 CB ARG A 476 -0.800 -3.397 6.154 1.00 0.00 C ATOM 632 CG ARG A 476 -1.857 -4.111 6.979 1.00 0.00 C ATOM 633 CD ARG A 476 -1.354 -5.286 7.737 1.00 0.00 C ATOM 634 NE ARG A 476 -2.349 -5.932 8.579 1.00 0.00 N ATOM 635 CZ ARG A 476 -2.186 -7.130 9.172 1.00 0.00 C ATOM 636 NH1 ARG A 476 -1.091 -7.834 8.989 1.00 0.00 N ATOM 637 NH2 ARG A 476 -3.169 -7.592 9.925 1.00 0.00 N ATOM 0 H ARG A 476 -1.413 -3.744 3.393 1.00 0.00 H new ATOM 0 HA ARG A 476 -2.084 -1.838 5.539 1.00 0.00 H new ATOM 0 HB2 ARG A 476 -0.155 -4.144 5.692 1.00 0.00 H new ATOM 0 HB3 ARG A 476 -0.175 -2.807 6.824 1.00 0.00 H new ATOM 0 HG2 ARG A 476 -2.293 -3.401 7.681 1.00 0.00 H new ATOM 0 HG3 ARG A 476 -2.658 -4.437 6.316 1.00 0.00 H new ATOM 0 HD2 ARG A 476 -0.964 -6.018 7.030 1.00 0.00 H new ATOM 0 HD3 ARG A 476 -0.519 -4.969 8.361 1.00 0.00 H new ATOM 0 HE ARG A 476 -3.231 -5.444 8.731 1.00 0.00 H new ATOM 0 HH11 ARG A 476 -0.348 -7.475 8.390 1.00 0.00 H new ATOM 0 HH12 ARG A 476 -0.985 -8.740 9.446 1.00 0.00 H new ATOM 0 HH21 ARG A 476 -4.021 -7.044 10.044 1.00 0.00 H new ATOM 0 HH22 ARG A 476 -3.075 -8.496 10.387 1.00 0.00 H new ATOM 651 N VAL A 477 0.065 -0.516 5.197 1.00 0.00 N ATOM 652 CA VAL A 477 1.110 0.404 4.764 1.00 0.00 C ATOM 653 C VAL A 477 2.113 0.661 5.880 1.00 0.00 C ATOM 654 O VAL A 477 1.733 0.900 7.028 1.00 0.00 O ATOM 655 CB VAL A 477 0.520 1.748 4.297 1.00 0.00 C ATOM 656 CG1 VAL A 477 1.631 2.742 3.998 1.00 0.00 C ATOM 657 CG2 VAL A 477 -0.358 1.549 3.071 1.00 0.00 C ATOM 0 H VAL A 477 -0.386 -0.259 6.075 1.00 0.00 H new ATOM 0 HA VAL A 477 1.619 -0.070 3.925 1.00 0.00 H new ATOM 0 HB VAL A 477 -0.097 2.150 5.101 1.00 0.00 H new ATOM 0 HG11 VAL A 477 1.196 3.686 3.669 1.00 0.00 H new ATOM 0 HG12 VAL A 477 2.222 2.909 4.899 1.00 0.00 H new ATOM 0 HG13 VAL A 477 2.273 2.345 3.211 1.00 0.00 H new ATOM 0 HG21 VAL A 477 -0.766 2.509 2.756 1.00 0.00 H new ATOM 0 HG22 VAL A 477 0.237 1.124 2.262 1.00 0.00 H new ATOM 0 HG23 VAL A 477 -1.175 0.870 3.315 1.00 0.00 H new ATOM 667 N TYR A 478 3.396 0.611 5.539 1.00 0.00 N ATOM 668 CA TYR A 478 4.457 0.822 6.517 1.00 0.00 C ATOM 669 C TYR A 478 5.342 1.997 6.125 1.00 0.00 C ATOM 670 O TYR A 478 5.552 2.262 4.941 1.00 0.00 O ATOM 671 CB TYR A 478 5.304 -0.444 6.667 1.00 0.00 C ATOM 672 CG TYR A 478 4.505 -1.676 7.034 1.00 0.00 C ATOM 673 CD1 TYR A 478 3.806 -2.385 6.067 1.00 0.00 C ATOM 674 CD2 TYR A 478 4.454 -2.127 8.344 1.00 0.00 C ATOM 675 CE1 TYR A 478 3.076 -3.510 6.396 1.00 0.00 C ATOM 676 CE2 TYR A 478 3.726 -3.251 8.684 1.00 0.00 C ATOM 677 CZ TYR A 478 3.038 -3.939 7.707 1.00 0.00 C ATOM 678 OH TYR A 478 2.313 -5.061 8.040 1.00 0.00 O ATOM 0 H TYR A 478 3.727 0.426 4.592 1.00 0.00 H new ATOM 0 HA TYR A 478 3.988 1.052 7.473 1.00 0.00 H new ATOM 0 HB2 TYR A 478 5.831 -0.630 5.731 1.00 0.00 H new ATOM 0 HB3 TYR A 478 6.062 -0.274 7.431 1.00 0.00 H new ATOM 0 HD1 TYR A 478 3.833 -2.051 5.040 1.00 0.00 H new ATOM 0 HD2 TYR A 478 4.992 -1.591 9.112 1.00 0.00 H new ATOM 0 HE1 TYR A 478 2.538 -4.051 5.632 1.00 0.00 H new ATOM 0 HE2 TYR A 478 3.696 -3.589 9.709 1.00 0.00 H new ATOM 0 HH TYR A 478 2.391 -5.227 9.003 1.00 0.00 H new ATOM 688 N ILE A 479 5.860 2.700 7.125 1.00 0.00 N ATOM 689 CA ILE A 479 6.877 3.721 6.900 1.00 0.00 C ATOM 690 C ILE A 479 8.158 3.400 7.658 1.00 0.00 C ATOM 691 O ILE A 479 8.164 3.343 8.888 1.00 0.00 O ATOM 692 CB ILE A 479 6.379 5.117 7.317 1.00 0.00 C ATOM 693 CG1 ILE A 479 5.144 5.509 6.503 1.00 0.00 C ATOM 694 CG2 ILE A 479 7.483 6.149 7.146 1.00 0.00 C ATOM 695 CD1 ILE A 479 4.502 6.803 6.953 1.00 0.00 C ATOM 0 H ILE A 479 5.592 2.582 8.102 1.00 0.00 H new ATOM 0 HA ILE A 479 7.085 3.726 5.830 1.00 0.00 H new ATOM 0 HB ILE A 479 6.100 5.085 8.370 1.00 0.00 H new ATOM 0 HG12 ILE A 479 5.425 5.599 5.454 1.00 0.00 H new ATOM 0 HG13 ILE A 479 4.408 4.707 6.568 1.00 0.00 H new ATOM 0 HG21 ILE A 479 7.114 7.130 7.445 1.00 0.00 H new ATOM 0 HG22 ILE A 479 8.335 5.877 7.769 1.00 0.00 H new ATOM 0 HG23 ILE A 479 7.792 6.181 6.101 1.00 0.00 H new ATOM 0 HD11 ILE A 479 3.634 7.014 6.329 1.00 0.00 H new ATOM 0 HD12 ILE A 479 4.188 6.711 7.993 1.00 0.00 H new ATOM 0 HD13 ILE A 479 5.221 7.617 6.862 1.00 0.00 H new ATOM 707 N ASN A 480 9.241 3.192 6.917 1.00 0.00 N ATOM 708 CA ASN A 480 10.522 2.840 7.518 1.00 0.00 C ATOM 709 C ASN A 480 10.393 1.619 8.417 1.00 0.00 C ATOM 710 O ASN A 480 10.973 1.569 9.501 1.00 0.00 O ATOM 711 CB ASN A 480 11.109 4.004 8.296 1.00 0.00 C ATOM 712 CG ASN A 480 11.539 5.156 7.430 1.00 0.00 C ATOM 713 OD1 ASN A 480 11.846 4.987 6.244 1.00 0.00 O ATOM 714 ND2 ASN A 480 11.640 6.311 8.037 1.00 0.00 N ATOM 0 H ASN A 480 9.257 3.261 5.899 1.00 0.00 H new ATOM 0 HA ASN A 480 11.203 2.597 6.702 1.00 0.00 H new ATOM 0 HB2 ASN A 480 10.370 4.358 9.015 1.00 0.00 H new ATOM 0 HB3 ASN A 480 11.967 3.651 8.868 1.00 0.00 H new ATOM 0 HD21 ASN A 480 11.986 7.125 7.529 1.00 0.00 H new ATOM 0 HD22 ASN A 480 11.373 6.397 9.018 1.00 0.00 H new ATOM 721 N GLY A 481 9.630 0.632 7.959 1.00 0.00 N ATOM 722 CA GLY A 481 9.516 -0.639 8.664 1.00 0.00 C ATOM 723 C GLY A 481 8.422 -0.589 9.721 1.00 0.00 C ATOM 724 O GLY A 481 8.058 -1.611 10.303 1.00 0.00 O ATOM 0 H GLY A 481 9.081 0.688 7.101 1.00 0.00 H new ATOM 0 HA2 GLY A 481 9.300 -1.435 7.951 1.00 0.00 H new ATOM 0 HA3 GLY A 481 10.468 -0.883 9.135 1.00 0.00 H new ATOM 728 N THR A 482 7.900 0.609 9.970 1.00 0.00 N ATOM 729 CA THR A 482 6.875 0.803 10.989 1.00 0.00 C ATOM 730 C THR A 482 5.483 0.837 10.371 1.00 0.00 C ATOM 731 O THR A 482 5.274 1.450 9.323 1.00 0.00 O ATOM 732 CB THR A 482 7.106 2.101 11.782 1.00 0.00 C ATOM 733 OG1 THR A 482 8.371 2.035 12.454 1.00 0.00 O ATOM 734 CG2 THR A 482 6.001 2.302 12.808 1.00 0.00 C ATOM 0 H THR A 482 8.171 1.461 9.479 1.00 0.00 H new ATOM 0 HA THR A 482 6.945 -0.045 11.670 1.00 0.00 H new ATOM 0 HB THR A 482 7.100 2.940 11.087 1.00 0.00 H new ATOM 0 HG1 THR A 482 8.518 2.863 12.957 1.00 0.00 H new ATOM 0 HG21 THR A 482 6.180 3.225 13.360 1.00 0.00 H new ATOM 0 HG22 THR A 482 5.039 2.365 12.299 1.00 0.00 H new ATOM 0 HG23 THR A 482 5.991 1.461 13.501 1.00 0.00 H new ATOM 742 N LEU A 483 4.535 0.176 11.024 1.00 0.00 N ATOM 743 CA LEU A 483 3.149 0.174 10.569 1.00 0.00 C ATOM 744 C LEU A 483 2.506 1.541 10.758 1.00 0.00 C ATOM 745 O LEU A 483 2.420 2.050 11.875 1.00 0.00 O ATOM 746 CB LEU A 483 2.348 -0.900 11.315 1.00 0.00 C ATOM 747 CG LEU A 483 0.864 -0.989 10.934 1.00 0.00 C ATOM 748 CD1 LEU A 483 0.723 -1.390 9.474 1.00 0.00 C ATOM 749 CD2 LEU A 483 0.167 -1.994 11.840 1.00 0.00 C ATOM 0 H LEU A 483 4.700 -0.367 11.872 1.00 0.00 H new ATOM 0 HA LEU A 483 3.143 -0.056 9.504 1.00 0.00 H new ATOM 0 HB2 LEU A 483 2.812 -1.869 11.133 1.00 0.00 H new ATOM 0 HB3 LEU A 483 2.421 -0.708 12.385 1.00 0.00 H new ATOM 0 HG LEU A 483 0.395 -0.014 11.065 1.00 0.00 H new ATOM 0 HD11 LEU A 483 -0.334 -1.450 9.214 1.00 0.00 H new ATOM 0 HD12 LEU A 483 1.210 -0.646 8.844 1.00 0.00 H new ATOM 0 HD13 LEU A 483 1.191 -2.362 9.317 1.00 0.00 H new ATOM 0 HD21 LEU A 483 -0.887 -2.058 11.570 1.00 0.00 H new ATOM 0 HD22 LEU A 483 0.631 -2.973 11.722 1.00 0.00 H new ATOM 0 HD23 LEU A 483 0.257 -1.672 12.877 1.00 0.00 H new ATOM 761 N TYR A 484 2.052 2.134 9.657 1.00 0.00 N ATOM 762 CA TYR A 484 1.448 3.459 9.694 1.00 0.00 C ATOM 763 C TYR A 484 -0.073 3.372 9.718 1.00 0.00 C ATOM 764 O TYR A 484 -0.735 4.125 10.430 1.00 0.00 O ATOM 765 CB TYR A 484 1.907 4.289 8.494 1.00 0.00 C ATOM 766 CG TYR A 484 1.116 5.563 8.291 1.00 0.00 C ATOM 767 CD1 TYR A 484 1.378 6.693 9.049 1.00 0.00 C ATOM 768 CD2 TYR A 484 0.110 5.630 7.338 1.00 0.00 C ATOM 769 CE1 TYR A 484 0.658 7.859 8.869 1.00 0.00 C ATOM 770 CE2 TYR A 484 -0.615 6.790 7.149 1.00 0.00 C ATOM 771 CZ TYR A 484 -0.339 7.902 7.916 1.00 0.00 C ATOM 772 OH TYR A 484 -1.057 9.061 7.729 1.00 0.00 O ATOM 0 H TYR A 484 2.092 1.716 8.728 1.00 0.00 H new ATOM 0 HA TYR A 484 1.775 3.949 10.611 1.00 0.00 H new ATOM 0 HB2 TYR A 484 2.959 4.543 8.621 1.00 0.00 H new ATOM 0 HB3 TYR A 484 1.833 3.679 7.593 1.00 0.00 H new ATOM 0 HD1 TYR A 484 2.159 6.662 9.794 1.00 0.00 H new ATOM 0 HD2 TYR A 484 -0.110 4.762 6.735 1.00 0.00 H new ATOM 0 HE1 TYR A 484 0.874 8.730 9.470 1.00 0.00 H new ATOM 0 HE2 TYR A 484 -1.395 6.826 6.403 1.00 0.00 H new ATOM 0 HH TYR A 484 -1.223 9.192 6.772 1.00 0.00 H new ATOM 782 N LYS A 485 -0.618 2.448 8.936 1.00 0.00 N ATOM 783 CA LYS A 485 -2.062 2.355 8.753 1.00 0.00 C ATOM 784 C LYS A 485 -2.453 1.025 8.124 1.00 0.00 C ATOM 785 O LYS A 485 -1.635 0.368 7.479 1.00 0.00 O ATOM 786 CB LYS A 485 -2.567 3.512 7.892 1.00 0.00 C ATOM 787 CG LYS A 485 -4.082 3.676 7.883 1.00 0.00 C ATOM 788 CD LYS A 485 -4.597 4.122 9.243 1.00 0.00 C ATOM 789 CE LYS A 485 -6.105 4.323 9.227 1.00 0.00 C ATOM 790 NZ LYS A 485 -6.628 4.731 10.559 1.00 0.00 N ATOM 0 H LYS A 485 -0.082 1.752 8.418 1.00 0.00 H new ATOM 0 HA LYS A 485 -2.527 2.416 9.737 1.00 0.00 H new ATOM 0 HB2 LYS A 485 -2.116 4.438 8.248 1.00 0.00 H new ATOM 0 HB3 LYS A 485 -2.224 3.364 6.868 1.00 0.00 H new ATOM 0 HG2 LYS A 485 -4.366 4.407 7.126 1.00 0.00 H new ATOM 0 HG3 LYS A 485 -4.551 2.732 7.606 1.00 0.00 H new ATOM 0 HD2 LYS A 485 -4.336 3.377 9.995 1.00 0.00 H new ATOM 0 HD3 LYS A 485 -4.108 5.052 9.532 1.00 0.00 H new ATOM 0 HE2 LYS A 485 -6.361 5.083 8.489 1.00 0.00 H new ATOM 0 HE3 LYS A 485 -6.591 3.398 8.915 1.00 0.00 H new ATOM 0 HZ1 LYS A 485 -7.659 4.857 10.503 1.00 0.00 H new ATOM 0 HZ2 LYS A 485 -6.407 3.995 11.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 485 -6.185 5.627 10.847 1.00 0.00 H new ATOM 804 N ASN A 486 -3.708 0.631 8.315 1.00 0.00 N ATOM 805 CA ASN A 486 -4.196 -0.647 7.811 1.00 0.00 C ATOM 806 C ASN A 486 -5.628 -0.530 7.305 1.00 0.00 C ATOM 807 O ASN A 486 -6.395 0.311 7.774 1.00 0.00 O ATOM 808 CB ASN A 486 -4.098 -1.733 8.866 1.00 0.00 C ATOM 809 CG ASN A 486 -4.999 -1.509 10.049 1.00 0.00 C ATOM 810 OD1 ASN A 486 -6.219 -1.691 9.969 1.00 0.00 O ATOM 811 ND2 ASN A 486 -4.415 -1.038 11.121 1.00 0.00 N ATOM 0 H ASN A 486 -4.406 1.180 8.816 1.00 0.00 H new ATOM 0 HA ASN A 486 -3.557 -0.928 6.974 1.00 0.00 H new ATOM 0 HB2 ASN A 486 -4.343 -2.693 8.411 1.00 0.00 H new ATOM 0 HB3 ASN A 486 -3.067 -1.798 9.213 1.00 0.00 H new ATOM 0 HD21 ASN A 486 -4.971 -0.802 11.943 1.00 0.00 H new ATOM 0 HD22 ASN A 486 -3.404 -0.907 11.135 1.00 0.00 H new ATOM 818 N TRP A 487 -5.983 -1.377 6.347 1.00 0.00 N ATOM 819 CA TRP A 487 -7.369 -1.507 5.913 1.00 0.00 C ATOM 820 C TRP A 487 -7.748 -2.967 5.703 1.00 0.00 C ATOM 821 O TRP A 487 -6.941 -3.766 5.229 1.00 0.00 O ATOM 822 CB TRP A 487 -7.599 -0.716 4.623 1.00 0.00 C ATOM 823 CG TRP A 487 -7.339 0.754 4.768 1.00 0.00 C ATOM 824 CD1 TRP A 487 -8.261 1.723 5.028 1.00 0.00 C ATOM 825 CD2 TRP A 487 -6.074 1.418 4.661 1.00 0.00 C ATOM 826 NE1 TRP A 487 -7.650 2.950 5.091 1.00 0.00 N ATOM 827 CE2 TRP A 487 -6.306 2.789 4.869 1.00 0.00 C ATOM 828 CE3 TRP A 487 -4.766 0.985 4.410 1.00 0.00 C ATOM 829 CZ2 TRP A 487 -5.288 3.729 4.832 1.00 0.00 C ATOM 830 CZ3 TRP A 487 -3.746 1.927 4.375 1.00 0.00 C ATOM 831 CH2 TRP A 487 -3.998 3.259 4.580 1.00 0.00 C ATOM 0 H TRP A 487 -5.329 -1.986 5.855 1.00 0.00 H new ATOM 0 HA TRP A 487 -8.004 -1.101 6.700 1.00 0.00 H new ATOM 0 HB2 TRP A 487 -6.953 -1.116 3.841 1.00 0.00 H new ATOM 0 HB3 TRP A 487 -8.627 -0.864 4.294 1.00 0.00 H new ATOM 0 HD1 TRP A 487 -9.318 1.550 5.165 1.00 0.00 H new ATOM 0 HE1 TRP A 487 -8.119 3.837 5.273 1.00 0.00 H new ATOM 0 HE3 TRP A 487 -4.555 -0.061 4.247 1.00 0.00 H new ATOM 0 HZ2 TRP A 487 -5.484 4.779 4.991 1.00 0.00 H new ATOM 0 HZ3 TRP A 487 -2.734 1.604 4.182 1.00 0.00 H new ATOM 0 HH2 TRP A 487 -3.179 3.962 4.546 1.00 0.00 H new ATOM 842 N THR A 488 -8.980 -3.310 6.060 1.00 0.00 N ATOM 843 CA THR A 488 -9.541 -4.614 5.724 1.00 0.00 C ATOM 844 C THR A 488 -10.567 -4.501 4.605 1.00 0.00 C ATOM 845 O THR A 488 -11.526 -3.734 4.703 1.00 0.00 O ATOM 846 CB THR A 488 -10.202 -5.277 6.947 1.00 0.00 C ATOM 847 OG1 THR A 488 -9.224 -5.469 7.977 1.00 0.00 O ATOM 848 CG2 THR A 488 -10.801 -6.622 6.566 1.00 0.00 C ATOM 0 H THR A 488 -9.611 -2.703 6.583 1.00 0.00 H new ATOM 0 HA THR A 488 -8.710 -5.236 5.390 1.00 0.00 H new ATOM 0 HB THR A 488 -10.998 -4.625 7.308 1.00 0.00 H new ATOM 0 HG1 THR A 488 -9.646 -5.889 8.755 1.00 0.00 H new ATOM 0 HG21 THR A 488 -11.264 -7.076 7.443 1.00 0.00 H new ATOM 0 HG22 THR A 488 -11.554 -6.478 5.791 1.00 0.00 H new ATOM 0 HG23 THR A 488 -10.015 -7.277 6.191 1.00 0.00 H new ATOM 856 N VAL A 489 -10.361 -5.268 3.540 1.00 0.00 N ATOM 857 CA VAL A 489 -11.236 -5.213 2.375 1.00 0.00 C ATOM 858 C VAL A 489 -11.512 -6.608 1.828 1.00 0.00 C ATOM 859 O VAL A 489 -10.848 -7.574 2.202 1.00 0.00 O ATOM 860 CB VAL A 489 -10.634 -4.344 1.256 1.00 0.00 C ATOM 861 CG1 VAL A 489 -10.436 -2.915 1.738 1.00 0.00 C ATOM 862 CG2 VAL A 489 -9.314 -4.929 0.778 1.00 0.00 C ATOM 0 H VAL A 489 -9.594 -5.936 3.460 1.00 0.00 H new ATOM 0 HA VAL A 489 -12.172 -4.764 2.707 1.00 0.00 H new ATOM 0 HB VAL A 489 -11.331 -4.333 0.418 1.00 0.00 H new ATOM 0 HG11 VAL A 489 -10.010 -2.316 0.934 1.00 0.00 H new ATOM 0 HG12 VAL A 489 -11.397 -2.494 2.034 1.00 0.00 H new ATOM 0 HG13 VAL A 489 -9.759 -2.910 2.592 1.00 0.00 H new ATOM 0 HG21 VAL A 489 -8.903 -4.302 -0.013 1.00 0.00 H new ATOM 0 HG22 VAL A 489 -8.612 -4.970 1.610 1.00 0.00 H new ATOM 0 HG23 VAL A 489 -9.480 -5.935 0.393 1.00 0.00 H new ATOM 872 N SER A 490 -12.496 -6.706 0.940 1.00 0.00 N ATOM 873 CA SER A 490 -12.715 -7.925 0.172 1.00 0.00 C ATOM 874 C SER A 490 -12.666 -7.648 -1.325 1.00 0.00 C ATOM 875 O SER A 490 -13.120 -6.602 -1.787 1.00 0.00 O ATOM 876 CB SER A 490 -14.045 -8.548 0.551 1.00 0.00 C ATOM 877 OG SER A 490 -14.079 -8.940 1.895 1.00 0.00 O ATOM 0 H SER A 490 -13.155 -5.955 0.735 1.00 0.00 H new ATOM 0 HA SER A 490 -11.914 -8.626 0.409 1.00 0.00 H new ATOM 0 HB2 SER A 490 -14.846 -7.834 0.362 1.00 0.00 H new ATOM 0 HB3 SER A 490 -14.233 -9.414 -0.084 1.00 0.00 H new ATOM 0 HG SER A 490 -14.953 -9.335 2.099 1.00 0.00 H new ATOM 883 N LEU A 491 -12.112 -8.592 -2.078 1.00 0.00 N ATOM 884 CA LEU A 491 -11.976 -8.439 -3.521 1.00 0.00 C ATOM 885 C LEU A 491 -12.537 -9.647 -4.260 1.00 0.00 C ATOM 886 O LEU A 491 -12.194 -10.788 -3.954 1.00 0.00 O ATOM 887 CB LEU A 491 -10.504 -8.224 -3.894 1.00 0.00 C ATOM 888 CG LEU A 491 -9.871 -6.940 -3.340 1.00 0.00 C ATOM 889 CD1 LEU A 491 -8.371 -6.944 -3.600 1.00 0.00 C ATOM 890 CD2 LEU A 491 -10.527 -5.729 -3.986 1.00 0.00 C ATOM 0 H LEU A 491 -11.750 -9.472 -1.712 1.00 0.00 H new ATOM 0 HA LEU A 491 -12.551 -7.564 -3.823 1.00 0.00 H new ATOM 0 HB2 LEU A 491 -9.927 -9.078 -3.538 1.00 0.00 H new ATOM 0 HB3 LEU A 491 -10.419 -8.213 -4.981 1.00 0.00 H new ATOM 0 HG LEU A 491 -10.031 -6.892 -2.263 1.00 0.00 H new ATOM 0 HD11 LEU A 491 -7.931 -6.029 -3.204 1.00 0.00 H new ATOM 0 HD12 LEU A 491 -7.919 -7.806 -3.110 1.00 0.00 H new ATOM 0 HD13 LEU A 491 -8.188 -6.999 -4.673 1.00 0.00 H new ATOM 0 HD21 LEU A 491 -10.077 -4.818 -3.592 1.00 0.00 H new ATOM 0 HD22 LEU A 491 -10.381 -5.769 -5.065 1.00 0.00 H new ATOM 0 HD23 LEU A 491 -11.594 -5.732 -3.764 1.00 0.00 H new ATOM 902 N GLY A 492 -13.404 -9.389 -5.232 1.00 0.00 N ATOM 903 CA GLY A 492 -13.977 -10.450 -6.051 1.00 0.00 C ATOM 904 C GLY A 492 -13.100 -10.746 -7.261 1.00 0.00 C ATOM 905 O GLY A 492 -11.958 -10.292 -7.338 1.00 0.00 O ATOM 0 H GLY A 492 -13.726 -8.452 -5.473 1.00 0.00 H new ATOM 0 HA2 GLY A 492 -14.092 -11.353 -5.452 1.00 0.00 H new ATOM 0 HA3 GLY A 492 -14.973 -10.159 -6.383 1.00 0.00 H new ATOM 909 N PRO A 493 -13.641 -11.510 -8.204 1.00 0.00 N ATOM 910 CA PRO A 493 -12.938 -11.804 -9.448 1.00 0.00 C ATOM 911 C PRO A 493 -12.684 -10.534 -10.251 1.00 0.00 C ATOM 912 O PRO A 493 -13.619 -9.906 -10.747 1.00 0.00 O ATOM 913 CB PRO A 493 -13.868 -12.776 -10.182 1.00 0.00 C ATOM 914 CG PRO A 493 -15.216 -12.507 -9.606 1.00 0.00 C ATOM 915 CD PRO A 493 -14.969 -12.154 -8.163 1.00 0.00 C ATOM 0 HA PRO A 493 -11.950 -12.233 -9.284 1.00 0.00 H new ATOM 0 HB2 PRO A 493 -13.854 -12.603 -11.258 1.00 0.00 H new ATOM 0 HB3 PRO A 493 -13.567 -13.811 -10.022 1.00 0.00 H new ATOM 0 HG2 PRO A 493 -15.712 -11.691 -10.131 1.00 0.00 H new ATOM 0 HG3 PRO A 493 -15.862 -13.381 -9.692 1.00 0.00 H new ATOM 0 HD2 PRO A 493 -15.733 -11.480 -7.775 1.00 0.00 H new ATOM 0 HD3 PRO A 493 -14.970 -13.038 -7.525 1.00 0.00 H new ATOM 923 N LYS A 494 -11.414 -10.163 -10.376 1.00 0.00 N ATOM 924 CA LYS A 494 -11.030 -9.006 -11.174 1.00 0.00 C ATOM 925 C LYS A 494 -11.541 -7.712 -10.551 1.00 0.00 C ATOM 926 O LYS A 494 -11.928 -6.783 -11.258 1.00 0.00 O ATOM 927 CB LYS A 494 -11.554 -9.144 -12.605 1.00 0.00 C ATOM 928 CG LYS A 494 -11.115 -10.416 -13.315 1.00 0.00 C ATOM 929 CD LYS A 494 -11.645 -10.464 -14.742 1.00 0.00 C ATOM 930 CE LYS A 494 -11.281 -11.774 -15.424 1.00 0.00 C ATOM 931 NZ LYS A 494 -11.791 -11.834 -16.821 1.00 0.00 N ATOM 0 H LYS A 494 -10.633 -10.648 -9.934 1.00 0.00 H new ATOM 0 HA LYS A 494 -9.941 -8.965 -11.199 1.00 0.00 H new ATOM 0 HB2 LYS A 494 -12.643 -9.111 -12.585 1.00 0.00 H new ATOM 0 HB3 LYS A 494 -11.220 -8.284 -13.186 1.00 0.00 H new ATOM 0 HG2 LYS A 494 -10.026 -10.471 -13.327 1.00 0.00 H new ATOM 0 HG3 LYS A 494 -11.472 -11.285 -12.763 1.00 0.00 H new ATOM 0 HD2 LYS A 494 -12.728 -10.345 -14.734 1.00 0.00 H new ATOM 0 HD3 LYS A 494 -11.237 -9.629 -15.312 1.00 0.00 H new ATOM 0 HE2 LYS A 494 -10.197 -11.892 -15.428 1.00 0.00 H new ATOM 0 HE3 LYS A 494 -11.690 -12.607 -14.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 494 -11.522 -12.742 -17.250 1.00 0.00 H new ATOM 0 HZ2 LYS A 494 -12.827 -11.747 -16.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 494 -11.381 -11.055 -17.374 1.00 0.00 H new ATOM 945 N GLU A 495 -11.538 -7.661 -9.223 1.00 0.00 N ATOM 946 CA GLU A 495 -11.978 -6.473 -8.502 1.00 0.00 C ATOM 947 C GLU A 495 -10.795 -5.596 -8.109 1.00 0.00 C ATOM 948 O GLU A 495 -9.722 -6.099 -7.775 1.00 0.00 O ATOM 949 CB GLU A 495 -12.777 -6.866 -7.258 1.00 0.00 C ATOM 950 CG GLU A 495 -13.321 -5.689 -6.462 1.00 0.00 C ATOM 951 CD GLU A 495 -14.226 -4.831 -7.303 1.00 0.00 C ATOM 952 OE1 GLU A 495 -13.744 -4.223 -8.228 1.00 0.00 O ATOM 953 OE2 GLU A 495 -15.415 -4.871 -7.092 1.00 0.00 O ATOM 0 H GLU A 495 -11.235 -8.429 -8.624 1.00 0.00 H new ATOM 0 HA GLU A 495 -12.621 -5.899 -9.169 1.00 0.00 H new ATOM 0 HB2 GLU A 495 -13.610 -7.500 -7.562 1.00 0.00 H new ATOM 0 HB3 GLU A 495 -12.141 -7.466 -6.607 1.00 0.00 H new ATOM 0 HG2 GLU A 495 -13.868 -6.056 -5.594 1.00 0.00 H new ATOM 0 HG3 GLU A 495 -12.493 -5.088 -6.086 1.00 0.00 H new ATOM 960 N GLU A 496 -10.996 -4.283 -8.152 1.00 0.00 N ATOM 961 CA GLU A 496 -9.973 -3.337 -7.728 1.00 0.00 C ATOM 962 C GLU A 496 -10.509 -2.383 -6.668 1.00 0.00 C ATOM 963 O GLU A 496 -11.659 -1.949 -6.735 1.00 0.00 O ATOM 964 CB GLU A 496 -9.445 -2.546 -8.927 1.00 0.00 C ATOM 965 CG GLU A 496 -8.372 -1.522 -8.582 1.00 0.00 C ATOM 966 CD GLU A 496 -7.888 -0.803 -9.810 1.00 0.00 C ATOM 967 OE1 GLU A 496 -8.432 -1.033 -10.862 1.00 0.00 O ATOM 968 OE2 GLU A 496 -7.050 0.056 -9.678 1.00 0.00 O ATOM 0 H GLU A 496 -11.860 -3.850 -8.477 1.00 0.00 H new ATOM 0 HA GLU A 496 -9.154 -3.907 -7.290 1.00 0.00 H new ATOM 0 HB2 GLU A 496 -9.041 -3.245 -9.659 1.00 0.00 H new ATOM 0 HB3 GLU A 496 -10.280 -2.033 -9.404 1.00 0.00 H new ATOM 0 HG2 GLU A 496 -8.771 -0.800 -7.869 1.00 0.00 H new ATOM 0 HG3 GLU A 496 -7.533 -2.021 -8.096 1.00 0.00 H new ATOM 975 N LYS A 497 -9.670 -2.064 -5.689 1.00 0.00 N ATOM 976 CA LYS A 497 -10.048 -1.136 -4.629 1.00 0.00 C ATOM 977 C LYS A 497 -8.994 -0.053 -4.444 1.00 0.00 C ATOM 978 O LYS A 497 -7.798 -0.305 -4.592 1.00 0.00 O ATOM 979 CB LYS A 497 -10.268 -1.886 -3.314 1.00 0.00 C ATOM 980 CG LYS A 497 -11.592 -2.636 -3.232 1.00 0.00 C ATOM 981 CD LYS A 497 -12.754 -1.683 -2.994 1.00 0.00 C ATOM 982 CE LYS A 497 -12.661 -1.028 -1.625 1.00 0.00 C ATOM 983 NZ LYS A 497 -13.715 0.006 -1.431 1.00 0.00 N ATOM 0 H LYS A 497 -8.723 -2.434 -5.607 1.00 0.00 H new ATOM 0 HA LYS A 497 -10.981 -0.656 -4.923 1.00 0.00 H new ATOM 0 HB2 LYS A 497 -9.453 -2.596 -3.174 1.00 0.00 H new ATOM 0 HB3 LYS A 497 -10.216 -1.174 -2.490 1.00 0.00 H new ATOM 0 HG2 LYS A 497 -11.757 -3.190 -4.156 1.00 0.00 H new ATOM 0 HG3 LYS A 497 -11.548 -3.368 -2.426 1.00 0.00 H new ATOM 0 HD2 LYS A 497 -12.761 -0.915 -3.767 1.00 0.00 H new ATOM 0 HD3 LYS A 497 -13.695 -2.226 -3.076 1.00 0.00 H new ATOM 0 HE2 LYS A 497 -12.753 -1.790 -0.851 1.00 0.00 H new ATOM 0 HE3 LYS A 497 -11.678 -0.571 -1.507 1.00 0.00 H new ATOM 0 HZ1 LYS A 497 -13.617 0.428 -0.486 1.00 0.00 H new ATOM 0 HZ2 LYS A 497 -13.612 0.747 -2.154 1.00 0.00 H new ATOM 0 HZ3 LYS A 497 -14.653 -0.434 -1.518 1.00 0.00 H new ATOM 997 N VAL A 498 -9.443 1.156 -4.119 1.00 0.00 N ATOM 998 CA VAL A 498 -8.536 2.273 -3.888 1.00 0.00 C ATOM 999 C VAL A 498 -8.567 2.713 -2.430 1.00 0.00 C ATOM 1000 O VAL A 498 -9.609 3.123 -1.917 1.00 0.00 O ATOM 1001 CB VAL A 498 -8.882 3.475 -4.786 1.00 0.00 C ATOM 1002 CG1 VAL A 498 -7.943 4.638 -4.502 1.00 0.00 C ATOM 1003 CG2 VAL A 498 -8.812 3.082 -6.253 1.00 0.00 C ATOM 0 H VAL A 498 -10.431 1.386 -4.010 1.00 0.00 H new ATOM 0 HA VAL A 498 -7.534 1.923 -4.137 1.00 0.00 H new ATOM 0 HB VAL A 498 -9.901 3.790 -4.562 1.00 0.00 H new ATOM 0 HG11 VAL A 498 -8.201 5.479 -5.145 1.00 0.00 H new ATOM 0 HG12 VAL A 498 -8.039 4.936 -3.458 1.00 0.00 H new ATOM 0 HG13 VAL A 498 -6.915 4.333 -4.699 1.00 0.00 H new ATOM 0 HG21 VAL A 498 -9.060 3.944 -6.873 1.00 0.00 H new ATOM 0 HG22 VAL A 498 -7.804 2.741 -6.491 1.00 0.00 H new ATOM 0 HG23 VAL A 498 -9.522 2.278 -6.449 1.00 0.00 H new ATOM 1013 N LEU A 499 -7.419 2.629 -1.767 1.00 0.00 N ATOM 1014 CA LEU A 499 -7.284 3.121 -0.402 1.00 0.00 C ATOM 1015 C LEU A 499 -6.534 4.446 -0.365 1.00 0.00 C ATOM 1016 O LEU A 499 -5.597 4.662 -1.136 1.00 0.00 O ATOM 1017 CB LEU A 499 -6.571 2.081 0.470 1.00 0.00 C ATOM 1018 CG LEU A 499 -7.230 0.696 0.501 1.00 0.00 C ATOM 1019 CD1 LEU A 499 -6.345 -0.286 1.256 1.00 0.00 C ATOM 1020 CD2 LEU A 499 -8.601 0.798 1.152 1.00 0.00 C ATOM 0 H LEU A 499 -6.567 2.224 -2.154 1.00 0.00 H new ATOM 0 HA LEU A 499 -8.285 3.290 -0.004 1.00 0.00 H new ATOM 0 HB2 LEU A 499 -5.547 1.971 0.113 1.00 0.00 H new ATOM 0 HB3 LEU A 499 -6.514 2.462 1.490 1.00 0.00 H new ATOM 0 HG LEU A 499 -7.354 0.330 -0.518 1.00 0.00 H new ATOM 0 HD11 LEU A 499 -6.821 -1.266 1.273 1.00 0.00 H new ATOM 0 HD12 LEU A 499 -5.378 -0.361 0.759 1.00 0.00 H new ATOM 0 HD13 LEU A 499 -6.201 0.065 2.278 1.00 0.00 H new ATOM 0 HD21 LEU A 499 -9.068 -0.187 1.173 1.00 0.00 H new ATOM 0 HD22 LEU A 499 -8.493 1.171 2.171 1.00 0.00 H new ATOM 0 HD23 LEU A 499 -9.226 1.483 0.579 1.00 0.00 H new ATOM 1032 N THR A 500 -6.948 5.331 0.534 1.00 0.00 N ATOM 1033 CA THR A 500 -6.277 6.613 0.714 1.00 0.00 C ATOM 1034 C THR A 500 -5.795 6.786 2.148 1.00 0.00 C ATOM 1035 O THR A 500 -6.367 6.217 3.079 1.00 0.00 O ATOM 1036 CB THR A 500 -7.199 7.791 0.349 1.00 0.00 C ATOM 1037 OG1 THR A 500 -8.410 7.709 1.111 1.00 0.00 O ATOM 1038 CG2 THR A 500 -7.536 7.761 -1.135 1.00 0.00 C ATOM 0 H THR A 500 -7.747 5.184 1.151 1.00 0.00 H new ATOM 0 HA THR A 500 -5.419 6.614 0.042 1.00 0.00 H new ATOM 0 HB THR A 500 -6.681 8.723 0.577 1.00 0.00 H new ATOM 0 HG1 THR A 500 -8.994 8.461 0.878 1.00 0.00 H new ATOM 0 HG21 THR A 500 -8.188 8.600 -1.377 1.00 0.00 H new ATOM 0 HG22 THR A 500 -6.618 7.835 -1.718 1.00 0.00 H new ATOM 0 HG23 THR A 500 -8.043 6.826 -1.374 1.00 0.00 H new ATOM 1046 N PHE A 501 -4.741 7.574 2.322 1.00 0.00 N ATOM 1047 CA PHE A 501 -4.334 8.030 3.647 1.00 0.00 C ATOM 1048 C PHE A 501 -3.577 9.350 3.568 1.00 0.00 C ATOM 1049 O PHE A 501 -3.007 9.688 2.530 1.00 0.00 O ATOM 1050 CB PHE A 501 -3.472 6.970 4.335 1.00 0.00 C ATOM 1051 CG PHE A 501 -2.195 6.662 3.607 1.00 0.00 C ATOM 1052 CD1 PHE A 501 -2.149 5.665 2.644 1.00 0.00 C ATOM 1053 CD2 PHE A 501 -1.033 7.370 3.883 1.00 0.00 C ATOM 1054 CE1 PHE A 501 -0.975 5.379 1.975 1.00 0.00 C ATOM 1055 CE2 PHE A 501 0.141 7.088 3.214 1.00 0.00 C ATOM 1056 CZ PHE A 501 0.170 6.093 2.260 1.00 0.00 C ATOM 0 H PHE A 501 -4.151 7.911 1.561 1.00 0.00 H new ATOM 0 HA PHE A 501 -5.237 8.191 4.236 1.00 0.00 H new ATOM 0 HB2 PHE A 501 -3.232 7.308 5.343 1.00 0.00 H new ATOM 0 HB3 PHE A 501 -4.052 6.053 4.436 1.00 0.00 H new ATOM 0 HD1 PHE A 501 -3.043 5.105 2.414 1.00 0.00 H new ATOM 0 HD2 PHE A 501 -1.048 8.150 4.630 1.00 0.00 H new ATOM 0 HE1 PHE A 501 -0.954 4.597 1.230 1.00 0.00 H new ATOM 0 HE2 PHE A 501 1.037 7.647 3.438 1.00 0.00 H new ATOM 0 HZ PHE A 501 1.089 5.873 1.736 1.00 0.00 H new ATOM 1066 N SER A 502 -3.577 10.093 4.669 1.00 0.00 N ATOM 1067 CA SER A 502 -2.931 11.399 4.711 1.00 0.00 C ATOM 1068 C SER A 502 -1.850 11.444 5.782 1.00 0.00 C ATOM 1069 O SER A 502 -2.089 11.085 6.936 1.00 0.00 O ATOM 1070 CB SER A 502 -3.962 12.484 4.955 1.00 0.00 C ATOM 1071 OG SER A 502 -4.899 12.564 3.917 1.00 0.00 O ATOM 0 H SER A 502 -4.018 9.813 5.545 1.00 0.00 H new ATOM 0 HA SER A 502 -2.454 11.573 3.746 1.00 0.00 H new ATOM 0 HB2 SER A 502 -4.479 12.288 5.895 1.00 0.00 H new ATOM 0 HB3 SER A 502 -3.458 13.445 5.063 1.00 0.00 H new ATOM 0 HG SER A 502 -5.546 13.274 4.114 1.00 0.00 H new ATOM 1077 N TRP A 503 -0.659 11.889 5.396 1.00 0.00 N ATOM 1078 CA TRP A 503 0.503 11.828 6.275 1.00 0.00 C ATOM 1079 C TRP A 503 1.172 13.191 6.397 1.00 0.00 C ATOM 1080 O TRP A 503 1.466 13.842 5.394 1.00 0.00 O ATOM 1081 CB TRP A 503 1.507 10.794 5.758 1.00 0.00 C ATOM 1082 CG TRP A 503 2.802 10.790 6.514 1.00 0.00 C ATOM 1083 CD1 TRP A 503 2.956 10.719 7.866 1.00 0.00 C ATOM 1084 CD2 TRP A 503 4.121 10.859 5.961 1.00 0.00 C ATOM 1085 NE1 TRP A 503 4.290 10.740 8.191 1.00 0.00 N ATOM 1086 CE2 TRP A 503 5.026 10.824 7.037 1.00 0.00 C ATOM 1087 CE3 TRP A 503 4.625 10.945 4.658 1.00 0.00 C ATOM 1088 CZ2 TRP A 503 6.399 10.874 6.855 1.00 0.00 C ATOM 1089 CZ3 TRP A 503 6.002 10.995 4.474 1.00 0.00 C ATOM 1090 CH2 TRP A 503 6.864 10.960 5.541 1.00 0.00 C ATOM 0 H TRP A 503 -0.473 12.296 4.479 1.00 0.00 H new ATOM 0 HA TRP A 503 0.160 11.527 7.265 1.00 0.00 H new ATOM 0 HB2 TRP A 503 1.058 9.802 5.816 1.00 0.00 H new ATOM 0 HB3 TRP A 503 1.710 10.991 4.705 1.00 0.00 H new ATOM 0 HD1 TRP A 503 2.147 10.655 8.578 1.00 0.00 H new ATOM 0 HE1 TRP A 503 4.671 10.700 9.136 1.00 0.00 H new ATOM 0 HE3 TRP A 503 3.956 10.972 3.811 1.00 0.00 H new ATOM 0 HZ2 TRP A 503 7.080 10.848 7.693 1.00 0.00 H new ATOM 0 HZ3 TRP A 503 6.401 11.063 3.473 1.00 0.00 H new ATOM 0 HH2 TRP A 503 7.928 11.000 5.360 1.00 0.00 H new ATOM 1101 N THR A 504 1.413 13.617 7.631 1.00 0.00 N ATOM 1102 CA THR A 504 2.179 14.830 7.887 1.00 0.00 C ATOM 1103 C THR A 504 3.500 14.512 8.577 1.00 0.00 C ATOM 1104 O THR A 504 3.523 14.111 9.742 1.00 0.00 O ATOM 1105 CB THR A 504 1.388 15.827 8.754 1.00 0.00 C ATOM 1106 OG1 THR A 504 0.187 16.207 8.072 1.00 0.00 O ATOM 1107 CG2 THR A 504 2.221 17.069 9.036 1.00 0.00 C ATOM 0 H THR A 504 1.088 13.139 8.472 1.00 0.00 H new ATOM 0 HA THR A 504 2.378 15.285 6.917 1.00 0.00 H new ATOM 0 HB THR A 504 1.141 15.346 9.700 1.00 0.00 H new ATOM 0 HG1 THR A 504 -0.317 16.840 8.625 1.00 0.00 H new ATOM 0 HG21 THR A 504 1.645 17.762 9.650 1.00 0.00 H new ATOM 0 HG22 THR A 504 3.130 16.785 9.565 1.00 0.00 H new ATOM 0 HG23 THR A 504 2.485 17.551 8.095 1.00 0.00 H new ATOM 1115 N PRO A 505 4.599 14.693 7.852 1.00 0.00 N ATOM 1116 CA PRO A 505 5.930 14.512 8.420 1.00 0.00 C ATOM 1117 C PRO A 505 6.279 15.645 9.376 1.00 0.00 C ATOM 1118 O PRO A 505 5.804 16.771 9.219 1.00 0.00 O ATOM 1119 CB PRO A 505 6.856 14.479 7.200 1.00 0.00 C ATOM 1120 CG PRO A 505 6.158 15.316 6.181 1.00 0.00 C ATOM 1121 CD PRO A 505 4.689 15.072 6.403 1.00 0.00 C ATOM 0 HA PRO A 505 6.015 13.605 9.018 1.00 0.00 H new ATOM 0 HB2 PRO A 505 7.841 14.881 7.438 1.00 0.00 H new ATOM 0 HB3 PRO A 505 7.006 13.460 6.842 1.00 0.00 H new ATOM 0 HG2 PRO A 505 6.404 16.371 6.303 1.00 0.00 H new ATOM 0 HG3 PRO A 505 6.455 15.034 5.171 1.00 0.00 H new ATOM 0 HD2 PRO A 505 4.099 15.963 6.186 1.00 0.00 H new ATOM 0 HD3 PRO A 505 4.315 14.277 5.758 1.00 0.00 H new ATOM 1129 N THR A 506 7.113 15.342 10.364 1.00 0.00 N ATOM 1130 CA THR A 506 7.550 16.341 11.331 1.00 0.00 C ATOM 1131 C THR A 506 9.069 16.448 11.365 1.00 0.00 C ATOM 1132 O THR A 506 9.623 17.395 11.925 1.00 0.00 O ATOM 1133 CB THR A 506 7.037 16.023 12.747 1.00 0.00 C ATOM 1134 OG1 THR A 506 7.543 14.747 13.165 1.00 0.00 O ATOM 1135 CG2 THR A 506 5.517 15.993 12.771 1.00 0.00 C ATOM 0 H THR A 506 7.500 14.411 10.516 1.00 0.00 H new ATOM 0 HA THR A 506 7.128 17.293 11.008 1.00 0.00 H new ATOM 0 HB THR A 506 7.385 16.801 13.426 1.00 0.00 H new ATOM 0 HG1 THR A 506 7.218 14.546 14.067 1.00 0.00 H new ATOM 0 HG21 THR A 506 5.173 15.767 13.780 1.00 0.00 H new ATOM 0 HG22 THR A 506 5.129 16.965 12.465 1.00 0.00 H new ATOM 0 HG23 THR A 506 5.157 15.226 12.085 1.00 0.00 H new ATOM 1143 N GLN A 507 9.739 15.472 10.761 1.00 0.00 N ATOM 1144 CA GLN A 507 11.196 15.464 10.702 1.00 0.00 C ATOM 1145 C GLN A 507 11.688 15.335 9.267 1.00 0.00 C ATOM 1146 O GLN A 507 11.157 14.543 8.488 1.00 0.00 O ATOM 1147 CB GLN A 507 11.761 14.321 11.548 1.00 0.00 C ATOM 1148 CG GLN A 507 13.280 14.267 11.589 1.00 0.00 C ATOM 1149 CD GLN A 507 13.796 13.188 12.521 1.00 0.00 C ATOM 1150 OE1 GLN A 507 13.016 12.450 13.132 1.00 0.00 O ATOM 1151 NE2 GLN A 507 15.115 13.091 12.640 1.00 0.00 N ATOM 0 H GLN A 507 9.295 14.675 10.305 1.00 0.00 H new ATOM 0 HA GLN A 507 11.549 16.414 11.104 1.00 0.00 H new ATOM 0 HB2 GLN A 507 11.385 14.417 12.566 1.00 0.00 H new ATOM 0 HB3 GLN A 507 11.386 13.375 11.158 1.00 0.00 H new ATOM 0 HG2 GLN A 507 13.662 14.088 10.584 1.00 0.00 H new ATOM 0 HG3 GLN A 507 13.667 15.235 11.909 1.00 0.00 H new ATOM 0 HE21 GLN A 507 15.722 13.722 12.116 1.00 0.00 H new ATOM 0 HE22 GLN A 507 15.521 12.386 13.255 1.00 0.00 H new ATOM 1160 N GLU A 508 12.706 16.117 8.923 1.00 0.00 N ATOM 1161 CA GLU A 508 13.282 16.081 7.584 1.00 0.00 C ATOM 1162 C GLU A 508 14.180 14.864 7.402 1.00 0.00 C ATOM 1163 O GLU A 508 14.925 14.491 8.307 1.00 0.00 O ATOM 1164 CB GLU A 508 14.069 17.363 7.304 1.00 0.00 C ATOM 1165 CG GLU A 508 14.961 17.297 6.072 1.00 0.00 C ATOM 1166 CD GLU A 508 15.733 18.573 5.888 1.00 0.00 C ATOM 1167 OE1 GLU A 508 16.518 18.899 6.746 1.00 0.00 O ATOM 1168 OE2 GLU A 508 15.621 19.165 4.840 1.00 0.00 O ATOM 0 H GLU A 508 13.150 16.784 9.554 1.00 0.00 H new ATOM 0 HA GLU A 508 12.461 16.007 6.871 1.00 0.00 H new ATOM 0 HB2 GLU A 508 13.366 18.188 7.185 1.00 0.00 H new ATOM 0 HB3 GLU A 508 14.686 17.593 8.173 1.00 0.00 H new ATOM 0 HG2 GLU A 508 15.654 16.461 6.166 1.00 0.00 H new ATOM 0 HG3 GLU A 508 14.351 17.108 5.189 1.00 0.00 H new ATOM 1175 N GLY A 509 14.104 14.249 6.227 1.00 0.00 N ATOM 1176 CA GLY A 509 14.836 13.017 5.959 1.00 0.00 C ATOM 1177 C GLY A 509 14.131 12.176 4.902 1.00 0.00 C ATOM 1178 O GLY A 509 13.036 12.517 4.453 1.00 0.00 O ATOM 0 H GLY A 509 13.542 14.584 5.444 1.00 0.00 H new ATOM 0 HA2 GLY A 509 15.845 13.256 5.624 1.00 0.00 H new ATOM 0 HA3 GLY A 509 14.934 12.442 6.880 1.00 0.00 H new ATOM 1182 N MET A 510 14.764 11.077 4.507 1.00 0.00 N ATOM 1183 CA MET A 510 14.165 10.146 3.559 1.00 0.00 C ATOM 1184 C MET A 510 13.272 9.137 4.268 1.00 0.00 C ATOM 1185 O MET A 510 13.681 8.509 5.246 1.00 0.00 O ATOM 1186 CB MET A 510 15.254 9.424 2.768 1.00 0.00 C ATOM 1187 CG MET A 510 16.125 10.338 1.916 1.00 0.00 C ATOM 1188 SD MET A 510 15.176 11.241 0.675 1.00 0.00 S ATOM 1189 CE MET A 510 14.701 9.907 -0.423 1.00 0.00 C ATOM 0 H MET A 510 15.694 10.809 4.830 1.00 0.00 H new ATOM 0 HA MET A 510 13.545 10.719 2.869 1.00 0.00 H new ATOM 0 HB2 MET A 510 15.892 8.881 3.465 1.00 0.00 H new ATOM 0 HB3 MET A 510 14.785 8.683 2.121 1.00 0.00 H new ATOM 0 HG2 MET A 510 16.640 11.049 2.562 1.00 0.00 H new ATOM 0 HG3 MET A 510 16.892 9.744 1.420 1.00 0.00 H new ATOM 0 HE1 MET A 510 14.345 10.321 -1.366 1.00 0.00 H new ATOM 0 HE2 MET A 510 15.562 9.266 -0.610 1.00 0.00 H new ATOM 0 HE3 MET A 510 13.906 9.321 0.039 1.00 0.00 H new ATOM 1199 N TYR A 511 12.051 8.983 3.769 1.00 0.00 N ATOM 1200 CA TYR A 511 11.123 7.994 4.307 1.00 0.00 C ATOM 1201 C TYR A 511 10.722 6.981 3.243 1.00 0.00 C ATOM 1202 O TYR A 511 10.333 7.349 2.135 1.00 0.00 O ATOM 1203 CB TYR A 511 9.876 8.680 4.873 1.00 0.00 C ATOM 1204 CG TYR A 511 10.147 9.533 6.092 1.00 0.00 C ATOM 1205 CD1 TYR A 511 10.633 10.826 5.965 1.00 0.00 C ATOM 1206 CD2 TYR A 511 9.912 9.043 7.367 1.00 0.00 C ATOM 1207 CE1 TYR A 511 10.882 11.610 7.075 1.00 0.00 C ATOM 1208 CE2 TYR A 511 10.157 9.817 8.487 1.00 0.00 C ATOM 1209 CZ TYR A 511 10.642 11.099 8.336 1.00 0.00 C ATOM 1210 OH TYR A 511 10.887 11.875 9.445 1.00 0.00 O ATOM 0 H TYR A 511 11.680 9.530 2.992 1.00 0.00 H new ATOM 0 HA TYR A 511 11.632 7.463 5.112 1.00 0.00 H new ATOM 0 HB2 TYR A 511 9.432 9.303 4.097 1.00 0.00 H new ATOM 0 HB3 TYR A 511 9.140 7.919 5.131 1.00 0.00 H new ATOM 0 HD1 TYR A 511 10.820 11.227 4.980 1.00 0.00 H new ATOM 0 HD2 TYR A 511 9.531 8.040 7.488 1.00 0.00 H new ATOM 0 HE1 TYR A 511 11.261 12.614 6.958 1.00 0.00 H new ATOM 0 HE2 TYR A 511 9.970 9.420 9.474 1.00 0.00 H new ATOM 0 HH TYR A 511 10.990 12.811 9.173 1.00 0.00 H new ATOM 1220 N ARG A 512 10.821 5.700 3.586 1.00 0.00 N ATOM 1221 CA ARG A 512 10.478 4.629 2.657 1.00 0.00 C ATOM 1222 C ARG A 512 9.129 4.013 3.001 1.00 0.00 C ATOM 1223 O ARG A 512 8.941 3.476 4.091 1.00 0.00 O ATOM 1224 CB ARG A 512 11.569 3.572 2.573 1.00 0.00 C ATOM 1225 CG ARG A 512 11.345 2.503 1.516 1.00 0.00 C ATOM 1226 CD ARG A 512 12.489 1.576 1.330 1.00 0.00 C ATOM 1227 NE ARG A 512 12.726 0.680 2.450 1.00 0.00 N ATOM 1228 CZ ARG A 512 13.785 -0.147 2.557 1.00 0.00 C ATOM 1229 NH1 ARG A 512 14.683 -0.224 1.601 1.00 0.00 N ATOM 1230 NH2 ARG A 512 13.882 -0.899 3.639 1.00 0.00 N ATOM 0 H ARG A 512 11.136 5.379 4.501 1.00 0.00 H new ATOM 0 HA ARG A 512 10.397 5.077 1.667 1.00 0.00 H new ATOM 0 HB2 ARG A 512 12.519 4.067 2.373 1.00 0.00 H new ATOM 0 HB3 ARG A 512 11.661 3.087 3.545 1.00 0.00 H new ATOM 0 HG2 ARG A 512 10.463 1.922 1.785 1.00 0.00 H new ATOM 0 HG3 ARG A 512 11.129 2.989 0.565 1.00 0.00 H new ATOM 0 HD2 ARG A 512 12.315 0.980 0.434 1.00 0.00 H new ATOM 0 HD3 ARG A 512 13.391 2.162 1.153 1.00 0.00 H new ATOM 0 HE ARG A 512 12.043 0.677 3.208 1.00 0.00 H new ATOM 0 HH11 ARG A 512 14.585 0.347 0.762 1.00 0.00 H new ATOM 0 HH12 ARG A 512 15.478 -0.855 1.698 1.00 0.00 H new ATOM 0 HH21 ARG A 512 13.167 -0.844 4.364 1.00 0.00 H new ATOM 0 HH22 ARG A 512 14.672 -1.535 3.749 1.00 0.00 H new ATOM 1244 N ILE A 513 8.191 4.095 2.063 1.00 0.00 N ATOM 1245 CA ILE A 513 6.838 3.598 2.286 1.00 0.00 C ATOM 1246 C ILE A 513 6.613 2.274 1.570 1.00 0.00 C ATOM 1247 O ILE A 513 6.794 2.175 0.357 1.00 0.00 O ATOM 1248 CB ILE A 513 5.780 4.612 1.816 1.00 0.00 C ATOM 1249 CG1 ILE A 513 5.946 5.941 2.557 1.00 0.00 C ATOM 1250 CG2 ILE A 513 4.379 4.055 2.026 1.00 0.00 C ATOM 1251 CD1 ILE A 513 5.079 7.055 2.017 1.00 0.00 C ATOM 0 H ILE A 513 8.343 4.501 1.140 1.00 0.00 H new ATOM 0 HA ILE A 513 6.731 3.448 3.360 1.00 0.00 H new ATOM 0 HB ILE A 513 5.923 4.792 0.750 1.00 0.00 H new ATOM 0 HG12 ILE A 513 5.712 5.790 3.611 1.00 0.00 H new ATOM 0 HG13 ILE A 513 6.991 6.248 2.503 1.00 0.00 H new ATOM 0 HG21 ILE A 513 3.643 4.785 1.688 1.00 0.00 H new ATOM 0 HG22 ILE A 513 4.265 3.133 1.455 1.00 0.00 H new ATOM 0 HG23 ILE A 513 4.225 3.847 3.085 1.00 0.00 H new ATOM 0 HD11 ILE A 513 5.253 7.964 2.594 1.00 0.00 H new ATOM 0 HD12 ILE A 513 5.328 7.235 0.971 1.00 0.00 H new ATOM 0 HD13 ILE A 513 4.030 6.770 2.096 1.00 0.00 H new ATOM 1263 N ASN A 514 6.217 1.257 2.327 1.00 0.00 N ATOM 1264 CA ASN A 514 5.963 -0.065 1.766 1.00 0.00 C ATOM 1265 C ASN A 514 4.520 -0.493 1.996 1.00 0.00 C ATOM 1266 O ASN A 514 3.925 -0.176 3.026 1.00 0.00 O ATOM 1267 CB ASN A 514 6.916 -1.100 2.333 1.00 0.00 C ATOM 1268 CG ASN A 514 8.320 -0.984 1.806 1.00 0.00 C ATOM 1269 OD1 ASN A 514 9.226 -0.504 2.497 1.00 0.00 O ATOM 1270 ND2 ASN A 514 8.488 -1.346 0.561 1.00 0.00 N ATOM 0 H ASN A 514 6.065 1.323 3.333 1.00 0.00 H new ATOM 0 HA ASN A 514 6.135 0.002 0.692 1.00 0.00 H new ATOM 0 HB2 ASN A 514 6.936 -1.006 3.419 1.00 0.00 H new ATOM 0 HB3 ASN A 514 6.534 -2.095 2.107 1.00 0.00 H new ATOM 0 HD21 ASN A 514 9.400 -1.237 0.117 1.00 0.00 H new ATOM 0 HD22 ASN A 514 7.707 -1.737 0.034 1.00 0.00 H new ATOM 1277 N ALA A 515 3.962 -1.217 1.031 1.00 0.00 N ATOM 1278 CA ALA A 515 2.603 -1.732 1.150 1.00 0.00 C ATOM 1279 C ALA A 515 2.570 -3.244 0.974 1.00 0.00 C ATOM 1280 O ALA A 515 3.314 -3.802 0.167 1.00 0.00 O ATOM 1281 CB ALA A 515 1.691 -1.058 0.135 1.00 0.00 C ATOM 0 H ALA A 515 4.430 -1.460 0.158 1.00 0.00 H new ATOM 0 HA ALA A 515 2.242 -1.503 2.153 1.00 0.00 H new ATOM 0 HB1 ALA A 515 0.680 -1.453 0.236 1.00 0.00 H new ATOM 0 HB2 ALA A 515 1.680 0.017 0.313 1.00 0.00 H new ATOM 0 HB3 ALA A 515 2.059 -1.255 -0.872 1.00 0.00 H new ATOM 1287 N THR A 516 1.706 -3.906 1.737 1.00 0.00 N ATOM 1288 CA THR A 516 1.534 -5.348 1.629 1.00 0.00 C ATOM 1289 C THR A 516 0.062 -5.723 1.527 1.00 0.00 C ATOM 1290 O THR A 516 -0.807 -4.998 2.010 1.00 0.00 O ATOM 1291 CB THR A 516 2.158 -6.084 2.829 1.00 0.00 C ATOM 1292 OG1 THR A 516 1.523 -5.652 4.039 1.00 0.00 O ATOM 1293 CG2 THR A 516 3.650 -5.797 2.913 1.00 0.00 C ATOM 0 H THR A 516 1.113 -3.464 2.439 1.00 0.00 H new ATOM 0 HA THR A 516 2.048 -5.656 0.718 1.00 0.00 H new ATOM 0 HB THR A 516 2.012 -7.156 2.696 1.00 0.00 H new ATOM 0 HG1 THR A 516 1.919 -6.122 4.802 1.00 0.00 H new ATOM 0 HG21 THR A 516 4.075 -6.325 3.767 1.00 0.00 H new ATOM 0 HG22 THR A 516 4.138 -6.135 1.998 1.00 0.00 H new ATOM 0 HG23 THR A 516 3.808 -4.725 3.034 1.00 0.00 H new ATOM 1301 N VAL A 517 -0.213 -6.860 0.895 1.00 0.00 N ATOM 1302 CA VAL A 517 -1.564 -7.403 0.848 1.00 0.00 C ATOM 1303 C VAL A 517 -1.595 -8.847 1.329 1.00 0.00 C ATOM 1304 O VAL A 517 -0.694 -9.631 1.032 1.00 0.00 O ATOM 1305 CB VAL A 517 -2.152 -7.332 -0.574 1.00 0.00 C ATOM 1306 CG1 VAL A 517 -1.297 -8.135 -1.542 1.00 0.00 C ATOM 1307 CG2 VAL A 517 -3.586 -7.840 -0.583 1.00 0.00 C ATOM 0 H VAL A 517 0.484 -7.423 0.408 1.00 0.00 H new ATOM 0 HA VAL A 517 -2.172 -6.790 1.513 1.00 0.00 H new ATOM 0 HB VAL A 517 -2.154 -6.291 -0.896 1.00 0.00 H new ATOM 0 HG11 VAL A 517 -1.726 -8.075 -2.542 1.00 0.00 H new ATOM 0 HG12 VAL A 517 -0.285 -7.730 -1.556 1.00 0.00 H new ATOM 0 HG13 VAL A 517 -1.266 -9.177 -1.222 1.00 0.00 H new ATOM 0 HG21 VAL A 517 -3.986 -7.783 -1.595 1.00 0.00 H new ATOM 0 HG22 VAL A 517 -3.607 -8.875 -0.242 1.00 0.00 H new ATOM 0 HG23 VAL A 517 -4.194 -7.226 0.082 1.00 0.00 H new ATOM 1524 N VAL A 532 3.790 -6.879 -2.703 1.00 0.00 N ATOM 1525 CA VAL A 532 4.501 -5.817 -2.001 1.00 0.00 C ATOM 1526 C VAL A 532 4.880 -4.687 -2.949 1.00 0.00 C ATOM 1527 O VAL A 532 5.274 -4.927 -4.090 1.00 0.00 O ATOM 1528 CB VAL A 532 5.774 -6.348 -1.315 1.00 0.00 C ATOM 1529 CG1 VAL A 532 6.486 -5.227 -0.572 1.00 0.00 C ATOM 1530 CG2 VAL A 532 5.434 -7.485 -0.364 1.00 0.00 C ATOM 0 HA VAL A 532 3.822 -5.434 -1.239 1.00 0.00 H new ATOM 0 HB VAL A 532 6.444 -6.732 -2.084 1.00 0.00 H new ATOM 0 HG11 VAL A 532 7.383 -5.620 -0.093 1.00 0.00 H new ATOM 0 HG12 VAL A 532 6.764 -4.443 -1.276 1.00 0.00 H new ATOM 0 HG13 VAL A 532 5.821 -4.814 0.187 1.00 0.00 H new ATOM 0 HG21 VAL A 532 6.346 -7.847 0.111 1.00 0.00 H new ATOM 0 HG22 VAL A 532 4.744 -7.126 0.400 1.00 0.00 H new ATOM 0 HG23 VAL A 532 4.968 -8.298 -0.921 1.00 0.00 H new ATOM 1540 N ALA A 533 4.757 -3.454 -2.471 1.00 0.00 N ATOM 1541 CA ALA A 533 5.120 -2.285 -3.263 1.00 0.00 C ATOM 1542 C ALA A 533 6.028 -1.348 -2.476 1.00 0.00 C ATOM 1543 O ALA A 533 5.798 -1.092 -1.294 1.00 0.00 O ATOM 1544 CB ALA A 533 3.871 -1.552 -3.729 1.00 0.00 C ATOM 0 H ALA A 533 4.408 -3.238 -1.537 1.00 0.00 H new ATOM 0 HA ALA A 533 5.671 -2.628 -4.139 1.00 0.00 H new ATOM 0 HB1 ALA A 533 4.159 -0.682 -4.319 1.00 0.00 H new ATOM 0 HB2 ALA A 533 3.264 -2.220 -4.340 1.00 0.00 H new ATOM 0 HB3 ALA A 533 3.294 -1.228 -2.862 1.00 0.00 H new ATOM 1550 N THR A 534 7.060 -0.836 -3.139 1.00 0.00 N ATOM 1551 CA THR A 534 8.000 0.079 -2.504 1.00 0.00 C ATOM 1552 C THR A 534 7.940 1.460 -3.142 1.00 0.00 C ATOM 1553 O THR A 534 8.070 1.600 -4.359 1.00 0.00 O ATOM 1554 CB THR A 534 9.445 -0.450 -2.584 1.00 0.00 C ATOM 1555 OG1 THR A 534 9.534 -1.711 -1.909 1.00 0.00 O ATOM 1556 CG2 THR A 534 10.409 0.535 -1.940 1.00 0.00 C ATOM 0 H THR A 534 7.266 -1.040 -4.117 1.00 0.00 H new ATOM 0 HA THR A 534 7.707 0.153 -1.457 1.00 0.00 H new ATOM 0 HB THR A 534 9.713 -0.573 -3.633 1.00 0.00 H new ATOM 0 HG1 THR A 534 10.453 -2.046 -1.962 1.00 0.00 H new ATOM 0 HG21 THR A 534 11.425 0.145 -2.005 1.00 0.00 H new ATOM 0 HG22 THR A 534 10.353 1.492 -2.460 1.00 0.00 H new ATOM 0 HG23 THR A 534 10.141 0.675 -0.893 1.00 0.00 H new ATOM 1564 N PHE A 535 7.742 2.480 -2.313 1.00 0.00 N ATOM 1565 CA PHE A 535 7.680 3.855 -2.794 1.00 0.00 C ATOM 1566 C PHE A 535 8.506 4.785 -1.912 1.00 0.00 C ATOM 1567 O PHE A 535 8.368 4.779 -0.690 1.00 0.00 O ATOM 1568 CB PHE A 535 6.229 4.336 -2.851 1.00 0.00 C ATOM 1569 CG PHE A 535 6.059 5.675 -3.511 1.00 0.00 C ATOM 1570 CD1 PHE A 535 5.926 5.773 -4.888 1.00 0.00 C ATOM 1571 CD2 PHE A 535 6.034 6.839 -2.756 1.00 0.00 C ATOM 1572 CE1 PHE A 535 5.771 7.005 -5.496 1.00 0.00 C ATOM 1573 CE2 PHE A 535 5.878 8.071 -3.362 1.00 0.00 C ATOM 1574 CZ PHE A 535 5.746 8.153 -4.734 1.00 0.00 C ATOM 0 H PHE A 535 7.622 2.380 -1.305 1.00 0.00 H new ATOM 0 HA PHE A 535 8.101 3.877 -3.799 1.00 0.00 H new ATOM 0 HB2 PHE A 535 5.632 3.598 -3.388 1.00 0.00 H new ATOM 0 HB3 PHE A 535 5.833 4.389 -1.837 1.00 0.00 H new ATOM 0 HD1 PHE A 535 5.944 4.878 -5.492 1.00 0.00 H new ATOM 0 HD2 PHE A 535 6.138 6.781 -1.683 1.00 0.00 H new ATOM 0 HE1 PHE A 535 5.669 7.068 -6.569 1.00 0.00 H new ATOM 0 HE2 PHE A 535 5.859 8.969 -2.763 1.00 0.00 H new ATOM 0 HZ PHE A 535 5.623 9.115 -5.209 1.00 0.00 H new ATOM 1584 N ASP A 536 9.362 5.581 -2.541 1.00 0.00 N ATOM 1585 CA ASP A 536 10.302 6.423 -1.811 1.00 0.00 C ATOM 1586 C ASP A 536 9.806 7.860 -1.729 1.00 0.00 C ATOM 1587 O ASP A 536 9.451 8.464 -2.741 1.00 0.00 O ATOM 1588 CB ASP A 536 11.684 6.381 -2.470 1.00 0.00 C ATOM 1589 CG ASP A 536 12.407 5.048 -2.329 1.00 0.00 C ATOM 1590 OD1 ASP A 536 11.987 4.248 -1.528 1.00 0.00 O ATOM 1591 OD2 ASP A 536 13.273 4.778 -3.127 1.00 0.00 O ATOM 0 H ASP A 536 9.425 5.661 -3.556 1.00 0.00 H new ATOM 0 HA ASP A 536 10.381 6.031 -0.797 1.00 0.00 H new ATOM 0 HB2 ASP A 536 11.575 6.611 -3.530 1.00 0.00 H new ATOM 0 HB3 ASP A 536 12.304 7.165 -2.036 1.00 0.00 H new ATOM 1596 N VAL A 537 9.784 8.406 -0.517 1.00 0.00 N ATOM 1597 CA VAL A 537 9.377 9.789 -0.306 1.00 0.00 C ATOM 1598 C VAL A 537 10.488 10.597 0.354 1.00 0.00 C ATOM 1599 O VAL A 537 11.127 10.134 1.298 1.00 0.00 O ATOM 1600 CB VAL A 537 8.106 9.878 0.558 1.00 0.00 C ATOM 1601 CG1 VAL A 537 7.731 11.332 0.804 1.00 0.00 C ATOM 1602 CG2 VAL A 537 6.956 9.136 -0.102 1.00 0.00 C ATOM 0 H VAL A 537 10.044 7.909 0.335 1.00 0.00 H new ATOM 0 HA VAL A 537 9.165 10.207 -1.290 1.00 0.00 H new ATOM 0 HB VAL A 537 8.311 9.406 1.519 1.00 0.00 H new ATOM 0 HG11 VAL A 537 6.830 11.377 1.416 1.00 0.00 H new ATOM 0 HG12 VAL A 537 8.547 11.836 1.322 1.00 0.00 H new ATOM 0 HG13 VAL A 537 7.546 11.826 -0.150 1.00 0.00 H new ATOM 0 HG21 VAL A 537 6.067 9.211 0.525 1.00 0.00 H new ATOM 0 HG22 VAL A 537 6.751 9.577 -1.077 1.00 0.00 H new ATOM 0 HG23 VAL A 537 7.224 8.087 -0.227 1.00 0.00 H new ATOM 1612 N SER A 538 10.713 11.805 -0.149 1.00 0.00 N ATOM 1613 CA SER A 538 11.666 12.723 0.461 1.00 0.00 C ATOM 1614 C SER A 538 10.951 13.842 1.206 1.00 0.00 C ATOM 1615 O SER A 538 10.127 14.556 0.635 1.00 0.00 O ATOM 1616 CB SER A 538 12.587 13.299 -0.596 1.00 0.00 C ATOM 1617 OG SER A 538 13.464 14.255 -0.067 1.00 0.00 O ATOM 0 H SER A 538 10.247 12.172 -0.979 1.00 0.00 H new ATOM 0 HA SER A 538 12.261 12.164 1.183 1.00 0.00 H new ATOM 0 HB2 SER A 538 13.162 12.494 -1.053 1.00 0.00 H new ATOM 0 HB3 SER A 538 11.991 13.753 -1.387 1.00 0.00 H new ATOM 0 HG SER A 538 14.241 13.805 0.326 1.00 0.00 H new ATOM 1623 N VAL A 539 11.272 13.991 2.487 1.00 0.00 N ATOM 1624 CA VAL A 539 10.758 15.101 3.283 1.00 0.00 C ATOM 1625 C VAL A 539 11.811 16.189 3.454 1.00 0.00 C ATOM 1626 O VAL A 539 12.931 15.920 3.890 1.00 0.00 O ATOM 1627 CB VAL A 539 10.290 14.632 4.672 1.00 0.00 C ATOM 1628 CG1 VAL A 539 9.827 15.817 5.506 1.00 0.00 C ATOM 1629 CG2 VAL A 539 9.174 13.607 4.540 1.00 0.00 C ATOM 0 H VAL A 539 11.886 13.356 2.997 1.00 0.00 H new ATOM 0 HA VAL A 539 9.904 15.507 2.741 1.00 0.00 H new ATOM 0 HB VAL A 539 11.133 14.161 5.178 1.00 0.00 H new ATOM 0 HG11 VAL A 539 9.500 15.467 6.485 1.00 0.00 H new ATOM 0 HG12 VAL A 539 10.651 16.520 5.629 1.00 0.00 H new ATOM 0 HG13 VAL A 539 8.998 16.315 5.003 1.00 0.00 H new ATOM 0 HG21 VAL A 539 8.855 13.286 5.532 1.00 0.00 H new ATOM 0 HG22 VAL A 539 8.330 14.054 4.014 1.00 0.00 H new ATOM 0 HG23 VAL A 539 9.536 12.745 3.979 1.00 0.00 H new ATOM 1639 N VAL A 540 11.445 17.419 3.107 1.00 0.00 N ATOM 1640 CA VAL A 540 12.370 18.543 3.180 1.00 0.00 C ATOM 1641 C VAL A 540 11.812 19.661 4.051 1.00 0.00 C ATOM 1642 O VAL A 540 10.599 19.784 4.218 1.00 0.00 O ATOM 1643 CB VAL A 540 12.689 19.105 1.782 1.00 0.00 C ATOM 1644 CG1 VAL A 540 13.375 18.050 0.928 1.00 0.00 C ATOM 1645 CG2 VAL A 540 11.419 19.594 1.103 1.00 0.00 C ATOM 0 H VAL A 540 10.513 17.662 2.772 1.00 0.00 H new ATOM 0 HA VAL A 540 13.289 18.164 3.627 1.00 0.00 H new ATOM 0 HB VAL A 540 13.367 19.951 1.897 1.00 0.00 H new ATOM 0 HG11 VAL A 540 13.593 18.464 -0.056 1.00 0.00 H new ATOM 0 HG12 VAL A 540 14.305 17.743 1.407 1.00 0.00 H new ATOM 0 HG13 VAL A 540 12.719 17.186 0.821 1.00 0.00 H new ATOM 0 HG21 VAL A 540 11.663 19.988 0.116 1.00 0.00 H new ATOM 0 HG22 VAL A 540 10.719 18.765 1.000 1.00 0.00 H new ATOM 0 HG23 VAL A 540 10.964 20.380 1.705 1.00 0.00 H new ATOM 1655 N LEU A 541 12.706 20.474 4.605 1.00 0.00 N ATOM 1656 CA LEU A 541 12.301 21.616 5.416 1.00 0.00 C ATOM 1657 C LEU A 541 11.910 22.802 4.543 1.00 0.00 C ATOM 1658 O LEU A 541 12.419 23.910 4.719 1.00 0.00 O ATOM 1659 CB LEU A 541 13.431 22.011 6.376 1.00 0.00 C ATOM 1660 CG LEU A 541 13.882 20.908 7.341 1.00 0.00 C ATOM 1661 CD1 LEU A 541 15.075 21.384 8.157 1.00 0.00 C ATOM 1662 CD2 LEU A 541 12.725 20.523 8.251 1.00 0.00 C ATOM 0 H LEU A 541 13.715 20.363 4.507 1.00 0.00 H new ATOM 0 HA LEU A 541 11.426 21.324 5.997 1.00 0.00 H new ATOM 0 HB2 LEU A 541 14.291 22.331 5.788 1.00 0.00 H new ATOM 0 HB3 LEU A 541 13.106 22.872 6.960 1.00 0.00 H new ATOM 0 HG LEU A 541 14.187 20.030 6.772 1.00 0.00 H new ATOM 0 HD11 LEU A 541 15.388 20.594 8.839 1.00 0.00 H new ATOM 0 HD12 LEU A 541 15.898 21.632 7.487 1.00 0.00 H new ATOM 0 HD13 LEU A 541 14.795 22.268 8.730 1.00 0.00 H new ATOM 0 HD21 LEU A 541 13.047 19.739 8.936 1.00 0.00 H new ATOM 0 HD22 LEU A 541 12.405 21.395 8.821 1.00 0.00 H new ATOM 0 HD23 LEU A 541 11.893 20.159 7.648 1.00 0.00 H new