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= -0.895 K(o=-0.76,f=-6.5!) USER MOD Set 1.2: A 534 THR OG1 : rot -152:sc= 0.135 USER MOD Single : A 441 THR OG1 : rot 180:sc= -0.0386 USER MOD Single : A 445 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 453 ASN : amide:sc= -0.176 K(o=-0.18,f=-0.83) USER MOD Single : A 454 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 458 TYR OH : rot -149:sc= 0.283 USER MOD Single : A 461 HIS : no HD1:sc= -0.0613 K(o=-0.061,f=-1) USER MOD Single : A 463 LYS NZ :NH3+ -129:sc= 0.115 (180deg=0) USER MOD Single : A 464 ASN : amide:sc= -2.26! C(o=-2.3!,f=-12!) USER MOD Single : A 472 SER OG : rot 180:sc= 0 USER MOD Single : A 473 THR OG1 : rot -170:sc= -0.544 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= 0.499 K(o=0.5,f=-3.7!) USER MOD Single : A 482 THR OG1 : rot 180:sc= 0 USER MOD Single : A 484 TYR OH : rot 61:sc= -0.794 USER MOD Single : A 485 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 486 ASN : amide:sc= -0.0921 K(o=-0.092,f=-0.67) 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= -0.109 USER MOD Single : A 506 THR OG1 : rot 180:sc= 0 USER MOD Single : A 507 GLN : amide:sc= 0 K(o=0,f=-0.72) USER MOD Single : A 510 MET CE :methyl -165:sc= -0.0471 (180deg=-0.345) USER MOD Single : A 511 TYR OH : rot 16:sc= 0.799 USER MOD Single : A 516 THR OG1 : rot 180:sc= 0 USER MOD Single : A 538 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 55 N PRO A 438 -5.769 -16.708 -6.265 1.00 0.00 N ATOM 56 CA PRO A 438 -5.889 -15.296 -6.610 1.00 0.00 C ATOM 57 C PRO A 438 -4.623 -14.786 -7.284 1.00 0.00 C ATOM 58 O PRO A 438 -3.596 -15.465 -7.296 1.00 0.00 O ATOM 59 CB PRO A 438 -6.150 -14.602 -5.271 1.00 0.00 C ATOM 60 CG PRO A 438 -6.612 -15.696 -4.369 1.00 0.00 C ATOM 61 CD PRO A 438 -5.879 -16.927 -4.829 1.00 0.00 C ATOM 0 HA PRO A 438 -6.687 -15.103 -7.327 1.00 0.00 H new ATOM 0 HB2 PRO A 438 -5.247 -14.126 -4.888 1.00 0.00 H new ATOM 0 HB3 PRO A 438 -6.905 -13.822 -5.368 1.00 0.00 H new ATOM 0 HG2 PRO A 438 -6.385 -15.469 -3.327 1.00 0.00 H new ATOM 0 HG3 PRO A 438 -7.691 -15.832 -4.437 1.00 0.00 H new ATOM 0 HD2 PRO A 438 -4.901 -17.018 -4.356 1.00 0.00 H new ATOM 0 HD3 PRO A 438 -6.431 -17.838 -4.598 1.00 0.00 H new ATOM 69 N ASP A 439 -4.700 -13.584 -7.845 1.00 0.00 N ATOM 70 CA ASP A 439 -3.508 -12.857 -8.267 1.00 0.00 C ATOM 71 C ASP A 439 -3.515 -11.429 -7.733 1.00 0.00 C ATOM 72 O ASP A 439 -3.714 -10.475 -8.486 1.00 0.00 O ATOM 73 CB ASP A 439 -3.399 -12.844 -9.794 1.00 0.00 C ATOM 74 CG ASP A 439 -2.072 -12.321 -10.325 1.00 0.00 C ATOM 75 OD1 ASP A 439 -1.678 -11.248 -9.931 1.00 0.00 O ATOM 76 OD2 ASP A 439 -1.390 -13.059 -10.995 1.00 0.00 O ATOM 0 H ASP A 439 -5.577 -13.092 -8.018 1.00 0.00 H new ATOM 0 HA ASP A 439 -2.641 -13.373 -7.854 1.00 0.00 H new ATOM 0 HB2 ASP A 439 -3.551 -13.857 -10.166 1.00 0.00 H new ATOM 0 HB3 ASP A 439 -4.205 -12.232 -10.198 1.00 0.00 H new ATOM 81 N LEU A 440 -3.300 -11.290 -6.429 1.00 0.00 N ATOM 82 CA LEU A 440 -3.413 -9.996 -5.768 1.00 0.00 C ATOM 83 C LEU A 440 -2.173 -9.145 -6.007 1.00 0.00 C ATOM 84 O LEU A 440 -1.049 -9.646 -5.980 1.00 0.00 O ATOM 85 CB LEU A 440 -3.648 -10.188 -4.265 1.00 0.00 C ATOM 86 CG LEU A 440 -4.948 -10.914 -3.895 1.00 0.00 C ATOM 87 CD1 LEU A 440 -4.957 -11.243 -2.408 1.00 0.00 C ATOM 88 CD2 LEU A 440 -6.141 -10.044 -4.262 1.00 0.00 C ATOM 0 H LEU A 440 -3.046 -12.059 -5.809 1.00 0.00 H new ATOM 0 HA LEU A 440 -4.267 -9.471 -6.196 1.00 0.00 H new ATOM 0 HB2 LEU A 440 -2.808 -10.746 -3.851 1.00 0.00 H new ATOM 0 HB3 LEU A 440 -3.648 -9.209 -3.785 1.00 0.00 H new ATOM 0 HG LEU A 440 -5.013 -11.849 -4.452 1.00 0.00 H new ATOM 0 HD11 LEU A 440 -5.884 -11.758 -2.155 1.00 0.00 H new ATOM 0 HD12 LEU A 440 -4.109 -11.886 -2.172 1.00 0.00 H new ATOM 0 HD13 LEU A 440 -4.885 -10.321 -1.831 1.00 0.00 H new ATOM 0 HD21 LEU A 440 -7.063 -10.561 -3.998 1.00 0.00 H new ATOM 0 HD22 LEU A 440 -6.085 -9.102 -3.717 1.00 0.00 H new ATOM 0 HD23 LEU A 440 -6.130 -9.845 -5.334 1.00 0.00 H new ATOM 100 N THR A 441 -2.384 -7.854 -6.239 1.00 0.00 N ATOM 101 CA THR A 441 -1.279 -6.915 -6.409 1.00 0.00 C ATOM 102 C THR A 441 -1.632 -5.542 -5.852 1.00 0.00 C ATOM 103 O THR A 441 -2.806 -5.200 -5.717 1.00 0.00 O ATOM 104 CB THR A 441 -0.885 -6.771 -7.891 1.00 0.00 C ATOM 105 OG1 THR A 441 0.280 -5.944 -7.999 1.00 0.00 O ATOM 106 CG2 THR A 441 -2.021 -6.146 -8.687 1.00 0.00 C ATOM 0 H THR A 441 -3.310 -7.433 -6.314 1.00 0.00 H new ATOM 0 HA THR A 441 -0.433 -7.321 -5.855 1.00 0.00 H new ATOM 0 HB THR A 441 -0.675 -7.762 -8.294 1.00 0.00 H new ATOM 0 HG1 THR A 441 0.531 -5.854 -8.942 1.00 0.00 H new ATOM 0 HG21 THR A 441 -1.725 -6.052 -9.732 1.00 0.00 H new ATOM 0 HG22 THR A 441 -2.906 -6.779 -8.616 1.00 0.00 H new ATOM 0 HG23 THR A 441 -2.248 -5.159 -8.284 1.00 0.00 H new ATOM 114 N VAL A 442 -0.607 -4.761 -5.529 1.00 0.00 N ATOM 115 CA VAL A 442 -0.807 -3.450 -4.922 1.00 0.00 C ATOM 116 C VAL A 442 0.035 -2.388 -5.616 1.00 0.00 C ATOM 117 O VAL A 442 1.059 -2.694 -6.227 1.00 0.00 O ATOM 118 CB VAL A 442 -0.462 -3.465 -3.421 1.00 0.00 C ATOM 119 CG1 VAL A 442 -1.352 -4.450 -2.679 1.00 0.00 C ATOM 120 CG2 VAL A 442 1.004 -3.813 -3.214 1.00 0.00 C ATOM 0 H VAL A 442 0.370 -5.013 -5.677 1.00 0.00 H new ATOM 0 HA VAL A 442 -1.863 -3.206 -5.040 1.00 0.00 H new ATOM 0 HB VAL A 442 -0.640 -2.468 -3.018 1.00 0.00 H new ATOM 0 HG11 VAL A 442 -1.094 -4.447 -1.620 1.00 0.00 H new ATOM 0 HG12 VAL A 442 -2.396 -4.159 -2.799 1.00 0.00 H new ATOM 0 HG13 VAL A 442 -1.205 -5.451 -3.085 1.00 0.00 H new ATOM 0 HG21 VAL A 442 1.230 -3.819 -2.148 1.00 0.00 H new ATOM 0 HG22 VAL A 442 1.207 -4.799 -3.633 1.00 0.00 H new ATOM 0 HG23 VAL A 442 1.628 -3.071 -3.713 1.00 0.00 H new ATOM 130 N GLU A 443 -0.401 -1.136 -5.519 1.00 0.00 N ATOM 131 CA GLU A 443 0.334 -0.021 -6.101 1.00 0.00 C ATOM 132 C GLU A 443 0.320 1.191 -5.178 1.00 0.00 C ATOM 133 O GLU A 443 -0.714 1.540 -4.612 1.00 0.00 O ATOM 134 CB GLU A 443 -0.250 0.352 -7.467 1.00 0.00 C ATOM 135 CG GLU A 443 0.022 -0.666 -8.565 1.00 0.00 C ATOM 136 CD GLU A 443 -0.566 -0.224 -9.876 1.00 0.00 C ATOM 137 OE1 GLU A 443 -1.171 0.820 -9.912 1.00 0.00 O ATOM 138 OE2 GLU A 443 -0.319 -0.875 -10.864 1.00 0.00 O ATOM 0 H GLU A 443 -1.262 -0.869 -5.041 1.00 0.00 H new ATOM 0 HA GLU A 443 1.369 -0.337 -6.232 1.00 0.00 H new ATOM 0 HB2 GLU A 443 -1.328 0.480 -7.365 1.00 0.00 H new ATOM 0 HB3 GLU A 443 0.158 1.316 -7.772 1.00 0.00 H new ATOM 0 HG2 GLU A 443 1.097 -0.807 -8.675 1.00 0.00 H new ATOM 0 HG3 GLU A 443 -0.399 -1.631 -8.282 1.00 0.00 H new ATOM 145 N ILE A 444 1.476 1.829 -5.030 1.00 0.00 N ATOM 146 CA ILE A 444 1.582 3.048 -4.240 1.00 0.00 C ATOM 147 C ILE A 444 1.806 4.264 -5.132 1.00 0.00 C ATOM 148 O ILE A 444 2.726 4.284 -5.950 1.00 0.00 O ATOM 149 CB ILE A 444 2.724 2.960 -3.212 1.00 0.00 C ATOM 150 CG1 ILE A 444 2.466 1.820 -2.225 1.00 0.00 C ATOM 151 CG2 ILE A 444 2.880 4.281 -2.475 1.00 0.00 C ATOM 152 CD1 ILE A 444 3.629 1.538 -1.300 1.00 0.00 C ATOM 0 H ILE A 444 2.354 1.521 -5.448 1.00 0.00 H new ATOM 0 HA ILE A 444 0.637 3.160 -3.708 1.00 0.00 H new ATOM 0 HB ILE A 444 3.653 2.752 -3.743 1.00 0.00 H new ATOM 0 HG12 ILE A 444 1.588 2.062 -1.626 1.00 0.00 H new ATOM 0 HG13 ILE A 444 2.231 0.914 -2.784 1.00 0.00 H new ATOM 0 HG21 ILE A 444 3.692 4.201 -1.752 1.00 0.00 H new ATOM 0 HG22 ILE A 444 3.108 5.072 -3.190 1.00 0.00 H new ATOM 0 HG23 ILE A 444 1.953 4.519 -1.954 1.00 0.00 H new ATOM 0 HD11 ILE A 444 3.371 0.718 -0.630 1.00 0.00 H new ATOM 0 HD12 ILE A 444 4.504 1.264 -1.889 1.00 0.00 H new ATOM 0 HD13 ILE A 444 3.852 2.429 -0.713 1.00 0.00 H new ATOM 164 N LYS A 445 0.961 5.274 -4.969 1.00 0.00 N ATOM 165 CA LYS A 445 1.104 6.521 -5.712 1.00 0.00 C ATOM 166 C LYS A 445 0.886 7.729 -4.811 1.00 0.00 C ATOM 167 O LYS A 445 0.112 7.672 -3.856 1.00 0.00 O ATOM 168 CB LYS A 445 0.127 6.559 -6.888 1.00 0.00 C ATOM 169 CG LYS A 445 0.411 5.533 -7.976 1.00 0.00 C ATOM 170 CD LYS A 445 -0.566 5.667 -9.134 1.00 0.00 C ATOM 171 CE LYS A 445 -0.299 4.627 -10.210 1.00 0.00 C ATOM 172 NZ LYS A 445 -1.267 4.727 -11.337 1.00 0.00 N ATOM 0 H LYS A 445 0.168 5.255 -4.328 1.00 0.00 H new ATOM 0 HA LYS A 445 2.123 6.564 -6.097 1.00 0.00 H new ATOM 0 HB2 LYS A 445 -0.883 6.400 -6.510 1.00 0.00 H new ATOM 0 HB3 LYS A 445 0.149 7.555 -7.330 1.00 0.00 H new ATOM 0 HG2 LYS A 445 1.430 5.660 -8.341 1.00 0.00 H new ATOM 0 HG3 LYS A 445 0.346 4.529 -7.557 1.00 0.00 H new ATOM 0 HD2 LYS A 445 -1.586 5.558 -8.766 1.00 0.00 H new ATOM 0 HD3 LYS A 445 -0.488 6.666 -9.564 1.00 0.00 H new ATOM 0 HE2 LYS A 445 0.715 4.752 -10.591 1.00 0.00 H new ATOM 0 HE3 LYS A 445 -0.354 3.630 -9.772 1.00 0.00 H new ATOM 0 HZ1 LYS A 445 -1.049 4.000 -12.048 1.00 0.00 H new ATOM 0 HZ2 LYS A 445 -2.233 4.582 -10.979 1.00 0.00 H new ATOM 0 HZ3 LYS A 445 -1.197 5.669 -11.772 1.00 0.00 H new ATOM 186 N GLY A 446 1.574 8.823 -5.120 1.00 0.00 N ATOM 187 CA GLY A 446 1.419 10.063 -4.368 1.00 0.00 C ATOM 188 C GLY A 446 2.641 10.960 -4.527 1.00 0.00 C ATOM 189 O GLY A 446 3.498 10.712 -5.375 1.00 0.00 O ATOM 0 H GLY A 446 2.245 8.876 -5.887 1.00 0.00 H new ATOM 0 HA2 GLY A 446 0.530 10.591 -4.712 1.00 0.00 H new ATOM 0 HA3 GLY A 446 1.267 9.835 -3.313 1.00 0.00 H new ATOM 193 N PRO A 447 2.713 12.003 -3.707 1.00 0.00 N ATOM 194 CA PRO A 447 3.821 12.949 -3.768 1.00 0.00 C ATOM 195 C PRO A 447 5.125 12.300 -3.327 1.00 0.00 C ATOM 196 O PRO A 447 5.269 11.891 -2.174 1.00 0.00 O ATOM 197 CB PRO A 447 3.395 14.084 -2.831 1.00 0.00 C ATOM 198 CG PRO A 447 2.416 13.451 -1.903 1.00 0.00 C ATOM 199 CD PRO A 447 1.696 12.418 -2.728 1.00 0.00 C ATOM 0 HA PRO A 447 4.015 13.307 -4.779 1.00 0.00 H new ATOM 0 HB2 PRO A 447 4.248 14.494 -2.290 1.00 0.00 H new ATOM 0 HB3 PRO A 447 2.943 14.907 -3.384 1.00 0.00 H new ATOM 0 HG2 PRO A 447 2.920 12.993 -1.052 1.00 0.00 H new ATOM 0 HG3 PRO A 447 1.721 14.189 -1.502 1.00 0.00 H new ATOM 0 HD2 PRO A 447 1.358 11.580 -2.119 1.00 0.00 H new ATOM 0 HD3 PRO A 447 0.814 12.834 -3.215 1.00 0.00 H new ATOM 207 N ASP A 448 6.078 12.208 -4.249 1.00 0.00 N ATOM 208 CA ASP A 448 7.395 11.669 -3.938 1.00 0.00 C ATOM 209 C ASP A 448 8.231 12.674 -3.155 1.00 0.00 C ATOM 210 O ASP A 448 9.221 12.310 -2.518 1.00 0.00 O ATOM 211 CB ASP A 448 8.126 11.265 -5.221 1.00 0.00 C ATOM 212 CG ASP A 448 8.346 12.406 -6.207 1.00 0.00 C ATOM 213 OD1 ASP A 448 7.907 13.496 -5.928 1.00 0.00 O ATOM 214 OD2 ASP A 448 9.079 12.219 -7.147 1.00 0.00 O ATOM 0 H ASP A 448 5.961 12.501 -5.219 1.00 0.00 H new ATOM 0 HA ASP A 448 7.254 10.784 -3.317 1.00 0.00 H new ATOM 0 HB2 ASP A 448 9.094 10.840 -4.955 1.00 0.00 H new ATOM 0 HB3 ASP A 448 7.557 10.478 -5.716 1.00 0.00 H new ATOM 219 N VAL A 449 7.828 13.938 -3.207 1.00 0.00 N ATOM 220 CA VAL A 449 8.401 14.961 -2.340 1.00 0.00 C ATOM 221 C VAL A 449 7.315 15.696 -1.564 1.00 0.00 C ATOM 222 O VAL A 449 6.338 16.169 -2.143 1.00 0.00 O ATOM 223 CB VAL A 449 9.228 15.983 -3.142 1.00 0.00 C ATOM 224 CG1 VAL A 449 9.785 17.057 -2.219 1.00 0.00 C ATOM 225 CG2 VAL A 449 10.354 15.288 -3.891 1.00 0.00 C ATOM 0 H VAL A 449 7.106 14.280 -3.841 1.00 0.00 H new ATOM 0 HA VAL A 449 9.059 14.447 -1.639 1.00 0.00 H new ATOM 0 HB VAL A 449 8.573 16.460 -3.871 1.00 0.00 H new ATOM 0 HG11 VAL A 449 10.367 17.771 -2.801 1.00 0.00 H new ATOM 0 HG12 VAL A 449 8.963 17.575 -1.726 1.00 0.00 H new ATOM 0 HG13 VAL A 449 10.425 16.595 -1.468 1.00 0.00 H new ATOM 0 HG21 VAL A 449 10.928 16.026 -4.452 1.00 0.00 H new ATOM 0 HG22 VAL A 449 11.008 14.785 -3.179 1.00 0.00 H new ATOM 0 HG23 VAL A 449 9.935 14.555 -4.580 1.00 0.00 H new ATOM 235 N VAL A 450 7.494 15.789 -0.250 1.00 0.00 N ATOM 236 CA VAL A 450 6.546 16.493 0.604 1.00 0.00 C ATOM 237 C VAL A 450 7.257 17.483 1.516 1.00 0.00 C ATOM 238 O VAL A 450 8.432 17.309 1.840 1.00 0.00 O ATOM 239 CB VAL A 450 5.724 15.514 1.464 1.00 0.00 C ATOM 240 CG1 VAL A 450 4.938 14.560 0.579 1.00 0.00 C ATOM 241 CG2 VAL A 450 6.633 14.740 2.404 1.00 0.00 C ATOM 0 H VAL A 450 8.288 15.385 0.246 1.00 0.00 H new ATOM 0 HA VAL A 450 5.870 17.035 -0.057 1.00 0.00 H new ATOM 0 HB VAL A 450 5.018 16.090 2.063 1.00 0.00 H new ATOM 0 HG11 VAL A 450 4.363 13.875 1.203 1.00 0.00 H new ATOM 0 HG12 VAL A 450 4.259 15.129 -0.057 1.00 0.00 H new ATOM 0 HG13 VAL A 450 5.627 13.991 -0.045 1.00 0.00 H new ATOM 0 HG21 VAL A 450 6.036 14.053 3.004 1.00 0.00 H new ATOM 0 HG22 VAL A 450 7.361 14.175 1.822 1.00 0.00 H new ATOM 0 HG23 VAL A 450 7.155 15.436 3.061 1.00 0.00 H new ATOM 251 N GLY A 451 6.539 18.521 1.930 1.00 0.00 N ATOM 252 CA GLY A 451 7.075 19.498 2.870 1.00 0.00 C ATOM 253 C GLY A 451 7.015 18.976 4.300 1.00 0.00 C ATOM 254 O GLY A 451 6.132 18.192 4.648 1.00 0.00 O ATOM 0 H GLY A 451 5.583 18.708 1.629 1.00 0.00 H new ATOM 0 HA2 GLY A 451 8.107 19.731 2.608 1.00 0.00 H new ATOM 0 HA3 GLY A 451 6.510 20.427 2.795 1.00 0.00 H new ATOM 258 N VAL A 452 7.960 19.415 5.125 1.00 0.00 N ATOM 259 CA VAL A 452 7.988 19.032 6.531 1.00 0.00 C ATOM 260 C VAL A 452 6.857 19.698 7.306 1.00 0.00 C ATOM 261 O VAL A 452 6.586 20.886 7.128 1.00 0.00 O ATOM 262 CB VAL A 452 9.331 19.396 7.189 1.00 0.00 C ATOM 263 CG1 VAL A 452 9.412 20.893 7.445 1.00 0.00 C ATOM 264 CG2 VAL A 452 9.515 18.625 8.488 1.00 0.00 C ATOM 0 H VAL A 452 8.717 20.037 4.843 1.00 0.00 H new ATOM 0 HA VAL A 452 7.859 17.950 6.564 1.00 0.00 H new ATOM 0 HB VAL A 452 10.134 19.119 6.506 1.00 0.00 H new ATOM 0 HG11 VAL A 452 10.368 21.131 7.911 1.00 0.00 H new ATOM 0 HG12 VAL A 452 9.325 21.429 6.500 1.00 0.00 H new ATOM 0 HG13 VAL A 452 8.601 21.193 8.108 1.00 0.00 H new ATOM 0 HG21 VAL A 452 10.470 18.895 8.939 1.00 0.00 H new ATOM 0 HG22 VAL A 452 8.706 18.872 9.175 1.00 0.00 H new ATOM 0 HG23 VAL A 452 9.501 17.555 8.281 1.00 0.00 H new ATOM 274 N ASN A 453 6.200 18.926 8.165 1.00 0.00 N ATOM 275 CA ASN A 453 5.043 19.415 8.904 1.00 0.00 C ATOM 276 C ASN A 453 3.913 19.810 7.961 1.00 0.00 C ATOM 277 O ASN A 453 3.093 20.668 8.285 1.00 0.00 O ATOM 278 CB ASN A 453 5.410 20.583 9.801 1.00 0.00 C ATOM 279 CG ASN A 453 6.317 20.209 10.940 1.00 0.00 C ATOM 280 OD1 ASN A 453 5.992 19.344 11.761 1.00 0.00 O ATOM 281 ND2 ASN A 453 7.416 20.913 11.041 1.00 0.00 N ATOM 0 H ASN A 453 6.450 17.958 8.366 1.00 0.00 H new ATOM 0 HA ASN A 453 4.696 18.597 9.535 1.00 0.00 H new ATOM 0 HB2 ASN A 453 5.894 21.353 9.200 1.00 0.00 H new ATOM 0 HB3 ASN A 453 4.497 21.021 10.204 1.00 0.00 H new ATOM 0 HD21 ASN A 453 8.050 20.759 11.825 1.00 0.00 H new ATOM 0 HD22 ASN A 453 7.638 21.616 10.336 1.00 0.00 H new ATOM 288 N LYS A 454 3.876 19.178 6.794 1.00 0.00 N ATOM 289 CA LYS A 454 2.849 19.465 5.799 1.00 0.00 C ATOM 290 C LYS A 454 2.085 18.205 5.416 1.00 0.00 C ATOM 291 O LYS A 454 2.638 17.105 5.423 1.00 0.00 O ATOM 292 CB LYS A 454 3.471 20.100 4.554 1.00 0.00 C ATOM 293 CG LYS A 454 3.980 21.520 4.761 1.00 0.00 C ATOM 294 CD LYS A 454 2.855 22.458 5.173 1.00 0.00 C ATOM 295 CE LYS A 454 1.790 22.555 4.090 1.00 0.00 C ATOM 296 NZ LYS A 454 0.667 23.444 4.492 1.00 0.00 N ATOM 0 H LYS A 454 4.546 18.462 6.513 1.00 0.00 H new ATOM 0 HA LYS A 454 2.145 20.169 6.242 1.00 0.00 H new ATOM 0 HB2 LYS A 454 4.299 19.476 4.217 1.00 0.00 H new ATOM 0 HB3 LYS A 454 2.730 20.105 3.755 1.00 0.00 H new ATOM 0 HG2 LYS A 454 4.756 21.522 5.526 1.00 0.00 H new ATOM 0 HG3 LYS A 454 4.439 21.882 3.841 1.00 0.00 H new ATOM 0 HD2 LYS A 454 2.403 22.103 6.099 1.00 0.00 H new ATOM 0 HD3 LYS A 454 3.261 23.449 5.376 1.00 0.00 H new ATOM 0 HE2 LYS A 454 2.240 22.932 3.172 1.00 0.00 H new ATOM 0 HE3 LYS A 454 1.404 21.560 3.871 1.00 0.00 H new ATOM 0 HZ1 LYS A 454 -0.036 23.483 3.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 454 0.221 23.071 5.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 454 1.031 24.401 4.677 1.00 0.00 H new ATOM 310 N LEU A 455 0.809 18.370 5.085 1.00 0.00 N ATOM 311 CA LEU A 455 -0.078 17.235 4.862 1.00 0.00 C ATOM 312 C LEU A 455 0.022 16.728 3.430 1.00 0.00 C ATOM 313 O LEU A 455 -0.104 17.501 2.478 1.00 0.00 O ATOM 314 CB LEU A 455 -1.525 17.621 5.191 1.00 0.00 C ATOM 315 CG LEU A 455 -2.524 16.457 5.214 1.00 0.00 C ATOM 316 CD1 LEU A 455 -2.197 15.511 6.363 1.00 0.00 C ATOM 317 CD2 LEU A 455 -3.937 17.000 5.349 1.00 0.00 C ATOM 0 H LEU A 455 0.365 19.281 4.965 1.00 0.00 H new ATOM 0 HA LEU A 455 0.234 16.428 5.525 1.00 0.00 H new ATOM 0 HB2 LEU A 455 -1.541 18.111 6.164 1.00 0.00 H new ATOM 0 HB3 LEU A 455 -1.864 18.355 4.459 1.00 0.00 H new ATOM 0 HG LEU A 455 -2.452 15.899 4.281 1.00 0.00 H new ATOM 0 HD11 LEU A 455 -2.912 14.688 6.371 1.00 0.00 H new ATOM 0 HD12 LEU A 455 -1.190 15.116 6.233 1.00 0.00 H new ATOM 0 HD13 LEU A 455 -2.256 16.052 7.308 1.00 0.00 H new ATOM 0 HD21 LEU A 455 -4.645 16.172 5.365 1.00 0.00 H new ATOM 0 HD22 LEU A 455 -4.022 17.568 6.276 1.00 0.00 H new ATOM 0 HD23 LEU A 455 -4.159 17.651 4.503 1.00 0.00 H new ATOM 329 N ALA A 456 0.248 15.427 3.281 1.00 0.00 N ATOM 330 CA ALA A 456 0.305 14.805 1.964 1.00 0.00 C ATOM 331 C ALA A 456 -0.695 13.663 1.851 1.00 0.00 C ATOM 332 O ALA A 456 -0.957 12.956 2.825 1.00 0.00 O ATOM 333 CB ALA A 456 1.714 14.311 1.672 1.00 0.00 C ATOM 0 H ALA A 456 0.395 14.782 4.058 1.00 0.00 H new ATOM 0 HA ALA A 456 0.038 15.558 1.223 1.00 0.00 H new ATOM 0 HB1 ALA A 456 1.740 13.849 0.685 1.00 0.00 H new ATOM 0 HB2 ALA A 456 2.407 15.152 1.698 1.00 0.00 H new ATOM 0 HB3 ALA A 456 2.006 13.578 2.424 1.00 0.00 H new ATOM 339 N GLU A 457 -1.252 13.486 0.657 1.00 0.00 N ATOM 340 CA GLU A 457 -2.218 12.421 0.414 1.00 0.00 C ATOM 341 C GLU A 457 -1.623 11.328 -0.463 1.00 0.00 C ATOM 342 O GLU A 457 -0.990 11.611 -1.480 1.00 0.00 O ATOM 343 CB GLU A 457 -3.484 12.986 -0.235 1.00 0.00 C ATOM 344 CG GLU A 457 -4.510 13.525 0.751 1.00 0.00 C ATOM 345 CD GLU A 457 -5.552 14.358 0.058 1.00 0.00 C ATOM 346 OE1 GLU A 457 -6.176 13.859 -0.847 1.00 0.00 O ATOM 347 OE2 GLU A 457 -5.800 15.453 0.504 1.00 0.00 O ATOM 0 H GLU A 457 -1.051 14.067 -0.157 1.00 0.00 H new ATOM 0 HA GLU A 457 -2.479 11.981 1.376 1.00 0.00 H new ATOM 0 HB2 GLU A 457 -3.201 13.786 -0.919 1.00 0.00 H new ATOM 0 HB3 GLU A 457 -3.950 12.204 -0.834 1.00 0.00 H new ATOM 0 HG2 GLU A 457 -4.991 12.695 1.268 1.00 0.00 H new ATOM 0 HG3 GLU A 457 -4.008 14.125 1.510 1.00 0.00 H new ATOM 354 N TYR A 458 -1.830 10.078 -0.064 1.00 0.00 N ATOM 355 CA TYR A 458 -1.327 8.938 -0.823 1.00 0.00 C ATOM 356 C TYR A 458 -2.437 7.935 -1.108 1.00 0.00 C ATOM 357 O TYR A 458 -3.445 7.890 -0.402 1.00 0.00 O ATOM 358 CB TYR A 458 -0.185 8.256 -0.069 1.00 0.00 C ATOM 359 CG TYR A 458 1.042 9.126 0.100 1.00 0.00 C ATOM 360 CD1 TYR A 458 1.133 10.035 1.142 1.00 0.00 C ATOM 361 CD2 TYR A 458 2.107 9.032 -0.784 1.00 0.00 C ATOM 362 CE1 TYR A 458 2.251 10.833 1.300 1.00 0.00 C ATOM 363 CE2 TYR A 458 3.230 9.822 -0.635 1.00 0.00 C ATOM 364 CZ TYR A 458 3.298 10.722 0.408 1.00 0.00 C ATOM 365 OH TYR A 458 4.415 11.511 0.562 1.00 0.00 O ATOM 0 H TYR A 458 -2.343 9.828 0.781 1.00 0.00 H new ATOM 0 HA TYR A 458 -0.950 9.311 -1.776 1.00 0.00 H new ATOM 0 HB2 TYR A 458 -0.542 7.953 0.915 1.00 0.00 H new ATOM 0 HB3 TYR A 458 0.096 7.347 -0.600 1.00 0.00 H new ATOM 0 HD1 TYR A 458 0.316 10.122 1.843 1.00 0.00 H new ATOM 0 HD2 TYR A 458 2.057 8.329 -1.603 1.00 0.00 H new ATOM 0 HE1 TYR A 458 2.304 11.538 2.116 1.00 0.00 H new ATOM 0 HE2 TYR A 458 4.051 9.736 -1.332 1.00 0.00 H new ATOM 0 HH TYR A 458 4.809 11.695 -0.316 1.00 0.00 H new ATOM 375 N GLU A 459 -2.245 7.128 -2.146 1.00 0.00 N ATOM 376 CA GLU A 459 -3.250 6.153 -2.555 1.00 0.00 C ATOM 377 C GLU A 459 -2.633 4.772 -2.743 1.00 0.00 C ATOM 378 O GLU A 459 -1.519 4.645 -3.251 1.00 0.00 O ATOM 379 CB GLU A 459 -3.939 6.602 -3.846 1.00 0.00 C ATOM 380 CG GLU A 459 -4.725 7.898 -3.720 1.00 0.00 C ATOM 381 CD GLU A 459 -5.375 8.272 -5.024 1.00 0.00 C ATOM 382 OE1 GLU A 459 -5.197 7.556 -5.980 1.00 0.00 O ATOM 383 OE2 GLU A 459 -6.138 9.208 -5.038 1.00 0.00 O ATOM 0 H GLU A 459 -1.402 7.130 -2.720 1.00 0.00 H new ATOM 0 HA GLU A 459 -3.994 6.089 -1.761 1.00 0.00 H new ATOM 0 HB2 GLU A 459 -3.184 6.723 -4.623 1.00 0.00 H new ATOM 0 HB3 GLU A 459 -4.614 5.813 -4.177 1.00 0.00 H new ATOM 0 HG2 GLU A 459 -5.488 7.790 -2.949 1.00 0.00 H new ATOM 0 HG3 GLU A 459 -4.060 8.700 -3.400 1.00 0.00 H new ATOM 390 N VAL A 460 -3.364 3.744 -2.332 1.00 0.00 N ATOM 391 CA VAL A 460 -2.994 2.369 -2.643 1.00 0.00 C ATOM 392 C VAL A 460 -4.001 1.728 -3.588 1.00 0.00 C ATOM 393 O VAL A 460 -5.185 1.619 -3.267 1.00 0.00 O ATOM 394 CB VAL A 460 -2.881 1.511 -1.369 1.00 0.00 C ATOM 395 CG1 VAL A 460 -2.435 0.097 -1.716 1.00 0.00 C ATOM 396 CG2 VAL A 460 -1.914 2.145 -0.382 1.00 0.00 C ATOM 0 H VAL A 460 -4.218 3.836 -1.782 1.00 0.00 H new ATOM 0 HA VAL A 460 -2.019 2.409 -3.129 1.00 0.00 H new ATOM 0 HB VAL A 460 -3.865 1.459 -0.902 1.00 0.00 H new ATOM 0 HG11 VAL A 460 -2.360 -0.495 -0.804 1.00 0.00 H new ATOM 0 HG12 VAL A 460 -3.163 -0.360 -2.387 1.00 0.00 H new ATOM 0 HG13 VAL A 460 -1.462 0.132 -2.206 1.00 0.00 H new ATOM 0 HG21 VAL A 460 -1.847 1.525 0.512 1.00 0.00 H new ATOM 0 HG22 VAL A 460 -0.929 2.228 -0.840 1.00 0.00 H new ATOM 0 HG23 VAL A 460 -2.272 3.138 -0.109 1.00 0.00 H new ATOM 406 N HIS A 461 -3.526 1.304 -4.754 1.00 0.00 N ATOM 407 CA HIS A 461 -4.389 0.687 -5.756 1.00 0.00 C ATOM 408 C HIS A 461 -4.237 -0.829 -5.754 1.00 0.00 C ATOM 409 O HIS A 461 -3.194 -1.358 -6.136 1.00 0.00 O ATOM 410 CB HIS A 461 -4.081 1.242 -7.150 1.00 0.00 C ATOM 411 CG HIS A 461 -4.293 2.719 -7.269 1.00 0.00 C ATOM 412 ND1 HIS A 461 -5.546 3.283 -7.383 1.00 0.00 N ATOM 413 CD2 HIS A 461 -3.412 3.747 -7.293 1.00 0.00 C ATOM 414 CE1 HIS A 461 -5.426 4.597 -7.470 1.00 0.00 C ATOM 415 NE2 HIS A 461 -4.142 4.903 -7.420 1.00 0.00 N ATOM 0 H HIS A 461 -2.547 1.376 -5.029 1.00 0.00 H new ATOM 0 HA HIS A 461 -5.420 0.930 -5.499 1.00 0.00 H new ATOM 0 HB2 HIS A 461 -3.046 1.011 -7.403 1.00 0.00 H new ATOM 0 HB3 HIS A 461 -4.709 0.733 -7.881 1.00 0.00 H new ATOM 0 HD2 HIS A 461 -2.337 3.672 -7.225 1.00 0.00 H new ATOM 0 HE1 HIS A 461 -6.240 5.301 -7.566 1.00 0.00 H new ATOM 0 HE2 HIS A 461 -3.755 5.846 -7.468 1.00 0.00 H new ATOM 423 N VAL A 462 -5.285 -1.522 -5.321 1.00 0.00 N ATOM 424 CA VAL A 462 -5.203 -2.955 -5.066 1.00 0.00 C ATOM 425 C VAL A 462 -6.114 -3.736 -6.003 1.00 0.00 C ATOM 426 O VAL A 462 -7.284 -3.394 -6.173 1.00 0.00 O ATOM 427 CB VAL A 462 -5.572 -3.290 -3.608 1.00 0.00 C ATOM 428 CG1 VAL A 462 -4.774 -2.426 -2.644 1.00 0.00 C ATOM 429 CG2 VAL A 462 -7.064 -3.102 -3.381 1.00 0.00 C ATOM 0 H VAL A 462 -6.202 -1.114 -5.139 1.00 0.00 H new ATOM 0 HA VAL A 462 -4.169 -3.247 -5.246 1.00 0.00 H new ATOM 0 HB VAL A 462 -5.323 -4.334 -3.421 1.00 0.00 H new ATOM 0 HG11 VAL A 462 -5.048 -2.676 -1.619 1.00 0.00 H new ATOM 0 HG12 VAL A 462 -3.709 -2.607 -2.790 1.00 0.00 H new ATOM 0 HG13 VAL A 462 -4.993 -1.375 -2.831 1.00 0.00 H new ATOM 0 HG21 VAL A 462 -7.308 -3.343 -2.346 1.00 0.00 H new ATOM 0 HG22 VAL A 462 -7.336 -2.067 -3.586 1.00 0.00 H new ATOM 0 HG23 VAL A 462 -7.619 -3.762 -4.048 1.00 0.00 H new ATOM 439 N LYS A 463 -5.572 -4.787 -6.610 1.00 0.00 N ATOM 440 CA LYS A 463 -6.318 -5.583 -7.576 1.00 0.00 C ATOM 441 C LYS A 463 -6.282 -7.063 -7.216 1.00 0.00 C ATOM 442 O LYS A 463 -5.363 -7.524 -6.538 1.00 0.00 O ATOM 443 CB LYS A 463 -5.763 -5.371 -8.986 1.00 0.00 C ATOM 444 CG LYS A 463 -5.899 -3.947 -9.507 1.00 0.00 C ATOM 445 CD LYS A 463 -5.205 -3.783 -10.851 1.00 0.00 C ATOM 446 CE LYS A 463 -5.487 -2.415 -11.457 1.00 0.00 C ATOM 447 NZ LYS A 463 -4.739 -1.334 -10.760 1.00 0.00 N ATOM 0 H LYS A 463 -4.617 -5.107 -6.449 1.00 0.00 H new ATOM 0 HA LYS A 463 -7.356 -5.252 -7.550 1.00 0.00 H new ATOM 0 HB2 LYS A 463 -4.709 -5.649 -8.994 1.00 0.00 H new ATOM 0 HB3 LYS A 463 -6.276 -6.046 -9.671 1.00 0.00 H new ATOM 0 HG2 LYS A 463 -6.954 -3.693 -9.607 1.00 0.00 H new ATOM 0 HG3 LYS A 463 -5.470 -3.251 -8.786 1.00 0.00 H new ATOM 0 HD2 LYS A 463 -4.130 -3.913 -10.726 1.00 0.00 H new ATOM 0 HD3 LYS A 463 -5.543 -4.562 -11.534 1.00 0.00 H new ATOM 0 HE2 LYS A 463 -5.215 -2.422 -12.512 1.00 0.00 H new ATOM 0 HE3 LYS A 463 -6.556 -2.208 -11.405 1.00 0.00 H new ATOM 0 HZ1 LYS A 463 -5.396 -0.572 -10.497 1.00 0.00 H new ATOM 0 HZ2 LYS A 463 -4.293 -1.718 -9.903 1.00 0.00 H new ATOM 0 HZ3 LYS A 463 -4.005 -0.956 -11.393 1.00 0.00 H new ATOM 461 N ASN A 464 -7.287 -7.802 -7.671 1.00 0.00 N ATOM 462 CA ASN A 464 -7.178 -9.251 -7.795 1.00 0.00 C ATOM 463 C ASN A 464 -7.298 -9.690 -9.248 1.00 0.00 C ATOM 464 O ASN A 464 -8.307 -9.430 -9.904 1.00 0.00 O ATOM 465 CB ASN A 464 -8.214 -9.960 -6.945 1.00 0.00 C ATOM 466 CG ASN A 464 -8.044 -11.453 -6.902 1.00 0.00 C ATOM 467 OD1 ASN A 464 -7.364 -12.045 -7.750 1.00 0.00 O ATOM 468 ND2 ASN A 464 -8.722 -12.073 -5.971 1.00 0.00 N ATOM 0 H ASN A 464 -8.188 -7.421 -7.961 1.00 0.00 H new ATOM 0 HA ASN A 464 -6.190 -9.532 -7.431 1.00 0.00 H new ATOM 0 HB2 ASN A 464 -8.166 -9.569 -5.929 1.00 0.00 H new ATOM 0 HB3 ASN A 464 -9.207 -9.728 -7.330 1.00 0.00 H new ATOM 0 HD21 ASN A 464 -8.705 -13.092 -5.921 1.00 0.00 H new ATOM 0 HD22 ASN A 464 -9.267 -11.538 -5.295 1.00 0.00 H new ATOM 475 N LEU A 465 -6.263 -10.357 -9.749 1.00 0.00 N ATOM 476 CA LEU A 465 -6.142 -10.628 -11.176 1.00 0.00 C ATOM 477 C LEU A 465 -6.215 -12.122 -11.462 1.00 0.00 C ATOM 478 O LEU A 465 -5.983 -12.561 -12.588 1.00 0.00 O ATOM 479 CB LEU A 465 -4.831 -10.043 -11.718 1.00 0.00 C ATOM 480 CG LEU A 465 -4.636 -8.541 -11.475 1.00 0.00 C ATOM 481 CD1 LEU A 465 -3.234 -8.122 -11.897 1.00 0.00 C ATOM 482 CD2 LEU A 465 -5.688 -7.761 -12.248 1.00 0.00 C ATOM 0 H LEU A 465 -5.494 -10.720 -9.185 1.00 0.00 H new ATOM 0 HA LEU A 465 -6.979 -10.149 -11.683 1.00 0.00 H new ATOM 0 HB2 LEU A 465 -3.998 -10.579 -11.264 1.00 0.00 H new ATOM 0 HB3 LEU A 465 -4.784 -10.230 -12.791 1.00 0.00 H new ATOM 0 HG LEU A 465 -4.750 -8.326 -10.413 1.00 0.00 H new ATOM 0 HD11 LEU A 465 -3.105 -7.054 -11.721 1.00 0.00 H new ATOM 0 HD12 LEU A 465 -2.498 -8.677 -11.316 1.00 0.00 H new ATOM 0 HD13 LEU A 465 -3.094 -8.334 -12.957 1.00 0.00 H new ATOM 0 HD21 LEU A 465 -5.549 -6.694 -12.075 1.00 0.00 H new ATOM 0 HD22 LEU A 465 -5.588 -7.972 -13.313 1.00 0.00 H new ATOM 0 HD23 LEU A 465 -6.681 -8.057 -11.911 1.00 0.00 H new ATOM 494 N GLY A 466 -6.539 -12.900 -10.434 1.00 0.00 N ATOM 495 CA GLY A 466 -6.509 -14.354 -10.535 1.00 0.00 C ATOM 496 C GLY A 466 -7.861 -14.904 -10.975 1.00 0.00 C ATOM 497 O GLY A 466 -8.033 -16.115 -11.118 1.00 0.00 O ATOM 0 H GLY A 466 -6.826 -12.547 -9.521 1.00 0.00 H new ATOM 0 HA2 GLY A 466 -5.741 -14.656 -11.247 1.00 0.00 H new ATOM 0 HA3 GLY A 466 -6.235 -14.783 -9.571 1.00 0.00 H new ATOM 501 N GLY A 467 -8.818 -14.006 -11.184 1.00 0.00 N ATOM 502 CA GLY A 467 -10.157 -14.400 -11.608 1.00 0.00 C ATOM 503 C GLY A 467 -10.898 -15.123 -10.493 1.00 0.00 C ATOM 504 O GLY A 467 -11.864 -15.845 -10.741 1.00 0.00 O ATOM 0 H GLY A 467 -8.691 -13.001 -11.067 1.00 0.00 H new ATOM 0 HA2 GLY A 467 -10.720 -13.517 -11.909 1.00 0.00 H new ATOM 0 HA3 GLY A 467 -10.088 -15.048 -12.482 1.00 0.00 H new ATOM 508 N ILE A 468 -10.440 -14.927 -9.260 1.00 0.00 N ATOM 509 CA ILE A 468 -11.141 -15.443 -8.090 1.00 0.00 C ATOM 510 C ILE A 468 -11.313 -14.362 -7.030 1.00 0.00 C ATOM 511 O ILE A 468 -10.451 -13.500 -6.864 1.00 0.00 O ATOM 512 CB ILE A 468 -10.400 -16.643 -7.472 1.00 0.00 C ATOM 513 CG1 ILE A 468 -11.086 -17.081 -6.176 1.00 0.00 C ATOM 514 CG2 ILE A 468 -8.943 -16.292 -7.215 1.00 0.00 C ATOM 515 CD1 ILE A 468 -10.573 -18.394 -5.627 1.00 0.00 C ATOM 0 H ILE A 468 -9.585 -14.414 -9.046 1.00 0.00 H new ATOM 0 HA ILE A 468 -12.123 -15.771 -8.431 1.00 0.00 H new ATOM 0 HB ILE A 468 -10.433 -17.474 -8.177 1.00 0.00 H new ATOM 0 HG12 ILE A 468 -10.949 -16.305 -5.423 1.00 0.00 H new ATOM 0 HG13 ILE A 468 -12.158 -17.166 -6.354 1.00 0.00 H new ATOM 0 HG21 ILE A 468 -8.433 -17.151 -6.778 1.00 0.00 H new ATOM 0 HG22 ILE A 468 -8.462 -16.024 -8.156 1.00 0.00 H new ATOM 0 HG23 ILE A 468 -8.888 -15.449 -6.527 1.00 0.00 H new ATOM 0 HD11 ILE A 468 -11.107 -18.638 -4.708 1.00 0.00 H new ATOM 0 HD12 ILE A 468 -10.735 -19.183 -6.361 1.00 0.00 H new ATOM 0 HD13 ILE A 468 -9.507 -18.308 -5.415 1.00 0.00 H new ATOM 527 N GLY A 469 -12.432 -14.415 -6.315 1.00 0.00 N ATOM 528 CA GLY A 469 -12.711 -13.453 -5.257 1.00 0.00 C ATOM 529 C GLY A 469 -12.067 -13.876 -3.943 1.00 0.00 C ATOM 530 O GLY A 469 -12.148 -15.038 -3.546 1.00 0.00 O ATOM 0 H GLY A 469 -13.161 -15.116 -6.450 1.00 0.00 H new ATOM 0 HA2 GLY A 469 -12.339 -12.471 -5.548 1.00 0.00 H new ATOM 0 HA3 GLY A 469 -13.789 -13.358 -5.123 1.00 0.00 H new ATOM 534 N VAL A 470 -11.425 -12.925 -3.272 1.00 0.00 N ATOM 535 CA VAL A 470 -10.871 -13.166 -1.944 1.00 0.00 C ATOM 536 C VAL A 470 -11.471 -12.217 -0.915 1.00 0.00 C ATOM 537 O VAL A 470 -11.295 -11.001 -1.001 1.00 0.00 O ATOM 538 CB VAL A 470 -9.338 -13.013 -1.937 1.00 0.00 C ATOM 539 CG1 VAL A 470 -8.785 -13.253 -0.541 1.00 0.00 C ATOM 540 CG2 VAL A 470 -8.701 -13.971 -2.932 1.00 0.00 C ATOM 0 H VAL A 470 -11.275 -11.980 -3.626 1.00 0.00 H new ATOM 0 HA VAL A 470 -11.127 -14.192 -1.678 1.00 0.00 H new ATOM 0 HB VAL A 470 -9.094 -11.993 -2.235 1.00 0.00 H new ATOM 0 HG11 VAL A 470 -7.701 -13.141 -0.555 1.00 0.00 H new ATOM 0 HG12 VAL A 470 -9.216 -12.529 0.150 1.00 0.00 H new ATOM 0 HG13 VAL A 470 -9.041 -14.262 -0.217 1.00 0.00 H new ATOM 0 HG21 VAL A 470 -7.618 -13.848 -2.913 1.00 0.00 H new ATOM 0 HG22 VAL A 470 -8.955 -14.996 -2.663 1.00 0.00 H new ATOM 0 HG23 VAL A 470 -9.073 -13.756 -3.934 1.00 0.00 H new ATOM 550 N PRO A 471 -12.181 -12.779 0.057 1.00 0.00 N ATOM 551 CA PRO A 471 -12.770 -11.988 1.130 1.00 0.00 C ATOM 552 C PRO A 471 -11.737 -11.659 2.201 1.00 0.00 C ATOM 553 O PRO A 471 -11.927 -10.742 3.000 1.00 0.00 O ATOM 554 CB PRO A 471 -13.898 -12.872 1.670 1.00 0.00 C ATOM 555 CG PRO A 471 -13.398 -14.265 1.491 1.00 0.00 C ATOM 556 CD PRO A 471 -12.577 -14.234 0.231 1.00 0.00 C ATOM 0 HA PRO A 471 -13.139 -11.021 0.789 1.00 0.00 H new ATOM 0 HB2 PRO A 471 -14.105 -12.656 2.718 1.00 0.00 H new ATOM 0 HB3 PRO A 471 -14.826 -12.710 1.122 1.00 0.00 H new ATOM 0 HG2 PRO A 471 -12.797 -14.580 2.344 1.00 0.00 H new ATOM 0 HG3 PRO A 471 -14.224 -14.971 1.405 1.00 0.00 H new ATOM 0 HD2 PRO A 471 -11.699 -14.875 0.316 1.00 0.00 H new ATOM 0 HD3 PRO A 471 -13.151 -14.592 -0.623 1.00 0.00 H new ATOM 564 N SER A 472 -10.643 -12.413 2.213 1.00 0.00 N ATOM 565 CA SER A 472 -9.729 -12.419 3.348 1.00 0.00 C ATOM 566 C SER A 472 -8.617 -11.394 3.166 1.00 0.00 C ATOM 567 O SER A 472 -7.641 -11.380 3.917 1.00 0.00 O ATOM 568 CB SER A 472 -9.143 -13.805 3.541 1.00 0.00 C ATOM 569 OG SER A 472 -8.304 -14.173 2.480 1.00 0.00 O ATOM 0 H SER A 472 -10.368 -13.029 1.448 1.00 0.00 H new ATOM 0 HA SER A 472 -10.294 -12.146 4.239 1.00 0.00 H new ATOM 0 HB2 SER A 472 -8.581 -13.834 4.474 1.00 0.00 H new ATOM 0 HB3 SER A 472 -9.951 -14.531 3.633 1.00 0.00 H new ATOM 0 HG SER A 472 -7.945 -15.070 2.643 1.00 0.00 H new ATOM 575 N THR A 473 -8.769 -10.536 2.163 1.00 0.00 N ATOM 576 CA THR A 473 -7.649 -9.763 1.637 1.00 0.00 C ATOM 577 C THR A 473 -7.356 -8.553 2.515 1.00 0.00 C ATOM 578 O THR A 473 -8.160 -7.625 2.599 1.00 0.00 O ATOM 579 CB THR A 473 -7.917 -9.287 0.199 1.00 0.00 C ATOM 580 OG1 THR A 473 -8.094 -10.423 -0.657 1.00 0.00 O ATOM 581 CG2 THR A 473 -6.753 -8.450 -0.311 1.00 0.00 C ATOM 0 H THR A 473 -9.659 -10.358 1.697 1.00 0.00 H new ATOM 0 HA THR A 473 -6.784 -10.426 1.635 1.00 0.00 H new ATOM 0 HB THR A 473 -8.820 -8.676 0.196 1.00 0.00 H new ATOM 0 HG1 THR A 473 -8.107 -10.129 -1.592 1.00 0.00 H new ATOM 0 HG21 THR A 473 -6.960 -8.122 -1.330 1.00 0.00 H new ATOM 0 HG22 THR A 473 -6.622 -7.579 0.331 1.00 0.00 H new ATOM 0 HG23 THR A 473 -5.842 -9.049 -0.301 1.00 0.00 H new ATOM 589 N LYS A 474 -6.199 -8.569 3.168 1.00 0.00 N ATOM 590 CA LYS A 474 -5.775 -7.453 4.004 1.00 0.00 C ATOM 591 C LYS A 474 -4.595 -6.715 3.382 1.00 0.00 C ATOM 592 O LYS A 474 -3.585 -7.325 3.033 1.00 0.00 O ATOM 593 CB LYS A 474 -5.409 -7.942 5.406 1.00 0.00 C ATOM 594 CG LYS A 474 -6.547 -8.628 6.150 1.00 0.00 C ATOM 595 CD LYS A 474 -6.080 -9.179 7.489 1.00 0.00 C ATOM 596 CE LYS A 474 -7.142 -10.064 8.125 1.00 0.00 C ATOM 597 NZ LYS A 474 -6.667 -10.681 9.392 1.00 0.00 N ATOM 0 H LYS A 474 -5.537 -9.344 3.134 1.00 0.00 H new ATOM 0 HA LYS A 474 -6.611 -6.757 4.079 1.00 0.00 H new ATOM 0 HB2 LYS A 474 -4.572 -8.635 5.329 1.00 0.00 H new ATOM 0 HB3 LYS A 474 -5.066 -7.092 5.996 1.00 0.00 H new ATOM 0 HG2 LYS A 474 -7.359 -7.919 6.310 1.00 0.00 H new ATOM 0 HG3 LYS A 474 -6.946 -9.438 5.540 1.00 0.00 H new ATOM 0 HD2 LYS A 474 -5.163 -9.751 7.349 1.00 0.00 H new ATOM 0 HD3 LYS A 474 -5.841 -8.354 8.161 1.00 0.00 H new ATOM 0 HE2 LYS A 474 -8.036 -9.473 8.323 1.00 0.00 H new ATOM 0 HE3 LYS A 474 -7.427 -10.849 7.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 474 -7.420 -11.276 9.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 474 -5.829 -11.266 9.200 1.00 0.00 H new ATOM 0 HZ3 LYS A 474 -6.419 -9.933 10.071 1.00 0.00 H new ATOM 611 N VAL A 475 -4.731 -5.400 3.246 1.00 0.00 N ATOM 612 CA VAL A 475 -3.666 -4.573 2.693 1.00 0.00 C ATOM 613 C VAL A 475 -3.140 -3.587 3.727 1.00 0.00 C ATOM 614 O VAL A 475 -3.909 -2.840 4.333 1.00 0.00 O ATOM 615 CB VAL A 475 -4.141 -3.795 1.451 1.00 0.00 C ATOM 616 CG1 VAL A 475 -3.023 -2.916 0.912 1.00 0.00 C ATOM 617 CG2 VAL A 475 -4.629 -4.755 0.377 1.00 0.00 C ATOM 0 H VAL A 475 -5.570 -4.884 3.512 1.00 0.00 H new ATOM 0 HA VAL A 475 -2.863 -5.250 2.401 1.00 0.00 H new ATOM 0 HB VAL A 475 -4.972 -3.153 1.744 1.00 0.00 H new ATOM 0 HG11 VAL A 475 -3.377 -2.374 0.035 1.00 0.00 H new ATOM 0 HG12 VAL A 475 -2.718 -2.205 1.679 1.00 0.00 H new ATOM 0 HG13 VAL A 475 -2.172 -3.538 0.635 1.00 0.00 H new ATOM 0 HG21 VAL A 475 -4.961 -4.189 -0.493 1.00 0.00 H new ATOM 0 HG22 VAL A 475 -3.816 -5.421 0.088 1.00 0.00 H new ATOM 0 HG23 VAL A 475 -5.460 -5.344 0.766 1.00 0.00 H new ATOM 627 N ARG A 476 -1.826 -3.589 3.927 1.00 0.00 N ATOM 628 CA ARG A 476 -1.212 -2.812 4.997 1.00 0.00 C ATOM 629 C ARG A 476 -0.100 -1.921 4.461 1.00 0.00 C ATOM 630 O ARG A 476 0.490 -2.206 3.421 1.00 0.00 O ATOM 631 CB ARG A 476 -0.721 -3.694 6.135 1.00 0.00 C ATOM 632 CG ARG A 476 -1.815 -4.422 6.899 1.00 0.00 C ATOM 633 CD ARG A 476 -1.328 -5.539 7.750 1.00 0.00 C ATOM 634 NE ARG A 476 -2.363 -6.200 8.527 1.00 0.00 N ATOM 635 CZ ARG A 476 -2.199 -7.360 9.191 1.00 0.00 C ATOM 636 NH1 ARG A 476 -1.057 -8.011 9.145 1.00 0.00 N ATOM 637 NH2 ARG A 476 -3.224 -7.842 9.871 1.00 0.00 N ATOM 0 H ARG A 476 -1.165 -4.121 3.361 1.00 0.00 H new ATOM 0 HA ARG A 476 -1.986 -2.166 5.411 1.00 0.00 H new ATOM 0 HB2 ARG A 476 -0.028 -4.432 5.730 1.00 0.00 H new ATOM 0 HB3 ARG A 476 -0.157 -3.078 6.835 1.00 0.00 H new ATOM 0 HG2 ARG A 476 -2.342 -3.704 7.528 1.00 0.00 H new ATOM 0 HG3 ARG A 476 -2.541 -4.814 6.186 1.00 0.00 H new ATOM 0 HD2 ARG A 476 -0.841 -6.278 7.114 1.00 0.00 H new ATOM 0 HD3 ARG A 476 -0.569 -5.155 8.432 1.00 0.00 H new ATOM 0 HE ARG A 476 -3.279 -5.753 8.573 1.00 0.00 H new ATOM 0 HH11 ARG A 476 -0.279 -7.638 8.601 1.00 0.00 H new ATOM 0 HH12 ARG A 476 -0.949 -8.888 9.654 1.00 0.00 H new ATOM 0 HH21 ARG A 476 -4.110 -7.337 9.883 1.00 0.00 H new ATOM 0 HH22 ARG A 476 -3.129 -8.719 10.384 1.00 0.00 H new ATOM 651 N VAL A 477 0.179 -0.838 5.178 1.00 0.00 N ATOM 652 CA VAL A 477 1.209 0.108 4.768 1.00 0.00 C ATOM 653 C VAL A 477 2.186 0.387 5.902 1.00 0.00 C ATOM 654 O VAL A 477 1.779 0.639 7.036 1.00 0.00 O ATOM 655 CB VAL A 477 0.597 1.440 4.291 1.00 0.00 C ATOM 656 CG1 VAL A 477 1.690 2.461 4.021 1.00 0.00 C ATOM 657 CG2 VAL A 477 -0.245 1.222 3.044 1.00 0.00 C ATOM 0 H VAL A 477 -0.295 -0.594 6.047 1.00 0.00 H new ATOM 0 HA VAL A 477 1.744 -0.353 3.938 1.00 0.00 H new ATOM 0 HB VAL A 477 -0.048 1.825 5.081 1.00 0.00 H new ATOM 0 HG11 VAL A 477 1.240 3.395 3.685 1.00 0.00 H new ATOM 0 HG12 VAL A 477 2.256 2.639 4.936 1.00 0.00 H new ATOM 0 HG13 VAL A 477 2.359 2.082 3.248 1.00 0.00 H new ATOM 0 HG21 VAL A 477 -0.669 2.173 2.721 1.00 0.00 H new ATOM 0 HG22 VAL A 477 0.380 0.815 2.249 1.00 0.00 H new ATOM 0 HG23 VAL A 477 -1.050 0.522 3.267 1.00 0.00 H new ATOM 667 N TYR A 478 3.476 0.341 5.591 1.00 0.00 N ATOM 668 CA TYR A 478 4.514 0.591 6.584 1.00 0.00 C ATOM 669 C TYR A 478 5.384 1.777 6.186 1.00 0.00 C ATOM 670 O TYR A 478 5.618 2.018 5.002 1.00 0.00 O ATOM 671 CB TYR A 478 5.382 -0.655 6.776 1.00 0.00 C ATOM 672 CG TYR A 478 4.626 -1.854 7.306 1.00 0.00 C ATOM 673 CD1 TYR A 478 3.809 -2.605 6.476 1.00 0.00 C ATOM 674 CD2 TYR A 478 4.734 -2.230 8.637 1.00 0.00 C ATOM 675 CE1 TYR A 478 3.115 -3.700 6.956 1.00 0.00 C ATOM 676 CE2 TYR A 478 4.046 -3.322 9.128 1.00 0.00 C ATOM 677 CZ TYR A 478 3.238 -4.056 8.283 1.00 0.00 C ATOM 678 OH TYR A 478 2.551 -5.145 8.766 1.00 0.00 O ATOM 0 H TYR A 478 3.829 0.132 4.657 1.00 0.00 H new ATOM 0 HA TYR A 478 4.022 0.830 7.527 1.00 0.00 H new ATOM 0 HB2 TYR A 478 5.838 -0.918 5.822 1.00 0.00 H new ATOM 0 HB3 TYR A 478 6.194 -0.417 7.463 1.00 0.00 H new ATOM 0 HD1 TYR A 478 3.713 -2.330 5.436 1.00 0.00 H new ATOM 0 HD2 TYR A 478 5.367 -1.659 9.300 1.00 0.00 H new ATOM 0 HE1 TYR A 478 2.481 -4.273 6.296 1.00 0.00 H new ATOM 0 HE2 TYR A 478 4.140 -3.600 10.167 1.00 0.00 H new ATOM 0 HH TYR A 478 2.748 -5.260 9.719 1.00 0.00 H new ATOM 688 N ILE A 479 5.860 2.514 7.182 1.00 0.00 N ATOM 689 CA ILE A 479 6.838 3.572 6.955 1.00 0.00 C ATOM 690 C ILE A 479 8.136 3.293 7.701 1.00 0.00 C ATOM 691 O ILE A 479 8.155 3.235 8.930 1.00 0.00 O ATOM 692 CB ILE A 479 6.294 4.946 7.384 1.00 0.00 C ATOM 693 CG1 ILE A 479 5.048 5.306 6.572 1.00 0.00 C ATOM 694 CG2 ILE A 479 7.364 6.014 7.225 1.00 0.00 C ATOM 695 CD1 ILE A 479 4.382 6.590 7.011 1.00 0.00 C ATOM 0 H ILE A 479 5.584 2.398 8.157 1.00 0.00 H new ATOM 0 HA ILE A 479 7.037 3.590 5.883 1.00 0.00 H new ATOM 0 HB ILE A 479 6.014 4.894 8.436 1.00 0.00 H new ATOM 0 HG12 ILE A 479 5.323 5.392 5.521 1.00 0.00 H new ATOM 0 HG13 ILE A 479 4.329 4.491 6.648 1.00 0.00 H new ATOM 0 HG21 ILE A 479 6.963 6.980 7.533 1.00 0.00 H new ATOM 0 HG22 ILE A 479 8.223 5.763 7.847 1.00 0.00 H new ATOM 0 HG23 ILE A 479 7.674 6.066 6.181 1.00 0.00 H new ATOM 0 HD11 ILE A 479 3.507 6.777 6.388 1.00 0.00 H new ATOM 0 HD12 ILE A 479 4.074 6.502 8.053 1.00 0.00 H new ATOM 0 HD13 ILE A 479 5.084 7.417 6.909 1.00 0.00 H new ATOM 707 N ASN A 480 9.218 3.121 6.949 1.00 0.00 N ATOM 708 CA ASN A 480 10.513 2.794 7.536 1.00 0.00 C ATOM 709 C ASN A 480 10.420 1.562 8.426 1.00 0.00 C ATOM 710 O ASN A 480 11.016 1.515 9.502 1.00 0.00 O ATOM 711 CB ASN A 480 11.080 3.964 8.319 1.00 0.00 C ATOM 712 CG ASN A 480 11.449 5.143 7.462 1.00 0.00 C ATOM 713 OD1 ASN A 480 11.745 5.002 6.269 1.00 0.00 O ATOM 714 ND2 ASN A 480 11.515 6.294 8.082 1.00 0.00 N ATOM 0 H ASN A 480 9.224 3.202 5.932 1.00 0.00 H new ATOM 0 HA ASN A 480 11.192 2.575 6.712 1.00 0.00 H new ATOM 0 HB2 ASN A 480 10.348 4.281 9.062 1.00 0.00 H new ATOM 0 HB3 ASN A 480 11.964 3.631 8.864 1.00 0.00 H new ATOM 0 HD21 ASN A 480 11.822 7.127 7.580 1.00 0.00 H new ATOM 0 HD22 ASN A 480 11.260 6.358 9.067 1.00 0.00 H new ATOM 721 N GLY A 481 9.670 0.566 7.970 1.00 0.00 N ATOM 722 CA GLY A 481 9.577 -0.709 8.674 1.00 0.00 C ATOM 723 C GLY A 481 8.497 -0.667 9.748 1.00 0.00 C ATOM 724 O GLY A 481 8.136 -1.696 10.318 1.00 0.00 O ATOM 0 H GLY A 481 9.116 0.616 7.115 1.00 0.00 H new ATOM 0 HA2 GLY A 481 9.356 -1.505 7.963 1.00 0.00 H new ATOM 0 HA3 GLY A 481 10.538 -0.947 9.130 1.00 0.00 H new ATOM 728 N THR A 482 7.985 0.529 10.019 1.00 0.00 N ATOM 729 CA THR A 482 6.978 0.713 11.056 1.00 0.00 C ATOM 730 C THR A 482 5.575 0.744 10.463 1.00 0.00 C ATOM 731 O THR A 482 5.347 1.352 9.415 1.00 0.00 O ATOM 732 CB THR A 482 7.216 2.009 11.852 1.00 0.00 C ATOM 733 OG1 THR A 482 8.491 1.946 12.504 1.00 0.00 O ATOM 734 CG2 THR A 482 6.126 2.202 12.896 1.00 0.00 C ATOM 0 H THR A 482 8.252 1.386 9.534 1.00 0.00 H new ATOM 0 HA THR A 482 7.065 -0.138 11.731 1.00 0.00 H new ATOM 0 HB THR A 482 7.195 2.851 11.160 1.00 0.00 H new ATOM 0 HG1 THR A 482 8.642 2.772 13.009 1.00 0.00 H new ATOM 0 HG21 THR A 482 6.311 3.123 13.449 1.00 0.00 H new ATOM 0 HG22 THR A 482 5.156 2.263 12.402 1.00 0.00 H new ATOM 0 HG23 THR A 482 6.129 1.358 13.586 1.00 0.00 H new ATOM 742 N LEU A 483 4.638 0.087 11.135 1.00 0.00 N ATOM 743 CA LEU A 483 3.251 0.053 10.684 1.00 0.00 C ATOM 744 C LEU A 483 2.588 1.415 10.840 1.00 0.00 C ATOM 745 O LEU A 483 2.507 1.955 11.943 1.00 0.00 O ATOM 746 CB LEU A 483 2.469 -1.014 11.460 1.00 0.00 C ATOM 747 CG LEU A 483 0.987 -1.138 11.083 1.00 0.00 C ATOM 748 CD1 LEU A 483 0.851 -1.564 9.627 1.00 0.00 C ATOM 749 CD2 LEU A 483 0.310 -2.142 12.003 1.00 0.00 C ATOM 0 H LEU A 483 4.813 -0.431 11.996 1.00 0.00 H new ATOM 0 HA LEU A 483 3.245 -0.203 9.625 1.00 0.00 H new ATOM 0 HB2 LEU A 483 2.950 -1.980 11.304 1.00 0.00 H new ATOM 0 HB3 LEU A 483 2.540 -0.791 12.525 1.00 0.00 H new ATOM 0 HG LEU A 483 0.501 -0.170 11.202 1.00 0.00 H new ATOM 0 HD11 LEU A 483 -0.205 -1.649 9.370 1.00 0.00 H new ATOM 0 HD12 LEU A 483 1.322 -0.820 8.985 1.00 0.00 H new ATOM 0 HD13 LEU A 483 1.338 -2.528 9.483 1.00 0.00 H new ATOM 0 HD21 LEU A 483 -0.743 -2.229 11.734 1.00 0.00 H new ATOM 0 HD22 LEU A 483 0.793 -3.114 11.899 1.00 0.00 H new ATOM 0 HD23 LEU A 483 0.394 -1.804 13.036 1.00 0.00 H new ATOM 761 N TYR A 484 2.114 1.967 9.727 1.00 0.00 N ATOM 762 CA TYR A 484 1.471 3.274 9.736 1.00 0.00 C ATOM 763 C TYR A 484 -0.046 3.143 9.747 1.00 0.00 C ATOM 764 O TYR A 484 -0.737 3.885 10.444 1.00 0.00 O ATOM 765 CB TYR A 484 1.918 4.097 8.525 1.00 0.00 C ATOM 766 CG TYR A 484 1.083 5.336 8.284 1.00 0.00 C ATOM 767 CD1 TYR A 484 1.308 6.499 9.007 1.00 0.00 C ATOM 768 CD2 TYR A 484 0.074 5.340 7.333 1.00 0.00 C ATOM 769 CE1 TYR A 484 0.549 7.632 8.791 1.00 0.00 C ATOM 770 CE2 TYR A 484 -0.690 6.467 7.108 1.00 0.00 C ATOM 771 CZ TYR A 484 -0.450 7.612 7.839 1.00 0.00 C ATOM 772 OH TYR A 484 -1.209 8.739 7.619 1.00 0.00 O ATOM 0 H TYR A 484 2.164 1.528 8.808 1.00 0.00 H new ATOM 0 HA TYR A 484 1.774 3.788 10.648 1.00 0.00 H new ATOM 0 HB2 TYR A 484 2.958 4.393 8.663 1.00 0.00 H new ATOM 0 HB3 TYR A 484 1.881 3.467 7.636 1.00 0.00 H new ATOM 0 HD1 TYR A 484 2.090 6.518 9.751 1.00 0.00 H new ATOM 0 HD2 TYR A 484 -0.117 4.446 6.758 1.00 0.00 H new ATOM 0 HE1 TYR A 484 0.736 8.528 9.364 1.00 0.00 H new ATOM 0 HE2 TYR A 484 -1.472 6.453 6.363 1.00 0.00 H new ATOM 0 HH TYR A 484 -0.628 9.473 7.327 1.00 0.00 H new ATOM 782 N LYS A 485 -0.557 2.195 8.971 1.00 0.00 N ATOM 783 CA LYS A 485 -1.996 2.059 8.775 1.00 0.00 C ATOM 784 C LYS A 485 -2.340 0.725 8.126 1.00 0.00 C ATOM 785 O LYS A 485 -1.492 0.093 7.496 1.00 0.00 O ATOM 786 CB LYS A 485 -2.532 3.210 7.923 1.00 0.00 C ATOM 787 CG LYS A 485 -4.051 3.326 7.905 1.00 0.00 C ATOM 788 CD LYS A 485 -4.592 3.715 9.272 1.00 0.00 C ATOM 789 CE LYS A 485 -6.105 3.867 9.247 1.00 0.00 C ATOM 790 NZ LYS A 485 -6.652 4.228 10.584 1.00 0.00 N ATOM 0 H LYS A 485 0.004 1.508 8.467 1.00 0.00 H new ATOM 0 HA LYS A 485 -2.470 2.094 9.756 1.00 0.00 H new ATOM 0 HB2 LYS A 485 -2.113 4.146 8.293 1.00 0.00 H new ATOM 0 HB3 LYS A 485 -2.177 3.084 6.900 1.00 0.00 H new ATOM 0 HG2 LYS A 485 -4.352 4.070 7.167 1.00 0.00 H new ATOM 0 HG3 LYS A 485 -4.487 2.376 7.596 1.00 0.00 H new ATOM 0 HD2 LYS A 485 -4.313 2.958 10.004 1.00 0.00 H new ATOM 0 HD3 LYS A 485 -4.136 4.652 9.592 1.00 0.00 H new ATOM 0 HE2 LYS A 485 -6.380 4.634 8.524 1.00 0.00 H new ATOM 0 HE3 LYS A 485 -6.557 2.934 8.910 1.00 0.00 H new ATOM 0 HZ1 LYS A 485 -7.686 4.322 10.522 1.00 0.00 H new ATOM 0 HZ2 LYS A 485 -6.412 3.484 11.270 1.00 0.00 H new ATOM 0 HZ3 LYS A 485 -6.241 5.131 10.895 1.00 0.00 H new ATOM 804 N ASN A 486 -3.588 0.299 8.285 1.00 0.00 N ATOM 805 CA ASN A 486 -4.039 -0.975 7.739 1.00 0.00 C ATOM 806 C ASN A 486 -5.453 -0.867 7.184 1.00 0.00 C ATOM 807 O ASN A 486 -6.250 -0.048 7.641 1.00 0.00 O ATOM 808 CB ASN A 486 -3.969 -2.080 8.777 1.00 0.00 C ATOM 809 CG ASN A 486 -4.899 -1.879 9.940 1.00 0.00 C ATOM 810 OD1 ASN A 486 -6.117 -2.058 9.825 1.00 0.00 O ATOM 811 ND2 ASN A 486 -4.344 -1.432 11.037 1.00 0.00 N ATOM 0 H ASN A 486 -4.307 0.819 8.789 1.00 0.00 H new ATOM 0 HA ASN A 486 -3.364 -1.230 6.922 1.00 0.00 H new ATOM 0 HB2 ASN A 486 -4.202 -3.031 8.298 1.00 0.00 H new ATOM 0 HB3 ASN A 486 -2.947 -2.152 9.149 1.00 0.00 H new ATOM 0 HD21 ASN A 486 -4.922 -1.214 11.849 1.00 0.00 H new ATOM 0 HD22 ASN A 486 -3.333 -1.302 11.081 1.00 0.00 H new ATOM 818 N TRP A 487 -5.759 -1.698 6.193 1.00 0.00 N ATOM 819 CA TRP A 487 -7.128 -1.846 5.712 1.00 0.00 C ATOM 820 C TRP A 487 -7.464 -3.307 5.446 1.00 0.00 C ATOM 821 O TRP A 487 -6.627 -4.068 4.960 1.00 0.00 O ATOM 822 CB TRP A 487 -7.339 -1.019 4.442 1.00 0.00 C ATOM 823 CG TRP A 487 -7.141 0.452 4.645 1.00 0.00 C ATOM 824 CD1 TRP A 487 -8.106 1.374 4.924 1.00 0.00 C ATOM 825 CD2 TRP A 487 -5.903 1.172 4.589 1.00 0.00 C ATOM 826 NE1 TRP A 487 -7.547 2.621 5.042 1.00 0.00 N ATOM 827 CE2 TRP A 487 -6.193 2.522 4.842 1.00 0.00 C ATOM 828 CE3 TRP A 487 -4.575 0.799 4.347 1.00 0.00 C ATOM 829 CZ2 TRP A 487 -5.214 3.502 4.859 1.00 0.00 C ATOM 830 CZ3 TRP A 487 -3.591 1.782 4.366 1.00 0.00 C ATOM 831 CH2 TRP A 487 -3.903 3.094 4.616 1.00 0.00 C ATOM 0 H TRP A 487 -5.077 -2.280 5.707 1.00 0.00 H new ATOM 0 HA TRP A 487 -7.797 -1.480 6.491 1.00 0.00 H new ATOM 0 HB2 TRP A 487 -6.650 -1.367 3.673 1.00 0.00 H new ATOM 0 HB3 TRP A 487 -8.348 -1.193 4.068 1.00 0.00 H new ATOM 0 HD1 TRP A 487 -9.158 1.154 5.036 1.00 0.00 H new ATOM 0 HE1 TRP A 487 -8.055 3.482 5.245 1.00 0.00 H new ATOM 0 HE3 TRP A 487 -4.320 -0.232 4.149 1.00 0.00 H new ATOM 0 HZ2 TRP A 487 -5.456 4.537 5.052 1.00 0.00 H new ATOM 0 HZ3 TRP A 487 -2.563 1.507 4.181 1.00 0.00 H new ATOM 0 HH2 TRP A 487 -3.113 3.830 4.625 1.00 0.00 H new ATOM 842 N THR A 488 -8.693 -3.695 5.768 1.00 0.00 N ATOM 843 CA THR A 488 -9.225 -4.985 5.344 1.00 0.00 C ATOM 844 C THR A 488 -10.308 -4.815 4.287 1.00 0.00 C ATOM 845 O THR A 488 -11.278 -4.083 4.491 1.00 0.00 O ATOM 846 CB THR A 488 -9.802 -5.776 6.532 1.00 0.00 C ATOM 847 OG1 THR A 488 -8.769 -6.014 7.498 1.00 0.00 O ATOM 848 CG2 THR A 488 -10.368 -7.108 6.063 1.00 0.00 C ATOM 0 H THR A 488 -9.340 -3.134 6.322 1.00 0.00 H new ATOM 0 HA THR A 488 -8.391 -5.543 4.918 1.00 0.00 H new ATOM 0 HB THR A 488 -10.604 -5.191 6.983 1.00 0.00 H new ATOM 0 HG1 THR A 488 -9.138 -6.516 8.254 1.00 0.00 H new ATOM 0 HG21 THR A 488 -10.771 -7.653 6.917 1.00 0.00 H new ATOM 0 HG22 THR A 488 -11.162 -6.931 5.338 1.00 0.00 H new ATOM 0 HG23 THR A 488 -9.577 -7.696 5.598 1.00 0.00 H new ATOM 856 N VAL A 489 -10.138 -5.493 3.157 1.00 0.00 N ATOM 857 CA VAL A 489 -11.052 -5.346 2.030 1.00 0.00 C ATOM 858 C VAL A 489 -11.346 -6.692 1.380 1.00 0.00 C ATOM 859 O VAL A 489 -10.678 -7.686 1.660 1.00 0.00 O ATOM 860 CB VAL A 489 -10.487 -4.386 0.967 1.00 0.00 C ATOM 861 CG1 VAL A 489 -10.269 -3.002 1.560 1.00 0.00 C ATOM 862 CG2 VAL A 489 -9.186 -4.930 0.396 1.00 0.00 C ATOM 0 H VAL A 489 -9.375 -6.151 2.997 1.00 0.00 H new ATOM 0 HA VAL A 489 -11.977 -4.929 2.428 1.00 0.00 H new ATOM 0 HB VAL A 489 -11.212 -4.304 0.157 1.00 0.00 H new ATOM 0 HG11 VAL A 489 -9.869 -2.337 0.794 1.00 0.00 H new ATOM 0 HG12 VAL A 489 -11.218 -2.608 1.923 1.00 0.00 H new ATOM 0 HG13 VAL A 489 -9.563 -3.068 2.388 1.00 0.00 H new ATOM 0 HG21 VAL A 489 -8.801 -4.239 -0.354 1.00 0.00 H new ATOM 0 HG22 VAL A 489 -8.455 -5.041 1.197 1.00 0.00 H new ATOM 0 HG23 VAL A 489 -9.369 -5.901 -0.065 1.00 0.00 H new ATOM 872 N SER A 490 -12.351 -6.717 0.511 1.00 0.00 N ATOM 873 CA SER A 490 -12.605 -7.877 -0.332 1.00 0.00 C ATOM 874 C SER A 490 -12.489 -7.520 -1.808 1.00 0.00 C ATOM 875 O SER A 490 -12.912 -6.444 -2.233 1.00 0.00 O ATOM 876 CB SER A 490 -13.978 -8.449 -0.034 1.00 0.00 C ATOM 877 OG SER A 490 -14.320 -9.482 -0.917 1.00 0.00 O ATOM 0 H SER A 490 -13.003 -5.945 0.373 1.00 0.00 H new ATOM 0 HA SER A 490 -11.850 -8.631 -0.108 1.00 0.00 H new ATOM 0 HB2 SER A 490 -14.000 -8.825 0.989 1.00 0.00 H new ATOM 0 HB3 SER A 490 -14.723 -7.656 -0.098 1.00 0.00 H new ATOM 0 HG SER A 490 -15.210 -9.825 -0.691 1.00 0.00 H new ATOM 883 N LEU A 491 -11.913 -8.429 -2.589 1.00 0.00 N ATOM 884 CA LEU A 491 -11.720 -8.201 -4.015 1.00 0.00 C ATOM 885 C LEU A 491 -12.253 -9.369 -4.836 1.00 0.00 C ATOM 886 O LEU A 491 -11.880 -10.521 -4.611 1.00 0.00 O ATOM 887 CB LEU A 491 -10.234 -7.971 -4.319 1.00 0.00 C ATOM 888 CG LEU A 491 -9.619 -6.729 -3.661 1.00 0.00 C ATOM 889 CD1 LEU A 491 -8.106 -6.740 -3.838 1.00 0.00 C ATOM 890 CD2 LEU A 491 -10.224 -5.475 -4.275 1.00 0.00 C ATOM 0 H LEU A 491 -11.572 -9.331 -2.257 1.00 0.00 H new ATOM 0 HA LEU A 491 -12.281 -7.309 -4.294 1.00 0.00 H new ATOM 0 HB2 LEU A 491 -9.673 -8.849 -3.997 1.00 0.00 H new ATOM 0 HB3 LEU A 491 -10.108 -7.891 -5.399 1.00 0.00 H new ATOM 0 HG LEU A 491 -9.838 -6.737 -2.593 1.00 0.00 H new ATOM 0 HD11 LEU A 491 -7.678 -5.855 -3.368 1.00 0.00 H new ATOM 0 HD12 LEU A 491 -7.692 -7.634 -3.372 1.00 0.00 H new ATOM 0 HD13 LEU A 491 -7.864 -6.739 -4.901 1.00 0.00 H new ATOM 0 HD21 LEU A 491 -9.786 -4.593 -3.807 1.00 0.00 H new ATOM 0 HD22 LEU A 491 -10.018 -5.458 -5.345 1.00 0.00 H new ATOM 0 HD23 LEU A 491 -11.302 -5.474 -4.113 1.00 0.00 H new ATOM 902 N GLY A 492 -13.127 -9.064 -5.790 1.00 0.00 N ATOM 903 CA GLY A 492 -13.668 -10.079 -6.686 1.00 0.00 C ATOM 904 C GLY A 492 -12.704 -10.377 -7.827 1.00 0.00 C ATOM 905 O GLY A 492 -11.576 -9.884 -7.845 1.00 0.00 O ATOM 0 H GLY A 492 -13.476 -8.121 -5.962 1.00 0.00 H new ATOM 0 HA2 GLY A 492 -13.867 -10.993 -6.126 1.00 0.00 H new ATOM 0 HA3 GLY A 492 -14.621 -9.739 -7.091 1.00 0.00 H new ATOM 909 N PRO A 493 -13.153 -11.188 -8.779 1.00 0.00 N ATOM 910 CA PRO A 493 -12.367 -11.482 -9.970 1.00 0.00 C ATOM 911 C PRO A 493 -12.088 -10.218 -10.773 1.00 0.00 C ATOM 912 O PRO A 493 -12.998 -9.627 -11.354 1.00 0.00 O ATOM 913 CB PRO A 493 -13.227 -12.482 -10.749 1.00 0.00 C ATOM 914 CG PRO A 493 -14.612 -12.250 -10.250 1.00 0.00 C ATOM 915 CD PRO A 493 -14.457 -11.880 -8.799 1.00 0.00 C ATOM 0 HA PRO A 493 -11.383 -11.888 -9.736 1.00 0.00 H new ATOM 0 HB2 PRO A 493 -13.158 -12.312 -11.823 1.00 0.00 H new ATOM 0 HB3 PRO A 493 -12.906 -13.508 -10.567 1.00 0.00 H new ATOM 0 HG2 PRO A 493 -15.103 -11.453 -10.809 1.00 0.00 H new ATOM 0 HG3 PRO A 493 -15.226 -13.144 -10.364 1.00 0.00 H new ATOM 0 HD2 PRO A 493 -15.265 -11.232 -8.458 1.00 0.00 H new ATOM 0 HD3 PRO A 493 -14.459 -12.759 -8.154 1.00 0.00 H new ATOM 923 N LYS A 494 -10.824 -9.808 -10.803 1.00 0.00 N ATOM 924 CA LYS A 494 -10.429 -8.596 -11.510 1.00 0.00 C ATOM 925 C LYS A 494 -11.169 -7.379 -10.970 1.00 0.00 C ATOM 926 O LYS A 494 -11.605 -6.517 -11.735 1.00 0.00 O ATOM 927 CB LYS A 494 -10.681 -8.744 -13.011 1.00 0.00 C ATOM 928 CG LYS A 494 -9.912 -9.881 -13.669 1.00 0.00 C ATOM 929 CD LYS A 494 -10.178 -9.936 -15.166 1.00 0.00 C ATOM 930 CE LYS A 494 -9.461 -11.110 -15.815 1.00 0.00 C ATOM 931 NZ LYS A 494 -9.755 -11.208 -17.269 1.00 0.00 N ATOM 0 H LYS A 494 -10.055 -10.298 -10.345 1.00 0.00 H new ATOM 0 HA LYS A 494 -9.362 -8.446 -11.346 1.00 0.00 H new ATOM 0 HB2 LYS A 494 -11.747 -8.901 -13.174 1.00 0.00 H new ATOM 0 HB3 LYS A 494 -10.417 -7.809 -13.505 1.00 0.00 H new ATOM 0 HG2 LYS A 494 -8.844 -9.751 -13.492 1.00 0.00 H new ATOM 0 HG3 LYS A 494 -10.198 -10.828 -13.212 1.00 0.00 H new ATOM 0 HD2 LYS A 494 -11.250 -10.019 -15.344 1.00 0.00 H new ATOM 0 HD3 LYS A 494 -9.850 -9.006 -15.630 1.00 0.00 H new ATOM 0 HE2 LYS A 494 -8.386 -11.004 -15.669 1.00 0.00 H new ATOM 0 HE3 LYS A 494 -9.760 -12.035 -15.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 494 -9.247 -12.021 -17.672 1.00 0.00 H new ATOM 0 HZ2 LYS A 494 -10.778 -11.335 -17.409 1.00 0.00 H new ATOM 0 HZ3 LYS A 494 -9.446 -10.336 -17.745 1.00 0.00 H new ATOM 945 N GLU A 495 -11.305 -7.311 -9.651 1.00 0.00 N ATOM 946 CA GLU A 495 -11.861 -6.132 -8.997 1.00 0.00 C ATOM 947 C GLU A 495 -10.762 -5.264 -8.398 1.00 0.00 C ATOM 948 O GLU A 495 -9.760 -5.775 -7.898 1.00 0.00 O ATOM 949 CB GLU A 495 -12.858 -6.543 -7.910 1.00 0.00 C ATOM 950 CG GLU A 495 -13.617 -5.382 -7.284 1.00 0.00 C ATOM 951 CD GLU A 495 -14.731 -5.872 -6.401 1.00 0.00 C ATOM 952 OE1 GLU A 495 -14.454 -6.593 -5.473 1.00 0.00 O ATOM 953 OE2 GLU A 495 -15.843 -5.436 -6.585 1.00 0.00 O ATOM 0 H GLU A 495 -11.037 -8.060 -9.012 1.00 0.00 H new ATOM 0 HA GLU A 495 -12.383 -5.546 -9.754 1.00 0.00 H new ATOM 0 HB2 GLU A 495 -13.576 -7.242 -8.338 1.00 0.00 H new ATOM 0 HB3 GLU A 495 -12.322 -7.077 -7.125 1.00 0.00 H new ATOM 0 HG2 GLU A 495 -12.931 -4.768 -6.701 1.00 0.00 H new ATOM 0 HG3 GLU A 495 -14.025 -4.746 -8.069 1.00 0.00 H new ATOM 960 N GLU A 496 -10.956 -3.952 -8.453 1.00 0.00 N ATOM 961 CA GLU A 496 -9.967 -3.010 -7.941 1.00 0.00 C ATOM 962 C GLU A 496 -10.561 -2.128 -6.849 1.00 0.00 C ATOM 963 O GLU A 496 -11.707 -1.690 -6.946 1.00 0.00 O ATOM 964 CB GLU A 496 -9.417 -2.142 -9.075 1.00 0.00 C ATOM 965 CG GLU A 496 -8.380 -1.117 -8.636 1.00 0.00 C ATOM 966 CD GLU A 496 -7.884 -0.308 -9.802 1.00 0.00 C ATOM 967 OE1 GLU A 496 -8.418 -0.458 -10.874 1.00 0.00 O ATOM 968 OE2 GLU A 496 -7.048 0.541 -9.597 1.00 0.00 O ATOM 0 H GLU A 496 -11.789 -3.515 -8.847 1.00 0.00 H new ATOM 0 HA GLU A 496 -9.150 -3.587 -7.508 1.00 0.00 H new ATOM 0 HB2 GLU A 496 -8.972 -2.791 -9.830 1.00 0.00 H new ATOM 0 HB3 GLU A 496 -10.247 -1.620 -9.552 1.00 0.00 H new ATOM 0 HG2 GLU A 496 -8.815 -0.453 -7.889 1.00 0.00 H new ATOM 0 HG3 GLU A 496 -7.541 -1.626 -8.161 1.00 0.00 H new ATOM 975 N LYS A 497 -9.775 -1.874 -5.810 1.00 0.00 N ATOM 976 CA LYS A 497 -10.182 -0.962 -4.747 1.00 0.00 C ATOM 977 C LYS A 497 -9.113 0.090 -4.483 1.00 0.00 C ATOM 978 O LYS A 497 -7.920 -0.173 -4.632 1.00 0.00 O ATOM 979 CB LYS A 497 -10.484 -1.738 -3.463 1.00 0.00 C ATOM 980 CG LYS A 497 -11.760 -2.568 -3.515 1.00 0.00 C ATOM 981 CD LYS A 497 -12.997 -1.684 -3.478 1.00 0.00 C ATOM 982 CE LYS A 497 -13.203 -1.076 -2.099 1.00 0.00 C ATOM 983 NZ LYS A 497 -14.315 -0.087 -2.087 1.00 0.00 N ATOM 0 H LYS A 497 -8.851 -2.287 -5.680 1.00 0.00 H new ATOM 0 HA LYS A 497 -11.088 -0.452 -5.075 1.00 0.00 H new ATOM 0 HB2 LYS A 497 -9.644 -2.398 -3.246 1.00 0.00 H new ATOM 0 HB3 LYS A 497 -10.557 -1.033 -2.635 1.00 0.00 H new ATOM 0 HG2 LYS A 497 -11.768 -3.170 -4.424 1.00 0.00 H new ATOM 0 HG3 LYS A 497 -11.780 -3.261 -2.674 1.00 0.00 H new ATOM 0 HD2 LYS A 497 -12.900 -0.889 -4.217 1.00 0.00 H new ATOM 0 HD3 LYS A 497 -13.874 -2.270 -3.754 1.00 0.00 H new ATOM 0 HE2 LYS A 497 -13.415 -1.868 -1.381 1.00 0.00 H new ATOM 0 HE3 LYS A 497 -12.282 -0.590 -1.775 1.00 0.00 H new ATOM 0 HZ1 LYS A 497 -14.422 0.303 -1.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 497 -14.102 0.683 -2.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 497 -15.199 -0.555 -2.371 1.00 0.00 H new ATOM 997 N VAL A 498 -9.547 1.283 -4.090 1.00 0.00 N ATOM 998 CA VAL A 498 -8.630 2.383 -3.826 1.00 0.00 C ATOM 999 C VAL A 498 -8.605 2.735 -2.343 1.00 0.00 C ATOM 1000 O VAL A 498 -9.624 3.116 -1.769 1.00 0.00 O ATOM 1001 CB VAL A 498 -9.004 3.638 -4.635 1.00 0.00 C ATOM 1002 CG1 VAL A 498 -8.053 4.782 -4.316 1.00 0.00 C ATOM 1003 CG2 VAL A 498 -8.989 3.336 -6.126 1.00 0.00 C ATOM 0 H VAL A 498 -10.531 1.512 -3.947 1.00 0.00 H new ATOM 0 HA VAL A 498 -7.640 2.047 -4.134 1.00 0.00 H new ATOM 0 HB VAL A 498 -10.013 3.939 -4.354 1.00 0.00 H new ATOM 0 HG11 VAL A 498 -8.333 5.661 -4.897 1.00 0.00 H new ATOM 0 HG12 VAL A 498 -8.110 5.017 -3.253 1.00 0.00 H new ATOM 0 HG13 VAL A 498 -7.034 4.489 -4.569 1.00 0.00 H new ATOM 0 HG21 VAL A 498 -9.256 4.235 -6.682 1.00 0.00 H new ATOM 0 HG22 VAL A 498 -7.992 3.009 -6.421 1.00 0.00 H new ATOM 0 HG23 VAL A 498 -9.709 2.547 -6.345 1.00 0.00 H new ATOM 1013 N LEU A 499 -7.434 2.604 -1.730 1.00 0.00 N ATOM 1014 CA LEU A 499 -7.245 3.022 -0.346 1.00 0.00 C ATOM 1015 C LEU A 499 -6.518 4.358 -0.268 1.00 0.00 C ATOM 1016 O LEU A 499 -5.609 4.629 -1.052 1.00 0.00 O ATOM 1017 CB LEU A 499 -6.472 1.948 0.431 1.00 0.00 C ATOM 1018 CG LEU A 499 -7.066 0.537 0.359 1.00 0.00 C ATOM 1019 CD1 LEU A 499 -6.122 -0.462 1.013 1.00 0.00 C ATOM 1020 CD2 LEU A 499 -8.426 0.521 1.041 1.00 0.00 C ATOM 0 H LEU A 499 -6.601 2.212 -2.170 1.00 0.00 H new ATOM 0 HA LEU A 499 -8.229 3.148 0.106 1.00 0.00 H new ATOM 0 HB2 LEU A 499 -5.450 1.914 0.054 1.00 0.00 H new ATOM 0 HB3 LEU A 499 -6.416 2.249 1.477 1.00 0.00 H new ATOM 0 HG LEU A 499 -7.195 0.251 -0.685 1.00 0.00 H new ATOM 0 HD11 LEU A 499 -6.554 -1.461 0.956 1.00 0.00 H new ATOM 0 HD12 LEU A 499 -5.164 -0.451 0.494 1.00 0.00 H new ATOM 0 HD13 LEU A 499 -5.972 -0.190 2.058 1.00 0.00 H new ATOM 0 HD21 LEU A 499 -8.847 -0.483 0.989 1.00 0.00 H new ATOM 0 HD22 LEU A 499 -8.313 0.814 2.085 1.00 0.00 H new ATOM 0 HD23 LEU A 499 -9.093 1.221 0.538 1.00 0.00 H new ATOM 1032 N THR A 500 -6.923 5.191 0.684 1.00 0.00 N ATOM 1033 CA THR A 500 -6.291 6.490 0.886 1.00 0.00 C ATOM 1034 C THR A 500 -5.761 6.631 2.307 1.00 0.00 C ATOM 1035 O THR A 500 -6.286 6.020 3.237 1.00 0.00 O ATOM 1036 CB THR A 500 -7.269 7.645 0.596 1.00 0.00 C ATOM 1037 OG1 THR A 500 -8.474 7.455 1.349 1.00 0.00 O ATOM 1038 CG2 THR A 500 -7.604 7.701 -0.886 1.00 0.00 C ATOM 0 H THR A 500 -7.687 4.990 1.329 1.00 0.00 H new ATOM 0 HA THR A 500 -5.458 6.546 0.185 1.00 0.00 H new ATOM 0 HB THR A 500 -6.796 8.583 0.886 1.00 0.00 H new ATOM 0 HG1 THR A 500 -9.094 8.191 1.165 1.00 0.00 H new ATOM 0 HG21 THR A 500 -8.296 8.523 -1.072 1.00 0.00 H new ATOM 0 HG22 THR A 500 -6.691 7.859 -1.460 1.00 0.00 H new ATOM 0 HG23 THR A 500 -8.066 6.762 -1.190 1.00 0.00 H new ATOM 1046 N PHE A 501 -4.718 7.438 2.466 1.00 0.00 N ATOM 1047 CA PHE A 501 -4.295 7.890 3.786 1.00 0.00 C ATOM 1048 C PHE A 501 -3.552 9.218 3.701 1.00 0.00 C ATOM 1049 O PHE A 501 -2.998 9.564 2.659 1.00 0.00 O ATOM 1050 CB PHE A 501 -3.412 6.836 4.456 1.00 0.00 C ATOM 1051 CG PHE A 501 -2.135 6.557 3.716 1.00 0.00 C ATOM 1052 CD1 PHE A 501 -0.993 7.304 3.969 1.00 0.00 C ATOM 1053 CD2 PHE A 501 -2.071 5.550 2.767 1.00 0.00 C ATOM 1054 CE1 PHE A 501 0.183 7.049 3.290 1.00 0.00 C ATOM 1055 CE2 PHE A 501 -0.896 5.291 2.087 1.00 0.00 C ATOM 1056 CZ PHE A 501 0.231 6.043 2.349 1.00 0.00 C ATOM 0 H PHE A 501 -4.150 7.793 1.697 1.00 0.00 H new ATOM 0 HA PHE A 501 -5.190 8.038 4.390 1.00 0.00 H new ATOM 0 HB2 PHE A 501 -3.171 7.166 5.466 1.00 0.00 H new ATOM 0 HB3 PHE A 501 -3.977 5.909 4.550 1.00 0.00 H new ATOM 0 HD1 PHE A 501 -1.024 8.094 4.705 1.00 0.00 H new ATOM 0 HD2 PHE A 501 -2.950 4.960 2.556 1.00 0.00 H new ATOM 0 HE1 PHE A 501 1.064 7.638 3.497 1.00 0.00 H new ATOM 0 HE2 PHE A 501 -0.860 4.501 1.351 1.00 0.00 H new ATOM 0 HZ PHE A 501 1.150 5.844 1.817 1.00 0.00 H new ATOM 1066 N SER A 502 -3.546 9.957 4.805 1.00 0.00 N ATOM 1067 CA SER A 502 -2.918 11.273 4.842 1.00 0.00 C ATOM 1068 C SER A 502 -1.798 11.320 5.874 1.00 0.00 C ATOM 1069 O SER A 502 -1.993 10.951 7.032 1.00 0.00 O ATOM 1070 CB SER A 502 -3.955 12.338 5.138 1.00 0.00 C ATOM 1071 OG SER A 502 -4.915 12.435 4.123 1.00 0.00 O ATOM 0 H SER A 502 -3.969 9.667 5.687 1.00 0.00 H new ATOM 0 HA SER A 502 -2.479 11.468 3.863 1.00 0.00 H new ATOM 0 HB2 SER A 502 -4.449 12.110 6.083 1.00 0.00 H new ATOM 0 HB3 SER A 502 -3.460 13.301 5.261 1.00 0.00 H new ATOM 0 HG SER A 502 -5.565 13.131 4.353 1.00 0.00 H new ATOM 1077 N TRP A 503 -0.625 11.777 5.447 1.00 0.00 N ATOM 1078 CA TRP A 503 0.569 11.710 6.278 1.00 0.00 C ATOM 1079 C TRP A 503 1.216 13.084 6.424 1.00 0.00 C ATOM 1080 O TRP A 503 1.459 13.773 5.434 1.00 0.00 O ATOM 1081 CB TRP A 503 1.574 10.719 5.689 1.00 0.00 C ATOM 1082 CG TRP A 503 2.901 10.725 6.387 1.00 0.00 C ATOM 1083 CD1 TRP A 503 3.117 10.657 7.731 1.00 0.00 C ATOM 1084 CD2 TRP A 503 4.195 10.803 5.775 1.00 0.00 C ATOM 1085 NE1 TRP A 503 4.462 10.689 7.997 1.00 0.00 N ATOM 1086 CE2 TRP A 503 5.146 10.777 6.810 1.00 0.00 C ATOM 1087 CE3 TRP A 503 4.640 10.892 4.450 1.00 0.00 C ATOM 1088 CZ2 TRP A 503 6.510 10.839 6.566 1.00 0.00 C ATOM 1089 CZ3 TRP A 503 6.006 10.951 4.207 1.00 0.00 C ATOM 1090 CH2 TRP A 503 6.915 10.925 5.234 1.00 0.00 C ATOM 0 H TRP A 503 -0.477 12.198 4.530 1.00 0.00 H new ATOM 0 HA TRP A 503 0.268 11.366 7.268 1.00 0.00 H new ATOM 0 HB2 TRP A 503 1.152 9.715 5.736 1.00 0.00 H new ATOM 0 HB3 TRP A 503 1.726 10.951 4.635 1.00 0.00 H new ATOM 0 HD1 TRP A 503 2.341 10.588 8.479 1.00 0.00 H new ATOM 0 HE1 TRP A 503 4.885 10.653 8.925 1.00 0.00 H new ATOM 0 HE3 TRP A 503 3.934 10.914 3.633 1.00 0.00 H new ATOM 0 HZ2 TRP A 503 7.228 10.821 7.373 1.00 0.00 H new ATOM 0 HZ3 TRP A 503 6.360 11.019 3.189 1.00 0.00 H new ATOM 0 HH2 TRP A 503 7.970 10.972 5.006 1.00 0.00 H new ATOM 1101 N THR A 504 1.491 13.473 7.663 1.00 0.00 N ATOM 1102 CA THR A 504 2.244 14.692 7.934 1.00 0.00 C ATOM 1103 C THR A 504 3.551 14.384 8.655 1.00 0.00 C ATOM 1104 O THR A 504 3.549 14.014 9.830 1.00 0.00 O ATOM 1105 CB THR A 504 1.426 15.687 8.776 1.00 0.00 C ATOM 1106 OG1 THR A 504 0.234 16.051 8.069 1.00 0.00 O ATOM 1107 CG2 THR A 504 2.241 16.938 9.066 1.00 0.00 C ATOM 0 H THR A 504 1.204 12.961 8.497 1.00 0.00 H new ATOM 0 HA THR A 504 2.465 15.145 6.968 1.00 0.00 H new ATOM 0 HB THR A 504 1.164 15.209 9.720 1.00 0.00 H new ATOM 0 HG1 THR A 504 -0.286 16.683 8.608 1.00 0.00 H new ATOM 0 HG21 THR A 504 1.646 17.630 9.662 1.00 0.00 H new ATOM 0 HG22 THR A 504 3.142 16.666 9.617 1.00 0.00 H new ATOM 0 HG23 THR A 504 2.520 17.416 8.127 1.00 0.00 H new ATOM 1115 N PRO A 505 4.663 14.536 7.946 1.00 0.00 N ATOM 1116 CA PRO A 505 5.982 14.399 8.550 1.00 0.00 C ATOM 1117 C PRO A 505 6.298 15.579 9.459 1.00 0.00 C ATOM 1118 O PRO A 505 5.718 16.656 9.317 1.00 0.00 O ATOM 1119 CB PRO A 505 6.936 14.321 7.355 1.00 0.00 C ATOM 1120 CG PRO A 505 6.261 15.114 6.288 1.00 0.00 C ATOM 1121 CD PRO A 505 4.787 14.869 6.483 1.00 0.00 C ATOM 0 HA PRO A 505 6.062 13.521 9.192 1.00 0.00 H new ATOM 0 HB2 PRO A 505 7.914 14.736 7.600 1.00 0.00 H new ATOM 0 HB3 PRO A 505 7.097 13.289 7.042 1.00 0.00 H new ATOM 0 HG2 PRO A 505 6.499 16.174 6.376 1.00 0.00 H new ATOM 0 HG3 PRO A 505 6.585 14.796 5.297 1.00 0.00 H new ATOM 0 HD2 PRO A 505 4.198 15.749 6.223 1.00 0.00 H new ATOM 0 HD3 PRO A 505 4.432 14.051 5.856 1.00 0.00 H new ATOM 1129 N THR A 506 7.218 15.371 10.395 1.00 0.00 N ATOM 1130 CA THR A 506 7.634 16.427 11.309 1.00 0.00 C ATOM 1131 C THR A 506 9.143 16.632 11.264 1.00 0.00 C ATOM 1132 O THR A 506 9.646 17.695 11.629 1.00 0.00 O ATOM 1133 CB THR A 506 7.212 16.117 12.758 1.00 0.00 C ATOM 1134 OG1 THR A 506 7.816 14.889 13.183 1.00 0.00 O ATOM 1135 CG2 THR A 506 5.699 15.996 12.858 1.00 0.00 C ATOM 0 H THR A 506 7.690 14.479 10.540 1.00 0.00 H new ATOM 0 HA THR A 506 7.137 17.340 10.982 1.00 0.00 H new ATOM 0 HB THR A 506 7.544 16.933 13.400 1.00 0.00 H new ATOM 0 HG1 THR A 506 7.548 14.695 14.105 1.00 0.00 H new ATOM 0 HG21 THR A 506 5.419 15.777 13.888 1.00 0.00 H new ATOM 0 HG22 THR A 506 5.238 16.934 12.548 1.00 0.00 H new ATOM 0 HG23 THR A 506 5.355 15.191 12.209 1.00 0.00 H new ATOM 1143 N GLN A 507 9.862 15.609 10.815 1.00 0.00 N ATOM 1144 CA GLN A 507 11.316 15.673 10.728 1.00 0.00 C ATOM 1145 C GLN A 507 11.790 15.501 9.291 1.00 0.00 C ATOM 1146 O GLN A 507 11.268 14.668 8.550 1.00 0.00 O ATOM 1147 CB GLN A 507 11.953 14.600 11.614 1.00 0.00 C ATOM 1148 CG GLN A 507 11.722 14.802 13.102 1.00 0.00 C ATOM 1149 CD GLN A 507 12.322 13.688 13.939 1.00 0.00 C ATOM 1150 OE1 GLN A 507 12.956 12.771 13.413 1.00 0.00 O ATOM 1151 NE2 GLN A 507 12.122 13.760 15.250 1.00 0.00 N ATOM 0 H GLN A 507 9.460 14.724 10.505 1.00 0.00 H new ATOM 0 HA GLN A 507 11.626 16.658 11.078 1.00 0.00 H new ATOM 0 HB2 GLN A 507 11.558 13.626 11.326 1.00 0.00 H new ATOM 0 HB3 GLN A 507 13.026 14.578 11.424 1.00 0.00 H new ATOM 0 HG2 GLN A 507 12.154 15.755 13.408 1.00 0.00 H new ATOM 0 HG3 GLN A 507 10.651 14.861 13.296 1.00 0.00 H new ATOM 0 HE21 GLN A 507 11.591 14.537 15.643 1.00 0.00 H new ATOM 0 HE22 GLN A 507 12.499 13.038 15.864 1.00 0.00 H new ATOM 1160 N GLU A 508 12.782 16.293 8.902 1.00 0.00 N ATOM 1161 CA GLU A 508 13.353 16.207 7.563 1.00 0.00 C ATOM 1162 C GLU A 508 14.221 14.965 7.415 1.00 0.00 C ATOM 1163 O GLU A 508 14.965 14.603 8.325 1.00 0.00 O ATOM 1164 CB GLU A 508 14.170 17.460 7.247 1.00 0.00 C ATOM 1165 CG GLU A 508 14.995 17.368 5.971 1.00 0.00 C ATOM 1166 CD GLU A 508 15.819 18.608 5.761 1.00 0.00 C ATOM 1167 OE1 GLU A 508 16.645 18.898 6.594 1.00 0.00 O ATOM 1168 OE2 GLU A 508 15.703 19.205 4.718 1.00 0.00 O ATOM 0 H GLU A 508 13.209 17.004 9.496 1.00 0.00 H new ATOM 0 HA GLU A 508 12.529 16.134 6.853 1.00 0.00 H new ATOM 0 HB2 GLU A 508 13.492 18.310 7.166 1.00 0.00 H new ATOM 0 HB3 GLU A 508 14.839 17.663 8.083 1.00 0.00 H new ATOM 0 HG2 GLU A 508 15.650 16.498 6.021 1.00 0.00 H new ATOM 0 HG3 GLU A 508 14.333 17.220 5.118 1.00 0.00 H new ATOM 1175 N GLY A 509 14.122 14.314 6.259 1.00 0.00 N ATOM 1176 CA GLY A 509 14.822 13.058 6.025 1.00 0.00 C ATOM 1177 C GLY A 509 14.099 12.208 4.987 1.00 0.00 C ATOM 1178 O GLY A 509 13.013 12.563 4.529 1.00 0.00 O ATOM 0 H GLY A 509 13.563 14.638 5.470 1.00 0.00 H new ATOM 0 HA2 GLY A 509 15.838 13.263 5.687 1.00 0.00 H new ATOM 0 HA3 GLY A 509 14.902 12.504 6.960 1.00 0.00 H new ATOM 1182 N MET A 510 14.709 11.088 4.618 1.00 0.00 N ATOM 1183 CA MET A 510 14.098 10.158 3.673 1.00 0.00 C ATOM 1184 C MET A 510 13.167 9.185 4.384 1.00 0.00 C ATOM 1185 O MET A 510 13.552 8.543 5.362 1.00 0.00 O ATOM 1186 CB MET A 510 15.179 9.394 2.911 1.00 0.00 C ATOM 1187 CG MET A 510 16.014 10.253 1.971 1.00 0.00 C ATOM 1188 SD MET A 510 15.015 11.086 0.721 1.00 0.00 S ATOM 1189 CE MET A 510 14.420 9.688 -0.224 1.00 0.00 C ATOM 0 H MET A 510 15.627 10.801 4.958 1.00 0.00 H new ATOM 0 HA MET A 510 13.505 10.736 2.964 1.00 0.00 H new ATOM 0 HB2 MET A 510 15.843 8.914 3.630 1.00 0.00 H new ATOM 0 HB3 MET A 510 14.706 8.599 2.334 1.00 0.00 H new ATOM 0 HG2 MET A 510 16.558 10.998 2.552 1.00 0.00 H new ATOM 0 HG3 MET A 510 16.759 9.628 1.478 1.00 0.00 H new ATOM 0 HE1 MET A 510 14.016 10.037 -1.174 1.00 0.00 H new ATOM 0 HE2 MET A 510 15.243 8.998 -0.411 1.00 0.00 H new ATOM 0 HE3 MET A 510 13.638 9.176 0.337 1.00 0.00 H new ATOM 1199 N TYR A 511 11.940 9.079 3.887 1.00 0.00 N ATOM 1200 CA TYR A 511 10.980 8.117 4.416 1.00 0.00 C ATOM 1201 C TYR A 511 10.520 7.148 3.334 1.00 0.00 C ATOM 1202 O TYR A 511 10.130 7.561 2.241 1.00 0.00 O ATOM 1203 CB TYR A 511 9.773 8.839 5.019 1.00 0.00 C ATOM 1204 CG TYR A 511 10.109 9.686 6.227 1.00 0.00 C ATOM 1205 CD1 TYR A 511 10.616 10.968 6.081 1.00 0.00 C ATOM 1206 CD2 TYR A 511 9.912 9.198 7.512 1.00 0.00 C ATOM 1207 CE1 TYR A 511 10.923 11.745 7.182 1.00 0.00 C ATOM 1208 CE2 TYR A 511 10.216 9.967 8.620 1.00 0.00 C ATOM 1209 CZ TYR A 511 10.721 11.240 8.450 1.00 0.00 C ATOM 1210 OH TYR A 511 11.024 12.010 9.551 1.00 0.00 O ATOM 0 H TYR A 511 11.586 9.648 3.118 1.00 0.00 H new ATOM 0 HA TYR A 511 11.479 7.546 5.199 1.00 0.00 H new ATOM 0 HB2 TYR A 511 9.323 9.474 4.256 1.00 0.00 H new ATOM 0 HB3 TYR A 511 9.023 8.100 5.302 1.00 0.00 H new ATOM 0 HD1 TYR A 511 10.774 11.366 5.090 1.00 0.00 H new ATOM 0 HD2 TYR A 511 9.515 8.203 7.648 1.00 0.00 H new ATOM 0 HE1 TYR A 511 11.319 12.741 7.051 1.00 0.00 H new ATOM 0 HE2 TYR A 511 10.059 9.574 9.613 1.00 0.00 H new ATOM 0 HH TYR A 511 11.124 12.946 9.278 1.00 0.00 H new ATOM 1220 N ARG A 512 10.570 5.857 3.643 1.00 0.00 N ATOM 1221 CA ARG A 512 10.168 4.825 2.693 1.00 0.00 C ATOM 1222 C ARG A 512 8.791 4.270 3.033 1.00 0.00 C ATOM 1223 O ARG A 512 8.578 3.727 4.116 1.00 0.00 O ATOM 1224 CB ARG A 512 11.202 3.716 2.581 1.00 0.00 C ATOM 1225 CG ARG A 512 10.807 2.562 1.673 1.00 0.00 C ATOM 1226 CD ARG A 512 11.896 1.587 1.411 1.00 0.00 C ATOM 1227 NE ARG A 512 13.042 2.137 0.705 1.00 0.00 N ATOM 1228 CZ ARG A 512 14.270 1.586 0.696 1.00 0.00 C ATOM 1229 NH1 ARG A 512 14.530 0.495 1.382 1.00 0.00 N ATOM 1230 NH2 ARG A 512 15.218 2.186 -0.002 1.00 0.00 N ATOM 0 H ARG A 512 10.885 5.499 4.545 1.00 0.00 H new ATOM 0 HA ARG A 512 10.105 5.298 1.713 1.00 0.00 H new ATOM 0 HB2 ARG A 512 12.135 4.145 2.215 1.00 0.00 H new ATOM 0 HB3 ARG A 512 11.401 3.323 3.578 1.00 0.00 H new ATOM 0 HG2 ARG A 512 9.964 2.035 2.121 1.00 0.00 H new ATOM 0 HG3 ARG A 512 10.461 2.966 0.722 1.00 0.00 H new ATOM 0 HD2 ARG A 512 12.234 1.176 2.362 1.00 0.00 H new ATOM 0 HD3 ARG A 512 11.492 0.758 0.831 1.00 0.00 H new ATOM 0 HE ARG A 512 12.906 3.001 0.180 1.00 0.00 H new ATOM 0 HH11 ARG A 512 13.795 0.052 1.933 1.00 0.00 H new ATOM 0 HH12 ARG A 512 15.467 0.092 1.363 1.00 0.00 H new ATOM 0 HH21 ARG A 512 15.009 3.043 -0.515 1.00 0.00 H new ATOM 0 HH22 ARG A 512 16.159 1.792 -0.028 1.00 0.00 H new ATOM 1244 N ILE A 513 7.855 4.412 2.100 1.00 0.00 N ATOM 1245 CA ILE A 513 6.517 3.859 2.266 1.00 0.00 C ATOM 1246 C ILE A 513 6.347 2.574 1.466 1.00 0.00 C ATOM 1247 O ILE A 513 6.489 2.571 0.245 1.00 0.00 O ATOM 1248 CB ILE A 513 5.433 4.865 1.839 1.00 0.00 C ATOM 1249 CG1 ILE A 513 5.542 6.150 2.665 1.00 0.00 C ATOM 1250 CG2 ILE A 513 4.049 4.252 1.987 1.00 0.00 C ATOM 1251 CD1 ILE A 513 4.673 7.278 2.158 1.00 0.00 C ATOM 0 H ILE A 513 8.000 4.906 1.220 1.00 0.00 H new ATOM 0 HA ILE A 513 6.399 3.640 3.327 1.00 0.00 H new ATOM 0 HB ILE A 513 5.588 5.115 0.789 1.00 0.00 H new ATOM 0 HG12 ILE A 513 5.270 5.931 3.698 1.00 0.00 H new ATOM 0 HG13 ILE A 513 6.581 6.479 2.672 1.00 0.00 H new ATOM 0 HG21 ILE A 513 3.295 4.977 1.681 1.00 0.00 H new ATOM 0 HG22 ILE A 513 3.975 3.364 1.359 1.00 0.00 H new ATOM 0 HG23 ILE A 513 3.883 3.974 3.028 1.00 0.00 H new ATOM 0 HD11 ILE A 513 4.805 8.153 2.794 1.00 0.00 H new ATOM 0 HD12 ILE A 513 4.959 7.526 1.136 1.00 0.00 H new ATOM 0 HD13 ILE A 513 3.628 6.969 2.178 1.00 0.00 H new ATOM 1263 N ASN A 514 6.043 1.485 2.163 1.00 0.00 N ATOM 1264 CA ASN A 514 5.857 0.191 1.519 1.00 0.00 C ATOM 1265 C ASN A 514 4.475 -0.377 1.812 1.00 0.00 C ATOM 1266 O ASN A 514 3.923 -0.166 2.892 1.00 0.00 O ATOM 1267 CB ASN A 514 6.930 -0.798 1.939 1.00 0.00 C ATOM 1268 CG ASN A 514 8.213 -0.662 1.168 1.00 0.00 C ATOM 1269 OD1 ASN A 514 8.655 0.449 0.849 1.00 0.00 O ATOM 1270 ND2 ASN A 514 8.771 -1.785 0.797 1.00 0.00 N ATOM 0 H ASN A 514 5.920 1.473 3.175 1.00 0.00 H new ATOM 0 HA ASN A 514 5.944 0.352 0.444 1.00 0.00 H new ATOM 0 HB2 ASN A 514 7.139 -0.665 3.001 1.00 0.00 H new ATOM 0 HB3 ASN A 514 6.547 -1.811 1.814 1.00 0.00 H new ATOM 0 HD21 ASN A 514 9.610 -1.770 0.218 1.00 0.00 H new ATOM 0 HD22 ASN A 514 8.367 -2.675 1.087 1.00 0.00 H new ATOM 1277 N ALA A 515 3.919 -1.097 0.843 1.00 0.00 N ATOM 1278 CA ALA A 515 2.608 -1.715 1.005 1.00 0.00 C ATOM 1279 C ALA A 515 2.669 -3.214 0.732 1.00 0.00 C ATOM 1280 O ALA A 515 3.355 -3.659 -0.188 1.00 0.00 O ATOM 1281 CB ALA A 515 1.591 -1.047 0.093 1.00 0.00 C ATOM 0 H ALA A 515 4.356 -1.267 -0.063 1.00 0.00 H new ATOM 0 HA ALA A 515 2.294 -1.576 2.039 1.00 0.00 H new ATOM 0 HB1 ALA A 515 0.618 -1.519 0.226 1.00 0.00 H new ATOM 0 HB2 ALA A 515 1.518 0.011 0.343 1.00 0.00 H new ATOM 0 HB3 ALA A 515 1.908 -1.153 -0.945 1.00 0.00 H new ATOM 1287 N THR A 516 1.946 -3.986 1.536 1.00 0.00 N ATOM 1288 CA THR A 516 1.869 -5.428 1.345 1.00 0.00 C ATOM 1289 C THR A 516 0.425 -5.915 1.390 1.00 0.00 C ATOM 1290 O THR A 516 -0.427 -5.297 2.030 1.00 0.00 O ATOM 1291 CB THR A 516 2.688 -6.185 2.409 1.00 0.00 C ATOM 1292 OG1 THR A 516 2.122 -5.951 3.705 1.00 0.00 O ATOM 1293 CG2 THR A 516 4.135 -5.717 2.400 1.00 0.00 C ATOM 0 H THR A 516 1.405 -3.636 2.327 1.00 0.00 H new ATOM 0 HA THR A 516 2.289 -5.636 0.361 1.00 0.00 H new ATOM 0 HB THR A 516 2.660 -7.250 2.179 1.00 0.00 H new ATOM 0 HG1 THR A 516 2.642 -6.434 4.381 1.00 0.00 H new ATOM 0 HG21 THR A 516 4.698 -6.262 3.157 1.00 0.00 H new ATOM 0 HG22 THR A 516 4.572 -5.903 1.419 1.00 0.00 H new ATOM 0 HG23 THR A 516 4.174 -4.650 2.617 1.00 0.00 H new ATOM 1301 N VAL A 517 0.158 -7.022 0.708 1.00 0.00 N ATOM 1302 CA VAL A 517 -1.135 -7.687 0.804 1.00 0.00 C ATOM 1303 C VAL A 517 -0.976 -9.154 1.186 1.00 0.00 C ATOM 1304 O VAL A 517 -0.003 -9.801 0.800 1.00 0.00 O ATOM 1305 CB VAL A 517 -1.919 -7.593 -0.518 1.00 0.00 C ATOM 1306 CG1 VAL A 517 -1.157 -8.285 -1.638 1.00 0.00 C ATOM 1307 CG2 VAL A 517 -3.305 -8.202 -0.362 1.00 0.00 C ATOM 0 H VAL A 517 0.821 -7.479 0.082 1.00 0.00 H new ATOM 0 HA VAL A 517 -1.694 -7.171 1.585 1.00 0.00 H new ATOM 0 HB VAL A 517 -2.033 -6.540 -0.776 1.00 0.00 H new ATOM 0 HG11 VAL A 517 -1.725 -8.209 -2.565 1.00 0.00 H new ATOM 0 HG12 VAL A 517 -0.186 -7.807 -1.767 1.00 0.00 H new ATOM 0 HG13 VAL A 517 -1.013 -9.336 -1.385 1.00 0.00 H new ATOM 0 HG21 VAL A 517 -3.844 -8.126 -1.306 1.00 0.00 H new ATOM 0 HG22 VAL A 517 -3.212 -9.251 -0.080 1.00 0.00 H new ATOM 0 HG23 VAL A 517 -3.853 -7.666 0.413 1.00 0.00 H new ATOM 1524 N VAL A 532 3.952 -6.734 -3.620 1.00 0.00 N ATOM 1525 CA VAL A 532 4.497 -5.743 -2.700 1.00 0.00 C ATOM 1526 C VAL A 532 5.004 -4.517 -3.448 1.00 0.00 C ATOM 1527 O VAL A 532 5.527 -4.626 -4.556 1.00 0.00 O ATOM 1528 CB VAL A 532 5.643 -6.328 -1.854 1.00 0.00 C ATOM 1529 CG1 VAL A 532 6.244 -5.254 -0.958 1.00 0.00 C ATOM 1530 CG2 VAL A 532 5.146 -7.498 -1.020 1.00 0.00 C ATOM 0 HA VAL A 532 3.683 -5.448 -2.037 1.00 0.00 H new ATOM 0 HB VAL A 532 6.419 -6.690 -2.528 1.00 0.00 H new ATOM 0 HG11 VAL A 532 7.053 -5.684 -0.367 1.00 0.00 H new ATOM 0 HG12 VAL A 532 6.636 -4.444 -1.573 1.00 0.00 H new ATOM 0 HG13 VAL A 532 5.475 -4.864 -0.291 1.00 0.00 H new ATOM 0 HG21 VAL A 532 5.969 -7.899 -0.429 1.00 0.00 H new ATOM 0 HG22 VAL A 532 4.352 -7.159 -0.354 1.00 0.00 H new ATOM 0 HG23 VAL A 532 4.760 -8.276 -1.678 1.00 0.00 H new ATOM 1540 N ALA A 533 4.846 -3.349 -2.835 1.00 0.00 N ATOM 1541 CA ALA A 533 5.195 -2.089 -3.482 1.00 0.00 C ATOM 1542 C ALA A 533 6.121 -1.257 -2.604 1.00 0.00 C ATOM 1543 O ALA A 533 5.880 -1.097 -1.408 1.00 0.00 O ATOM 1544 CB ALA A 533 3.937 -1.304 -3.826 1.00 0.00 C ATOM 0 H ALA A 533 4.478 -3.248 -1.889 1.00 0.00 H new ATOM 0 HA ALA A 533 5.727 -2.319 -4.405 1.00 0.00 H new ATOM 0 HB1 ALA A 533 4.214 -0.366 -4.308 1.00 0.00 H new ATOM 0 HB2 ALA A 533 3.316 -1.891 -4.503 1.00 0.00 H new ATOM 0 HB3 ALA A 533 3.379 -1.092 -2.914 1.00 0.00 H new ATOM 1550 N THR A 534 7.180 -0.728 -3.208 1.00 0.00 N ATOM 1551 CA THR A 534 8.106 0.147 -2.500 1.00 0.00 C ATOM 1552 C THR A 534 8.087 1.556 -3.079 1.00 0.00 C ATOM 1553 O THR A 534 8.306 1.749 -4.274 1.00 0.00 O ATOM 1554 CB THR A 534 9.547 -0.397 -2.548 1.00 0.00 C ATOM 1555 OG1 THR A 534 9.599 -1.676 -1.902 1.00 0.00 O ATOM 1556 CG2 THR A 534 10.501 0.559 -1.850 1.00 0.00 C ATOM 0 H THR A 534 7.418 -0.890 -4.186 1.00 0.00 H new ATOM 0 HA THR A 534 7.774 0.180 -1.462 1.00 0.00 H new ATOM 0 HB THR A 534 9.848 -0.497 -3.591 1.00 0.00 H new ATOM 0 HG1 THR A 534 10.496 -1.821 -1.535 1.00 0.00 H new ATOM 0 HG21 THR A 534 11.514 0.159 -1.894 1.00 0.00 H new ATOM 0 HG22 THR A 534 10.472 1.529 -2.347 1.00 0.00 H new ATOM 0 HG23 THR A 534 10.202 0.676 -0.808 1.00 0.00 H new ATOM 1564 N PHE A 535 7.823 2.536 -2.223 1.00 0.00 N ATOM 1565 CA PHE A 535 7.809 3.935 -2.641 1.00 0.00 C ATOM 1566 C PHE A 535 8.688 4.788 -1.737 1.00 0.00 C ATOM 1567 O PHE A 535 8.560 4.750 -0.513 1.00 0.00 O ATOM 1568 CB PHE A 535 6.378 4.476 -2.648 1.00 0.00 C ATOM 1569 CG PHE A 535 6.260 5.870 -3.193 1.00 0.00 C ATOM 1570 CD1 PHE A 535 7.172 6.346 -4.123 1.00 0.00 C ATOM 1571 CD2 PHE A 535 5.239 6.711 -2.776 1.00 0.00 C ATOM 1572 CE1 PHE A 535 7.066 7.629 -4.625 1.00 0.00 C ATOM 1573 CE2 PHE A 535 5.128 7.993 -3.278 1.00 0.00 C ATOM 1574 CZ PHE A 535 6.045 8.453 -4.203 1.00 0.00 C ATOM 0 H PHE A 535 7.616 2.389 -1.235 1.00 0.00 H new ATOM 0 HA PHE A 535 8.212 3.986 -3.653 1.00 0.00 H new ATOM 0 HB2 PHE A 535 5.751 3.810 -3.240 1.00 0.00 H new ATOM 0 HB3 PHE A 535 5.988 4.460 -1.630 1.00 0.00 H new ATOM 0 HD1 PHE A 535 7.975 5.706 -4.459 1.00 0.00 H new ATOM 0 HD2 PHE A 535 4.522 6.359 -2.049 1.00 0.00 H new ATOM 0 HE1 PHE A 535 7.784 7.986 -5.349 1.00 0.00 H new ATOM 0 HE2 PHE A 535 4.325 8.635 -2.948 1.00 0.00 H new ATOM 0 HZ PHE A 535 5.962 9.456 -4.595 1.00 0.00 H new ATOM 1584 N ASP A 536 9.583 5.559 -2.346 1.00 0.00 N ATOM 1585 CA ASP A 536 10.477 6.435 -1.598 1.00 0.00 C ATOM 1586 C ASP A 536 9.990 7.876 -1.629 1.00 0.00 C ATOM 1587 O ASP A 536 9.742 8.436 -2.699 1.00 0.00 O ATOM 1588 CB ASP A 536 11.901 6.348 -2.155 1.00 0.00 C ATOM 1589 CG ASP A 536 12.600 5.023 -1.888 1.00 0.00 C ATOM 1590 OD1 ASP A 536 12.628 4.605 -0.755 1.00 0.00 O ATOM 1591 OD2 ASP A 536 12.963 4.364 -2.833 1.00 0.00 O ATOM 0 H ASP A 536 9.708 5.595 -3.358 1.00 0.00 H new ATOM 0 HA ASP A 536 10.481 6.100 -0.561 1.00 0.00 H new ATOM 0 HB2 ASP A 536 11.868 6.517 -3.231 1.00 0.00 H new ATOM 0 HB3 ASP A 536 12.497 7.153 -1.724 1.00 0.00 H new ATOM 1596 N VAL A 537 9.853 8.476 -0.451 1.00 0.00 N ATOM 1597 CA VAL A 537 9.436 9.869 -0.343 1.00 0.00 C ATOM 1598 C VAL A 537 10.481 10.700 0.393 1.00 0.00 C ATOM 1599 O VAL A 537 11.019 10.275 1.413 1.00 0.00 O ATOM 1600 CB VAL A 537 8.085 10.000 0.384 1.00 0.00 C ATOM 1601 CG1 VAL A 537 7.699 11.464 0.530 1.00 0.00 C ATOM 1602 CG2 VAL A 537 7.002 9.237 -0.361 1.00 0.00 C ATOM 0 H VAL A 537 10.025 8.018 0.444 1.00 0.00 H new ATOM 0 HA VAL A 537 9.327 10.245 -1.360 1.00 0.00 H new ATOM 0 HB VAL A 537 8.187 9.569 1.380 1.00 0.00 H new ATOM 0 HG11 VAL A 537 6.742 11.538 1.046 1.00 0.00 H new ATOM 0 HG12 VAL A 537 8.463 11.986 1.106 1.00 0.00 H new ATOM 0 HG13 VAL A 537 7.615 11.918 -0.457 1.00 0.00 H new ATOM 0 HG21 VAL A 537 6.054 9.341 0.168 1.00 0.00 H new ATOM 0 HG22 VAL A 537 6.901 9.639 -1.369 1.00 0.00 H new ATOM 0 HG23 VAL A 537 7.273 8.183 -0.417 1.00 0.00 H new ATOM 1612 N SER A 538 10.763 11.886 -0.134 1.00 0.00 N ATOM 1613 CA SER A 538 11.672 12.819 0.520 1.00 0.00 C ATOM 1614 C SER A 538 10.905 13.916 1.247 1.00 0.00 C ATOM 1615 O SER A 538 10.046 14.579 0.664 1.00 0.00 O ATOM 1616 CB SER A 538 12.621 13.424 -0.496 1.00 0.00 C ATOM 1617 OG SER A 538 13.451 14.399 0.074 1.00 0.00 O ATOM 0 H SER A 538 10.374 12.224 -1.014 1.00 0.00 H new ATOM 0 HA SER A 538 12.250 12.266 1.260 1.00 0.00 H new ATOM 0 HB2 SER A 538 13.235 12.636 -0.932 1.00 0.00 H new ATOM 0 HB3 SER A 538 12.046 13.868 -1.309 1.00 0.00 H new ATOM 0 HG SER A 538 14.048 14.763 -0.613 1.00 0.00 H new ATOM 1623 N VAL A 539 11.219 14.103 2.525 1.00 0.00 N ATOM 1624 CA VAL A 539 10.667 15.211 3.295 1.00 0.00 C ATOM 1625 C VAL A 539 11.661 16.360 3.397 1.00 0.00 C ATOM 1626 O VAL A 539 12.806 16.169 3.809 1.00 0.00 O ATOM 1627 CB VAL A 539 10.264 14.767 4.714 1.00 0.00 C ATOM 1628 CG1 VAL A 539 9.739 15.950 5.513 1.00 0.00 C ATOM 1629 CG2 VAL A 539 9.218 13.665 4.650 1.00 0.00 C ATOM 0 H VAL A 539 11.854 13.501 3.049 1.00 0.00 H new ATOM 0 HA VAL A 539 9.778 15.550 2.764 1.00 0.00 H new ATOM 0 HB VAL A 539 11.149 14.376 5.216 1.00 0.00 H new ATOM 0 HG11 VAL A 539 9.459 15.618 6.513 1.00 0.00 H new ATOM 0 HG12 VAL A 539 10.515 16.712 5.588 1.00 0.00 H new ATOM 0 HG13 VAL A 539 8.866 16.369 5.012 1.00 0.00 H new ATOM 0 HG21 VAL A 539 8.945 13.363 5.661 1.00 0.00 H new ATOM 0 HG22 VAL A 539 8.334 14.033 4.130 1.00 0.00 H new ATOM 0 HG23 VAL A 539 9.625 12.808 4.113 1.00 0.00 H new ATOM 1639 N VAL A 540 11.219 17.554 3.020 1.00 0.00 N ATOM 1640 CA VAL A 540 12.103 18.712 2.942 1.00 0.00 C ATOM 1641 C VAL A 540 11.615 19.839 3.844 1.00 0.00 C ATOM 1642 O VAL A 540 10.416 19.974 4.090 1.00 0.00 O ATOM 1643 CB VAL A 540 12.223 19.236 1.499 1.00 0.00 C ATOM 1644 CG1 VAL A 540 12.844 18.178 0.599 1.00 0.00 C ATOM 1645 CG2 VAL A 540 10.860 19.652 0.969 1.00 0.00 C ATOM 0 H VAL A 540 10.251 17.746 2.763 1.00 0.00 H new ATOM 0 HA VAL A 540 13.085 18.381 3.280 1.00 0.00 H new ATOM 0 HB VAL A 540 12.873 20.111 1.502 1.00 0.00 H new ATOM 0 HG11 VAL A 540 12.922 18.565 -0.417 1.00 0.00 H new ATOM 0 HG12 VAL A 540 13.838 17.925 0.968 1.00 0.00 H new ATOM 0 HG13 VAL A 540 12.218 17.286 0.601 1.00 0.00 H new ATOM 0 HG21 VAL A 540 10.963 20.020 -0.052 1.00 0.00 H new ATOM 0 HG22 VAL A 540 10.188 18.794 0.979 1.00 0.00 H new ATOM 0 HG23 VAL A 540 10.450 20.441 1.599 1.00 0.00 H new ATOM 1655 N LEU A 541 12.551 20.646 4.332 1.00 0.00 N ATOM 1656 CA LEU A 541 12.212 21.798 5.158 1.00 0.00 C ATOM 1657 C LEU A 541 11.732 22.965 4.305 1.00 0.00 C ATOM 1658 O LEU A 541 12.233 24.083 4.427 1.00 0.00 O ATOM 1659 CB LEU A 541 13.422 22.218 6.004 1.00 0.00 C ATOM 1660 CG LEU A 541 13.976 21.132 6.935 1.00 0.00 C ATOM 1661 CD1 LEU A 541 15.214 21.644 7.655 1.00 0.00 C ATOM 1662 CD2 LEU A 541 12.902 20.721 7.932 1.00 0.00 C ATOM 0 H LEU A 541 13.550 20.523 4.170 1.00 0.00 H new ATOM 0 HA LEU A 541 11.397 21.510 5.822 1.00 0.00 H new ATOM 0 HB2 LEU A 541 14.219 22.541 5.334 1.00 0.00 H new ATOM 0 HB3 LEU A 541 13.142 23.082 6.606 1.00 0.00 H new ATOM 0 HG LEU A 541 14.261 20.259 6.347 1.00 0.00 H new ATOM 0 HD11 LEU A 541 15.600 20.866 8.314 1.00 0.00 H new ATOM 0 HD12 LEU A 541 15.976 21.911 6.923 1.00 0.00 H new ATOM 0 HD13 LEU A 541 14.954 22.523 8.245 1.00 0.00 H new ATOM 0 HD21 LEU A 541 13.296 19.949 8.593 1.00 0.00 H new ATOM 0 HD22 LEU A 541 12.603 21.587 8.522 1.00 0.00 H new ATOM 0 HD23 LEU A 541 12.037 20.332 7.395 1.00 0.00 H new