USER MOD reduce.3.24.130724 H: found=0, std=0, add=715, rem=0, adj=20 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= -0.595 K(o=-1.1,f=2) USER MOD Set 1.2: A 534 THR OG1 : rot 180:sc= -0.486 USER MOD Single : A 441 THR OG1 : rot 180:sc= -0.018 USER MOD Single : A 445 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 453 ASN : amide:sc= -0.0103 X(o=-0.01,f=-0.41) USER MOD Single : A 454 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 458 TYR OH : rot -156:sc= 0.853 USER MOD Single : A 461 HIS : no HE2:sc= 0.627 K(o=0.63,f=-2!) USER MOD Single : A 463 LYS NZ :NH3+ 177:sc= 0.964 (180deg=0.96) USER MOD Single : A 464 ASN : amide:sc= -3.24! C(o=-3.2!,f=-13!) USER MOD Single : A 472 SER OG : rot 180:sc= 0 USER MOD Single : A 473 THR OG1 : rot 95:sc= 0.0115 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= -0.114 K(o=-0.11,f=-1.4!) USER MOD Single : A 482 THR OG1 : rot 180:sc= 0 USER MOD Single : A 484 TYR OH : rot 43:sc= 0.937 USER MOD Single : A 485 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 486 ASN : amide:sc= -0.0996 K(o=-0.1,f=-0.65) USER MOD Single : A 488 THR OG1 : rot 180:sc= 0 USER MOD Single : A 490 SER OG : rot -43:sc= 0.305 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= -1.03 USER MOD Single : A 504 THR OG1 : rot 180:sc= -1.02 USER MOD Single : A 506 THR OG1 : rot 180:sc= 0 USER MOD Single : A 507 GLN : amide:sc= 0 K(o=0,f=-0.88) USER MOD Single : A 510 MET CE :methyl -165:sc= -0.0461 (180deg=-0.304) USER MOD Single : A 511 TYR OH : rot 17:sc= 0.0608 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 -5.479 -16.628 -6.602 1.00 0.00 N ATOM 56 CA PRO A 438 -5.586 -15.272 -7.126 1.00 0.00 C ATOM 57 C PRO A 438 -4.219 -14.714 -7.494 1.00 0.00 C ATOM 58 O PRO A 438 -3.189 -15.303 -7.168 1.00 0.00 O ATOM 59 CB PRO A 438 -6.245 -14.483 -5.988 1.00 0.00 C ATOM 60 CG PRO A 438 -5.811 -15.189 -4.748 1.00 0.00 C ATOM 61 CD PRO A 438 -5.741 -16.645 -5.121 1.00 0.00 C ATOM 0 HA PRO A 438 -6.167 -15.219 -8.047 1.00 0.00 H new ATOM 0 HB2 PRO A 438 -5.921 -13.442 -5.987 1.00 0.00 H new ATOM 0 HB3 PRO A 438 -7.331 -14.479 -6.084 1.00 0.00 H new ATOM 0 HG2 PRO A 438 -4.842 -14.824 -4.407 1.00 0.00 H new ATOM 0 HG3 PRO A 438 -6.518 -15.025 -3.935 1.00 0.00 H new ATOM 0 HD2 PRO A 438 -4.945 -17.158 -4.581 1.00 0.00 H new ATOM 0 HD3 PRO A 438 -6.671 -17.163 -4.886 1.00 0.00 H new ATOM 69 N ASP A 439 -4.215 -13.572 -8.175 1.00 0.00 N ATOM 70 CA ASP A 439 -2.989 -12.813 -8.389 1.00 0.00 C ATOM 71 C ASP A 439 -3.064 -11.447 -7.718 1.00 0.00 C ATOM 72 O ASP A 439 -3.002 -10.413 -8.382 1.00 0.00 O ATOM 73 CB ASP A 439 -2.714 -12.647 -9.886 1.00 0.00 C ATOM 74 CG ASP A 439 -1.415 -11.921 -10.210 1.00 0.00 C ATOM 75 OD1 ASP A 439 -0.634 -11.716 -9.314 1.00 0.00 O ATOM 76 OD2 ASP A 439 -1.145 -11.720 -11.370 1.00 0.00 O ATOM 0 H ASP A 439 -5.048 -13.152 -8.588 1.00 0.00 H new ATOM 0 HA ASP A 439 -2.169 -13.372 -7.938 1.00 0.00 H new ATOM 0 HB2 ASP A 439 -2.691 -13.633 -10.350 1.00 0.00 H new ATOM 0 HB3 ASP A 439 -3.543 -12.102 -10.337 1.00 0.00 H new ATOM 81 N LEU A 440 -3.199 -11.451 -6.395 1.00 0.00 N ATOM 82 CA LEU A 440 -3.372 -10.217 -5.639 1.00 0.00 C ATOM 83 C LEU A 440 -2.125 -9.344 -5.715 1.00 0.00 C ATOM 84 O LEU A 440 -1.004 -9.839 -5.602 1.00 0.00 O ATOM 85 CB LEU A 440 -3.716 -10.533 -4.178 1.00 0.00 C ATOM 86 CG LEU A 440 -5.063 -11.235 -3.961 1.00 0.00 C ATOM 87 CD1 LEU A 440 -5.201 -11.660 -2.506 1.00 0.00 C ATOM 88 CD2 LEU A 440 -6.193 -10.299 -4.362 1.00 0.00 C ATOM 0 H LEU A 440 -3.192 -12.297 -5.825 1.00 0.00 H new ATOM 0 HA LEU A 440 -4.197 -9.661 -6.084 1.00 0.00 H new ATOM 0 HB2 LEU A 440 -2.927 -11.160 -3.763 1.00 0.00 H new ATOM 0 HB3 LEU A 440 -3.714 -9.602 -3.611 1.00 0.00 H new ATOM 0 HG LEU A 440 -5.113 -12.129 -4.582 1.00 0.00 H new ATOM 0 HD11 LEU A 440 -6.160 -12.157 -2.362 1.00 0.00 H new ATOM 0 HD12 LEU A 440 -4.394 -12.346 -2.249 1.00 0.00 H new ATOM 0 HD13 LEU A 440 -5.148 -10.781 -1.864 1.00 0.00 H new ATOM 0 HD21 LEU A 440 -7.150 -10.797 -4.208 1.00 0.00 H new ATOM 0 HD22 LEU A 440 -6.152 -9.396 -3.752 1.00 0.00 H new ATOM 0 HD23 LEU A 440 -6.088 -10.032 -5.413 1.00 0.00 H new ATOM 100 N THR A 441 -2.328 -8.045 -5.903 1.00 0.00 N ATOM 101 CA THR A 441 -1.221 -7.100 -5.984 1.00 0.00 C ATOM 102 C THR A 441 -1.607 -5.748 -5.399 1.00 0.00 C ATOM 103 O THR A 441 -2.788 -5.406 -5.327 1.00 0.00 O ATOM 104 CB THR A 441 -0.751 -6.905 -7.436 1.00 0.00 C ATOM 105 OG1 THR A 441 0.424 -6.085 -7.455 1.00 0.00 O ATOM 106 CG2 THR A 441 -1.839 -6.240 -8.265 1.00 0.00 C ATOM 0 H THR A 441 -3.251 -7.622 -6.002 1.00 0.00 H new ATOM 0 HA THR A 441 -0.403 -7.524 -5.401 1.00 0.00 H new ATOM 0 HB THR A 441 -0.528 -7.883 -7.863 1.00 0.00 H new ATOM 0 HG1 THR A 441 0.723 -5.963 -8.380 1.00 0.00 H new ATOM 0 HG21 THR A 441 -1.488 -6.110 -9.289 1.00 0.00 H new ATOM 0 HG22 THR A 441 -2.731 -6.866 -8.264 1.00 0.00 H new ATOM 0 HG23 THR A 441 -2.078 -5.266 -7.837 1.00 0.00 H new ATOM 114 N VAL A 442 -0.604 -4.981 -4.983 1.00 0.00 N ATOM 115 CA VAL A 442 -0.835 -3.650 -4.434 1.00 0.00 C ATOM 116 C VAL A 442 0.029 -2.610 -5.132 1.00 0.00 C ATOM 117 O VAL A 442 1.084 -2.931 -5.682 1.00 0.00 O ATOM 118 CB VAL A 442 -0.554 -3.606 -2.921 1.00 0.00 C ATOM 119 CG1 VAL A 442 -1.489 -4.547 -2.176 1.00 0.00 C ATOM 120 CG2 VAL A 442 0.896 -3.966 -2.638 1.00 0.00 C ATOM 0 H VAL A 442 0.377 -5.259 -5.016 1.00 0.00 H new ATOM 0 HA VAL A 442 -1.886 -3.418 -4.605 1.00 0.00 H new ATOM 0 HB VAL A 442 -0.734 -2.590 -2.568 1.00 0.00 H new ATOM 0 HG11 VAL A 442 -1.275 -4.502 -1.108 1.00 0.00 H new ATOM 0 HG12 VAL A 442 -2.522 -4.248 -2.352 1.00 0.00 H new ATOM 0 HG13 VAL A 442 -1.340 -5.566 -2.533 1.00 0.00 H new ATOM 0 HG21 VAL A 442 1.077 -3.930 -1.564 1.00 0.00 H new ATOM 0 HG22 VAL A 442 1.100 -4.971 -3.007 1.00 0.00 H new ATOM 0 HG23 VAL A 442 1.552 -3.255 -3.141 1.00 0.00 H new ATOM 130 N GLU A 443 -0.422 -1.360 -5.108 1.00 0.00 N ATOM 131 CA GLU A 443 0.333 -0.262 -5.701 1.00 0.00 C ATOM 132 C GLU A 443 0.286 0.978 -4.816 1.00 0.00 C ATOM 133 O GLU A 443 -0.769 1.346 -4.303 1.00 0.00 O ATOM 134 CB GLU A 443 -0.205 0.067 -7.096 1.00 0.00 C ATOM 135 CG GLU A 443 -0.018 -1.045 -8.119 1.00 0.00 C ATOM 136 CD GLU A 443 -0.760 -0.745 -9.391 1.00 0.00 C ATOM 137 OE1 GLU A 443 -0.519 0.286 -9.971 1.00 0.00 O ATOM 138 OE2 GLU A 443 -1.489 -1.597 -9.844 1.00 0.00 O ATOM 0 H GLU A 443 -1.307 -1.082 -4.684 1.00 0.00 H new ATOM 0 HA GLU A 443 1.372 -0.580 -5.789 1.00 0.00 H new ATOM 0 HB2 GLU A 443 -1.267 0.297 -7.018 1.00 0.00 H new ATOM 0 HB3 GLU A 443 0.290 0.967 -7.461 1.00 0.00 H new ATOM 0 HG2 GLU A 443 1.043 -1.169 -8.335 1.00 0.00 H new ATOM 0 HG3 GLU A 443 -0.371 -1.988 -7.703 1.00 0.00 H new ATOM 145 N ILE A 444 1.438 1.618 -4.643 1.00 0.00 N ATOM 146 CA ILE A 444 1.513 2.870 -3.901 1.00 0.00 C ATOM 147 C ILE A 444 1.752 4.049 -4.835 1.00 0.00 C ATOM 148 O ILE A 444 2.705 4.053 -5.614 1.00 0.00 O ATOM 149 CB ILE A 444 2.628 2.832 -2.840 1.00 0.00 C ATOM 150 CG1 ILE A 444 2.364 1.717 -1.827 1.00 0.00 C ATOM 151 CG2 ILE A 444 2.740 4.177 -2.139 1.00 0.00 C ATOM 152 CD1 ILE A 444 3.518 1.462 -0.884 1.00 0.00 C ATOM 0 H ILE A 444 2.332 1.289 -5.007 1.00 0.00 H new ATOM 0 HA ILE A 444 0.553 2.997 -3.400 1.00 0.00 H new ATOM 0 HB ILE A 444 3.575 2.625 -3.339 1.00 0.00 H new ATOM 0 HG12 ILE A 444 1.480 1.972 -1.243 1.00 0.00 H new ATOM 0 HG13 ILE A 444 2.137 0.797 -2.365 1.00 0.00 H new ATOM 0 HG21 ILE A 444 3.533 4.133 -1.392 1.00 0.00 H new ATOM 0 HG22 ILE A 444 2.973 4.950 -2.871 1.00 0.00 H new ATOM 0 HG23 ILE A 444 1.794 4.413 -1.651 1.00 0.00 H new ATOM 0 HD11 ILE A 444 3.255 0.658 -0.196 1.00 0.00 H new ATOM 0 HD12 ILE A 444 4.400 1.175 -1.457 1.00 0.00 H new ATOM 0 HD13 ILE A 444 3.732 2.368 -0.318 1.00 0.00 H new ATOM 164 N LYS A 445 0.883 5.050 -4.752 1.00 0.00 N ATOM 165 CA LYS A 445 1.023 6.257 -5.555 1.00 0.00 C ATOM 166 C LYS A 445 0.750 7.506 -4.725 1.00 0.00 C ATOM 167 O LYS A 445 -0.071 7.487 -3.810 1.00 0.00 O ATOM 168 CB LYS A 445 0.084 6.212 -6.762 1.00 0.00 C ATOM 169 CG LYS A 445 0.437 5.148 -7.792 1.00 0.00 C ATOM 170 CD LYS A 445 -0.517 5.188 -8.977 1.00 0.00 C ATOM 171 CE LYS A 445 -0.203 4.088 -9.980 1.00 0.00 C ATOM 172 NZ LYS A 445 -1.146 4.097 -11.130 1.00 0.00 N ATOM 0 H LYS A 445 0.072 5.048 -4.134 1.00 0.00 H new ATOM 0 HA LYS A 445 2.052 6.302 -5.910 1.00 0.00 H new ATOM 0 HB2 LYS A 445 -0.933 6.037 -6.410 1.00 0.00 H new ATOM 0 HB3 LYS A 445 0.090 7.188 -7.248 1.00 0.00 H new ATOM 0 HG2 LYS A 445 1.459 5.300 -8.140 1.00 0.00 H new ATOM 0 HG3 LYS A 445 0.402 4.163 -7.327 1.00 0.00 H new ATOM 0 HD2 LYS A 445 -1.543 5.079 -8.624 1.00 0.00 H new ATOM 0 HD3 LYS A 445 -0.450 6.159 -9.467 1.00 0.00 H new ATOM 0 HE2 LYS A 445 0.816 4.211 -10.346 1.00 0.00 H new ATOM 0 HE3 LYS A 445 -0.248 3.120 -9.482 1.00 0.00 H new ATOM 0 HZ1 LYS A 445 -0.897 3.332 -11.789 1.00 0.00 H new ATOM 0 HZ2 LYS A 445 -2.116 3.954 -10.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 445 -1.085 5.011 -11.622 1.00 0.00 H new ATOM 186 N GLY A 446 1.445 8.591 -5.054 1.00 0.00 N ATOM 187 CA GLY A 446 1.244 9.863 -4.372 1.00 0.00 C ATOM 188 C GLY A 446 2.455 10.774 -4.536 1.00 0.00 C ATOM 189 O GLY A 446 3.317 10.530 -5.380 1.00 0.00 O ATOM 0 H GLY A 446 2.152 8.614 -5.789 1.00 0.00 H new ATOM 0 HA2 GLY A 446 0.358 10.356 -4.771 1.00 0.00 H new ATOM 0 HA3 GLY A 446 1.060 9.685 -3.312 1.00 0.00 H new ATOM 193 N PRO A 447 2.512 11.826 -3.727 1.00 0.00 N ATOM 194 CA PRO A 447 3.592 12.801 -3.813 1.00 0.00 C ATOM 195 C PRO A 447 4.951 12.133 -3.647 1.00 0.00 C ATOM 196 O PRO A 447 5.132 11.277 -2.782 1.00 0.00 O ATOM 197 CB PRO A 447 3.295 13.791 -2.683 1.00 0.00 C ATOM 198 CG PRO A 447 1.822 13.697 -2.486 1.00 0.00 C ATOM 199 CD PRO A 447 1.474 12.255 -2.740 1.00 0.00 C ATOM 0 HA PRO A 447 3.638 13.295 -4.784 1.00 0.00 H new ATOM 0 HB2 PRO A 447 3.835 13.529 -1.773 1.00 0.00 H new ATOM 0 HB3 PRO A 447 3.596 14.803 -2.952 1.00 0.00 H new ATOM 0 HG2 PRO A 447 1.541 13.997 -1.476 1.00 0.00 H new ATOM 0 HG3 PRO A 447 1.291 14.356 -3.173 1.00 0.00 H new ATOM 0 HD2 PRO A 447 1.517 11.663 -1.826 1.00 0.00 H new ATOM 0 HD3 PRO A 447 0.466 12.148 -3.142 1.00 0.00 H new ATOM 207 N ASP A 448 5.905 12.529 -4.484 1.00 0.00 N ATOM 208 CA ASP A 448 7.263 12.003 -4.401 1.00 0.00 C ATOM 209 C ASP A 448 8.102 12.798 -3.407 1.00 0.00 C ATOM 210 O ASP A 448 8.910 12.232 -2.671 1.00 0.00 O ATOM 211 CB ASP A 448 7.929 12.017 -5.779 1.00 0.00 C ATOM 212 CG ASP A 448 7.275 11.097 -6.801 1.00 0.00 C ATOM 213 OD1 ASP A 448 7.170 9.924 -6.535 1.00 0.00 O ATOM 214 OD2 ASP A 448 6.748 11.595 -7.768 1.00 0.00 O ATOM 0 H ASP A 448 5.763 13.213 -5.228 1.00 0.00 H new ATOM 0 HA ASP A 448 7.200 10.974 -4.048 1.00 0.00 H new ATOM 0 HB2 ASP A 448 7.917 13.036 -6.165 1.00 0.00 H new ATOM 0 HB3 ASP A 448 8.975 11.731 -5.667 1.00 0.00 H new ATOM 219 N VAL A 449 7.905 14.112 -3.392 1.00 0.00 N ATOM 220 CA VAL A 449 8.559 14.974 -2.416 1.00 0.00 C ATOM 221 C VAL A 449 7.542 15.803 -1.644 1.00 0.00 C ATOM 222 O VAL A 449 6.631 16.388 -2.228 1.00 0.00 O ATOM 223 CB VAL A 449 9.576 15.919 -3.087 1.00 0.00 C ATOM 224 CG1 VAL A 449 10.220 16.827 -2.051 1.00 0.00 C ATOM 225 CG2 VAL A 449 10.636 15.120 -3.828 1.00 0.00 C ATOM 0 H VAL A 449 7.296 14.603 -4.046 1.00 0.00 H new ATOM 0 HA VAL A 449 9.088 14.319 -1.724 1.00 0.00 H new ATOM 0 HB VAL A 449 9.047 16.541 -3.809 1.00 0.00 H new ATOM 0 HG11 VAL A 449 10.935 17.488 -2.541 1.00 0.00 H new ATOM 0 HG12 VAL A 449 9.450 17.424 -1.562 1.00 0.00 H new ATOM 0 HG13 VAL A 449 10.737 16.221 -1.307 1.00 0.00 H new ATOM 0 HG21 VAL A 449 11.346 15.803 -4.296 1.00 0.00 H new ATOM 0 HG22 VAL A 449 11.163 14.475 -3.125 1.00 0.00 H new ATOM 0 HG23 VAL A 449 10.161 14.509 -4.595 1.00 0.00 H new ATOM 235 N VAL A 450 7.702 15.851 -0.326 1.00 0.00 N ATOM 236 CA VAL A 450 6.794 16.605 0.531 1.00 0.00 C ATOM 237 C VAL A 450 7.561 17.508 1.486 1.00 0.00 C ATOM 238 O VAL A 450 8.703 17.219 1.848 1.00 0.00 O ATOM 239 CB VAL A 450 5.879 15.670 1.344 1.00 0.00 C ATOM 240 CG1 VAL A 450 5.049 14.796 0.416 1.00 0.00 C ATOM 241 CG2 VAL A 450 6.702 14.809 2.289 1.00 0.00 C ATOM 0 H VAL A 450 8.454 15.376 0.173 1.00 0.00 H new ATOM 0 HA VAL A 450 6.178 17.219 -0.126 1.00 0.00 H new ATOM 0 HB VAL A 450 5.201 16.284 1.937 1.00 0.00 H new ATOM 0 HG11 VAL A 450 4.409 14.142 1.008 1.00 0.00 H new ATOM 0 HG12 VAL A 450 4.431 15.427 -0.223 1.00 0.00 H new ATOM 0 HG13 VAL A 450 5.711 14.191 -0.203 1.00 0.00 H new ATOM 0 HG21 VAL A 450 6.039 14.155 2.855 1.00 0.00 H new ATOM 0 HG22 VAL A 450 7.403 14.205 1.713 1.00 0.00 H new ATOM 0 HG23 VAL A 450 7.254 15.449 2.977 1.00 0.00 H new ATOM 251 N GLY A 451 6.929 18.603 1.894 1.00 0.00 N ATOM 252 CA GLY A 451 7.551 19.551 2.809 1.00 0.00 C ATOM 253 C GLY A 451 7.415 19.092 4.255 1.00 0.00 C ATOM 254 O GLY A 451 6.563 18.263 4.576 1.00 0.00 O ATOM 0 H GLY A 451 5.984 18.856 1.604 1.00 0.00 H new ATOM 0 HA2 GLY A 451 8.606 19.664 2.558 1.00 0.00 H new ATOM 0 HA3 GLY A 451 7.089 20.531 2.691 1.00 0.00 H new ATOM 258 N VAL A 452 8.262 19.633 5.125 1.00 0.00 N ATOM 259 CA VAL A 452 8.239 19.277 6.539 1.00 0.00 C ATOM 260 C VAL A 452 7.078 19.953 7.257 1.00 0.00 C ATOM 261 O VAL A 452 6.781 21.122 7.012 1.00 0.00 O ATOM 262 CB VAL A 452 9.557 19.659 7.240 1.00 0.00 C ATOM 263 CG1 VAL A 452 9.607 21.158 7.499 1.00 0.00 C ATOM 264 CG2 VAL A 452 9.712 18.888 8.541 1.00 0.00 C ATOM 0 H VAL A 452 8.973 20.320 4.875 1.00 0.00 H new ATOM 0 HA VAL A 452 8.113 18.195 6.589 1.00 0.00 H new ATOM 0 HB VAL A 452 10.386 19.395 6.583 1.00 0.00 H new ATOM 0 HG11 VAL A 452 10.544 21.411 7.995 1.00 0.00 H new ATOM 0 HG12 VAL A 452 9.542 21.693 6.552 1.00 0.00 H new ATOM 0 HG13 VAL A 452 8.771 21.445 8.136 1.00 0.00 H new ATOM 0 HG21 VAL A 452 10.648 19.171 9.022 1.00 0.00 H new ATOM 0 HG22 VAL A 452 8.879 19.121 9.204 1.00 0.00 H new ATOM 0 HG23 VAL A 452 9.720 17.818 8.331 1.00 0.00 H new ATOM 274 N ASN A 453 6.428 19.211 8.146 1.00 0.00 N ATOM 275 CA ASN A 453 5.271 19.723 8.871 1.00 0.00 C ATOM 276 C ASN A 453 4.129 20.062 7.921 1.00 0.00 C ATOM 277 O ASN A 453 3.303 20.927 8.211 1.00 0.00 O ATOM 278 CB ASN A 453 5.634 20.937 9.709 1.00 0.00 C ATOM 279 CG ASN A 453 6.497 20.616 10.897 1.00 0.00 C ATOM 280 OD1 ASN A 453 6.125 19.815 11.762 1.00 0.00 O ATOM 281 ND2 ASN A 453 7.611 21.297 10.987 1.00 0.00 N ATOM 0 H ASN A 453 6.683 18.252 8.382 1.00 0.00 H new ATOM 0 HA ASN A 453 4.937 18.932 9.542 1.00 0.00 H new ATOM 0 HB2 ASN A 453 6.153 21.660 9.079 1.00 0.00 H new ATOM 0 HB3 ASN A 453 4.718 21.415 10.055 1.00 0.00 H new ATOM 0 HD21 ASN A 453 8.217 21.179 11.799 1.00 0.00 H new ATOM 0 HD22 ASN A 453 7.873 21.946 10.245 1.00 0.00 H new ATOM 288 N LYS A 454 4.090 19.376 6.785 1.00 0.00 N ATOM 289 CA LYS A 454 3.041 19.592 5.795 1.00 0.00 C ATOM 290 C LYS A 454 2.309 18.294 5.477 1.00 0.00 C ATOM 291 O LYS A 454 2.918 17.226 5.413 1.00 0.00 O ATOM 292 CB LYS A 454 3.625 20.193 4.517 1.00 0.00 C ATOM 293 CG LYS A 454 4.102 21.632 4.660 1.00 0.00 C ATOM 294 CD LYS A 454 2.947 22.568 4.981 1.00 0.00 C ATOM 295 CE LYS A 454 1.837 22.457 3.945 1.00 0.00 C ATOM 296 NZ LYS A 454 0.699 23.364 4.250 1.00 0.00 N ATOM 0 H LYS A 454 4.773 18.664 6.526 1.00 0.00 H new ATOM 0 HA LYS A 454 2.323 20.294 6.219 1.00 0.00 H new ATOM 0 HB2 LYS A 454 4.462 19.576 4.189 1.00 0.00 H new ATOM 0 HB3 LYS A 454 2.870 20.149 3.732 1.00 0.00 H new ATOM 0 HG2 LYS A 454 4.852 21.692 5.449 1.00 0.00 H new ATOM 0 HG3 LYS A 454 4.585 21.951 3.736 1.00 0.00 H new ATOM 0 HD2 LYS A 454 2.550 22.333 5.968 1.00 0.00 H new ATOM 0 HD3 LYS A 454 3.309 23.595 5.020 1.00 0.00 H new ATOM 0 HE2 LYS A 454 2.236 22.695 2.959 1.00 0.00 H new ATOM 0 HE3 LYS A 454 1.480 21.428 3.905 1.00 0.00 H new ATOM 0 HZ1 LYS A 454 -0.035 23.258 3.521 1.00 0.00 H new ATOM 0 HZ2 LYS A 454 0.301 23.121 5.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 454 1.034 24.349 4.263 1.00 0.00 H new ATOM 310 N LEU A 455 0.999 18.393 5.277 1.00 0.00 N ATOM 311 CA LEU A 455 0.163 17.216 5.079 1.00 0.00 C ATOM 312 C LEU A 455 0.150 16.788 3.617 1.00 0.00 C ATOM 313 O LEU A 455 -0.127 17.592 2.727 1.00 0.00 O ATOM 314 CB LEU A 455 -1.264 17.491 5.566 1.00 0.00 C ATOM 315 CG LEU A 455 -2.204 16.279 5.553 1.00 0.00 C ATOM 316 CD1 LEU A 455 -1.744 15.249 6.578 1.00 0.00 C ATOM 317 CD2 LEU A 455 -3.625 16.734 5.847 1.00 0.00 C ATOM 0 H LEU A 455 0.493 19.278 5.248 1.00 0.00 H new ATOM 0 HA LEU A 455 0.586 16.399 5.664 1.00 0.00 H new ATOM 0 HB2 LEU A 455 -1.215 17.881 6.582 1.00 0.00 H new ATOM 0 HB3 LEU A 455 -1.698 18.274 4.944 1.00 0.00 H new ATOM 0 HG LEU A 455 -2.182 15.813 4.568 1.00 0.00 H new ATOM 0 HD11 LEU A 455 -2.418 14.393 6.561 1.00 0.00 H new ATOM 0 HD12 LEU A 455 -0.733 14.920 6.335 1.00 0.00 H new ATOM 0 HD13 LEU A 455 -1.751 15.696 7.572 1.00 0.00 H new ATOM 0 HD21 LEU A 455 -4.292 15.872 5.838 1.00 0.00 H new ATOM 0 HD22 LEU A 455 -3.659 17.209 6.828 1.00 0.00 H new ATOM 0 HD23 LEU A 455 -3.943 17.448 5.087 1.00 0.00 H new ATOM 329 N ALA A 456 0.453 15.516 3.374 1.00 0.00 N ATOM 330 CA ALA A 456 0.394 14.959 2.030 1.00 0.00 C ATOM 331 C ALA A 456 -0.528 13.749 1.975 1.00 0.00 C ATOM 332 O ALA A 456 -0.596 12.964 2.920 1.00 0.00 O ATOM 333 CB ALA A 456 1.790 14.587 1.549 1.00 0.00 C ATOM 0 H ALA A 456 0.742 14.852 4.093 1.00 0.00 H new ATOM 0 HA ALA A 456 -0.014 15.722 1.367 1.00 0.00 H new ATOM 0 HB1 ALA A 456 1.730 14.172 0.543 1.00 0.00 H new ATOM 0 HB2 ALA A 456 2.420 15.476 1.537 1.00 0.00 H new ATOM 0 HB3 ALA A 456 2.221 13.846 2.222 1.00 0.00 H new ATOM 339 N GLU A 457 -1.238 13.601 0.860 1.00 0.00 N ATOM 340 CA GLU A 457 -2.241 12.553 0.725 1.00 0.00 C ATOM 341 C GLU A 457 -1.789 11.483 -0.261 1.00 0.00 C ATOM 342 O GLU A 457 -1.284 11.794 -1.339 1.00 0.00 O ATOM 343 CB GLU A 457 -3.580 13.147 0.280 1.00 0.00 C ATOM 344 CG GLU A 457 -4.774 12.699 1.110 1.00 0.00 C ATOM 345 CD GLU A 457 -6.047 13.331 0.621 1.00 0.00 C ATOM 346 OE1 GLU A 457 -6.099 14.535 0.541 1.00 0.00 O ATOM 347 OE2 GLU A 457 -6.929 12.608 0.221 1.00 0.00 O ATOM 0 H GLU A 457 -1.136 14.195 0.037 1.00 0.00 H new ATOM 0 HA GLU A 457 -2.369 12.085 1.701 1.00 0.00 H new ATOM 0 HB2 GLU A 457 -3.513 14.234 0.320 1.00 0.00 H new ATOM 0 HB3 GLU A 457 -3.755 12.877 -0.761 1.00 0.00 H new ATOM 0 HG2 GLU A 457 -4.864 11.614 1.065 1.00 0.00 H new ATOM 0 HG3 GLU A 457 -4.613 12.963 2.155 1.00 0.00 H new ATOM 354 N TYR A 458 -1.975 10.223 0.116 1.00 0.00 N ATOM 355 CA TYR A 458 -1.477 9.105 -0.677 1.00 0.00 C ATOM 356 C TYR A 458 -2.577 8.082 -0.935 1.00 0.00 C ATOM 357 O TYR A 458 -3.561 8.014 -0.198 1.00 0.00 O ATOM 358 CB TYR A 458 -0.294 8.437 0.021 1.00 0.00 C ATOM 359 CG TYR A 458 0.972 9.264 0.007 1.00 0.00 C ATOM 360 CD1 TYR A 458 1.176 10.273 0.938 1.00 0.00 C ATOM 361 CD2 TYR A 458 1.962 9.035 -0.937 1.00 0.00 C ATOM 362 CE1 TYR A 458 2.330 11.032 0.929 1.00 0.00 C ATOM 363 CE2 TYR A 458 3.121 9.787 -0.955 1.00 0.00 C ATOM 364 CZ TYR A 458 3.300 10.785 -0.019 1.00 0.00 C ATOM 365 OH TYR A 458 4.454 11.538 -0.032 1.00 0.00 O ATOM 0 H TYR A 458 -2.467 9.950 0.967 1.00 0.00 H new ATOM 0 HA TYR A 458 -1.144 9.500 -1.637 1.00 0.00 H new ATOM 0 HB2 TYR A 458 -0.567 8.226 1.055 1.00 0.00 H new ATOM 0 HB3 TYR A 458 -0.096 7.479 -0.459 1.00 0.00 H new ATOM 0 HD1 TYR A 458 0.419 10.468 1.683 1.00 0.00 H new ATOM 0 HD2 TYR A 458 1.825 8.255 -1.671 1.00 0.00 H new ATOM 0 HE1 TYR A 458 2.472 11.814 1.660 1.00 0.00 H new ATOM 0 HE2 TYR A 458 3.882 9.595 -1.697 1.00 0.00 H new ATOM 0 HH TYR A 458 4.844 11.524 -0.931 1.00 0.00 H new ATOM 375 N GLU A 459 -2.403 7.287 -1.986 1.00 0.00 N ATOM 376 CA GLU A 459 -3.403 6.298 -2.372 1.00 0.00 C ATOM 377 C GLU A 459 -2.770 4.930 -2.590 1.00 0.00 C ATOM 378 O GLU A 459 -1.686 4.822 -3.162 1.00 0.00 O ATOM 379 CB GLU A 459 -4.138 6.745 -3.638 1.00 0.00 C ATOM 380 CG GLU A 459 -4.751 8.136 -3.551 1.00 0.00 C ATOM 381 CD GLU A 459 -5.495 8.484 -4.810 1.00 0.00 C ATOM 382 OE1 GLU A 459 -5.507 7.681 -5.713 1.00 0.00 O ATOM 383 OE2 GLU A 459 -6.144 9.504 -4.830 1.00 0.00 O ATOM 0 H GLU A 459 -1.578 7.309 -2.586 1.00 0.00 H new ATOM 0 HA GLU A 459 -4.121 6.215 -1.556 1.00 0.00 H new ATOM 0 HB2 GLU A 459 -3.441 6.720 -4.476 1.00 0.00 H new ATOM 0 HB3 GLU A 459 -4.927 6.026 -3.858 1.00 0.00 H new ATOM 0 HG2 GLU A 459 -5.430 8.184 -2.700 1.00 0.00 H new ATOM 0 HG3 GLU A 459 -3.966 8.871 -3.375 1.00 0.00 H new ATOM 390 N VAL A 460 -3.454 3.887 -2.130 1.00 0.00 N ATOM 391 CA VAL A 460 -3.040 2.517 -2.408 1.00 0.00 C ATOM 392 C VAL A 460 -4.035 1.818 -3.325 1.00 0.00 C ATOM 393 O VAL A 460 -5.213 1.687 -2.993 1.00 0.00 O ATOM 394 CB VAL A 460 -2.886 1.700 -1.113 1.00 0.00 C ATOM 395 CG1 VAL A 460 -2.413 0.288 -1.428 1.00 0.00 C ATOM 396 CG2 VAL A 460 -1.919 2.384 -0.161 1.00 0.00 C ATOM 0 H VAL A 460 -4.298 3.965 -1.563 1.00 0.00 H new ATOM 0 HA VAL A 460 -2.072 2.575 -2.905 1.00 0.00 H new ATOM 0 HB VAL A 460 -3.860 1.639 -0.628 1.00 0.00 H new ATOM 0 HG11 VAL A 460 -2.309 -0.276 -0.501 1.00 0.00 H new ATOM 0 HG12 VAL A 460 -3.141 -0.204 -2.073 1.00 0.00 H new ATOM 0 HG13 VAL A 460 -1.450 0.332 -1.936 1.00 0.00 H new ATOM 0 HG21 VAL A 460 -1.823 1.791 0.749 1.00 0.00 H new ATOM 0 HG22 VAL A 460 -0.943 2.477 -0.638 1.00 0.00 H new ATOM 0 HG23 VAL A 460 -2.296 3.376 0.090 1.00 0.00 H new ATOM 406 N HIS A 461 -3.554 1.370 -4.479 1.00 0.00 N ATOM 407 CA HIS A 461 -4.391 0.647 -5.430 1.00 0.00 C ATOM 408 C HIS A 461 -4.206 -0.858 -5.291 1.00 0.00 C ATOM 409 O HIS A 461 -3.108 -1.378 -5.494 1.00 0.00 O ATOM 410 CB HIS A 461 -4.083 1.083 -6.864 1.00 0.00 C ATOM 411 CG HIS A 461 -4.481 2.494 -7.164 1.00 0.00 C ATOM 412 ND1 HIS A 461 -5.708 2.825 -7.697 1.00 0.00 N ATOM 413 CD2 HIS A 461 -3.814 3.662 -7.002 1.00 0.00 C ATOM 414 CE1 HIS A 461 -5.780 4.135 -7.852 1.00 0.00 C ATOM 415 NE2 HIS A 461 -4.644 4.665 -7.438 1.00 0.00 N ATOM 0 H HIS A 461 -2.587 1.495 -4.779 1.00 0.00 H new ATOM 0 HA HIS A 461 -5.430 0.888 -5.205 1.00 0.00 H new ATOM 0 HB2 HIS A 461 -3.014 0.970 -7.047 1.00 0.00 H new ATOM 0 HB3 HIS A 461 -4.597 0.415 -7.555 1.00 0.00 H new ATOM 0 HD1 HIS A 461 -6.446 2.162 -7.935 1.00 0.00 H new ATOM 0 HD2 HIS A 461 -2.817 3.782 -6.605 1.00 0.00 H new ATOM 0 HE1 HIS A 461 -6.624 4.679 -8.249 1.00 0.00 H new ATOM 423 N VAL A 462 -5.285 -1.554 -4.948 1.00 0.00 N ATOM 424 CA VAL A 462 -5.229 -2.995 -4.726 1.00 0.00 C ATOM 425 C VAL A 462 -6.118 -3.738 -5.715 1.00 0.00 C ATOM 426 O VAL A 462 -7.277 -3.376 -5.915 1.00 0.00 O ATOM 427 CB VAL A 462 -5.653 -3.362 -3.293 1.00 0.00 C ATOM 428 CG1 VAL A 462 -4.854 -2.557 -2.278 1.00 0.00 C ATOM 429 CG2 VAL A 462 -7.144 -3.129 -3.100 1.00 0.00 C ATOM 0 H VAL A 462 -6.210 -1.143 -4.818 1.00 0.00 H new ATOM 0 HA VAL A 462 -4.192 -3.297 -4.876 1.00 0.00 H new ATOM 0 HB VAL A 462 -5.447 -4.421 -3.135 1.00 0.00 H new ATOM 0 HG11 VAL A 462 -5.167 -2.829 -1.270 1.00 0.00 H new ATOM 0 HG12 VAL A 462 -3.792 -2.771 -2.399 1.00 0.00 H new ATOM 0 HG13 VAL A 462 -5.030 -1.493 -2.438 1.00 0.00 H new ATOM 0 HG21 VAL A 462 -7.425 -3.394 -2.081 1.00 0.00 H new ATOM 0 HG22 VAL A 462 -7.374 -2.079 -3.278 1.00 0.00 H new ATOM 0 HG23 VAL A 462 -7.703 -3.747 -3.803 1.00 0.00 H new ATOM 439 N LYS A 463 -5.568 -4.777 -6.333 1.00 0.00 N ATOM 440 CA LYS A 463 -6.276 -5.516 -7.371 1.00 0.00 C ATOM 441 C LYS A 463 -6.298 -7.008 -7.068 1.00 0.00 C ATOM 442 O LYS A 463 -5.432 -7.520 -6.358 1.00 0.00 O ATOM 443 CB LYS A 463 -5.640 -5.265 -8.738 1.00 0.00 C ATOM 444 CG LYS A 463 -5.690 -3.815 -9.200 1.00 0.00 C ATOM 445 CD LYS A 463 -4.908 -3.616 -10.490 1.00 0.00 C ATOM 446 CE LYS A 463 -5.057 -2.197 -11.016 1.00 0.00 C ATOM 447 NZ LYS A 463 -4.328 -1.211 -10.175 1.00 0.00 N ATOM 0 H LYS A 463 -4.631 -5.127 -6.132 1.00 0.00 H new ATOM 0 HA LYS A 463 -7.305 -5.158 -7.390 1.00 0.00 H new ATOM 0 HB2 LYS A 463 -4.599 -5.587 -8.705 1.00 0.00 H new ATOM 0 HB3 LYS A 463 -6.143 -5.887 -9.479 1.00 0.00 H new ATOM 0 HG2 LYS A 463 -6.727 -3.515 -9.352 1.00 0.00 H new ATOM 0 HG3 LYS A 463 -5.282 -3.169 -8.422 1.00 0.00 H new ATOM 0 HD2 LYS A 463 -3.854 -3.832 -10.315 1.00 0.00 H new ATOM 0 HD3 LYS A 463 -5.258 -4.323 -11.242 1.00 0.00 H new ATOM 0 HE2 LYS A 463 -4.682 -2.148 -12.038 1.00 0.00 H new ATOM 0 HE3 LYS A 463 -6.114 -1.932 -11.051 1.00 0.00 H new ATOM 0 HZ1 LYS A 463 -4.414 -0.264 -10.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 463 -4.736 -1.202 -9.218 1.00 0.00 H new ATOM 0 HZ3 LYS A 463 -3.324 -1.476 -10.121 1.00 0.00 H new ATOM 461 N ASN A 464 -7.292 -7.703 -7.610 1.00 0.00 N ATOM 462 CA ASN A 464 -7.191 -9.140 -7.830 1.00 0.00 C ATOM 463 C ASN A 464 -7.268 -9.478 -9.313 1.00 0.00 C ATOM 464 O ASN A 464 -8.158 -9.005 -10.021 1.00 0.00 O ATOM 465 CB ASN A 464 -8.261 -9.895 -7.063 1.00 0.00 C ATOM 466 CG ASN A 464 -8.062 -11.385 -7.054 1.00 0.00 C ATOM 467 OD1 ASN A 464 -7.382 -11.947 -7.920 1.00 0.00 O ATOM 468 ND2 ASN A 464 -8.718 -12.038 -6.127 1.00 0.00 N ATOM 0 H ASN A 464 -8.178 -7.293 -7.905 1.00 0.00 H new ATOM 0 HA ASN A 464 -6.217 -9.455 -7.455 1.00 0.00 H new ATOM 0 HB2 ASN A 464 -8.281 -9.534 -6.035 1.00 0.00 H new ATOM 0 HB3 ASN A 464 -9.234 -9.670 -7.499 1.00 0.00 H new ATOM 0 HD21 ASN A 464 -8.681 -13.057 -6.098 1.00 0.00 H new ATOM 0 HD22 ASN A 464 -9.265 -11.528 -5.434 1.00 0.00 H new ATOM 475 N LEU A 465 -6.333 -10.300 -9.778 1.00 0.00 N ATOM 476 CA LEU A 465 -6.120 -10.487 -11.208 1.00 0.00 C ATOM 477 C LEU A 465 -6.153 -11.965 -11.581 1.00 0.00 C ATOM 478 O LEU A 465 -5.910 -12.329 -12.731 1.00 0.00 O ATOM 479 CB LEU A 465 -4.786 -9.860 -11.631 1.00 0.00 C ATOM 480 CG LEU A 465 -4.614 -8.381 -11.264 1.00 0.00 C ATOM 481 CD1 LEU A 465 -3.185 -7.936 -11.546 1.00 0.00 C ATOM 482 CD2 LEU A 465 -5.607 -7.542 -12.054 1.00 0.00 C ATOM 0 H LEU A 465 -5.710 -10.848 -9.184 1.00 0.00 H new ATOM 0 HA LEU A 465 -6.930 -9.988 -11.739 1.00 0.00 H new ATOM 0 HB2 LEU A 465 -3.975 -10.428 -11.175 1.00 0.00 H new ATOM 0 HB3 LEU A 465 -4.680 -9.965 -12.711 1.00 0.00 H new ATOM 0 HG LEU A 465 -4.809 -8.245 -10.200 1.00 0.00 H new ATOM 0 HD11 LEU A 465 -3.073 -6.884 -11.282 1.00 0.00 H new ATOM 0 HD12 LEU A 465 -2.494 -8.535 -10.953 1.00 0.00 H new ATOM 0 HD13 LEU A 465 -2.964 -8.070 -12.605 1.00 0.00 H new ATOM 0 HD21 LEU A 465 -5.484 -6.491 -11.793 1.00 0.00 H new ATOM 0 HD22 LEU A 465 -5.427 -7.674 -13.121 1.00 0.00 H new ATOM 0 HD23 LEU A 465 -6.622 -7.859 -11.815 1.00 0.00 H new ATOM 494 N GLY A 466 -6.458 -12.810 -10.603 1.00 0.00 N ATOM 495 CA GLY A 466 -6.432 -14.254 -10.801 1.00 0.00 C ATOM 496 C GLY A 466 -7.796 -14.775 -11.232 1.00 0.00 C ATOM 497 O GLY A 466 -7.993 -15.981 -11.381 1.00 0.00 O ATOM 0 H GLY A 466 -6.727 -12.519 -9.663 1.00 0.00 H new ATOM 0 HA2 GLY A 466 -5.688 -14.507 -11.556 1.00 0.00 H new ATOM 0 HA3 GLY A 466 -6.128 -14.745 -9.877 1.00 0.00 H new ATOM 501 N GLY A 467 -8.739 -13.859 -11.430 1.00 0.00 N ATOM 502 CA GLY A 467 -10.082 -14.224 -11.864 1.00 0.00 C ATOM 503 C GLY A 467 -10.840 -14.950 -10.762 1.00 0.00 C ATOM 504 O GLY A 467 -11.816 -15.653 -11.025 1.00 0.00 O ATOM 0 H GLY A 467 -8.597 -12.858 -11.296 1.00 0.00 H new ATOM 0 HA2 GLY A 467 -10.629 -13.327 -12.155 1.00 0.00 H new ATOM 0 HA3 GLY A 467 -10.021 -14.860 -12.747 1.00 0.00 H new ATOM 508 N ILE A 468 -10.386 -14.776 -9.525 1.00 0.00 N ATOM 509 CA ILE A 468 -11.082 -15.327 -8.369 1.00 0.00 C ATOM 510 C ILE A 468 -11.253 -14.279 -7.277 1.00 0.00 C ATOM 511 O ILE A 468 -10.380 -13.433 -7.073 1.00 0.00 O ATOM 512 CB ILE A 468 -10.339 -16.543 -7.786 1.00 0.00 C ATOM 513 CG1 ILE A 468 -11.033 -17.034 -6.513 1.00 0.00 C ATOM 514 CG2 ILE A 468 -8.886 -16.193 -7.506 1.00 0.00 C ATOM 515 CD1 ILE A 468 -10.543 -18.381 -6.032 1.00 0.00 C ATOM 0 H ILE A 468 -9.538 -14.257 -9.298 1.00 0.00 H new ATOM 0 HA ILE A 468 -12.063 -15.647 -8.719 1.00 0.00 H new ATOM 0 HB ILE A 468 -10.362 -17.349 -8.520 1.00 0.00 H new ATOM 0 HG12 ILE A 468 -10.883 -16.299 -5.722 1.00 0.00 H new ATOM 0 HG13 ILE A 468 -12.106 -17.092 -6.695 1.00 0.00 H new ATOM 0 HG21 ILE A 468 -8.375 -17.063 -7.094 1.00 0.00 H new ATOM 0 HG22 ILE A 468 -8.399 -15.891 -8.433 1.00 0.00 H new ATOM 0 HG23 ILE A 468 -8.841 -15.373 -6.789 1.00 0.00 H new ATOM 0 HD11 ILE A 468 -11.081 -18.662 -5.127 1.00 0.00 H new ATOM 0 HD12 ILE A 468 -10.718 -19.129 -6.805 1.00 0.00 H new ATOM 0 HD13 ILE A 468 -9.476 -18.324 -5.817 1.00 0.00 H new ATOM 527 N GLY A 469 -12.381 -14.336 -6.577 1.00 0.00 N ATOM 528 CA GLY A 469 -12.669 -13.389 -5.508 1.00 0.00 C ATOM 529 C GLY A 469 -12.063 -13.849 -4.187 1.00 0.00 C ATOM 530 O GLY A 469 -12.195 -15.010 -3.803 1.00 0.00 O ATOM 0 H GLY A 469 -13.112 -15.030 -6.732 1.00 0.00 H new ATOM 0 HA2 GLY A 469 -12.273 -12.408 -5.771 1.00 0.00 H new ATOM 0 HA3 GLY A 469 -13.748 -13.278 -5.397 1.00 0.00 H new ATOM 534 N VAL A 470 -11.397 -12.929 -3.497 1.00 0.00 N ATOM 535 CA VAL A 470 -10.937 -13.178 -2.135 1.00 0.00 C ATOM 536 C VAL A 470 -11.552 -12.187 -1.156 1.00 0.00 C ATOM 537 O VAL A 470 -11.335 -10.979 -1.262 1.00 0.00 O ATOM 538 CB VAL A 470 -9.402 -13.100 -2.035 1.00 0.00 C ATOM 539 CG1 VAL A 470 -8.949 -13.337 -0.602 1.00 0.00 C ATOM 540 CG2 VAL A 470 -8.754 -14.109 -2.969 1.00 0.00 C ATOM 0 H VAL A 470 -11.164 -12.004 -3.858 1.00 0.00 H new ATOM 0 HA VAL A 470 -11.258 -14.186 -1.874 1.00 0.00 H new ATOM 0 HB VAL A 470 -9.089 -12.100 -2.336 1.00 0.00 H new ATOM 0 HG11 VAL A 470 -7.862 -13.278 -0.550 1.00 0.00 H new ATOM 0 HG12 VAL A 470 -9.385 -12.578 0.048 1.00 0.00 H new ATOM 0 HG13 VAL A 470 -9.275 -14.325 -0.276 1.00 0.00 H new ATOM 0 HG21 VAL A 470 -7.670 -14.039 -2.884 1.00 0.00 H new ATOM 0 HG22 VAL A 470 -9.075 -15.115 -2.697 1.00 0.00 H new ATOM 0 HG23 VAL A 470 -9.052 -13.898 -3.996 1.00 0.00 H new ATOM 550 N PRO A 471 -12.319 -12.703 -0.204 1.00 0.00 N ATOM 551 CA PRO A 471 -12.973 -11.862 0.793 1.00 0.00 C ATOM 552 C PRO A 471 -12.011 -11.490 1.914 1.00 0.00 C ATOM 553 O PRO A 471 -12.243 -10.530 2.650 1.00 0.00 O ATOM 554 CB PRO A 471 -14.142 -12.718 1.295 1.00 0.00 C ATOM 555 CG PRO A 471 -13.646 -14.120 1.193 1.00 0.00 C ATOM 556 CD PRO A 471 -12.756 -14.141 -0.020 1.00 0.00 C ATOM 0 HA PRO A 471 -13.313 -10.909 0.386 1.00 0.00 H new ATOM 0 HB2 PRO A 471 -14.408 -12.464 2.321 1.00 0.00 H new ATOM 0 HB3 PRO A 471 -15.034 -12.567 0.688 1.00 0.00 H new ATOM 0 HG2 PRO A 471 -13.096 -14.408 2.089 1.00 0.00 H new ATOM 0 HG3 PRO A 471 -14.473 -14.823 1.086 1.00 0.00 H new ATOM 0 HD2 PRO A 471 -11.900 -14.799 0.129 1.00 0.00 H new ATOM 0 HD3 PRO A 471 -13.290 -14.507 -0.897 1.00 0.00 H new ATOM 564 N SER A 472 -10.932 -12.254 2.039 1.00 0.00 N ATOM 565 CA SER A 472 -10.125 -12.246 3.254 1.00 0.00 C ATOM 566 C SER A 472 -8.975 -11.254 3.144 1.00 0.00 C ATOM 567 O SER A 472 -8.076 -11.235 3.985 1.00 0.00 O ATOM 568 CB SER A 472 -9.597 -13.638 3.538 1.00 0.00 C ATOM 569 OG SER A 472 -8.671 -14.057 2.574 1.00 0.00 O ATOM 0 H SER A 472 -10.595 -12.887 1.314 1.00 0.00 H new ATOM 0 HA SER A 472 -10.760 -11.932 4.082 1.00 0.00 H new ATOM 0 HB2 SER A 472 -9.128 -13.654 4.522 1.00 0.00 H new ATOM 0 HB3 SER A 472 -10.429 -14.341 3.571 1.00 0.00 H new ATOM 0 HG SER A 472 -8.354 -14.958 2.795 1.00 0.00 H new ATOM 575 N THR A 473 -9.007 -10.432 2.101 1.00 0.00 N ATOM 576 CA THR A 473 -7.816 -9.725 1.645 1.00 0.00 C ATOM 577 C THR A 473 -7.517 -8.521 2.527 1.00 0.00 C ATOM 578 O THR A 473 -8.262 -7.541 2.529 1.00 0.00 O ATOM 579 CB THR A 473 -7.962 -9.256 0.186 1.00 0.00 C ATOM 580 OG1 THR A 473 -8.176 -10.390 -0.663 1.00 0.00 O ATOM 581 CG2 THR A 473 -6.709 -8.520 -0.265 1.00 0.00 C ATOM 0 H THR A 473 -9.846 -10.239 1.555 1.00 0.00 H new ATOM 0 HA THR A 473 -6.989 -10.432 1.709 1.00 0.00 H new ATOM 0 HB THR A 473 -8.813 -8.578 0.121 1.00 0.00 H new ATOM 0 HG1 THR A 473 -9.138 -10.516 -0.804 1.00 0.00 H new ATOM 0 HG21 THR A 473 -6.830 -8.196 -1.299 1.00 0.00 H new ATOM 0 HG22 THR A 473 -6.549 -7.650 0.372 1.00 0.00 H new ATOM 0 HG23 THR A 473 -5.849 -9.186 -0.192 1.00 0.00 H new ATOM 589 N LYS A 474 -6.422 -8.599 3.277 1.00 0.00 N ATOM 590 CA LYS A 474 -6.013 -7.506 4.150 1.00 0.00 C ATOM 591 C LYS A 474 -4.749 -6.833 3.633 1.00 0.00 C ATOM 592 O LYS A 474 -3.742 -7.494 3.374 1.00 0.00 O ATOM 593 CB LYS A 474 -5.793 -8.015 5.576 1.00 0.00 C ATOM 594 CG LYS A 474 -7.034 -8.604 6.232 1.00 0.00 C ATOM 595 CD LYS A 474 -6.709 -9.204 7.591 1.00 0.00 C ATOM 596 CE LYS A 474 -7.907 -9.939 8.174 1.00 0.00 C ATOM 597 NZ LYS A 474 -7.574 -10.622 9.454 1.00 0.00 N ATOM 0 H LYS A 474 -5.802 -9.409 3.297 1.00 0.00 H new ATOM 0 HA LYS A 474 -6.814 -6.766 4.158 1.00 0.00 H new ATOM 0 HB2 LYS A 474 -5.010 -8.773 5.561 1.00 0.00 H new ATOM 0 HB3 LYS A 474 -5.428 -7.192 6.190 1.00 0.00 H new ATOM 0 HG2 LYS A 474 -7.791 -7.828 6.346 1.00 0.00 H new ATOM 0 HG3 LYS A 474 -7.460 -9.371 5.586 1.00 0.00 H new ATOM 0 HD2 LYS A 474 -5.869 -9.892 7.495 1.00 0.00 H new ATOM 0 HD3 LYS A 474 -6.397 -8.414 8.274 1.00 0.00 H new ATOM 0 HE2 LYS A 474 -8.720 -9.232 8.341 1.00 0.00 H new ATOM 0 HE3 LYS A 474 -8.267 -10.674 7.454 1.00 0.00 H new ATOM 0 HZ1 LYS A 474 -8.418 -11.110 9.817 1.00 0.00 H new ATOM 0 HZ2 LYS A 474 -6.816 -11.315 9.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 474 -7.255 -9.918 10.150 1.00 0.00 H new ATOM 611 N VAL A 475 -4.804 -5.513 3.485 1.00 0.00 N ATOM 612 CA VAL A 475 -3.675 -4.751 2.967 1.00 0.00 C ATOM 613 C VAL A 475 -3.131 -3.790 4.015 1.00 0.00 C ATOM 614 O VAL A 475 -3.882 -3.017 4.611 1.00 0.00 O ATOM 615 CB VAL A 475 -4.061 -3.955 1.705 1.00 0.00 C ATOM 616 CG1 VAL A 475 -2.882 -3.128 1.217 1.00 0.00 C ATOM 617 CG2 VAL A 475 -4.543 -4.893 0.609 1.00 0.00 C ATOM 0 H VAL A 475 -5.621 -4.948 3.717 1.00 0.00 H new ATOM 0 HA VAL A 475 -2.902 -5.474 2.707 1.00 0.00 H new ATOM 0 HB VAL A 475 -4.876 -3.278 1.961 1.00 0.00 H new ATOM 0 HG11 VAL A 475 -3.172 -2.572 0.325 1.00 0.00 H new ATOM 0 HG12 VAL A 475 -2.579 -2.430 1.997 1.00 0.00 H new ATOM 0 HG13 VAL A 475 -2.048 -3.788 0.978 1.00 0.00 H new ATOM 0 HG21 VAL A 475 -4.811 -4.313 -0.274 1.00 0.00 H new ATOM 0 HG22 VAL A 475 -3.748 -5.595 0.355 1.00 0.00 H new ATOM 0 HG23 VAL A 475 -5.415 -5.444 0.960 1.00 0.00 H new ATOM 627 N ARG A 476 -1.821 -3.842 4.237 1.00 0.00 N ATOM 628 CA ARG A 476 -1.191 -3.059 5.292 1.00 0.00 C ATOM 629 C ARG A 476 -0.089 -2.169 4.734 1.00 0.00 C ATOM 630 O ARG A 476 0.529 -2.493 3.720 1.00 0.00 O ATOM 631 CB ARG A 476 -0.680 -3.933 6.428 1.00 0.00 C ATOM 632 CG ARG A 476 -1.757 -4.694 7.185 1.00 0.00 C ATOM 633 CD ARG A 476 -1.252 -5.837 7.987 1.00 0.00 C ATOM 634 NE ARG A 476 -2.277 -6.560 8.721 1.00 0.00 N ATOM 635 CZ ARG A 476 -2.102 -7.766 9.294 1.00 0.00 C ATOM 636 NH1 ARG A 476 -0.959 -8.406 9.188 1.00 0.00 N ATOM 637 NH2 ARG A 476 -3.119 -8.301 9.945 1.00 0.00 N ATOM 0 H ARG A 476 -1.175 -4.420 3.699 1.00 0.00 H new ATOM 0 HA ARG A 476 -1.960 -2.412 5.714 1.00 0.00 H new ATOM 0 HB2 ARG A 476 0.034 -4.650 6.022 1.00 0.00 H new ATOM 0 HB3 ARG A 476 -0.135 -3.305 7.133 1.00 0.00 H new ATOM 0 HG2 ARG A 476 -2.276 -4.002 7.848 1.00 0.00 H new ATOM 0 HG3 ARG A 476 -2.493 -5.064 6.471 1.00 0.00 H new ATOM 0 HD2 ARG A 476 -0.741 -6.533 7.322 1.00 0.00 H new ATOM 0 HD3 ARG A 476 -0.509 -5.468 8.694 1.00 0.00 H new ATOM 0 HE ARG A 476 -3.194 -6.123 8.808 1.00 0.00 H new ATOM 0 HH11 ARG A 476 -0.188 -7.990 8.666 1.00 0.00 H new ATOM 0 HH12 ARG A 476 -0.843 -9.319 9.628 1.00 0.00 H new ATOM 0 HH21 ARG A 476 -4.007 -7.802 10.003 1.00 0.00 H new ATOM 0 HH22 ARG A 476 -3.017 -9.213 10.389 1.00 0.00 H new ATOM 651 N VAL A 477 0.151 -1.046 5.401 1.00 0.00 N ATOM 652 CA VAL A 477 1.093 -0.048 4.906 1.00 0.00 C ATOM 653 C VAL A 477 2.083 0.360 5.989 1.00 0.00 C ATOM 654 O VAL A 477 1.700 0.607 7.132 1.00 0.00 O ATOM 655 CB VAL A 477 0.365 1.207 4.390 1.00 0.00 C ATOM 656 CG1 VAL A 477 1.369 2.279 3.991 1.00 0.00 C ATOM 657 CG2 VAL A 477 -0.531 0.857 3.213 1.00 0.00 C ATOM 0 H VAL A 477 -0.294 -0.803 6.286 1.00 0.00 H new ATOM 0 HA VAL A 477 1.634 -0.509 4.080 1.00 0.00 H new ATOM 0 HB VAL A 477 -0.258 1.598 5.195 1.00 0.00 H new ATOM 0 HG11 VAL A 477 0.837 3.159 3.629 1.00 0.00 H new ATOM 0 HG12 VAL A 477 1.974 2.551 4.856 1.00 0.00 H new ATOM 0 HG13 VAL A 477 2.016 1.896 3.202 1.00 0.00 H new ATOM 0 HG21 VAL A 477 -1.037 1.756 2.861 1.00 0.00 H new ATOM 0 HG22 VAL A 477 0.073 0.442 2.406 1.00 0.00 H new ATOM 0 HG23 VAL A 477 -1.272 0.122 3.526 1.00 0.00 H new ATOM 667 N TYR A 478 3.359 0.429 5.622 1.00 0.00 N ATOM 668 CA TYR A 478 4.403 0.837 6.553 1.00 0.00 C ATOM 669 C TYR A 478 5.099 2.106 6.080 1.00 0.00 C ATOM 670 O TYR A 478 5.266 2.322 4.880 1.00 0.00 O ATOM 671 CB TYR A 478 5.426 -0.287 6.735 1.00 0.00 C ATOM 672 CG TYR A 478 4.839 -1.567 7.287 1.00 0.00 C ATOM 673 CD1 TYR A 478 4.050 -2.388 6.496 1.00 0.00 C ATOM 674 CD2 TYR A 478 5.077 -1.949 8.599 1.00 0.00 C ATOM 675 CE1 TYR A 478 3.512 -3.559 6.995 1.00 0.00 C ATOM 676 CE2 TYR A 478 4.544 -3.118 9.109 1.00 0.00 C ATOM 677 CZ TYR A 478 3.762 -3.920 8.304 1.00 0.00 C ATOM 678 OH TYR A 478 3.229 -5.084 8.806 1.00 0.00 O ATOM 0 H TYR A 478 3.694 0.207 4.685 1.00 0.00 H new ATOM 0 HA TYR A 478 3.931 1.046 7.513 1.00 0.00 H new ATOM 0 HB2 TYR A 478 5.894 -0.498 5.773 1.00 0.00 H new ATOM 0 HB3 TYR A 478 6.215 0.058 7.404 1.00 0.00 H new ATOM 0 HD1 TYR A 478 3.852 -2.107 5.472 1.00 0.00 H new ATOM 0 HD2 TYR A 478 5.688 -1.323 9.232 1.00 0.00 H new ATOM 0 HE1 TYR A 478 2.900 -4.188 6.365 1.00 0.00 H new ATOM 0 HE2 TYR A 478 4.739 -3.402 10.133 1.00 0.00 H new ATOM 0 HH TYR A 478 3.501 -5.192 9.741 1.00 0.00 H new ATOM 688 N ILE A 479 5.504 2.942 7.029 1.00 0.00 N ATOM 689 CA ILE A 479 6.351 4.091 6.728 1.00 0.00 C ATOM 690 C ILE A 479 7.674 4.011 7.477 1.00 0.00 C ATOM 691 O ILE A 479 7.703 4.016 8.708 1.00 0.00 O ATOM 692 CB ILE A 479 5.650 5.415 7.082 1.00 0.00 C ATOM 693 CG1 ILE A 479 4.368 5.578 6.259 1.00 0.00 C ATOM 694 CG2 ILE A 479 6.587 6.591 6.850 1.00 0.00 C ATOM 695 CD1 ILE A 479 3.545 6.785 6.646 1.00 0.00 C ATOM 0 H ILE A 479 5.259 2.846 8.015 1.00 0.00 H new ATOM 0 HA ILE A 479 6.544 4.068 5.655 1.00 0.00 H new ATOM 0 HB ILE A 479 5.381 5.393 8.138 1.00 0.00 H new ATOM 0 HG12 ILE A 479 4.631 5.652 5.204 1.00 0.00 H new ATOM 0 HG13 ILE A 479 3.758 4.682 6.373 1.00 0.00 H new ATOM 0 HG21 ILE A 479 6.076 7.519 7.105 1.00 0.00 H new ATOM 0 HG22 ILE A 479 7.472 6.480 7.476 1.00 0.00 H new ATOM 0 HG23 ILE A 479 6.885 6.617 5.802 1.00 0.00 H new ATOM 0 HD11 ILE A 479 2.654 6.834 6.020 1.00 0.00 H new ATOM 0 HD12 ILE A 479 3.250 6.704 7.692 1.00 0.00 H new ATOM 0 HD13 ILE A 479 4.137 7.689 6.505 1.00 0.00 H new ATOM 707 N ASN A 480 8.768 3.938 6.728 1.00 0.00 N ATOM 708 CA ASN A 480 10.102 3.992 7.313 1.00 0.00 C ATOM 709 C ASN A 480 10.272 2.934 8.398 1.00 0.00 C ATOM 710 O ASN A 480 10.852 3.199 9.450 1.00 0.00 O ATOM 711 CB ASN A 480 10.408 5.369 7.873 1.00 0.00 C ATOM 712 CG ASN A 480 11.878 5.645 8.031 1.00 0.00 C ATOM 713 OD1 ASN A 480 12.720 5.045 7.353 1.00 0.00 O ATOM 714 ND2 ASN A 480 12.194 6.492 8.978 1.00 0.00 N ATOM 0 H ASN A 480 8.757 3.841 5.713 1.00 0.00 H new ATOM 0 HA ASN A 480 10.812 3.784 6.512 1.00 0.00 H new ATOM 0 HB2 ASN A 480 9.974 6.123 7.216 1.00 0.00 H new ATOM 0 HB3 ASN A 480 9.922 5.473 8.843 1.00 0.00 H new ATOM 0 HD21 ASN A 480 13.174 6.683 9.185 1.00 0.00 H new ATOM 0 HD22 ASN A 480 11.460 6.961 9.509 1.00 0.00 H new ATOM 721 N GLY A 481 9.763 1.738 8.132 1.00 0.00 N ATOM 722 CA GLY A 481 10.002 0.594 9.004 1.00 0.00 C ATOM 723 C GLY A 481 8.848 0.392 9.978 1.00 0.00 C ATOM 724 O GLY A 481 8.642 -0.709 10.491 1.00 0.00 O ATOM 0 H GLY A 481 9.182 1.534 7.319 1.00 0.00 H new ATOM 0 HA2 GLY A 481 10.134 -0.305 8.401 1.00 0.00 H new ATOM 0 HA3 GLY A 481 10.928 0.744 9.559 1.00 0.00 H new ATOM 728 N THR A 482 8.098 1.459 10.228 1.00 0.00 N ATOM 729 CA THR A 482 7.026 1.428 11.215 1.00 0.00 C ATOM 730 C THR A 482 5.668 1.258 10.547 1.00 0.00 C ATOM 731 O THR A 482 5.398 1.853 9.503 1.00 0.00 O ATOM 732 CB THR A 482 7.008 2.706 12.071 1.00 0.00 C ATOM 733 OG1 THR A 482 8.245 2.822 12.786 1.00 0.00 O ATOM 734 CG2 THR A 482 5.855 2.668 13.063 1.00 0.00 C ATOM 0 H THR A 482 8.213 2.358 9.760 1.00 0.00 H new ATOM 0 HA THR A 482 7.220 0.572 11.862 1.00 0.00 H new ATOM 0 HB THR A 482 6.879 3.565 11.412 1.00 0.00 H new ATOM 0 HG1 THR A 482 8.233 3.637 13.330 1.00 0.00 H new ATOM 0 HG21 THR A 482 5.858 3.580 13.660 1.00 0.00 H new ATOM 0 HG22 THR A 482 4.912 2.592 12.522 1.00 0.00 H new ATOM 0 HG23 THR A 482 5.968 1.805 13.719 1.00 0.00 H new ATOM 742 N LEU A 483 4.813 0.440 11.154 1.00 0.00 N ATOM 743 CA LEU A 483 3.449 0.260 10.671 1.00 0.00 C ATOM 744 C LEU A 483 2.619 1.521 10.879 1.00 0.00 C ATOM 745 O LEU A 483 2.466 1.994 12.004 1.00 0.00 O ATOM 746 CB LEU A 483 2.792 -0.935 11.372 1.00 0.00 C ATOM 747 CG LEU A 483 1.322 -1.181 11.004 1.00 0.00 C ATOM 748 CD1 LEU A 483 1.205 -1.517 9.523 1.00 0.00 C ATOM 749 CD2 LEU A 483 0.766 -2.309 11.860 1.00 0.00 C ATOM 0 H LEU A 483 5.042 -0.109 11.983 1.00 0.00 H new ATOM 0 HA LEU A 483 3.493 0.061 9.600 1.00 0.00 H new ATOM 0 HB2 LEU A 483 3.364 -1.833 11.137 1.00 0.00 H new ATOM 0 HB3 LEU A 483 2.860 -0.786 12.450 1.00 0.00 H new ATOM 0 HG LEU A 483 0.742 -0.278 11.195 1.00 0.00 H new ATOM 0 HD11 LEU A 483 0.159 -1.690 9.271 1.00 0.00 H new ATOM 0 HD12 LEU A 483 1.589 -0.687 8.930 1.00 0.00 H new ATOM 0 HD13 LEU A 483 1.784 -2.415 9.307 1.00 0.00 H new ATOM 0 HD21 LEU A 483 -0.278 -2.484 11.599 1.00 0.00 H new ATOM 0 HD22 LEU A 483 1.341 -3.218 11.683 1.00 0.00 H new ATOM 0 HD23 LEU A 483 0.835 -2.035 12.913 1.00 0.00 H new ATOM 761 N TYR A 484 2.085 2.057 9.787 1.00 0.00 N ATOM 762 CA TYR A 484 1.382 3.334 9.828 1.00 0.00 C ATOM 763 C TYR A 484 -0.126 3.131 9.905 1.00 0.00 C ATOM 764 O TYR A 484 -0.818 3.835 10.639 1.00 0.00 O ATOM 765 CB TYR A 484 1.737 4.179 8.602 1.00 0.00 C ATOM 766 CG TYR A 484 0.761 5.302 8.330 1.00 0.00 C ATOM 767 CD1 TYR A 484 0.800 6.475 9.071 1.00 0.00 C ATOM 768 CD2 TYR A 484 -0.194 5.188 7.331 1.00 0.00 C ATOM 769 CE1 TYR A 484 -0.088 7.505 8.826 1.00 0.00 C ATOM 770 CE2 TYR A 484 -1.086 6.211 7.078 1.00 0.00 C ATOM 771 CZ TYR A 484 -1.030 7.369 7.827 1.00 0.00 C ATOM 772 OH TYR A 484 -1.917 8.391 7.579 1.00 0.00 O ATOM 0 H TYR A 484 2.126 1.627 8.863 1.00 0.00 H new ATOM 0 HA TYR A 484 1.701 3.862 10.727 1.00 0.00 H new ATOM 0 HB2 TYR A 484 2.733 4.601 8.739 1.00 0.00 H new ATOM 0 HB3 TYR A 484 1.783 3.531 7.727 1.00 0.00 H new ATOM 0 HD1 TYR A 484 1.537 6.585 9.853 1.00 0.00 H new ATOM 0 HD2 TYR A 484 -0.241 4.284 6.741 1.00 0.00 H new ATOM 0 HE1 TYR A 484 -0.045 8.411 9.413 1.00 0.00 H new ATOM 0 HE2 TYR A 484 -1.825 6.106 6.297 1.00 0.00 H new ATOM 0 HH TYR A 484 -1.444 9.249 7.606 1.00 0.00 H new ATOM 782 N LYS A 485 -0.626 2.165 9.144 1.00 0.00 N ATOM 783 CA LYS A 485 -2.063 1.976 8.993 1.00 0.00 C ATOM 784 C LYS A 485 -2.377 0.639 8.333 1.00 0.00 C ATOM 785 O LYS A 485 -1.509 0.021 7.717 1.00 0.00 O ATOM 786 CB LYS A 485 -2.671 3.119 8.179 1.00 0.00 C ATOM 787 CG LYS A 485 -4.194 3.169 8.205 1.00 0.00 C ATOM 788 CD LYS A 485 -4.716 3.431 9.610 1.00 0.00 C ATOM 789 CE LYS A 485 -6.236 3.483 9.635 1.00 0.00 C ATOM 790 NZ LYS A 485 -6.763 3.695 11.011 1.00 0.00 N ATOM 0 H LYS A 485 -0.056 1.500 8.621 1.00 0.00 H new ATOM 0 HA LYS A 485 -2.505 1.976 9.989 1.00 0.00 H new ATOM 0 HB2 LYS A 485 -2.282 4.065 8.556 1.00 0.00 H new ATOM 0 HB3 LYS A 485 -2.340 3.028 7.144 1.00 0.00 H new ATOM 0 HG2 LYS A 485 -4.546 3.952 7.533 1.00 0.00 H new ATOM 0 HG3 LYS A 485 -4.597 2.226 7.835 1.00 0.00 H new ATOM 0 HD2 LYS A 485 -4.366 2.648 10.282 1.00 0.00 H new ATOM 0 HD3 LYS A 485 -4.312 4.373 9.980 1.00 0.00 H new ATOM 0 HE2 LYS A 485 -6.582 4.287 8.986 1.00 0.00 H new ATOM 0 HE3 LYS A 485 -6.637 2.553 9.232 1.00 0.00 H new ATOM 0 HZ1 LYS A 485 -7.802 3.724 10.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 485 -6.454 2.914 11.625 1.00 0.00 H new ATOM 0 HZ3 LYS A 485 -6.401 4.595 11.387 1.00 0.00 H new ATOM 804 N ASN A 486 -3.624 0.198 8.466 1.00 0.00 N ATOM 805 CA ASN A 486 -4.067 -1.045 7.846 1.00 0.00 C ATOM 806 C ASN A 486 -5.487 -0.921 7.315 1.00 0.00 C ATOM 807 O ASN A 486 -6.280 -0.121 7.813 1.00 0.00 O ATOM 808 CB ASN A 486 -3.968 -2.211 8.813 1.00 0.00 C ATOM 809 CG ASN A 486 -4.880 -2.089 10.002 1.00 0.00 C ATOM 810 OD1 ASN A 486 -6.100 -2.258 9.894 1.00 0.00 O ATOM 811 ND2 ASN A 486 -4.308 -1.718 11.119 1.00 0.00 N ATOM 0 H ASN A 486 -4.346 0.684 8.998 1.00 0.00 H new ATOM 0 HA ASN A 486 -3.402 -1.241 7.005 1.00 0.00 H new ATOM 0 HB2 ASN A 486 -4.201 -3.134 8.281 1.00 0.00 H new ATOM 0 HB3 ASN A 486 -2.939 -2.295 9.163 1.00 0.00 H new ATOM 0 HD21 ASN A 486 -4.874 -1.555 11.952 1.00 0.00 H new ATOM 0 HD22 ASN A 486 -3.297 -1.592 11.157 1.00 0.00 H new ATOM 818 N TRP A 487 -5.805 -1.717 6.298 1.00 0.00 N ATOM 819 CA TRP A 487 -7.168 -1.800 5.787 1.00 0.00 C ATOM 820 C TRP A 487 -7.561 -3.243 5.495 1.00 0.00 C ATOM 821 O TRP A 487 -6.744 -4.033 5.021 1.00 0.00 O ATOM 822 CB TRP A 487 -7.317 -0.950 4.524 1.00 0.00 C ATOM 823 CG TRP A 487 -7.129 0.517 4.764 1.00 0.00 C ATOM 824 CD1 TRP A 487 -8.104 1.432 5.023 1.00 0.00 C ATOM 825 CD2 TRP A 487 -5.890 1.238 4.768 1.00 0.00 C ATOM 826 NE1 TRP A 487 -7.552 2.678 5.188 1.00 0.00 N ATOM 827 CE2 TRP A 487 -6.193 2.583 5.037 1.00 0.00 C ATOM 828 CE3 TRP A 487 -4.553 0.872 4.570 1.00 0.00 C ATOM 829 CZ2 TRP A 487 -5.214 3.565 5.111 1.00 0.00 C ATOM 830 CZ3 TRP A 487 -3.572 1.854 4.646 1.00 0.00 C ATOM 831 CH2 TRP A 487 -3.895 3.161 4.909 1.00 0.00 C ATOM 0 H TRP A 487 -5.136 -2.314 5.812 1.00 0.00 H new ATOM 0 HA TRP A 487 -7.837 -1.414 6.556 1.00 0.00 H new ATOM 0 HB2 TRP A 487 -6.591 -1.285 3.783 1.00 0.00 H new ATOM 0 HB3 TRP A 487 -8.307 -1.116 4.099 1.00 0.00 H new ATOM 0 HD1 TRP A 487 -9.159 1.209 5.089 1.00 0.00 H new ATOM 0 HE1 TRP A 487 -8.068 3.534 5.390 1.00 0.00 H new ATOM 0 HE3 TRP A 487 -4.289 -0.154 4.362 1.00 0.00 H new ATOM 0 HZ2 TRP A 487 -5.463 4.596 5.316 1.00 0.00 H new ATOM 0 HZ3 TRP A 487 -2.537 1.583 4.495 1.00 0.00 H new ATOM 0 HH2 TRP A 487 -3.106 3.897 4.961 1.00 0.00 H new ATOM 842 N THR A 488 -8.812 -3.579 5.783 1.00 0.00 N ATOM 843 CA THR A 488 -9.382 -4.851 5.353 1.00 0.00 C ATOM 844 C THR A 488 -10.399 -4.651 4.237 1.00 0.00 C ATOM 845 O THR A 488 -11.325 -3.850 4.363 1.00 0.00 O ATOM 846 CB THR A 488 -10.057 -5.593 6.521 1.00 0.00 C ATOM 847 OG1 THR A 488 -9.087 -5.869 7.540 1.00 0.00 O ATOM 848 CG2 THR A 488 -10.669 -6.899 6.041 1.00 0.00 C ATOM 0 H THR A 488 -9.453 -2.988 6.313 1.00 0.00 H new ATOM 0 HA THR A 488 -8.554 -5.455 4.982 1.00 0.00 H new ATOM 0 HB THR A 488 -10.848 -4.961 6.925 1.00 0.00 H new ATOM 0 HG1 THR A 488 -9.518 -6.340 8.283 1.00 0.00 H new ATOM 0 HG21 THR A 488 -11.141 -7.410 6.880 1.00 0.00 H new ATOM 0 HG22 THR A 488 -11.416 -6.691 5.275 1.00 0.00 H new ATOM 0 HG23 THR A 488 -9.888 -7.534 5.623 1.00 0.00 H new ATOM 856 N VAL A 489 -10.220 -5.382 3.142 1.00 0.00 N ATOM 857 CA VAL A 489 -11.077 -5.232 1.972 1.00 0.00 C ATOM 858 C VAL A 489 -11.419 -6.586 1.362 1.00 0.00 C ATOM 859 O VAL A 489 -10.817 -7.603 1.707 1.00 0.00 O ATOM 860 CB VAL A 489 -10.416 -4.349 0.898 1.00 0.00 C ATOM 861 CG1 VAL A 489 -10.166 -2.950 1.439 1.00 0.00 C ATOM 862 CG2 VAL A 489 -9.114 -4.975 0.420 1.00 0.00 C ATOM 0 H VAL A 489 -9.488 -6.085 3.040 1.00 0.00 H new ATOM 0 HA VAL A 489 -11.993 -4.749 2.313 1.00 0.00 H new ATOM 0 HB VAL A 489 -11.095 -4.274 0.048 1.00 0.00 H new ATOM 0 HG11 VAL A 489 -9.698 -2.339 0.667 1.00 0.00 H new ATOM 0 HG12 VAL A 489 -11.114 -2.499 1.734 1.00 0.00 H new ATOM 0 HG13 VAL A 489 -9.507 -3.007 2.305 1.00 0.00 H new ATOM 0 HG21 VAL A 489 -8.661 -4.337 -0.339 1.00 0.00 H new ATOM 0 HG22 VAL A 489 -8.430 -5.079 1.262 1.00 0.00 H new ATOM 0 HG23 VAL A 489 -9.318 -5.957 -0.006 1.00 0.00 H new ATOM 872 N SER A 490 -12.390 -6.592 0.456 1.00 0.00 N ATOM 873 CA SER A 490 -12.668 -7.768 -0.360 1.00 0.00 C ATOM 874 C SER A 490 -12.536 -7.453 -1.843 1.00 0.00 C ATOM 875 O SER A 490 -12.909 -6.370 -2.294 1.00 0.00 O ATOM 876 CB SER A 490 -14.055 -8.298 -0.053 1.00 0.00 C ATOM 877 OG SER A 490 -14.196 -8.659 1.292 1.00 0.00 O ATOM 0 H SER A 490 -12.998 -5.795 0.268 1.00 0.00 H new ATOM 0 HA SER A 490 -11.932 -8.534 -0.115 1.00 0.00 H new ATOM 0 HB2 SER A 490 -14.796 -7.539 -0.304 1.00 0.00 H new ATOM 0 HB3 SER A 490 -14.259 -9.163 -0.683 1.00 0.00 H new ATOM 0 HG SER A 490 -13.399 -9.149 1.584 1.00 0.00 H new ATOM 883 N LEU A 491 -12.003 -8.406 -2.600 1.00 0.00 N ATOM 884 CA LEU A 491 -11.772 -8.213 -4.027 1.00 0.00 C ATOM 885 C LEU A 491 -12.327 -9.376 -4.838 1.00 0.00 C ATOM 886 O LEU A 491 -12.030 -10.539 -4.560 1.00 0.00 O ATOM 887 CB LEU A 491 -10.272 -8.038 -4.302 1.00 0.00 C ATOM 888 CG LEU A 491 -9.627 -6.809 -3.648 1.00 0.00 C ATOM 889 CD1 LEU A 491 -8.113 -6.878 -3.790 1.00 0.00 C ATOM 890 CD2 LEU A 491 -10.173 -5.546 -4.295 1.00 0.00 C ATOM 0 H LEU A 491 -11.722 -9.321 -2.248 1.00 0.00 H new ATOM 0 HA LEU A 491 -12.297 -7.309 -4.335 1.00 0.00 H new ATOM 0 HB2 LEU A 491 -9.749 -8.930 -3.957 1.00 0.00 H new ATOM 0 HB3 LEU A 491 -10.121 -7.977 -5.380 1.00 0.00 H new ATOM 0 HG LEU A 491 -9.869 -6.791 -2.585 1.00 0.00 H new ATOM 0 HD11 LEU A 491 -7.663 -6.002 -3.323 1.00 0.00 H new ATOM 0 HD12 LEU A 491 -7.742 -7.779 -3.302 1.00 0.00 H new ATOM 0 HD13 LEU A 491 -7.847 -6.902 -4.847 1.00 0.00 H new ATOM 0 HD21 LEU A 491 -9.715 -4.672 -3.831 1.00 0.00 H new ATOM 0 HD22 LEU A 491 -9.942 -5.554 -5.360 1.00 0.00 H new ATOM 0 HD23 LEU A 491 -11.254 -5.505 -4.158 1.00 0.00 H new ATOM 902 N GLY A 492 -13.135 -9.057 -5.844 1.00 0.00 N ATOM 903 CA GLY A 492 -13.661 -10.067 -6.755 1.00 0.00 C ATOM 904 C GLY A 492 -12.703 -10.316 -7.912 1.00 0.00 C ATOM 905 O GLY A 492 -11.571 -9.832 -7.909 1.00 0.00 O ATOM 0 H GLY A 492 -13.440 -8.106 -6.049 1.00 0.00 H new ATOM 0 HA2 GLY A 492 -13.830 -10.997 -6.213 1.00 0.00 H new ATOM 0 HA3 GLY A 492 -14.627 -9.744 -7.142 1.00 0.00 H new ATOM 909 N PRO A 493 -13.163 -11.076 -8.900 1.00 0.00 N ATOM 910 CA PRO A 493 -12.372 -11.338 -10.098 1.00 0.00 C ATOM 911 C PRO A 493 -12.086 -10.051 -10.862 1.00 0.00 C ATOM 912 O PRO A 493 -12.995 -9.431 -11.413 1.00 0.00 O ATOM 913 CB PRO A 493 -13.232 -12.311 -10.909 1.00 0.00 C ATOM 914 CG PRO A 493 -14.618 -12.090 -10.407 1.00 0.00 C ATOM 915 CD PRO A 493 -14.466 -11.764 -8.945 1.00 0.00 C ATOM 0 HA PRO A 493 -11.390 -11.755 -9.873 1.00 0.00 H new ATOM 0 HB2 PRO A 493 -13.160 -12.109 -11.978 1.00 0.00 H new ATOM 0 HB3 PRO A 493 -12.915 -13.343 -10.758 1.00 0.00 H new ATOM 0 HG2 PRO A 493 -15.105 -11.275 -10.943 1.00 0.00 H new ATOM 0 HG3 PRO A 493 -15.234 -12.978 -10.550 1.00 0.00 H new ATOM 0 HD2 PRO A 493 -15.274 -11.126 -8.586 1.00 0.00 H new ATOM 0 HD3 PRO A 493 -14.471 -12.662 -8.327 1.00 0.00 H new ATOM 923 N LYS A 494 -10.819 -9.655 -10.889 1.00 0.00 N ATOM 924 CA LYS A 494 -10.407 -8.456 -11.610 1.00 0.00 C ATOM 925 C LYS A 494 -11.073 -7.211 -11.038 1.00 0.00 C ATOM 926 O LYS A 494 -11.417 -6.286 -11.771 1.00 0.00 O ATOM 927 CB LYS A 494 -10.730 -8.588 -13.099 1.00 0.00 C ATOM 928 CG LYS A 494 -10.053 -9.765 -13.787 1.00 0.00 C ATOM 929 CD LYS A 494 -10.354 -9.781 -15.278 1.00 0.00 C ATOM 930 CE LYS A 494 -9.753 -11.007 -15.952 1.00 0.00 C ATOM 931 NZ LYS A 494 -10.044 -11.039 -17.411 1.00 0.00 N ATOM 0 H LYS A 494 -10.058 -10.147 -10.420 1.00 0.00 H new ATOM 0 HA LYS A 494 -9.329 -8.350 -11.490 1.00 0.00 H new ATOM 0 HB2 LYS A 494 -11.809 -8.685 -13.217 1.00 0.00 H new ATOM 0 HB3 LYS A 494 -10.436 -7.669 -13.605 1.00 0.00 H new ATOM 0 HG2 LYS A 494 -8.976 -9.709 -13.632 1.00 0.00 H new ATOM 0 HG3 LYS A 494 -10.392 -10.697 -13.335 1.00 0.00 H new ATOM 0 HD2 LYS A 494 -11.433 -9.771 -15.433 1.00 0.00 H new ATOM 0 HD3 LYS A 494 -9.957 -8.878 -15.741 1.00 0.00 H new ATOM 0 HE2 LYS A 494 -8.674 -11.014 -15.797 1.00 0.00 H new ATOM 0 HE3 LYS A 494 -10.148 -11.909 -15.484 1.00 0.00 H new ATOM 0 HZ1 LYS A 494 -9.617 -11.889 -17.832 1.00 0.00 H new ATOM 0 HZ2 LYS A 494 -11.073 -11.059 -17.559 1.00 0.00 H new ATOM 0 HZ3 LYS A 494 -9.645 -10.192 -17.863 1.00 0.00 H new ATOM 945 N GLU A 495 -11.256 -7.197 -9.720 1.00 0.00 N ATOM 946 CA GLU A 495 -11.800 -6.031 -9.036 1.00 0.00 C ATOM 947 C GLU A 495 -10.692 -5.202 -8.397 1.00 0.00 C ATOM 948 O GLU A 495 -9.703 -5.744 -7.904 1.00 0.00 O ATOM 949 CB GLU A 495 -12.816 -6.458 -7.975 1.00 0.00 C ATOM 950 CG GLU A 495 -13.517 -5.302 -7.273 1.00 0.00 C ATOM 951 CD GLU A 495 -14.603 -5.796 -6.359 1.00 0.00 C ATOM 952 OE1 GLU A 495 -14.832 -6.982 -6.325 1.00 0.00 O ATOM 953 OE2 GLU A 495 -15.129 -5.005 -5.612 1.00 0.00 O ATOM 0 H GLU A 495 -11.035 -7.981 -9.106 1.00 0.00 H new ATOM 0 HA GLU A 495 -12.304 -5.413 -9.779 1.00 0.00 H new ATOM 0 HB2 GLU A 495 -13.568 -7.092 -8.444 1.00 0.00 H new ATOM 0 HB3 GLU A 495 -12.308 -7.067 -7.227 1.00 0.00 H new ATOM 0 HG2 GLU A 495 -12.790 -4.727 -6.700 1.00 0.00 H new ATOM 0 HG3 GLU A 495 -13.943 -4.627 -8.016 1.00 0.00 H new ATOM 960 N GLU A 496 -10.866 -3.885 -8.406 1.00 0.00 N ATOM 961 CA GLU A 496 -9.892 -2.979 -7.807 1.00 0.00 C ATOM 962 C GLU A 496 -10.526 -2.144 -6.700 1.00 0.00 C ATOM 963 O GLU A 496 -11.673 -1.713 -6.814 1.00 0.00 O ATOM 964 CB GLU A 496 -9.283 -2.065 -8.872 1.00 0.00 C ATOM 965 CG GLU A 496 -8.287 -1.049 -8.333 1.00 0.00 C ATOM 966 CD GLU A 496 -7.744 -0.180 -9.433 1.00 0.00 C ATOM 967 OE1 GLU A 496 -8.184 -0.322 -10.549 1.00 0.00 O ATOM 968 OE2 GLU A 496 -6.971 0.702 -9.140 1.00 0.00 O ATOM 0 H GLU A 496 -11.673 -3.420 -8.822 1.00 0.00 H new ATOM 0 HA GLU A 496 -9.100 -3.585 -7.367 1.00 0.00 H new ATOM 0 HB2 GLU A 496 -8.786 -2.681 -9.621 1.00 0.00 H new ATOM 0 HB3 GLU A 496 -10.087 -1.533 -9.380 1.00 0.00 H new ATOM 0 HG2 GLU A 496 -8.771 -0.427 -7.580 1.00 0.00 H new ATOM 0 HG3 GLU A 496 -7.466 -1.568 -7.838 1.00 0.00 H new ATOM 975 N LYS A 497 -9.770 -1.918 -5.631 1.00 0.00 N ATOM 976 CA LYS A 497 -10.204 -1.028 -4.561 1.00 0.00 C ATOM 977 C LYS A 497 -9.156 0.040 -4.274 1.00 0.00 C ATOM 978 O LYS A 497 -7.957 -0.207 -4.395 1.00 0.00 O ATOM 979 CB LYS A 497 -10.505 -1.824 -3.291 1.00 0.00 C ATOM 980 CG LYS A 497 -11.778 -2.659 -3.358 1.00 0.00 C ATOM 981 CD LYS A 497 -13.019 -1.785 -3.244 1.00 0.00 C ATOM 982 CE LYS A 497 -13.176 -1.225 -1.838 1.00 0.00 C ATOM 983 NZ LYS A 497 -14.310 -0.265 -1.746 1.00 0.00 N ATOM 0 H LYS A 497 -8.853 -2.339 -5.483 1.00 0.00 H new ATOM 0 HA LYS A 497 -11.116 -0.531 -4.891 1.00 0.00 H new ATOM 0 HB2 LYS A 497 -9.663 -2.484 -3.082 1.00 0.00 H new ATOM 0 HB3 LYS A 497 -10.583 -1.132 -2.453 1.00 0.00 H new ATOM 0 HG2 LYS A 497 -11.804 -3.211 -4.297 1.00 0.00 H new ATOM 0 HG3 LYS A 497 -11.775 -3.396 -2.555 1.00 0.00 H new ATOM 0 HD2 LYS A 497 -12.955 -0.965 -3.959 1.00 0.00 H new ATOM 0 HD3 LYS A 497 -13.902 -2.368 -3.506 1.00 0.00 H new ATOM 0 HE2 LYS A 497 -13.336 -2.044 -1.137 1.00 0.00 H new ATOM 0 HE3 LYS A 497 -12.253 -0.727 -1.541 1.00 0.00 H new ATOM 0 HZ1 LYS A 497 -14.383 0.094 -0.773 1.00 0.00 H new ATOM 0 HZ2 LYS A 497 -14.146 0.530 -2.396 1.00 0.00 H new ATOM 0 HZ3 LYS A 497 -15.195 -0.747 -2.005 1.00 0.00 H new ATOM 997 N VAL A 498 -9.618 1.226 -3.892 1.00 0.00 N ATOM 998 CA VAL A 498 -8.725 2.356 -3.659 1.00 0.00 C ATOM 999 C VAL A 498 -8.692 2.733 -2.184 1.00 0.00 C ATOM 1000 O VAL A 498 -9.715 3.093 -1.602 1.00 0.00 O ATOM 1001 CB VAL A 498 -9.142 3.585 -4.486 1.00 0.00 C ATOM 1002 CG1 VAL A 498 -8.218 4.760 -4.197 1.00 0.00 C ATOM 1003 CG2 VAL A 498 -9.134 3.256 -5.971 1.00 0.00 C ATOM 0 H VAL A 498 -10.605 1.430 -3.737 1.00 0.00 H new ATOM 0 HA VAL A 498 -7.729 2.042 -3.973 1.00 0.00 H new ATOM 0 HB VAL A 498 -10.156 3.864 -4.200 1.00 0.00 H new ATOM 0 HG11 VAL A 498 -8.527 5.621 -4.790 1.00 0.00 H new ATOM 0 HG12 VAL A 498 -8.270 5.012 -3.138 1.00 0.00 H new ATOM 0 HG13 VAL A 498 -7.194 4.490 -4.456 1.00 0.00 H new ATOM 0 HG21 VAL A 498 -9.431 4.137 -6.540 1.00 0.00 H new ATOM 0 HG22 VAL A 498 -8.131 2.952 -6.271 1.00 0.00 H new ATOM 0 HG23 VAL A 498 -9.834 2.444 -6.167 1.00 0.00 H new ATOM 1013 N LEU A 499 -7.509 2.651 -1.583 1.00 0.00 N ATOM 1014 CA LEU A 499 -7.313 3.103 -0.211 1.00 0.00 C ATOM 1015 C LEU A 499 -6.605 4.451 -0.171 1.00 0.00 C ATOM 1016 O LEU A 499 -5.696 4.710 -0.958 1.00 0.00 O ATOM 1017 CB LEU A 499 -6.518 2.060 0.582 1.00 0.00 C ATOM 1018 CG LEU A 499 -7.091 0.636 0.544 1.00 0.00 C ATOM 1019 CD1 LEU A 499 -6.114 -0.336 1.191 1.00 0.00 C ATOM 1020 CD2 LEU A 499 -8.434 0.610 1.259 1.00 0.00 C ATOM 0 H LEU A 499 -6.671 2.275 -2.026 1.00 0.00 H new ATOM 0 HA LEU A 499 -8.294 3.225 0.248 1.00 0.00 H new ATOM 0 HB2 LEU A 499 -5.498 2.035 0.198 1.00 0.00 H new ATOM 0 HB3 LEU A 499 -6.460 2.384 1.621 1.00 0.00 H new ATOM 0 HG LEU A 499 -7.240 0.330 -0.491 1.00 0.00 H new ATOM 0 HD11 LEU A 499 -6.529 -1.344 1.160 1.00 0.00 H new ATOM 0 HD12 LEU A 499 -5.168 -0.316 0.649 1.00 0.00 H new ATOM 0 HD13 LEU A 499 -5.945 -0.046 2.228 1.00 0.00 H new ATOM 0 HD21 LEU A 499 -8.841 -0.401 1.232 1.00 0.00 H new ATOM 0 HD22 LEU A 499 -8.300 0.920 2.295 1.00 0.00 H new ATOM 0 HD23 LEU A 499 -9.124 1.292 0.762 1.00 0.00 H new ATOM 1032 N THR A 500 -7.029 5.308 0.752 1.00 0.00 N ATOM 1033 CA THR A 500 -6.397 6.608 0.937 1.00 0.00 C ATOM 1034 C THR A 500 -5.941 6.799 2.378 1.00 0.00 C ATOM 1035 O THR A 500 -6.516 6.226 3.302 1.00 0.00 O ATOM 1036 CB THR A 500 -7.347 7.758 0.555 1.00 0.00 C ATOM 1037 OG1 THR A 500 -8.553 7.658 1.321 1.00 0.00 O ATOM 1038 CG2 THR A 500 -7.686 7.700 -0.927 1.00 0.00 C ATOM 0 H THR A 500 -7.808 5.125 1.384 1.00 0.00 H new ATOM 0 HA THR A 500 -5.529 6.631 0.278 1.00 0.00 H new ATOM 0 HB THR A 500 -6.851 8.705 0.767 1.00 0.00 H new ATOM 0 HG1 THR A 500 -9.156 8.391 1.079 1.00 0.00 H new ATOM 0 HG21 THR A 500 -8.358 8.520 -1.179 1.00 0.00 H new ATOM 0 HG22 THR A 500 -6.771 7.788 -1.513 1.00 0.00 H new ATOM 0 HG23 THR A 500 -8.172 6.751 -1.152 1.00 0.00 H new ATOM 1046 N PHE A 501 -4.901 7.607 2.562 1.00 0.00 N ATOM 1047 CA PHE A 501 -4.487 8.032 3.893 1.00 0.00 C ATOM 1048 C PHE A 501 -3.744 9.361 3.843 1.00 0.00 C ATOM 1049 O PHE A 501 -3.194 9.738 2.807 1.00 0.00 O ATOM 1050 CB PHE A 501 -3.608 6.963 4.545 1.00 0.00 C ATOM 1051 CG PHE A 501 -2.326 6.701 3.808 1.00 0.00 C ATOM 1052 CD1 PHE A 501 -1.183 7.431 4.094 1.00 0.00 C ATOM 1053 CD2 PHE A 501 -2.259 5.723 2.826 1.00 0.00 C ATOM 1054 CE1 PHE A 501 -0.003 7.192 3.415 1.00 0.00 C ATOM 1055 CE2 PHE A 501 -1.081 5.481 2.148 1.00 0.00 C ATOM 1056 CZ PHE A 501 0.047 6.216 2.444 1.00 0.00 C ATOM 0 H PHE A 501 -4.329 7.980 1.804 1.00 0.00 H new ATOM 0 HA PHE A 501 -5.386 8.168 4.494 1.00 0.00 H new ATOM 0 HB2 PHE A 501 -3.374 7.270 5.564 1.00 0.00 H new ATOM 0 HB3 PHE A 501 -4.173 6.034 4.614 1.00 0.00 H new ATOM 0 HD1 PHE A 501 -1.215 8.195 4.856 1.00 0.00 H new ATOM 0 HD2 PHE A 501 -3.139 5.144 2.589 1.00 0.00 H new ATOM 0 HE1 PHE A 501 0.880 7.770 3.646 1.00 0.00 H new ATOM 0 HE2 PHE A 501 -1.043 4.716 1.386 1.00 0.00 H new ATOM 0 HZ PHE A 501 0.969 6.027 1.915 1.00 0.00 H new ATOM 1066 N SER A 502 -3.733 10.069 4.967 1.00 0.00 N ATOM 1067 CA SER A 502 -3.044 11.352 5.056 1.00 0.00 C ATOM 1068 C SER A 502 -1.947 11.316 6.111 1.00 0.00 C ATOM 1069 O SER A 502 -2.170 10.877 7.239 1.00 0.00 O ATOM 1070 CB SER A 502 -4.038 12.456 5.365 1.00 0.00 C ATOM 1071 OG SER A 502 -4.969 12.631 4.332 1.00 0.00 O ATOM 0 H SER A 502 -4.193 9.777 5.829 1.00 0.00 H new ATOM 0 HA SER A 502 -2.575 11.554 4.093 1.00 0.00 H new ATOM 0 HB2 SER A 502 -4.564 12.221 6.290 1.00 0.00 H new ATOM 0 HB3 SER A 502 -3.502 13.390 5.531 1.00 0.00 H new ATOM 0 HG SER A 502 -5.592 13.349 4.571 1.00 0.00 H new ATOM 1077 N TRP A 503 -0.759 11.782 5.738 1.00 0.00 N ATOM 1078 CA TRP A 503 0.426 11.606 6.567 1.00 0.00 C ATOM 1079 C TRP A 503 1.301 12.853 6.547 1.00 0.00 C ATOM 1080 O TRP A 503 1.628 13.377 5.483 1.00 0.00 O ATOM 1081 CB TRP A 503 1.230 10.394 6.095 1.00 0.00 C ATOM 1082 CG TRP A 503 2.594 10.304 6.712 1.00 0.00 C ATOM 1083 CD1 TRP A 503 2.883 10.016 8.012 1.00 0.00 C ATOM 1084 CD2 TRP A 503 3.852 10.501 6.054 1.00 0.00 C ATOM 1085 NE1 TRP A 503 4.242 10.023 8.207 1.00 0.00 N ATOM 1086 CE2 TRP A 503 4.859 10.318 7.018 1.00 0.00 C ATOM 1087 CE3 TRP A 503 4.223 10.817 4.741 1.00 0.00 C ATOM 1088 CZ2 TRP A 503 6.207 10.440 6.716 1.00 0.00 C ATOM 1089 CZ3 TRP A 503 5.574 10.936 4.438 1.00 0.00 C ATOM 1090 CH2 TRP A 503 6.537 10.752 5.397 1.00 0.00 C ATOM 0 H TRP A 503 -0.593 12.285 4.866 1.00 0.00 H new ATOM 0 HA TRP A 503 0.096 11.437 7.592 1.00 0.00 H new ATOM 0 HB2 TRP A 503 0.674 9.486 6.328 1.00 0.00 H new ATOM 0 HB3 TRP A 503 1.332 10.436 5.011 1.00 0.00 H new ATOM 0 HD1 TRP A 503 2.149 9.812 8.778 1.00 0.00 H new ATOM 0 HE1 TRP A 503 4.715 9.839 9.092 1.00 0.00 H new ATOM 0 HE3 TRP A 503 3.473 10.965 3.978 1.00 0.00 H new ATOM 0 HZ2 TRP A 503 6.968 10.300 7.469 1.00 0.00 H new ATOM 0 HZ3 TRP A 503 5.871 11.178 3.428 1.00 0.00 H new ATOM 0 HH2 TRP A 503 7.577 10.851 5.124 1.00 0.00 H new ATOM 1101 N THR A 504 1.676 13.324 7.730 1.00 0.00 N ATOM 1102 CA THR A 504 2.503 14.518 7.853 1.00 0.00 C ATOM 1103 C THR A 504 3.856 14.192 8.473 1.00 0.00 C ATOM 1104 O THR A 504 3.947 13.887 9.662 1.00 0.00 O ATOM 1105 CB THR A 504 1.811 15.602 8.701 1.00 0.00 C ATOM 1106 OG1 THR A 504 0.596 16.011 8.058 1.00 0.00 O ATOM 1107 CG2 THR A 504 2.721 16.809 8.873 1.00 0.00 C ATOM 0 H THR A 504 1.420 12.896 8.620 1.00 0.00 H new ATOM 0 HA THR A 504 2.652 14.899 6.843 1.00 0.00 H new ATOM 0 HB THR A 504 1.589 15.186 9.684 1.00 0.00 H new ATOM 0 HG1 THR A 504 0.155 16.699 8.599 1.00 0.00 H new ATOM 0 HG21 THR A 504 2.215 17.564 9.475 1.00 0.00 H new ATOM 0 HG22 THR A 504 3.640 16.503 9.373 1.00 0.00 H new ATOM 0 HG23 THR A 504 2.961 17.226 7.895 1.00 0.00 H new ATOM 1115 N PRO A 505 4.904 14.257 7.660 1.00 0.00 N ATOM 1116 CA PRO A 505 6.270 14.140 8.158 1.00 0.00 C ATOM 1117 C PRO A 505 6.698 15.407 8.889 1.00 0.00 C ATOM 1118 O PRO A 505 6.739 16.489 8.303 1.00 0.00 O ATOM 1119 CB PRO A 505 7.107 13.888 6.902 1.00 0.00 C ATOM 1120 CG PRO A 505 6.380 14.610 5.819 1.00 0.00 C ATOM 1121 CD PRO A 505 4.921 14.496 6.173 1.00 0.00 C ATOM 0 HA PRO A 505 6.386 13.340 8.889 1.00 0.00 H new ATOM 0 HB2 PRO A 505 8.123 14.266 7.019 1.00 0.00 H new ATOM 0 HB3 PRO A 505 7.187 12.823 6.685 1.00 0.00 H new ATOM 0 HG2 PRO A 505 6.691 15.653 5.765 1.00 0.00 H new ATOM 0 HG3 PRO A 505 6.584 14.166 4.845 1.00 0.00 H new ATOM 0 HD2 PRO A 505 4.378 15.405 5.912 1.00 0.00 H new ATOM 0 HD3 PRO A 505 4.446 13.676 5.635 1.00 0.00 H new ATOM 1129 N THR A 506 7.017 15.265 10.170 1.00 0.00 N ATOM 1130 CA THR A 506 7.437 16.399 10.985 1.00 0.00 C ATOM 1131 C THR A 506 8.955 16.456 11.110 1.00 0.00 C ATOM 1132 O THR A 506 9.500 17.334 11.776 1.00 0.00 O ATOM 1133 CB THR A 506 6.819 16.342 12.395 1.00 0.00 C ATOM 1134 OG1 THR A 506 7.182 15.108 13.030 1.00 0.00 O ATOM 1135 CG2 THR A 506 5.304 16.440 12.318 1.00 0.00 C ATOM 0 H THR A 506 6.993 14.375 10.667 1.00 0.00 H new ATOM 0 HA THR A 506 7.083 17.297 10.479 1.00 0.00 H new ATOM 0 HB THR A 506 7.199 17.183 12.975 1.00 0.00 H new ATOM 0 HG1 THR A 506 6.790 15.074 13.927 1.00 0.00 H new ATOM 0 HG21 THR A 506 4.885 16.398 13.323 1.00 0.00 H new ATOM 0 HG22 THR A 506 5.024 17.382 11.847 1.00 0.00 H new ATOM 0 HG23 THR A 506 4.915 15.610 11.728 1.00 0.00 H new ATOM 1143 N GLN A 507 9.632 15.513 10.462 1.00 0.00 N ATOM 1144 CA GLN A 507 11.090 15.490 10.451 1.00 0.00 C ATOM 1145 C GLN A 507 11.626 15.341 9.031 1.00 0.00 C ATOM 1146 O GLN A 507 11.113 14.546 8.244 1.00 0.00 O ATOM 1147 CB GLN A 507 11.615 14.347 11.323 1.00 0.00 C ATOM 1148 CG GLN A 507 13.130 14.266 11.398 1.00 0.00 C ATOM 1149 CD GLN A 507 13.606 13.187 12.351 1.00 0.00 C ATOM 1150 OE1 GLN A 507 12.800 12.489 12.973 1.00 0.00 O ATOM 1151 NE2 GLN A 507 14.921 13.045 12.474 1.00 0.00 N ATOM 0 H GLN A 507 9.194 14.755 9.938 1.00 0.00 H new ATOM 0 HA GLN A 507 11.440 16.439 10.856 1.00 0.00 H new ATOM 0 HB2 GLN A 507 11.218 14.463 12.332 1.00 0.00 H new ATOM 0 HB3 GLN A 507 11.231 13.403 10.936 1.00 0.00 H new ATOM 0 HG2 GLN A 507 13.530 14.070 10.403 1.00 0.00 H new ATOM 0 HG3 GLN A 507 13.527 15.230 11.717 1.00 0.00 H new ATOM 0 HE21 GLN A 507 15.551 13.644 11.940 1.00 0.00 H new ATOM 0 HE22 GLN A 507 15.301 12.337 13.102 1.00 0.00 H new ATOM 1160 N GLU A 508 12.661 16.111 8.712 1.00 0.00 N ATOM 1161 CA GLU A 508 13.306 16.025 7.408 1.00 0.00 C ATOM 1162 C GLU A 508 14.149 14.761 7.293 1.00 0.00 C ATOM 1163 O GLU A 508 14.846 14.381 8.233 1.00 0.00 O ATOM 1164 CB GLU A 508 14.173 17.260 7.156 1.00 0.00 C ATOM 1165 CG GLU A 508 15.049 17.172 5.914 1.00 0.00 C ATOM 1166 CD GLU A 508 15.851 18.427 5.721 1.00 0.00 C ATOM 1167 OE1 GLU A 508 16.640 18.745 6.578 1.00 0.00 O ATOM 1168 OE2 GLU A 508 15.759 19.010 4.666 1.00 0.00 O ATOM 0 H GLU A 508 13.071 16.802 9.340 1.00 0.00 H new ATOM 0 HA GLU A 508 12.523 15.983 6.651 1.00 0.00 H new ATOM 0 HB2 GLU A 508 13.525 18.132 7.067 1.00 0.00 H new ATOM 0 HB3 GLU A 508 14.811 17.424 8.024 1.00 0.00 H new ATOM 0 HG2 GLU A 508 15.721 16.318 6.000 1.00 0.00 H new ATOM 0 HG3 GLU A 508 14.425 16.999 5.038 1.00 0.00 H new ATOM 1175 N GLY A 509 14.080 14.114 6.134 1.00 0.00 N ATOM 1176 CA GLY A 509 14.768 12.846 5.924 1.00 0.00 C ATOM 1177 C GLY A 509 14.066 12.008 4.863 1.00 0.00 C ATOM 1178 O GLY A 509 12.998 12.374 4.375 1.00 0.00 O ATOM 0 H GLY A 509 13.554 14.447 5.326 1.00 0.00 H new ATOM 0 HA2 GLY A 509 15.798 13.034 5.620 1.00 0.00 H new ATOM 0 HA3 GLY A 509 14.808 12.291 6.861 1.00 0.00 H new ATOM 1182 N MET A 510 14.675 10.879 4.511 1.00 0.00 N ATOM 1183 CA MET A 510 14.080 9.958 3.548 1.00 0.00 C ATOM 1184 C MET A 510 13.110 9.002 4.228 1.00 0.00 C ATOM 1185 O MET A 510 13.447 8.367 5.227 1.00 0.00 O ATOM 1186 CB MET A 510 15.174 9.175 2.824 1.00 0.00 C ATOM 1187 CG MET A 510 16.050 10.018 1.907 1.00 0.00 C ATOM 1188 SD MET A 510 15.102 10.876 0.635 1.00 0.00 S ATOM 1189 CE MET A 510 14.497 9.493 -0.325 1.00 0.00 C ATOM 0 H MET A 510 15.579 10.580 4.878 1.00 0.00 H new ATOM 0 HA MET A 510 13.520 10.544 2.820 1.00 0.00 H new ATOM 0 HB2 MET A 510 15.808 8.689 3.566 1.00 0.00 H new ATOM 0 HB3 MET A 510 14.709 8.384 2.236 1.00 0.00 H new ATOM 0 HG2 MET A 510 16.595 10.749 2.504 1.00 0.00 H new ATOM 0 HG3 MET A 510 16.793 9.378 1.431 1.00 0.00 H new ATOM 0 HE1 MET A 510 14.124 9.851 -1.284 1.00 0.00 H new ATOM 0 HE2 MET A 510 15.308 8.784 -0.493 1.00 0.00 H new ATOM 0 HE3 MET A 510 13.690 9.000 0.217 1.00 0.00 H new ATOM 1199 N TYR A 511 11.904 8.904 3.681 1.00 0.00 N ATOM 1200 CA TYR A 511 10.905 7.971 4.190 1.00 0.00 C ATOM 1201 C TYR A 511 10.498 6.964 3.122 1.00 0.00 C ATOM 1202 O TYR A 511 10.138 7.338 2.006 1.00 0.00 O ATOM 1203 CB TYR A 511 9.673 8.728 4.694 1.00 0.00 C ATOM 1204 CG TYR A 511 9.933 9.568 5.926 1.00 0.00 C ATOM 1205 CD1 TYR A 511 10.556 10.803 5.827 1.00 0.00 C ATOM 1206 CD2 TYR A 511 9.552 9.125 7.183 1.00 0.00 C ATOM 1207 CE1 TYR A 511 10.795 11.575 6.947 1.00 0.00 C ATOM 1208 CE2 TYR A 511 9.785 9.887 8.310 1.00 0.00 C ATOM 1209 CZ TYR A 511 10.407 11.113 8.188 1.00 0.00 C ATOM 1210 OH TYR A 511 10.642 11.877 9.309 1.00 0.00 O ATOM 0 H TYR A 511 11.594 9.460 2.884 1.00 0.00 H new ATOM 0 HA TYR A 511 11.351 7.426 5.022 1.00 0.00 H new ATOM 0 HB2 TYR A 511 9.304 9.373 3.897 1.00 0.00 H new ATOM 0 HB3 TYR A 511 8.883 8.011 4.915 1.00 0.00 H new ATOM 0 HD1 TYR A 511 10.860 11.168 4.857 1.00 0.00 H new ATOM 0 HD2 TYR A 511 9.064 8.167 7.282 1.00 0.00 H new ATOM 0 HE1 TYR A 511 11.282 12.534 6.852 1.00 0.00 H new ATOM 0 HE2 TYR A 511 9.482 9.526 9.282 1.00 0.00 H new ATOM 0 HH TYR A 511 10.830 12.801 9.042 1.00 0.00 H new ATOM 1220 N ARG A 512 10.553 5.683 3.472 1.00 0.00 N ATOM 1221 CA ARG A 512 10.203 4.619 2.540 1.00 0.00 C ATOM 1222 C ARG A 512 8.849 4.009 2.886 1.00 0.00 C ATOM 1223 O ARG A 512 8.662 3.468 3.975 1.00 0.00 O ATOM 1224 CB ARG A 512 11.285 3.554 2.450 1.00 0.00 C ATOM 1225 CG ARG A 512 11.058 2.499 1.378 1.00 0.00 C ATOM 1226 CD ARG A 512 12.168 1.525 1.233 1.00 0.00 C ATOM 1227 NE ARG A 512 12.291 0.584 2.334 1.00 0.00 N ATOM 1228 CZ ARG A 512 13.316 -0.277 2.496 1.00 0.00 C ATOM 1229 NH1 ARG A 512 14.287 -0.346 1.613 1.00 0.00 N ATOM 1230 NH2 ARG A 512 13.307 -1.068 3.553 1.00 0.00 N ATOM 0 H ARG A 512 10.837 5.357 4.396 1.00 0.00 H new ATOM 0 HA ARG A 512 10.125 5.072 1.552 1.00 0.00 H new ATOM 0 HB2 ARG A 512 12.241 4.043 2.261 1.00 0.00 H new ATOM 0 HB3 ARG A 512 11.367 3.057 3.417 1.00 0.00 H new ATOM 0 HG2 ARG A 512 10.142 1.956 1.608 1.00 0.00 H new ATOM 0 HG3 ARG A 512 10.901 2.998 0.422 1.00 0.00 H new ATOM 0 HD2 ARG A 512 12.026 0.966 0.308 1.00 0.00 H new ATOM 0 HD3 ARG A 512 13.105 2.073 1.133 1.00 0.00 H new ATOM 0 HE ARG A 512 11.549 0.574 3.034 1.00 0.00 H new ATOM 0 HH11 ARG A 512 14.272 0.257 0.791 1.00 0.00 H new ATOM 0 HH12 ARG A 512 15.055 -1.003 1.750 1.00 0.00 H new ATOM 0 HH21 ARG A 512 12.538 -1.018 4.221 1.00 0.00 H new ATOM 0 HH22 ARG A 512 14.069 -1.729 3.702 1.00 0.00 H new ATOM 1244 N ILE A 513 7.909 4.100 1.952 1.00 0.00 N ATOM 1245 CA ILE A 513 6.551 3.622 2.183 1.00 0.00 C ATOM 1246 C ILE A 513 6.316 2.284 1.494 1.00 0.00 C ATOM 1247 O ILE A 513 6.473 2.164 0.280 1.00 0.00 O ATOM 1248 CB ILE A 513 5.503 4.634 1.687 1.00 0.00 C ATOM 1249 CG1 ILE A 513 5.691 5.983 2.387 1.00 0.00 C ATOM 1250 CG2 ILE A 513 4.097 4.101 1.920 1.00 0.00 C ATOM 1251 CD1 ILE A 513 4.836 7.092 1.818 1.00 0.00 C ATOM 0 H ILE A 513 8.063 4.501 1.027 1.00 0.00 H new ATOM 0 HA ILE A 513 6.440 3.498 3.260 1.00 0.00 H new ATOM 0 HB ILE A 513 5.641 4.780 0.616 1.00 0.00 H new ATOM 0 HG12 ILE A 513 5.461 5.867 3.446 1.00 0.00 H new ATOM 0 HG13 ILE A 513 6.739 6.274 2.319 1.00 0.00 H new ATOM 0 HG21 ILE A 513 3.368 4.829 1.564 1.00 0.00 H new ATOM 0 HG22 ILE A 513 3.969 3.164 1.378 1.00 0.00 H new ATOM 0 HG23 ILE A 513 3.945 3.928 2.985 1.00 0.00 H new ATOM 0 HD11 ILE A 513 5.025 8.015 2.366 1.00 0.00 H new ATOM 0 HD12 ILE A 513 5.082 7.238 0.766 1.00 0.00 H new ATOM 0 HD13 ILE A 513 3.784 6.824 1.911 1.00 0.00 H new ATOM 1263 N ASN A 514 5.939 1.279 2.277 1.00 0.00 N ATOM 1264 CA ASN A 514 5.755 -0.071 1.757 1.00 0.00 C ATOM 1265 C ASN A 514 4.325 -0.551 1.967 1.00 0.00 C ATOM 1266 O ASN A 514 3.693 -0.230 2.973 1.00 0.00 O ATOM 1267 CB ASN A 514 6.734 -1.047 2.386 1.00 0.00 C ATOM 1268 CG ASN A 514 8.160 -0.829 1.962 1.00 0.00 C ATOM 1269 OD1 ASN A 514 8.970 -0.262 2.704 1.00 0.00 O ATOM 1270 ND2 ASN A 514 8.450 -1.205 0.743 1.00 0.00 N ATOM 0 H ASN A 514 5.755 1.374 3.276 1.00 0.00 H new ATOM 0 HA ASN A 514 5.953 -0.033 0.686 1.00 0.00 H new ATOM 0 HB2 ASN A 514 6.670 -0.964 3.471 1.00 0.00 H new ATOM 0 HB3 ASN A 514 6.438 -2.063 2.126 1.00 0.00 H new ATOM 0 HD21 ASN A 514 9.381 -1.033 0.364 1.00 0.00 H new ATOM 0 HD22 ASN A 514 7.745 -1.670 0.171 1.00 0.00 H new ATOM 1277 N ALA A 515 3.819 -1.324 1.011 1.00 0.00 N ATOM 1278 CA ALA A 515 2.496 -1.923 1.131 1.00 0.00 C ATOM 1279 C ALA A 515 2.556 -3.432 0.932 1.00 0.00 C ATOM 1280 O ALA A 515 3.286 -3.927 0.075 1.00 0.00 O ATOM 1281 CB ALA A 515 1.535 -1.293 0.134 1.00 0.00 C ATOM 0 H ALA A 515 4.307 -1.550 0.144 1.00 0.00 H new ATOM 0 HA ALA A 515 2.130 -1.731 2.139 1.00 0.00 H new ATOM 0 HB1 ALA A 515 0.552 -1.752 0.237 1.00 0.00 H new ATOM 0 HB2 ALA A 515 1.459 -0.223 0.328 1.00 0.00 H new ATOM 0 HB3 ALA A 515 1.905 -1.452 -0.879 1.00 0.00 H new ATOM 1287 N THR A 516 1.784 -4.161 1.733 1.00 0.00 N ATOM 1288 CA THR A 516 1.733 -5.614 1.632 1.00 0.00 C ATOM 1289 C THR A 516 0.294 -6.113 1.604 1.00 0.00 C ATOM 1290 O THR A 516 -0.602 -5.483 2.163 1.00 0.00 O ATOM 1291 CB THR A 516 2.476 -6.288 2.800 1.00 0.00 C ATOM 1292 OG1 THR A 516 1.886 -5.885 4.043 1.00 0.00 O ATOM 1293 CG2 THR A 516 3.947 -5.900 2.792 1.00 0.00 C ATOM 0 H THR A 516 1.185 -3.768 2.459 1.00 0.00 H new ATOM 0 HA THR A 516 2.226 -5.881 0.697 1.00 0.00 H new ATOM 0 HB THR A 516 2.395 -7.369 2.686 1.00 0.00 H new ATOM 0 HG1 THR A 516 2.359 -6.316 4.785 1.00 0.00 H new ATOM 0 HG21 THR A 516 4.456 -6.386 3.625 1.00 0.00 H new ATOM 0 HG22 THR A 516 4.402 -6.217 1.854 1.00 0.00 H new ATOM 0 HG23 THR A 516 4.039 -4.818 2.892 1.00 0.00 H new ATOM 1301 N VAL A 517 0.080 -7.250 0.949 1.00 0.00 N ATOM 1302 CA VAL A 517 -1.227 -7.893 0.940 1.00 0.00 C ATOM 1303 C VAL A 517 -1.163 -9.281 1.565 1.00 0.00 C ATOM 1304 O VAL A 517 -0.177 -10.000 1.402 1.00 0.00 O ATOM 1305 CB VAL A 517 -1.789 -8.011 -0.488 1.00 0.00 C ATOM 1306 CG1 VAL A 517 -0.873 -8.864 -1.352 1.00 0.00 C ATOM 1307 CG2 VAL A 517 -3.193 -8.595 -0.464 1.00 0.00 C ATOM 0 H VAL A 517 0.796 -7.744 0.417 1.00 0.00 H new ATOM 0 HA VAL A 517 -1.891 -7.262 1.531 1.00 0.00 H new ATOM 0 HB VAL A 517 -1.840 -7.012 -0.920 1.00 0.00 H new ATOM 0 HG11 VAL A 517 -1.286 -8.937 -2.358 1.00 0.00 H new ATOM 0 HG12 VAL A 517 0.115 -8.406 -1.397 1.00 0.00 H new ATOM 0 HG13 VAL A 517 -0.791 -9.862 -0.921 1.00 0.00 H new ATOM 0 HG21 VAL A 517 -3.573 -8.671 -1.483 1.00 0.00 H new ATOM 0 HG22 VAL A 517 -3.167 -9.587 -0.012 1.00 0.00 H new ATOM 0 HG23 VAL A 517 -3.847 -7.947 0.120 1.00 0.00 H new ATOM 1524 N VAL A 532 4.076 -7.208 -2.655 1.00 0.00 N ATOM 1525 CA VAL A 532 4.707 -6.066 -2.006 1.00 0.00 C ATOM 1526 C VAL A 532 4.925 -4.924 -2.992 1.00 0.00 C ATOM 1527 O VAL A 532 5.278 -5.151 -4.150 1.00 0.00 O ATOM 1528 CB VAL A 532 6.058 -6.449 -1.373 1.00 0.00 C ATOM 1529 CG1 VAL A 532 6.695 -5.240 -0.705 1.00 0.00 C ATOM 1530 CG2 VAL A 532 5.874 -7.578 -0.370 1.00 0.00 C ATOM 0 HA VAL A 532 4.028 -5.739 -1.218 1.00 0.00 H new ATOM 0 HB VAL A 532 6.724 -6.795 -2.163 1.00 0.00 H new ATOM 0 HG11 VAL A 532 7.649 -5.529 -0.263 1.00 0.00 H new ATOM 0 HG12 VAL A 532 6.861 -4.459 -1.447 1.00 0.00 H new ATOM 0 HG13 VAL A 532 6.033 -4.864 0.075 1.00 0.00 H new ATOM 0 HG21 VAL A 532 6.838 -7.836 0.068 1.00 0.00 H new ATOM 0 HG22 VAL A 532 5.192 -7.258 0.418 1.00 0.00 H new ATOM 0 HG23 VAL A 532 5.460 -8.450 -0.876 1.00 0.00 H new ATOM 1540 N ALA A 533 4.713 -3.698 -2.526 1.00 0.00 N ATOM 1541 CA ALA A 533 5.002 -2.514 -3.325 1.00 0.00 C ATOM 1542 C ALA A 533 5.821 -1.503 -2.534 1.00 0.00 C ATOM 1543 O ALA A 533 5.508 -1.203 -1.381 1.00 0.00 O ATOM 1544 CB ALA A 533 3.712 -1.883 -3.824 1.00 0.00 C ATOM 0 H ALA A 533 4.341 -3.499 -1.597 1.00 0.00 H new ATOM 0 HA ALA A 533 5.594 -2.824 -4.186 1.00 0.00 H new ATOM 0 HB1 ALA A 533 3.945 -1.000 -4.419 1.00 0.00 H new ATOM 0 HB2 ALA A 533 3.169 -2.602 -4.438 1.00 0.00 H new ATOM 0 HB3 ALA A 533 3.095 -1.594 -2.973 1.00 0.00 H new ATOM 1550 N THR A 534 6.870 -0.979 -3.158 1.00 0.00 N ATOM 1551 CA THR A 534 7.765 -0.036 -2.497 1.00 0.00 C ATOM 1552 C THR A 534 7.720 1.330 -3.169 1.00 0.00 C ATOM 1553 O THR A 534 7.916 1.442 -4.379 1.00 0.00 O ATOM 1554 CB THR A 534 9.218 -0.546 -2.488 1.00 0.00 C ATOM 1555 OG1 THR A 534 9.287 -1.790 -1.778 1.00 0.00 O ATOM 1556 CG2 THR A 534 10.134 0.466 -1.820 1.00 0.00 C ATOM 0 H THR A 534 7.122 -1.192 -4.123 1.00 0.00 H new ATOM 0 HA THR A 534 7.417 0.058 -1.468 1.00 0.00 H new ATOM 0 HB THR A 534 9.543 -0.690 -3.519 1.00 0.00 H new ATOM 0 HG1 THR A 534 10.212 -2.114 -1.774 1.00 0.00 H new ATOM 0 HG21 THR A 534 11.157 0.089 -1.823 1.00 0.00 H new ATOM 0 HG22 THR A 534 10.094 1.409 -2.365 1.00 0.00 H new ATOM 0 HG23 THR A 534 9.810 0.627 -0.792 1.00 0.00 H new ATOM 1564 N PHE A 535 7.463 2.364 -2.379 1.00 0.00 N ATOM 1565 CA PHE A 535 7.417 3.728 -2.891 1.00 0.00 C ATOM 1566 C PHE A 535 8.249 4.668 -2.027 1.00 0.00 C ATOM 1567 O PHE A 535 8.111 4.688 -0.804 1.00 0.00 O ATOM 1568 CB PHE A 535 5.973 4.223 -2.968 1.00 0.00 C ATOM 1569 CG PHE A 535 5.835 5.603 -3.548 1.00 0.00 C ATOM 1570 CD1 PHE A 535 5.908 5.804 -4.918 1.00 0.00 C ATOM 1571 CD2 PHE A 535 5.632 6.700 -2.725 1.00 0.00 C ATOM 1572 CE1 PHE A 535 5.781 7.071 -5.453 1.00 0.00 C ATOM 1573 CE2 PHE A 535 5.505 7.968 -3.257 1.00 0.00 C ATOM 1574 CZ PHE A 535 5.580 8.155 -4.623 1.00 0.00 C ATOM 0 H PHE A 535 7.283 2.284 -1.378 1.00 0.00 H new ATOM 0 HA PHE A 535 7.842 3.722 -3.895 1.00 0.00 H new ATOM 0 HB2 PHE A 535 5.391 3.526 -3.571 1.00 0.00 H new ATOM 0 HB3 PHE A 535 5.542 4.215 -1.967 1.00 0.00 H new ATOM 0 HD1 PHE A 535 6.066 4.961 -5.574 1.00 0.00 H new ATOM 0 HD2 PHE A 535 5.573 6.561 -1.656 1.00 0.00 H new ATOM 0 HE1 PHE A 535 5.839 7.214 -6.522 1.00 0.00 H new ATOM 0 HE2 PHE A 535 5.347 8.814 -2.604 1.00 0.00 H new ATOM 0 HZ PHE A 535 5.482 9.146 -5.040 1.00 0.00 H new ATOM 1584 N ASP A 536 9.112 5.448 -2.672 1.00 0.00 N ATOM 1585 CA ASP A 536 10.074 6.278 -1.957 1.00 0.00 C ATOM 1586 C ASP A 536 9.603 7.724 -1.880 1.00 0.00 C ATOM 1587 O ASP A 536 9.239 8.323 -2.892 1.00 0.00 O ATOM 1588 CB ASP A 536 11.447 6.207 -2.630 1.00 0.00 C ATOM 1589 CG ASP A 536 12.148 4.864 -2.490 1.00 0.00 C ATOM 1590 OD1 ASP A 536 11.722 4.075 -1.681 1.00 0.00 O ATOM 1591 OD2 ASP A 536 13.001 4.574 -3.296 1.00 0.00 O ATOM 0 H ASP A 536 9.164 5.522 -3.688 1.00 0.00 H new ATOM 0 HA ASP A 536 10.157 5.892 -0.941 1.00 0.00 H new ATOM 0 HB2 ASP A 536 11.331 6.433 -3.690 1.00 0.00 H new ATOM 0 HB3 ASP A 536 12.086 6.982 -2.207 1.00 0.00 H new ATOM 1596 N VAL A 537 9.611 8.280 -0.673 1.00 0.00 N ATOM 1597 CA VAL A 537 9.243 9.676 -0.471 1.00 0.00 C ATOM 1598 C VAL A 537 10.382 10.459 0.169 1.00 0.00 C ATOM 1599 O VAL A 537 11.015 9.991 1.115 1.00 0.00 O ATOM 1600 CB VAL A 537 7.986 9.808 0.409 1.00 0.00 C ATOM 1601 CG1 VAL A 537 7.654 11.273 0.648 1.00 0.00 C ATOM 1602 CG2 VAL A 537 6.807 9.094 -0.236 1.00 0.00 C ATOM 0 H VAL A 537 9.869 7.784 0.181 1.00 0.00 H new ATOM 0 HA VAL A 537 9.030 10.090 -1.457 1.00 0.00 H new ATOM 0 HB VAL A 537 8.189 9.339 1.372 1.00 0.00 H new ATOM 0 HG11 VAL A 537 6.763 11.347 1.272 1.00 0.00 H new ATOM 0 HG12 VAL A 537 8.490 11.758 1.151 1.00 0.00 H new ATOM 0 HG13 VAL A 537 7.470 11.765 -0.307 1.00 0.00 H new ATOM 0 HG21 VAL A 537 5.927 9.197 0.399 1.00 0.00 H new ATOM 0 HG22 VAL A 537 6.604 9.535 -1.212 1.00 0.00 H new ATOM 0 HG23 VAL A 537 7.044 8.037 -0.358 1.00 0.00 H new ATOM 1612 N SER A 538 10.639 11.653 -0.355 1.00 0.00 N ATOM 1613 CA SER A 538 11.620 12.554 0.239 1.00 0.00 C ATOM 1614 C SER A 538 10.940 13.693 0.985 1.00 0.00 C ATOM 1615 O SER A 538 10.104 14.404 0.428 1.00 0.00 O ATOM 1616 CB SER A 538 12.542 13.102 -0.833 1.00 0.00 C ATOM 1617 OG SER A 538 13.443 14.045 -0.322 1.00 0.00 O ATOM 0 H SER A 538 10.181 12.019 -1.190 1.00 0.00 H new ATOM 0 HA SER A 538 12.210 11.987 0.959 1.00 0.00 H new ATOM 0 HB2 SER A 538 13.096 12.281 -1.288 1.00 0.00 H new ATOM 0 HB3 SER A 538 11.947 13.561 -1.623 1.00 0.00 H new ATOM 0 HG SER A 538 14.019 14.372 -1.044 1.00 0.00 H new ATOM 1623 N VAL A 539 11.304 13.863 2.253 1.00 0.00 N ATOM 1624 CA VAL A 539 10.794 14.969 3.055 1.00 0.00 C ATOM 1625 C VAL A 539 11.830 16.079 3.184 1.00 0.00 C ATOM 1626 O VAL A 539 12.974 15.831 3.567 1.00 0.00 O ATOM 1627 CB VAL A 539 10.378 14.503 4.461 1.00 0.00 C ATOM 1628 CG1 VAL A 539 9.894 15.683 5.292 1.00 0.00 C ATOM 1629 CG2 VAL A 539 9.295 13.438 4.371 1.00 0.00 C ATOM 0 H VAL A 539 11.951 13.248 2.747 1.00 0.00 H new ATOM 0 HA VAL A 539 9.916 15.354 2.536 1.00 0.00 H new ATOM 0 HB VAL A 539 11.249 14.069 4.951 1.00 0.00 H new ATOM 0 HG11 VAL A 539 9.604 15.335 6.283 1.00 0.00 H new ATOM 0 HG12 VAL A 539 10.696 16.416 5.385 1.00 0.00 H new ATOM 0 HG13 VAL A 539 9.036 16.144 4.804 1.00 0.00 H new ATOM 0 HG21 VAL A 539 9.013 13.120 5.375 1.00 0.00 H new ATOM 0 HG22 VAL A 539 8.423 13.848 3.862 1.00 0.00 H new ATOM 0 HG23 VAL A 539 9.672 12.582 3.812 1.00 0.00 H new ATOM 1639 N VAL A 540 11.424 17.302 2.862 1.00 0.00 N ATOM 1640 CA VAL A 540 12.324 18.448 2.919 1.00 0.00 C ATOM 1641 C VAL A 540 11.782 19.526 3.848 1.00 0.00 C ATOM 1642 O VAL A 540 10.586 19.567 4.138 1.00 0.00 O ATOM 1643 CB VAL A 540 12.554 19.056 1.524 1.00 0.00 C ATOM 1644 CG1 VAL A 540 13.220 18.043 0.605 1.00 0.00 C ATOM 1645 CG2 VAL A 540 11.240 19.533 0.925 1.00 0.00 C ATOM 0 H VAL A 540 10.476 17.526 2.558 1.00 0.00 H new ATOM 0 HA VAL A 540 13.275 18.082 3.306 1.00 0.00 H new ATOM 0 HB VAL A 540 13.216 19.915 1.629 1.00 0.00 H new ATOM 0 HG11 VAL A 540 13.375 18.490 -0.377 1.00 0.00 H new ATOM 0 HG12 VAL A 540 14.181 17.747 1.025 1.00 0.00 H new ATOM 0 HG13 VAL A 540 12.581 17.165 0.508 1.00 0.00 H new ATOM 0 HG21 VAL A 540 11.423 19.960 -0.061 1.00 0.00 H new ATOM 0 HG22 VAL A 540 10.554 18.690 0.834 1.00 0.00 H new ATOM 0 HG23 VAL A 540 10.799 20.291 1.572 1.00 0.00 H new ATOM 1655 N LEU A 541 12.668 20.399 4.315 1.00 0.00 N ATOM 1656 CA LEU A 541 12.269 21.526 5.149 1.00 0.00 C ATOM 1657 C LEU A 541 11.740 22.676 4.301 1.00 0.00 C ATOM 1658 O LEU A 541 12.254 23.793 4.360 1.00 0.00 O ATOM 1659 CB LEU A 541 13.451 21.996 6.005 1.00 0.00 C ATOM 1660 CG LEU A 541 14.047 20.933 6.935 1.00 0.00 C ATOM 1661 CD1 LEU A 541 15.274 21.488 7.646 1.00 0.00 C ATOM 1662 CD2 LEU A 541 12.996 20.490 7.943 1.00 0.00 C ATOM 0 H LEU A 541 13.670 20.347 4.129 1.00 0.00 H new ATOM 0 HA LEU A 541 11.465 21.194 5.806 1.00 0.00 H new ATOM 0 HB2 LEU A 541 14.237 22.358 5.343 1.00 0.00 H new ATOM 0 HB3 LEU A 541 13.127 22.844 6.609 1.00 0.00 H new ATOM 0 HG LEU A 541 14.355 20.069 6.346 1.00 0.00 H new ATOM 0 HD11 LEU A 541 15.689 20.725 8.304 1.00 0.00 H new ATOM 0 HD12 LEU A 541 16.022 21.777 6.908 1.00 0.00 H new ATOM 0 HD13 LEU A 541 14.990 22.360 8.235 1.00 0.00 H new ATOM 0 HD21 LEU A 541 13.421 19.734 8.603 1.00 0.00 H new ATOM 0 HD22 LEU A 541 12.674 21.348 8.533 1.00 0.00 H new ATOM 0 HD23 LEU A 541 12.140 20.070 7.415 1.00 0.00 H new