USER MOD reduce.3.24.130724 H: found=0, std=0, add=696, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 707 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 Single : A 417 SER OG : rot 180:sc= 0 USER MOD Single : A 421 ASN : amide:sc= -4.81! C(o=-4.8!,f=-5.3!) USER MOD Single : A 425 HIS :FLIP no HD1:sc= -0.029 F(o=-1,f=-0.029) USER MOD Single : A 428 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 431 ASN : amide:sc= -4.36! C(o=-4.4!,f=-12!) USER MOD Single : A 432 THR OG1 : rot 176:sc= -6.68! USER MOD Single : A 435 SER OG : rot 180:sc= -0.183 USER MOD Single : A 439 GLN : amide:sc= -0.0034 X(o=-0.0034,f=-0.014) USER MOD Single : A 442 GLN :FLIP amide:sc= -3.4! C(o=-5.7!,f=-3.4!) USER MOD Single : A 444 TYR OH : rot 180:sc= -5.19! USER MOD Single : A 445 THR OG1 : rot 180:sc= -0.0231! USER MOD Single : A 454 ASN : amide:sc= -6.15! C(o=-6.1!,f=-16!) USER MOD Single : A 458 SER OG : rot 180:sc= 0 USER MOD Single : A 459 ASN :FLIP amide:sc= -2.68 F(o=-4.3!,f=-2.7) USER MOD Single : A 462 GLN :FLIP amide:sc= -0.784 F(o=-4.4,f=-0.78) USER MOD Single : A 463 ASN :FLIP amide:sc= 0.133 F(o=-1.1,f=0.13) USER MOD Single : A 466 THR OG1 : rot 180:sc= 0 USER MOD Single : A 470 GLN :FLIP amide:sc= -0.139 F(o=-0.76,f=-0.14) USER MOD Single : A 475 GLN :FLIP amide:sc= 0.355 F(o=-4.2!,f=0.35) USER MOD Single : A 479 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 482 TYR OH : rot 180:sc= 0 USER MOD Single : A 486 HIS : no HD1:sc= -3.15! C(o=-3.1!,f=-3.1!) USER MOD Single : A 490 ASN : amide:sc= -1.82! C(o=-1.8!,f=-9.5!) USER MOD Single : A 491 THR OG1 : rot 180:sc= 0 USER MOD Single : A 496 SER OG : rot 180:sc= 0 USER MOD Single : A 497 SER OG : rot 180:sc= 0 USER MOD Single : A 501 HIS : no HD1:sc= 0 X(o=0,f=-0.004) USER MOD Single : A 502 ASN : amide:sc= -0.0219 K(o=-0.022,f=-1.6) USER MOD Single : A 508 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 510 ASN : amide:sc= -0.0174 X(o=-0.017,f=-0.13) USER MOD Single : A 513 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 516 CYS SG : rot -44:sc= 0.549 USER MOD ----------------------------------------------------------------- ATOM 18 N ASP A 412 -0.895 36.210 7.937 1.00 0.00 N ATOM 19 CA ASP A 412 -1.043 34.772 7.794 1.00 0.00 C ATOM 20 C ASP A 412 -0.409 34.076 9.001 1.00 0.00 C ATOM 21 O ASP A 412 0.762 34.296 9.305 1.00 0.00 O ATOM 22 CB ASP A 412 -0.336 34.269 6.534 1.00 0.00 C ATOM 23 CG ASP A 412 -0.121 32.755 6.474 1.00 0.00 C ATOM 24 OD1 ASP A 412 0.684 32.255 5.673 1.00 0.00 O ATOM 25 OD2 ASP A 412 -0.828 32.069 7.306 1.00 0.00 O ATOM 0 HA ASP A 412 -2.107 34.547 7.725 1.00 0.00 H new ATOM 0 HB2 ASP A 412 -0.917 34.573 5.663 1.00 0.00 H new ATOM 0 HB3 ASP A 412 0.633 34.762 6.458 1.00 0.00 H new ATOM 31 N VAL A 413 -1.213 33.249 9.656 1.00 0.00 N ATOM 32 CA VAL A 413 -0.744 32.520 10.822 1.00 0.00 C ATOM 33 C VAL A 413 -0.461 31.069 10.430 1.00 0.00 C ATOM 34 O VAL A 413 -1.018 30.564 9.457 1.00 0.00 O ATOM 35 CB VAL A 413 -1.762 32.644 11.959 1.00 0.00 C ATOM 36 CG1 VAL A 413 -2.738 31.466 11.952 1.00 0.00 C ATOM 37 CG2 VAL A 413 -1.060 32.766 13.313 1.00 0.00 C ATOM 0 H VAL A 413 -2.184 33.069 9.401 1.00 0.00 H new ATOM 0 HA VAL A 413 0.190 32.946 11.190 1.00 0.00 H new ATOM 0 HB VAL A 413 -2.336 33.556 11.796 1.00 0.00 H new ATOM 0 HG11 VAL A 413 -3.450 31.579 12.769 1.00 0.00 H new ATOM 0 HG12 VAL A 413 -3.275 31.444 11.004 1.00 0.00 H new ATOM 0 HG13 VAL A 413 -2.185 30.535 12.078 1.00 0.00 H new ATOM 0 HG21 VAL A 413 -1.806 32.853 14.103 1.00 0.00 H new ATOM 0 HG22 VAL A 413 -0.448 31.881 13.487 1.00 0.00 H new ATOM 0 HG23 VAL A 413 -0.425 33.652 13.315 1.00 0.00 H new ATOM 47 N ASP A 414 0.407 30.439 11.209 1.00 0.00 N ATOM 48 CA ASP A 414 0.773 29.056 10.956 1.00 0.00 C ATOM 49 C ASP A 414 -0.148 28.134 11.760 1.00 0.00 C ATOM 50 O ASP A 414 0.251 27.599 12.792 1.00 0.00 O ATOM 51 CB ASP A 414 2.214 28.779 11.389 1.00 0.00 C ATOM 52 CG ASP A 414 2.711 27.358 11.113 1.00 0.00 C ATOM 53 OD1 ASP A 414 3.923 27.107 11.048 1.00 0.00 O ATOM 54 OD2 ASP A 414 1.782 26.477 10.958 1.00 0.00 O ATOM 0 H ASP A 414 0.867 30.861 12.015 1.00 0.00 H new ATOM 0 HA ASP A 414 0.677 28.872 9.886 1.00 0.00 H new ATOM 0 HB2 ASP A 414 2.872 29.483 10.880 1.00 0.00 H new ATOM 0 HB3 ASP A 414 2.301 28.977 12.457 1.00 0.00 H new ATOM 60 N GLU A 415 -1.363 27.978 11.254 1.00 0.00 N ATOM 61 CA GLU A 415 -2.344 27.131 11.911 1.00 0.00 C ATOM 62 C GLU A 415 -1.771 25.728 12.129 1.00 0.00 C ATOM 63 O GLU A 415 -2.255 24.983 12.981 1.00 0.00 O ATOM 64 CB GLU A 415 -3.644 27.074 11.108 1.00 0.00 C ATOM 65 CG GLU A 415 -4.257 28.467 10.958 1.00 0.00 C ATOM 66 CD GLU A 415 -4.186 28.944 9.507 1.00 0.00 C ATOM 67 OE1 GLU A 415 -4.182 28.118 8.581 1.00 0.00 O ATOM 68 OE2 GLU A 415 -4.136 30.224 9.354 1.00 0.00 O ATOM 0 H GLU A 415 -1.690 28.424 10.397 1.00 0.00 H new ATOM 0 HA GLU A 415 -2.576 27.563 12.884 1.00 0.00 H new ATOM 0 HB2 GLU A 415 -3.449 26.651 10.123 1.00 0.00 H new ATOM 0 HB3 GLU A 415 -4.354 26.412 11.604 1.00 0.00 H new ATOM 0 HG2 GLU A 415 -5.296 28.448 11.288 1.00 0.00 H new ATOM 0 HG3 GLU A 415 -3.730 29.171 11.602 1.00 0.00 H new ATOM 76 N CYS A 416 -0.752 25.411 11.345 1.00 0.00 N ATOM 77 CA CYS A 416 -0.109 24.112 11.442 1.00 0.00 C ATOM 78 C CYS A 416 0.813 24.121 12.663 1.00 0.00 C ATOM 79 O CYS A 416 1.175 23.065 13.180 1.00 0.00 O ATOM 80 CB CYS A 416 0.647 23.757 10.160 1.00 0.00 C ATOM 81 SG CYS A 416 -0.222 22.587 9.054 1.00 0.00 S ATOM 0 H CYS A 416 -0.355 26.032 10.639 1.00 0.00 H new ATOM 0 HA CYS A 416 -0.867 23.338 11.566 1.00 0.00 H new ATOM 0 HB2 CYS A 416 0.848 24.675 9.608 1.00 0.00 H new ATOM 0 HB3 CYS A 416 1.612 23.330 10.431 1.00 0.00 H new ATOM 86 N SER A 417 1.164 25.325 13.090 1.00 0.00 N ATOM 87 CA SER A 417 2.036 25.485 14.243 1.00 0.00 C ATOM 88 C SER A 417 1.202 25.741 15.498 1.00 0.00 C ATOM 89 O SER A 417 1.622 25.408 16.606 1.00 0.00 O ATOM 90 CB SER A 417 3.031 26.626 14.024 1.00 0.00 C ATOM 91 OG SER A 417 3.899 26.798 15.142 1.00 0.00 O ATOM 0 H SER A 417 0.861 26.199 12.659 1.00 0.00 H new ATOM 0 HA SER A 417 2.603 24.564 14.375 1.00 0.00 H new ATOM 0 HB2 SER A 417 3.624 26.424 13.132 1.00 0.00 H new ATOM 0 HB3 SER A 417 2.486 27.552 13.842 1.00 0.00 H new ATOM 0 HG SER A 417 4.520 27.534 14.963 1.00 0.00 H new ATOM 97 N LEU A 418 0.034 26.330 15.286 1.00 0.00 N ATOM 98 CA LEU A 418 -0.864 26.636 16.387 1.00 0.00 C ATOM 99 C LEU A 418 -1.354 25.329 17.015 1.00 0.00 C ATOM 100 O LEU A 418 -0.868 24.920 18.067 1.00 0.00 O ATOM 101 CB LEU A 418 -1.992 27.556 15.920 1.00 0.00 C ATOM 102 CG LEU A 418 -1.601 29.007 15.638 1.00 0.00 C ATOM 103 CD1 LEU A 418 -2.170 29.479 14.297 1.00 0.00 C ATOM 104 CD2 LEU A 418 -2.015 29.923 16.790 1.00 0.00 C ATOM 0 H LEU A 418 -0.312 26.604 14.366 1.00 0.00 H new ATOM 0 HA LEU A 418 -0.339 27.188 17.166 1.00 0.00 H new ATOM 0 HB2 LEU A 418 -2.426 27.135 15.013 1.00 0.00 H new ATOM 0 HB3 LEU A 418 -2.775 27.552 16.679 1.00 0.00 H new ATOM 0 HG LEU A 418 -0.515 29.057 15.563 1.00 0.00 H new ATOM 0 HD11 LEU A 418 -1.877 30.514 14.121 1.00 0.00 H new ATOM 0 HD12 LEU A 418 -1.781 28.851 13.495 1.00 0.00 H new ATOM 0 HD13 LEU A 418 -3.258 29.409 14.318 1.00 0.00 H new ATOM 0 HD21 LEU A 418 -1.724 30.948 16.562 1.00 0.00 H new ATOM 0 HD22 LEU A 418 -3.096 29.873 16.924 1.00 0.00 H new ATOM 0 HD23 LEU A 418 -1.521 29.601 17.707 1.00 0.00 H new ATOM 116 N GLY A 419 -2.313 24.711 16.341 1.00 0.00 N ATOM 117 CA GLY A 419 -2.875 23.459 16.820 1.00 0.00 C ATOM 118 C GLY A 419 -3.792 22.832 15.768 1.00 0.00 C ATOM 119 O GLY A 419 -4.757 22.148 16.107 1.00 0.00 O ATOM 0 H GLY A 419 -2.715 25.053 15.468 1.00 0.00 H new ATOM 0 HA2 GLY A 419 -2.071 22.766 17.066 1.00 0.00 H new ATOM 0 HA3 GLY A 419 -3.436 23.635 17.738 1.00 0.00 H new ATOM 123 N ALA A 420 -3.458 23.087 14.511 1.00 0.00 N ATOM 124 CA ALA A 420 -4.239 22.556 13.406 1.00 0.00 C ATOM 125 C ALA A 420 -3.319 21.780 12.464 1.00 0.00 C ATOM 126 O ALA A 420 -2.893 22.304 11.434 1.00 0.00 O ATOM 127 CB ALA A 420 -4.967 23.701 12.699 1.00 0.00 C ATOM 0 H ALA A 420 -2.657 23.654 14.233 1.00 0.00 H new ATOM 0 HA ALA A 420 -4.998 21.863 13.770 1.00 0.00 H new ATOM 0 HB1 ALA A 420 -5.553 23.303 11.870 1.00 0.00 H new ATOM 0 HB2 ALA A 420 -5.630 24.201 13.405 1.00 0.00 H new ATOM 0 HB3 ALA A 420 -4.238 24.415 12.318 1.00 0.00 H new ATOM 133 N ASN A 421 -3.037 20.543 12.847 1.00 0.00 N ATOM 134 CA ASN A 421 -2.174 19.689 12.048 1.00 0.00 C ATOM 135 C ASN A 421 -2.948 18.437 11.630 1.00 0.00 C ATOM 136 O ASN A 421 -3.200 17.557 12.452 1.00 0.00 O ATOM 137 CB ASN A 421 -0.948 19.243 12.847 1.00 0.00 C ATOM 138 CG ASN A 421 -0.202 18.120 12.125 1.00 0.00 C ATOM 139 OD1 ASN A 421 0.597 18.345 11.231 1.00 0.00 O ATOM 140 ND2 ASN A 421 -0.505 16.901 12.561 1.00 0.00 N ATOM 0 H ASN A 421 -3.391 20.112 13.701 1.00 0.00 H new ATOM 0 HA ASN A 421 -1.849 20.258 11.177 1.00 0.00 H new ATOM 0 HB2 ASN A 421 -0.279 20.091 12.997 1.00 0.00 H new ATOM 0 HB3 ASN A 421 -1.258 18.902 13.835 1.00 0.00 H new ATOM 0 HD21 ASN A 421 -0.059 16.084 12.143 1.00 0.00 H new ATOM 0 HD22 ASN A 421 -1.183 16.782 13.314 1.00 0.00 H new ATOM 147 N PRO A 422 -3.314 18.397 10.321 1.00 0.00 N ATOM 148 CA PRO A 422 -4.053 17.268 9.785 1.00 0.00 C ATOM 149 C PRO A 422 -3.143 16.052 9.604 1.00 0.00 C ATOM 150 O PRO A 422 -3.592 14.912 9.719 1.00 0.00 O ATOM 151 CB PRO A 422 -4.642 17.769 8.476 1.00 0.00 C ATOM 152 CG PRO A 422 -3.835 19.000 8.100 1.00 0.00 C ATOM 153 CD PRO A 422 -3.033 19.423 9.321 1.00 0.00 C ATOM 0 HA PRO A 422 -4.841 16.925 10.456 1.00 0.00 H new ATOM 0 HB2 PRO A 422 -4.575 17.006 7.700 1.00 0.00 H new ATOM 0 HB3 PRO A 422 -5.698 18.014 8.591 1.00 0.00 H new ATOM 0 HG2 PRO A 422 -3.171 18.780 7.264 1.00 0.00 H new ATOM 0 HG3 PRO A 422 -4.495 19.806 7.779 1.00 0.00 H new ATOM 0 HD2 PRO A 422 -1.968 19.476 9.096 1.00 0.00 H new ATOM 0 HD3 PRO A 422 -3.335 20.410 9.671 1.00 0.00 H new ATOM 161 N CYS A 423 -1.879 16.336 9.324 1.00 0.00 N ATOM 162 CA CYS A 423 -0.902 15.280 9.126 1.00 0.00 C ATOM 163 C CYS A 423 -1.021 14.288 10.285 1.00 0.00 C ATOM 164 O CYS A 423 -0.582 13.145 10.177 1.00 0.00 O ATOM 165 CB CYS A 423 0.518 15.838 9.000 1.00 0.00 C ATOM 166 SG CYS A 423 0.839 16.775 7.460 1.00 0.00 S ATOM 0 H CYS A 423 -1.510 17.282 9.230 1.00 0.00 H new ATOM 0 HA CYS A 423 -1.107 14.767 8.187 1.00 0.00 H new ATOM 0 HB2 CYS A 423 0.715 16.488 9.852 1.00 0.00 H new ATOM 0 HB3 CYS A 423 1.225 15.011 9.060 1.00 0.00 H new ATOM 171 N GLU A 424 -1.622 14.763 11.366 1.00 0.00 N ATOM 172 CA GLU A 424 -1.807 13.933 12.545 1.00 0.00 C ATOM 173 C GLU A 424 -0.460 13.654 13.215 1.00 0.00 C ATOM 174 O GLU A 424 0.068 14.504 13.930 1.00 0.00 O ATOM 175 CB GLU A 424 -2.523 12.628 12.189 1.00 0.00 C ATOM 176 CG GLU A 424 -3.960 12.895 11.739 1.00 0.00 C ATOM 177 CD GLU A 424 -4.964 12.335 12.748 1.00 0.00 C ATOM 178 OE1 GLU A 424 -5.684 13.105 13.400 1.00 0.00 O ATOM 179 OE2 GLU A 424 -4.981 11.049 12.842 1.00 0.00 O ATOM 0 H GLU A 424 -1.987 15.712 11.450 1.00 0.00 H new ATOM 0 HA GLU A 424 -2.436 14.474 13.251 1.00 0.00 H new ATOM 0 HB2 GLU A 424 -1.979 12.116 11.395 1.00 0.00 H new ATOM 0 HB3 GLU A 424 -2.526 11.964 13.053 1.00 0.00 H new ATOM 0 HG2 GLU A 424 -4.115 13.968 11.623 1.00 0.00 H new ATOM 0 HG3 GLU A 424 -4.129 12.441 10.762 1.00 0.00 H new ATOM 187 N HIS A 425 0.057 12.461 12.960 1.00 0.00 N ATOM 188 CA HIS A 425 1.332 12.060 13.529 1.00 0.00 C ATOM 189 C HIS A 425 2.219 11.463 12.434 1.00 0.00 C ATOM 190 O HIS A 425 2.949 10.504 12.677 1.00 0.00 O ATOM 191 CB HIS A 425 1.125 11.109 14.708 1.00 0.00 C ATOM 192 CG HIS A 425 0.418 9.824 14.344 1.00 0.00 C ATOM 193 ND1 HIS A 425 -0.742 9.609 13.661 1.00 0.00 N flip ATOM 194 CD2 HIS A 425 0.904 8.576 14.693 1.00 0.00 C flip ATOM 195 CE1 HIS A 425 -0.953 8.300 13.593 1.00 0.00 C flip ATOM 196 NE2 HIS A 425 0.066 7.658 14.234 1.00 0.00 N flip ATOM 0 H HIS A 425 -0.385 11.759 12.366 1.00 0.00 H new ATOM 0 HA HIS A 425 1.847 12.934 13.928 1.00 0.00 H new ATOM 0 HB2 HIS A 425 2.095 10.868 15.142 1.00 0.00 H new ATOM 0 HB3 HIS A 425 0.550 11.622 15.479 1.00 0.00 H new ATOM 0 HD2 HIS A 425 1.812 8.383 15.245 1.00 0.00 H new ATOM 0 HE1 HIS A 425 -1.793 7.822 13.110 1.00 0.00 H new ATOM 0 HE2 HIS A 425 0.165 6.649 14.341 1.00 0.00 H new ATOM 204 N ALA A 426 2.125 12.057 11.253 1.00 0.00 N ATOM 205 CA ALA A 426 2.910 11.597 10.120 1.00 0.00 C ATOM 206 C ALA A 426 2.632 12.495 8.913 1.00 0.00 C ATOM 207 O ALA A 426 1.671 12.274 8.178 1.00 0.00 O ATOM 208 CB ALA A 426 2.587 10.128 9.839 1.00 0.00 C ATOM 0 H ALA A 426 1.517 12.852 11.056 1.00 0.00 H new ATOM 0 HA ALA A 426 3.976 11.662 10.340 1.00 0.00 H new ATOM 0 HB1 ALA A 426 3.175 9.782 8.989 1.00 0.00 H new ATOM 0 HB2 ALA A 426 2.829 9.528 10.716 1.00 0.00 H new ATOM 0 HB3 ALA A 426 1.526 10.026 9.611 1.00 0.00 H new ATOM 214 N GLY A 427 3.490 13.491 8.748 1.00 0.00 N ATOM 215 CA GLY A 427 3.349 14.425 7.642 1.00 0.00 C ATOM 216 C GLY A 427 4.023 15.759 7.963 1.00 0.00 C ATOM 217 O GLY A 427 4.460 15.983 9.090 1.00 0.00 O ATOM 0 H GLY A 427 4.285 13.672 9.361 1.00 0.00 H new ATOM 0 HA2 GLY A 427 3.791 13.998 6.742 1.00 0.00 H new ATOM 0 HA3 GLY A 427 2.292 14.589 7.432 1.00 0.00 H new ATOM 221 N LYS A 428 4.090 16.612 6.950 1.00 0.00 N ATOM 222 CA LYS A 428 4.704 17.918 7.108 1.00 0.00 C ATOM 223 C LYS A 428 3.611 18.984 7.195 1.00 0.00 C ATOM 224 O LYS A 428 2.737 19.054 6.332 1.00 0.00 O ATOM 225 CB LYS A 428 5.722 18.170 5.995 1.00 0.00 C ATOM 226 CG LYS A 428 7.071 18.604 6.574 1.00 0.00 C ATOM 227 CD LYS A 428 7.016 20.055 7.059 1.00 0.00 C ATOM 228 CE LYS A 428 7.811 20.975 6.129 1.00 0.00 C ATOM 229 NZ LYS A 428 9.233 21.018 6.533 1.00 0.00 N ATOM 0 H LYS A 428 3.728 16.422 6.015 1.00 0.00 H new ATOM 0 HA LYS A 428 5.268 17.963 8.040 1.00 0.00 H new ATOM 0 HB2 LYS A 428 5.851 17.264 5.403 1.00 0.00 H new ATOM 0 HB3 LYS A 428 5.347 18.940 5.321 1.00 0.00 H new ATOM 0 HG2 LYS A 428 7.343 17.950 7.402 1.00 0.00 H new ATOM 0 HG3 LYS A 428 7.847 18.499 5.816 1.00 0.00 H new ATOM 0 HD2 LYS A 428 5.979 20.387 7.106 1.00 0.00 H new ATOM 0 HD3 LYS A 428 7.417 20.120 8.070 1.00 0.00 H new ATOM 0 HE2 LYS A 428 7.730 20.621 5.101 1.00 0.00 H new ATOM 0 HE3 LYS A 428 7.389 21.980 6.154 1.00 0.00 H new ATOM 0 HZ1 LYS A 428 9.757 21.647 5.891 1.00 0.00 H new ATOM 0 HZ2 LYS A 428 9.307 21.377 7.506 1.00 0.00 H new ATOM 0 HZ3 LYS A 428 9.636 20.061 6.486 1.00 0.00 H new ATOM 242 N CYS A 429 3.693 19.788 8.245 1.00 0.00 N ATOM 243 CA CYS A 429 2.723 20.848 8.455 1.00 0.00 C ATOM 244 C CYS A 429 3.411 22.190 8.200 1.00 0.00 C ATOM 245 O CYS A 429 4.288 22.597 8.961 1.00 0.00 O ATOM 246 CB CYS A 429 2.105 20.780 9.854 1.00 0.00 C ATOM 247 SG CYS A 429 0.280 20.898 9.894 1.00 0.00 S ATOM 0 H CYS A 429 4.418 19.726 8.960 1.00 0.00 H new ATOM 0 HA CYS A 429 1.895 20.729 7.756 1.00 0.00 H new ATOM 0 HB2 CYS A 429 2.405 19.843 10.323 1.00 0.00 H new ATOM 0 HB3 CYS A 429 2.520 21.586 10.459 1.00 0.00 H new ATOM 252 N ILE A 430 2.989 22.840 7.124 1.00 0.00 N ATOM 253 CA ILE A 430 3.555 24.128 6.759 1.00 0.00 C ATOM 254 C ILE A 430 2.488 25.212 6.917 1.00 0.00 C ATOM 255 O ILE A 430 1.315 24.907 7.127 1.00 0.00 O ATOM 256 CB ILE A 430 4.165 24.065 5.357 1.00 0.00 C ATOM 257 CG1 ILE A 430 3.846 22.731 4.679 1.00 0.00 C ATOM 258 CG2 ILE A 430 5.669 24.341 5.401 1.00 0.00 C ATOM 259 CD1 ILE A 430 4.540 21.572 5.395 1.00 0.00 C ATOM 0 H ILE A 430 2.263 22.499 6.494 1.00 0.00 H new ATOM 0 HA ILE A 430 4.375 24.388 7.428 1.00 0.00 H new ATOM 0 HB ILE A 430 3.711 24.850 4.752 1.00 0.00 H new ATOM 0 HG12 ILE A 430 2.768 22.569 4.677 1.00 0.00 H new ATOM 0 HG13 ILE A 430 4.165 22.763 3.637 1.00 0.00 H new ATOM 0 HG21 ILE A 430 6.078 24.290 4.392 1.00 0.00 H new ATOM 0 HG22 ILE A 430 5.845 25.334 5.814 1.00 0.00 H new ATOM 0 HG23 ILE A 430 6.158 23.595 6.028 1.00 0.00 H new ATOM 0 HD11 ILE A 430 4.296 20.636 4.893 1.00 0.00 H new ATOM 0 HD12 ILE A 430 5.619 21.725 5.374 1.00 0.00 H new ATOM 0 HD13 ILE A 430 4.200 21.528 6.430 1.00 0.00 H new ATOM 271 N ASN A 431 2.933 26.455 6.813 1.00 0.00 N ATOM 272 CA ASN A 431 2.030 27.587 6.943 1.00 0.00 C ATOM 273 C ASN A 431 1.830 28.234 5.570 1.00 0.00 C ATOM 274 O ASN A 431 2.787 28.415 4.819 1.00 0.00 O ATOM 275 CB ASN A 431 2.608 28.646 7.884 1.00 0.00 C ATOM 276 CG ASN A 431 1.731 29.900 7.902 1.00 0.00 C ATOM 277 OD1 ASN A 431 0.646 29.939 7.344 1.00 0.00 O ATOM 278 ND2 ASN A 431 2.260 30.920 8.571 1.00 0.00 N ATOM 0 H ASN A 431 3.907 26.704 6.640 1.00 0.00 H new ATOM 0 HA ASN A 431 1.086 27.221 7.347 1.00 0.00 H new ATOM 0 HB2 ASN A 431 2.687 28.238 8.892 1.00 0.00 H new ATOM 0 HB3 ASN A 431 3.617 28.908 7.566 1.00 0.00 H new ATOM 0 HD21 ASN A 431 1.753 31.802 8.640 1.00 0.00 H new ATOM 0 HD22 ASN A 431 3.173 30.820 9.015 1.00 0.00 H new ATOM 285 N THR A 432 0.578 28.562 5.285 1.00 0.00 N ATOM 286 CA THR A 432 0.240 29.185 4.015 1.00 0.00 C ATOM 287 C THR A 432 -0.563 30.466 4.248 1.00 0.00 C ATOM 288 O THR A 432 -1.087 30.685 5.339 1.00 0.00 O ATOM 289 CB THR A 432 -0.499 28.150 3.165 1.00 0.00 C ATOM 290 OG1 THR A 432 -0.791 27.096 4.077 1.00 0.00 O ATOM 291 CG2 THR A 432 0.407 27.498 2.118 1.00 0.00 C ATOM 0 H THR A 432 -0.213 28.409 5.910 1.00 0.00 H new ATOM 0 HA THR A 432 1.134 29.493 3.473 1.00 0.00 H new ATOM 0 HB THR A 432 -1.344 28.626 2.668 1.00 0.00 H new ATOM 0 HG1 THR A 432 -1.327 26.411 3.625 1.00 0.00 H new ATOM 0 HG21 THR A 432 -0.167 26.772 1.542 1.00 0.00 H new ATOM 0 HG22 THR A 432 0.799 28.264 1.449 1.00 0.00 H new ATOM 0 HG23 THR A 432 1.235 26.994 2.617 1.00 0.00 H new ATOM 299 N LEU A 433 -0.634 31.279 3.204 1.00 0.00 N ATOM 300 CA LEU A 433 -1.364 32.534 3.281 1.00 0.00 C ATOM 301 C LEU A 433 -2.864 32.242 3.343 1.00 0.00 C ATOM 302 O LEU A 433 -3.411 31.588 2.455 1.00 0.00 O ATOM 303 CB LEU A 433 -0.964 33.457 2.128 1.00 0.00 C ATOM 304 CG LEU A 433 0.066 34.538 2.461 1.00 0.00 C ATOM 305 CD1 LEU A 433 0.589 35.208 1.189 1.00 0.00 C ATOM 306 CD2 LEU A 433 -0.506 35.554 3.451 1.00 0.00 C ATOM 0 H LEU A 433 -0.198 31.094 2.301 1.00 0.00 H new ATOM 0 HA LEU A 433 -1.105 33.071 4.193 1.00 0.00 H new ATOM 0 HB2 LEU A 433 -0.569 32.844 1.318 1.00 0.00 H new ATOM 0 HB3 LEU A 433 -1.863 33.944 1.750 1.00 0.00 H new ATOM 0 HG LEU A 433 0.917 34.061 2.946 1.00 0.00 H new ATOM 0 HD11 LEU A 433 1.319 35.972 1.454 1.00 0.00 H new ATOM 0 HD12 LEU A 433 1.061 34.460 0.552 1.00 0.00 H new ATOM 0 HD13 LEU A 433 -0.241 35.669 0.653 1.00 0.00 H new ATOM 0 HD21 LEU A 433 0.247 36.311 3.671 1.00 0.00 H new ATOM 0 HD22 LEU A 433 -1.385 36.031 3.016 1.00 0.00 H new ATOM 0 HD23 LEU A 433 -0.788 35.045 4.373 1.00 0.00 H new ATOM 318 N GLY A 434 -3.488 32.740 4.400 1.00 0.00 N ATOM 319 CA GLY A 434 -4.914 32.541 4.590 1.00 0.00 C ATOM 320 C GLY A 434 -5.200 31.174 5.214 1.00 0.00 C ATOM 321 O GLY A 434 -6.001 31.065 6.141 1.00 0.00 O ATOM 0 H GLY A 434 -3.032 33.281 5.134 1.00 0.00 H new ATOM 0 HA2 GLY A 434 -5.312 33.328 5.231 1.00 0.00 H new ATOM 0 HA3 GLY A 434 -5.427 32.621 3.631 1.00 0.00 H new ATOM 325 N SER A 435 -4.527 30.164 4.682 1.00 0.00 N ATOM 326 CA SER A 435 -4.697 28.808 5.175 1.00 0.00 C ATOM 327 C SER A 435 -3.332 28.156 5.396 1.00 0.00 C ATOM 328 O SER A 435 -2.308 28.693 4.976 1.00 0.00 O ATOM 329 CB SER A 435 -5.536 27.970 4.206 1.00 0.00 C ATOM 330 OG SER A 435 -5.800 26.668 4.719 1.00 0.00 O ATOM 0 H SER A 435 -3.863 30.258 3.914 1.00 0.00 H new ATOM 0 HA SER A 435 -5.228 28.854 6.126 1.00 0.00 H new ATOM 0 HB2 SER A 435 -6.479 28.480 4.008 1.00 0.00 H new ATOM 0 HB3 SER A 435 -5.013 27.885 3.253 1.00 0.00 H new ATOM 0 HG SER A 435 -6.339 26.165 4.073 1.00 0.00 H new ATOM 336 N PHE A 436 -3.359 27.006 6.054 1.00 0.00 N ATOM 337 CA PHE A 436 -2.136 26.276 6.337 1.00 0.00 C ATOM 338 C PHE A 436 -2.003 25.056 5.421 1.00 0.00 C ATOM 339 O PHE A 436 -2.998 24.419 5.083 1.00 0.00 O ATOM 340 CB PHE A 436 -2.224 25.801 7.788 1.00 0.00 C ATOM 341 CG PHE A 436 -3.108 24.569 7.989 1.00 0.00 C ATOM 342 CD1 PHE A 436 -2.682 23.349 7.565 1.00 0.00 C ATOM 343 CD2 PHE A 436 -4.320 24.694 8.591 1.00 0.00 C ATOM 344 CE1 PHE A 436 -3.503 22.206 7.752 1.00 0.00 C ATOM 345 CE2 PHE A 436 -5.143 23.551 8.778 1.00 0.00 C ATOM 346 CZ PHE A 436 -4.716 22.331 8.354 1.00 0.00 C ATOM 0 H PHE A 436 -4.210 26.562 6.399 1.00 0.00 H new ATOM 0 HA PHE A 436 -1.272 26.919 6.171 1.00 0.00 H new ATOM 0 HB2 PHE A 436 -1.220 25.577 8.147 1.00 0.00 H new ATOM 0 HB3 PHE A 436 -2.608 26.615 8.403 1.00 0.00 H new ATOM 0 HD1 PHE A 436 -1.719 23.250 7.086 1.00 0.00 H new ATOM 0 HD2 PHE A 436 -4.658 25.663 8.928 1.00 0.00 H new ATOM 0 HE1 PHE A 436 -3.164 21.237 7.416 1.00 0.00 H new ATOM 0 HE2 PHE A 436 -6.106 23.651 9.256 1.00 0.00 H new ATOM 0 HZ PHE A 436 -5.341 21.461 8.496 1.00 0.00 H new ATOM 356 N GLU A 437 -0.765 24.770 5.046 1.00 0.00 N ATOM 357 CA GLU A 437 -0.489 23.640 4.178 1.00 0.00 C ATOM 358 C GLU A 437 0.185 22.516 4.968 1.00 0.00 C ATOM 359 O GLU A 437 0.974 22.775 5.874 1.00 0.00 O ATOM 360 CB GLU A 437 0.371 24.062 2.984 1.00 0.00 C ATOM 361 CG GLU A 437 1.036 22.849 2.331 1.00 0.00 C ATOM 362 CD GLU A 437 1.231 23.074 0.829 1.00 0.00 C ATOM 363 OE1 GLU A 437 0.394 22.641 0.024 1.00 0.00 O ATOM 364 OE2 GLU A 437 2.298 23.725 0.510 1.00 0.00 O ATOM 0 H GLU A 437 0.058 25.302 5.328 1.00 0.00 H new ATOM 0 HA GLU A 437 -1.436 23.267 3.788 1.00 0.00 H new ATOM 0 HB2 GLU A 437 -0.247 24.581 2.251 1.00 0.00 H new ATOM 0 HB3 GLU A 437 1.135 24.767 3.313 1.00 0.00 H new ATOM 0 HG2 GLU A 437 2.000 22.661 2.803 1.00 0.00 H new ATOM 0 HG3 GLU A 437 0.423 21.962 2.493 1.00 0.00 H new ATOM 372 N CYS A 438 -0.151 21.290 4.594 1.00 0.00 N ATOM 373 CA CYS A 438 0.411 20.125 5.256 1.00 0.00 C ATOM 374 C CYS A 438 0.633 19.034 4.205 1.00 0.00 C ATOM 375 O CYS A 438 -0.295 18.664 3.486 1.00 0.00 O ATOM 376 CB CYS A 438 -0.479 19.640 6.402 1.00 0.00 C ATOM 377 SG CYS A 438 0.324 18.468 7.555 1.00 0.00 S ATOM 0 H CYS A 438 -0.805 21.078 3.841 1.00 0.00 H new ATOM 0 HA CYS A 438 1.365 20.389 5.711 1.00 0.00 H new ATOM 0 HB2 CYS A 438 -0.823 20.506 6.968 1.00 0.00 H new ATOM 0 HB3 CYS A 438 -1.364 19.163 5.980 1.00 0.00 H new ATOM 382 N GLN A 439 1.865 18.552 4.150 1.00 0.00 N ATOM 383 CA GLN A 439 2.219 17.512 3.198 1.00 0.00 C ATOM 384 C GLN A 439 1.830 16.137 3.746 1.00 0.00 C ATOM 385 O GLN A 439 1.709 15.960 4.956 1.00 0.00 O ATOM 386 CB GLN A 439 3.709 17.564 2.858 1.00 0.00 C ATOM 387 CG GLN A 439 4.171 19.007 2.637 1.00 0.00 C ATOM 388 CD GLN A 439 5.529 19.046 1.932 1.00 0.00 C ATOM 389 OE1 GLN A 439 5.689 18.589 0.811 1.00 0.00 O ATOM 390 NE2 GLN A 439 6.494 19.615 2.648 1.00 0.00 N ATOM 0 H GLN A 439 2.631 18.862 4.748 1.00 0.00 H new ATOM 0 HA GLN A 439 1.663 17.686 2.276 1.00 0.00 H new ATOM 0 HB2 GLN A 439 4.286 17.113 3.666 1.00 0.00 H new ATOM 0 HB3 GLN A 439 3.902 16.975 1.961 1.00 0.00 H new ATOM 0 HG2 GLN A 439 3.432 19.542 2.040 1.00 0.00 H new ATOM 0 HG3 GLN A 439 4.240 19.521 3.595 1.00 0.00 H new ATOM 0 HE21 GLN A 439 6.292 19.977 3.580 1.00 0.00 H new ATOM 0 HE22 GLN A 439 7.437 19.690 2.265 1.00 0.00 H new ATOM 399 N CYS A 440 1.643 15.201 2.827 1.00 0.00 N ATOM 400 CA CYS A 440 1.271 13.848 3.202 1.00 0.00 C ATOM 401 C CYS A 440 2.549 13.057 3.483 1.00 0.00 C ATOM 402 O CYS A 440 3.616 13.393 2.969 1.00 0.00 O ATOM 403 CB CYS A 440 0.410 13.180 2.128 1.00 0.00 C ATOM 404 SG CYS A 440 0.891 13.570 0.406 1.00 0.00 S ATOM 0 H CYS A 440 1.742 15.353 1.823 1.00 0.00 H new ATOM 0 HA CYS A 440 0.657 13.874 4.102 1.00 0.00 H new ATOM 0 HB2 CYS A 440 0.454 12.100 2.267 1.00 0.00 H new ATOM 0 HB3 CYS A 440 -0.628 13.478 2.277 1.00 0.00 H new ATOM 409 N LEU A 441 2.401 12.022 4.296 1.00 0.00 N ATOM 410 CA LEU A 441 3.531 11.181 4.651 1.00 0.00 C ATOM 411 C LEU A 441 3.288 9.762 4.131 1.00 0.00 C ATOM 412 O LEU A 441 2.199 9.215 4.295 1.00 0.00 O ATOM 413 CB LEU A 441 3.798 11.246 6.156 1.00 0.00 C ATOM 414 CG LEU A 441 5.248 11.503 6.570 1.00 0.00 C ATOM 415 CD1 LEU A 441 6.156 10.355 6.127 1.00 0.00 C ATOM 416 CD2 LEU A 441 5.736 12.856 6.047 1.00 0.00 C ATOM 0 H LEU A 441 1.515 11.746 4.719 1.00 0.00 H new ATOM 0 HA LEU A 441 4.441 11.546 4.174 1.00 0.00 H new ATOM 0 HB2 LEU A 441 3.175 12.032 6.582 1.00 0.00 H new ATOM 0 HB3 LEU A 441 3.475 10.306 6.603 1.00 0.00 H new ATOM 0 HG LEU A 441 5.291 11.545 7.658 1.00 0.00 H new ATOM 0 HD11 LEU A 441 7.181 10.563 6.434 1.00 0.00 H new ATOM 0 HD12 LEU A 441 5.820 9.427 6.589 1.00 0.00 H new ATOM 0 HD13 LEU A 441 6.115 10.256 5.042 1.00 0.00 H new ATOM 0 HD21 LEU A 441 6.769 13.014 6.355 1.00 0.00 H new ATOM 0 HD22 LEU A 441 5.676 12.869 4.959 1.00 0.00 H new ATOM 0 HD23 LEU A 441 5.111 13.650 6.454 1.00 0.00 H new ATOM 428 N GLN A 442 4.322 9.207 3.513 1.00 0.00 N ATOM 429 CA GLN A 442 4.235 7.864 2.968 1.00 0.00 C ATOM 430 C GLN A 442 3.008 7.737 2.062 1.00 0.00 C ATOM 431 O GLN A 442 3.048 8.136 0.899 1.00 0.00 O ATOM 432 CB GLN A 442 4.200 6.819 4.087 1.00 0.00 C ATOM 433 CG GLN A 442 5.613 6.360 4.453 1.00 0.00 C ATOM 434 CD GLN A 442 5.828 6.404 5.967 1.00 0.00 C ATOM 435 OE1 GLN A 442 5.417 7.533 6.539 1.00 0.00 O flip ATOM 436 NE2 GLN A 442 6.335 5.476 6.575 1.00 0.00 N flip ATOM 0 H GLN A 442 5.224 9.664 3.378 1.00 0.00 H new ATOM 0 HA GLN A 442 5.126 7.678 2.369 1.00 0.00 H new ATOM 0 HB2 GLN A 442 3.711 7.239 4.966 1.00 0.00 H new ATOM 0 HB3 GLN A 442 3.606 5.962 3.770 1.00 0.00 H new ATOM 0 HG2 GLN A 442 5.776 5.346 4.088 1.00 0.00 H new ATOM 0 HG3 GLN A 442 6.346 6.998 3.959 1.00 0.00 H new ATOM 0 HE21 GLN A 442 6.628 4.637 6.074 1.00 0.00 H new ATOM 0 HE22 GLN A 442 6.466 5.539 7.585 1.00 0.00 H new ATOM 445 N GLY A 443 1.948 7.178 2.628 1.00 0.00 N ATOM 446 CA GLY A 443 0.713 6.995 1.886 1.00 0.00 C ATOM 447 C GLY A 443 -0.487 7.512 2.682 1.00 0.00 C ATOM 448 O GLY A 443 -1.276 6.726 3.204 1.00 0.00 O ATOM 0 H GLY A 443 1.920 6.846 3.592 1.00 0.00 H new ATOM 0 HA2 GLY A 443 0.776 7.521 0.933 1.00 0.00 H new ATOM 0 HA3 GLY A 443 0.575 5.938 1.658 1.00 0.00 H new ATOM 452 N TYR A 444 -0.587 8.831 2.748 1.00 0.00 N ATOM 453 CA TYR A 444 -1.679 9.463 3.470 1.00 0.00 C ATOM 454 C TYR A 444 -2.752 9.975 2.508 1.00 0.00 C ATOM 455 O TYR A 444 -2.496 10.129 1.313 1.00 0.00 O ATOM 456 CB TYR A 444 -1.062 10.654 4.207 1.00 0.00 C ATOM 457 CG TYR A 444 -0.786 10.394 5.689 1.00 0.00 C ATOM 458 CD1 TYR A 444 -0.027 9.304 6.068 1.00 0.00 C ATOM 459 CD2 TYR A 444 -1.296 11.247 6.646 1.00 0.00 C ATOM 460 CE1 TYR A 444 0.233 9.059 7.463 1.00 0.00 C ATOM 461 CE2 TYR A 444 -1.035 11.002 8.041 1.00 0.00 C ATOM 462 CZ TYR A 444 -0.285 9.920 8.382 1.00 0.00 C ATOM 463 OH TYR A 444 -0.039 9.688 9.699 1.00 0.00 O ATOM 0 H TYR A 444 0.070 9.480 2.314 1.00 0.00 H new ATOM 0 HA TYR A 444 -2.154 8.752 4.146 1.00 0.00 H new ATOM 0 HB2 TYR A 444 -0.128 10.927 3.717 1.00 0.00 H new ATOM 0 HB3 TYR A 444 -1.731 11.510 4.117 1.00 0.00 H new ATOM 0 HD1 TYR A 444 0.371 8.636 5.319 1.00 0.00 H new ATOM 0 HD2 TYR A 444 -1.891 12.098 6.349 1.00 0.00 H new ATOM 0 HE1 TYR A 444 0.826 8.211 7.773 1.00 0.00 H new ATOM 0 HE2 TYR A 444 -1.426 11.663 8.800 1.00 0.00 H new ATOM 0 HH TYR A 444 -0.469 10.383 10.240 1.00 0.00 H new ATOM 473 N THR A 445 -3.929 10.223 3.061 1.00 0.00 N ATOM 474 CA THR A 445 -5.041 10.714 2.266 1.00 0.00 C ATOM 475 C THR A 445 -5.213 12.221 2.460 1.00 0.00 C ATOM 476 O THR A 445 -4.273 12.988 2.260 1.00 0.00 O ATOM 477 CB THR A 445 -6.285 9.905 2.642 1.00 0.00 C ATOM 478 OG1 THR A 445 -7.345 10.556 1.947 1.00 0.00 O ATOM 479 CG2 THR A 445 -6.658 10.060 4.118 1.00 0.00 C ATOM 0 H THR A 445 -4.137 10.093 4.051 1.00 0.00 H new ATOM 0 HA THR A 445 -4.856 10.576 1.201 1.00 0.00 H new ATOM 0 HB THR A 445 -6.115 8.852 2.418 1.00 0.00 H new ATOM 0 HG1 THR A 445 -8.190 10.095 2.133 1.00 0.00 H new ATOM 0 HG21 THR A 445 -7.547 9.467 4.333 1.00 0.00 H new ATOM 0 HG22 THR A 445 -5.832 9.715 4.740 1.00 0.00 H new ATOM 0 HG23 THR A 445 -6.861 11.109 4.334 1.00 0.00 H new ATOM 487 N GLY A 446 -6.422 12.601 2.850 1.00 0.00 N ATOM 488 CA GLY A 446 -6.729 14.002 3.076 1.00 0.00 C ATOM 489 C GLY A 446 -6.982 14.728 1.753 1.00 0.00 C ATOM 490 O GLY A 446 -6.533 14.280 0.698 1.00 0.00 O ATOM 0 H GLY A 446 -7.200 11.962 3.015 1.00 0.00 H new ATOM 0 HA2 GLY A 446 -7.608 14.087 3.715 1.00 0.00 H new ATOM 0 HA3 GLY A 446 -5.903 14.478 3.604 1.00 0.00 H new ATOM 494 N PRO A 447 -7.720 15.866 1.853 1.00 0.00 N ATOM 495 CA PRO A 447 -8.038 16.657 0.677 1.00 0.00 C ATOM 496 C PRO A 447 -6.818 17.450 0.202 1.00 0.00 C ATOM 497 O PRO A 447 -6.741 17.837 -0.962 1.00 0.00 O ATOM 498 CB PRO A 447 -9.195 17.548 1.103 1.00 0.00 C ATOM 499 CG PRO A 447 -9.176 17.557 2.623 1.00 0.00 C ATOM 500 CD PRO A 447 -8.268 16.428 3.085 1.00 0.00 C ATOM 0 HA PRO A 447 -8.318 16.043 -0.179 1.00 0.00 H new ATOM 0 HB2 PRO A 447 -9.079 18.556 0.705 1.00 0.00 H new ATOM 0 HB3 PRO A 447 -10.143 17.164 0.726 1.00 0.00 H new ATOM 0 HG2 PRO A 447 -8.813 18.515 2.994 1.00 0.00 H new ATOM 0 HG3 PRO A 447 -10.183 17.423 3.018 1.00 0.00 H new ATOM 0 HD2 PRO A 447 -7.477 16.798 3.738 1.00 0.00 H new ATOM 0 HD3 PRO A 447 -8.823 15.679 3.649 1.00 0.00 H new ATOM 508 N ARG A 448 -5.896 17.666 1.128 1.00 0.00 N ATOM 509 CA ARG A 448 -4.683 18.405 0.819 1.00 0.00 C ATOM 510 C ARG A 448 -3.466 17.480 0.890 1.00 0.00 C ATOM 511 O ARG A 448 -2.355 17.883 0.551 1.00 0.00 O ATOM 512 CB ARG A 448 -4.486 19.572 1.790 1.00 0.00 C ATOM 513 CG ARG A 448 -5.706 20.494 1.791 1.00 0.00 C ATOM 514 CD ARG A 448 -5.748 21.352 0.523 1.00 0.00 C ATOM 515 NE ARG A 448 -6.260 22.703 0.842 1.00 0.00 N ATOM 516 CZ ARG A 448 -7.564 22.993 1.032 1.00 0.00 C ATOM 517 NH1 ARG A 448 -8.502 22.026 0.938 1.00 0.00 N ATOM 518 NH2 ARG A 448 -7.910 24.236 1.312 1.00 0.00 N ATOM 0 H ARG A 448 -5.964 17.342 2.093 1.00 0.00 H new ATOM 0 HA ARG A 448 -4.784 18.801 -0.191 1.00 0.00 H new ATOM 0 HB2 ARG A 448 -4.315 19.188 2.796 1.00 0.00 H new ATOM 0 HB3 ARG A 448 -3.598 20.138 1.509 1.00 0.00 H new ATOM 0 HG2 ARG A 448 -6.616 19.898 1.861 1.00 0.00 H new ATOM 0 HG3 ARG A 448 -5.678 21.139 2.670 1.00 0.00 H new ATOM 0 HD2 ARG A 448 -4.750 21.425 0.091 1.00 0.00 H new ATOM 0 HD3 ARG A 448 -6.386 20.880 -0.224 1.00 0.00 H new ATOM 0 HE ARG A 448 -5.585 23.463 0.923 1.00 0.00 H new ATOM 0 HH11 ARG A 448 -8.227 21.068 0.722 1.00 0.00 H new ATOM 0 HH12 ARG A 448 -9.486 22.254 1.083 1.00 0.00 H new ATOM 0 HH21 ARG A 448 -7.196 24.961 1.382 1.00 0.00 H new ATOM 0 HH22 ARG A 448 -8.892 24.471 1.458 1.00 0.00 H new ATOM 531 N CYS A 449 -3.717 16.257 1.333 1.00 0.00 N ATOM 532 CA CYS A 449 -2.657 15.273 1.453 1.00 0.00 C ATOM 533 C CYS A 449 -2.019 15.419 2.836 1.00 0.00 C ATOM 534 O CYS A 449 -0.810 15.618 2.948 1.00 0.00 O ATOM 535 CB CYS A 449 -1.625 15.412 0.331 1.00 0.00 C ATOM 536 SG CYS A 449 -1.030 13.829 -0.368 1.00 0.00 S ATOM 0 H CYS A 449 -4.640 15.926 1.613 1.00 0.00 H new ATOM 0 HA CYS A 449 -3.075 14.272 1.351 1.00 0.00 H new ATOM 0 HB2 CYS A 449 -2.061 16.006 -0.472 1.00 0.00 H new ATOM 0 HB3 CYS A 449 -0.769 15.969 0.711 1.00 0.00 H new ATOM 541 N GLU A 450 -2.859 15.313 3.855 1.00 0.00 N ATOM 542 CA GLU A 450 -2.393 15.431 5.225 1.00 0.00 C ATOM 543 C GLU A 450 -3.211 14.521 6.145 1.00 0.00 C ATOM 544 O GLU A 450 -3.056 14.563 7.363 1.00 0.00 O ATOM 545 CB GLU A 450 -2.451 16.884 5.701 1.00 0.00 C ATOM 546 CG GLU A 450 -3.076 17.786 4.635 1.00 0.00 C ATOM 547 CD GLU A 450 -4.554 17.444 4.425 1.00 0.00 C ATOM 548 OE1 GLU A 450 -4.888 16.678 3.509 1.00 0.00 O ATOM 549 OE2 GLU A 450 -5.366 18.003 5.256 1.00 0.00 O ATOM 0 H GLU A 450 -3.861 15.146 3.758 1.00 0.00 H new ATOM 0 HA GLU A 450 -1.351 15.112 5.262 1.00 0.00 H new ATOM 0 HB2 GLU A 450 -3.032 16.946 6.621 1.00 0.00 H new ATOM 0 HB3 GLU A 450 -1.446 17.234 5.935 1.00 0.00 H new ATOM 0 HG2 GLU A 450 -2.979 18.830 4.934 1.00 0.00 H new ATOM 0 HG3 GLU A 450 -2.536 17.673 3.695 1.00 0.00 H new ATOM 557 N ILE A 451 -4.065 13.719 5.524 1.00 0.00 N ATOM 558 CA ILE A 451 -4.908 12.802 6.270 1.00 0.00 C ATOM 559 C ILE A 451 -4.379 11.375 6.098 1.00 0.00 C ATOM 560 O ILE A 451 -3.841 11.033 5.046 1.00 0.00 O ATOM 561 CB ILE A 451 -6.373 12.967 5.863 1.00 0.00 C ATOM 562 CG1 ILE A 451 -6.929 14.308 6.349 1.00 0.00 C ATOM 563 CG2 ILE A 451 -7.214 11.787 6.353 1.00 0.00 C ATOM 564 CD1 ILE A 451 -5.864 15.404 6.265 1.00 0.00 C ATOM 0 H ILE A 451 -4.190 13.686 4.512 1.00 0.00 H new ATOM 0 HA ILE A 451 -4.870 13.031 7.335 1.00 0.00 H new ATOM 0 HB ILE A 451 -6.427 12.971 4.774 1.00 0.00 H new ATOM 0 HG12 ILE A 451 -7.793 14.588 5.746 1.00 0.00 H new ATOM 0 HG13 ILE A 451 -7.276 14.211 7.378 1.00 0.00 H new ATOM 0 HG21 ILE A 451 -8.251 11.929 6.050 1.00 0.00 H new ATOM 0 HG22 ILE A 451 -6.833 10.863 5.918 1.00 0.00 H new ATOM 0 HG23 ILE A 451 -7.158 11.727 7.440 1.00 0.00 H new ATOM 0 HD11 ILE A 451 -6.284 16.347 6.616 1.00 0.00 H new ATOM 0 HD12 ILE A 451 -5.012 15.132 6.888 1.00 0.00 H new ATOM 0 HD13 ILE A 451 -5.537 15.515 5.231 1.00 0.00 H new ATOM 576 N ASP A 452 -4.552 10.584 7.145 1.00 0.00 N ATOM 577 CA ASP A 452 -4.099 9.204 7.122 1.00 0.00 C ATOM 578 C ASP A 452 -5.288 8.286 6.834 1.00 0.00 C ATOM 579 O ASP A 452 -6.265 8.278 7.581 1.00 0.00 O ATOM 580 CB ASP A 452 -3.504 8.796 8.472 1.00 0.00 C ATOM 581 CG ASP A 452 -3.786 7.354 8.895 1.00 0.00 C ATOM 582 OD1 ASP A 452 -4.920 7.005 9.255 1.00 0.00 O ATOM 583 OD2 ASP A 452 -2.771 6.562 8.844 1.00 0.00 O ATOM 0 H ASP A 452 -5.000 10.872 8.015 1.00 0.00 H new ATOM 0 HA ASP A 452 -3.336 9.113 6.349 1.00 0.00 H new ATOM 0 HB2 ASP A 452 -2.425 8.943 8.435 1.00 0.00 H new ATOM 0 HB3 ASP A 452 -3.891 9.466 9.240 1.00 0.00 H new ATOM 589 N VAL A 453 -5.167 7.535 5.750 1.00 0.00 N ATOM 590 CA VAL A 453 -6.221 6.616 5.355 1.00 0.00 C ATOM 591 C VAL A 453 -5.865 5.205 5.830 1.00 0.00 C ATOM 592 O VAL A 453 -4.742 4.956 6.264 1.00 0.00 O ATOM 593 CB VAL A 453 -6.445 6.697 3.843 1.00 0.00 C ATOM 594 CG1 VAL A 453 -5.113 6.744 3.091 1.00 0.00 C ATOM 595 CG2 VAL A 453 -7.310 5.533 3.355 1.00 0.00 C ATOM 0 H VAL A 453 -4.355 7.544 5.133 1.00 0.00 H new ATOM 0 HA VAL A 453 -7.164 6.891 5.827 1.00 0.00 H new ATOM 0 HB VAL A 453 -6.979 7.624 3.633 1.00 0.00 H new ATOM 0 HG11 VAL A 453 -5.302 6.801 2.019 1.00 0.00 H new ATOM 0 HG12 VAL A 453 -4.547 7.621 3.407 1.00 0.00 H new ATOM 0 HG13 VAL A 453 -4.539 5.844 3.311 1.00 0.00 H new ATOM 0 HG21 VAL A 453 -7.454 5.614 2.278 1.00 0.00 H new ATOM 0 HG22 VAL A 453 -6.814 4.590 3.585 1.00 0.00 H new ATOM 0 HG23 VAL A 453 -8.278 5.565 3.854 1.00 0.00 H new ATOM 605 N ASN A 454 -6.845 4.318 5.732 1.00 0.00 N ATOM 606 CA ASN A 454 -6.650 2.940 6.148 1.00 0.00 C ATOM 607 C ASN A 454 -6.406 2.069 4.914 1.00 0.00 C ATOM 608 O ASN A 454 -7.345 1.719 4.201 1.00 0.00 O ATOM 609 CB ASN A 454 -7.888 2.402 6.869 1.00 0.00 C ATOM 610 CG ASN A 454 -7.632 0.999 7.425 1.00 0.00 C ATOM 611 OD1 ASN A 454 -6.954 0.179 6.827 1.00 0.00 O ATOM 612 ND2 ASN A 454 -8.210 0.770 8.601 1.00 0.00 N ATOM 0 H ASN A 454 -7.776 4.527 5.371 1.00 0.00 H new ATOM 0 HA ASN A 454 -5.796 2.910 6.825 1.00 0.00 H new ATOM 0 HB2 ASN A 454 -8.161 3.075 7.682 1.00 0.00 H new ATOM 0 HB3 ASN A 454 -8.732 2.376 6.180 1.00 0.00 H new ATOM 0 HD21 ASN A 454 -8.099 -0.136 9.056 1.00 0.00 H new ATOM 0 HD22 ASN A 454 -8.765 1.500 9.047 1.00 0.00 H new ATOM 619 N GLU A 455 -5.139 1.746 4.698 1.00 0.00 N ATOM 620 CA GLU A 455 -4.759 0.923 3.562 1.00 0.00 C ATOM 621 C GLU A 455 -4.965 -0.557 3.887 1.00 0.00 C ATOM 622 O GLU A 455 -4.885 -1.408 3.002 1.00 0.00 O ATOM 623 CB GLU A 455 -3.312 1.198 3.146 1.00 0.00 C ATOM 624 CG GLU A 455 -2.440 1.505 4.364 1.00 0.00 C ATOM 625 CD GLU A 455 -2.386 3.010 4.635 1.00 0.00 C ATOM 626 OE1 GLU A 455 -1.298 3.561 4.860 1.00 0.00 O ATOM 627 OE2 GLU A 455 -3.527 3.612 4.602 1.00 0.00 O ATOM 0 H GLU A 455 -4.362 2.039 5.291 1.00 0.00 H new ATOM 0 HA GLU A 455 -5.400 1.182 2.719 1.00 0.00 H new ATOM 0 HB2 GLU A 455 -2.912 0.333 2.616 1.00 0.00 H new ATOM 0 HB3 GLU A 455 -3.283 2.038 2.452 1.00 0.00 H new ATOM 0 HG2 GLU A 455 -2.836 0.988 5.238 1.00 0.00 H new ATOM 0 HG3 GLU A 455 -1.432 1.125 4.199 1.00 0.00 H new ATOM 635 N CYS A 456 -5.224 -0.821 5.160 1.00 0.00 N ATOM 636 CA CYS A 456 -5.441 -2.184 5.611 1.00 0.00 C ATOM 637 C CYS A 456 -6.949 -2.432 5.684 1.00 0.00 C ATOM 638 O CYS A 456 -7.393 -3.423 6.263 1.00 0.00 O ATOM 639 CB CYS A 456 -4.754 -2.452 6.953 1.00 0.00 C ATOM 640 SG CYS A 456 -5.879 -2.497 8.396 1.00 0.00 S ATOM 0 H CYS A 456 -5.288 -0.114 5.892 1.00 0.00 H new ATOM 0 HA CYS A 456 -4.993 -2.880 4.902 1.00 0.00 H new ATOM 0 HB2 CYS A 456 -4.227 -3.404 6.891 1.00 0.00 H new ATOM 0 HB3 CYS A 456 -4.002 -1.681 7.120 1.00 0.00 H new ATOM 645 N VAL A 457 -7.698 -1.514 5.089 1.00 0.00 N ATOM 646 CA VAL A 457 -9.147 -1.622 5.079 1.00 0.00 C ATOM 647 C VAL A 457 -9.581 -2.501 3.904 1.00 0.00 C ATOM 648 O VAL A 457 -10.226 -3.530 4.101 1.00 0.00 O ATOM 649 CB VAL A 457 -9.774 -0.226 5.043 1.00 0.00 C ATOM 650 CG1 VAL A 457 -10.688 -0.066 3.827 1.00 0.00 C ATOM 651 CG2 VAL A 457 -10.529 0.068 6.340 1.00 0.00 C ATOM 0 H VAL A 457 -7.328 -0.693 4.611 1.00 0.00 H new ATOM 0 HA VAL A 457 -9.501 -2.101 5.992 1.00 0.00 H new ATOM 0 HB VAL A 457 -8.968 0.502 4.952 1.00 0.00 H new ATOM 0 HG11 VAL A 457 -11.120 0.935 3.826 1.00 0.00 H new ATOM 0 HG12 VAL A 457 -10.109 -0.212 2.915 1.00 0.00 H new ATOM 0 HG13 VAL A 457 -11.487 -0.806 3.872 1.00 0.00 H new ATOM 0 HG21 VAL A 457 -10.965 1.066 6.289 1.00 0.00 H new ATOM 0 HG22 VAL A 457 -11.322 -0.668 6.474 1.00 0.00 H new ATOM 0 HG23 VAL A 457 -9.839 0.016 7.182 1.00 0.00 H new ATOM 661 N SER A 458 -9.210 -2.065 2.710 1.00 0.00 N ATOM 662 CA SER A 458 -9.552 -2.801 1.505 1.00 0.00 C ATOM 663 C SER A 458 -8.412 -3.749 1.128 1.00 0.00 C ATOM 664 O SER A 458 -8.440 -4.367 0.065 1.00 0.00 O ATOM 665 CB SER A 458 -9.856 -1.848 0.346 1.00 0.00 C ATOM 666 OG SER A 458 -11.208 -1.405 0.360 1.00 0.00 O ATOM 0 H SER A 458 -8.676 -1.211 2.551 1.00 0.00 H new ATOM 0 HA SER A 458 -10.450 -3.386 1.705 1.00 0.00 H new ATOM 0 HB2 SER A 458 -9.192 -0.986 0.402 1.00 0.00 H new ATOM 0 HB3 SER A 458 -9.649 -2.349 -0.599 1.00 0.00 H new ATOM 0 HG SER A 458 -11.361 -0.798 -0.394 1.00 0.00 H new ATOM 672 N ASN A 459 -7.437 -3.834 2.021 1.00 0.00 N ATOM 673 CA ASN A 459 -6.289 -4.697 1.795 1.00 0.00 C ATOM 674 C ASN A 459 -5.873 -5.341 3.120 1.00 0.00 C ATOM 675 O ASN A 459 -4.696 -5.334 3.473 1.00 0.00 O ATOM 676 CB ASN A 459 -5.098 -3.900 1.262 1.00 0.00 C ATOM 677 CG ASN A 459 -5.563 -2.757 0.358 1.00 0.00 C ATOM 678 OD1 ASN A 459 -6.267 -1.820 0.990 1.00 0.00 O flip ATOM 679 ND2 ASN A 459 -5.302 -2.727 -0.833 1.00 0.00 N flip ATOM 0 H ASN A 459 -7.418 -3.320 2.902 1.00 0.00 H new ATOM 0 HA ASN A 459 -6.573 -5.453 1.063 1.00 0.00 H new ATOM 0 HB2 ASN A 459 -4.523 -3.498 2.096 1.00 0.00 H new ATOM 0 HB3 ASN A 459 -4.433 -4.561 0.706 1.00 0.00 H new ATOM 0 HD21 ASN A 459 -4.757 -3.479 -1.255 1.00 0.00 H new ATOM 0 HD22 ASN A 459 -5.629 -1.950 -1.407 1.00 0.00 H new ATOM 686 N PRO A 460 -6.889 -5.896 3.834 1.00 0.00 N ATOM 687 CA PRO A 460 -6.640 -6.543 5.111 1.00 0.00 C ATOM 688 C PRO A 460 -5.985 -7.912 4.914 1.00 0.00 C ATOM 689 O PRO A 460 -5.685 -8.605 5.884 1.00 0.00 O ATOM 690 CB PRO A 460 -8.003 -6.627 5.781 1.00 0.00 C ATOM 691 CG PRO A 460 -9.025 -6.450 4.670 1.00 0.00 C ATOM 692 CD PRO A 460 -8.297 -5.922 3.445 1.00 0.00 C ATOM 0 HA PRO A 460 -5.938 -5.989 5.734 1.00 0.00 H new ATOM 0 HB2 PRO A 460 -8.133 -7.586 6.282 1.00 0.00 H new ATOM 0 HB3 PRO A 460 -8.113 -5.853 6.540 1.00 0.00 H new ATOM 0 HG2 PRO A 460 -9.512 -7.399 4.445 1.00 0.00 H new ATOM 0 HG3 PRO A 460 -9.807 -5.756 4.978 1.00 0.00 H new ATOM 0 HD2 PRO A 460 -8.457 -6.566 2.581 1.00 0.00 H new ATOM 0 HD3 PRO A 460 -8.651 -4.928 3.172 1.00 0.00 H new ATOM 700 N CYS A 461 -5.781 -8.258 3.652 1.00 0.00 N ATOM 701 CA CYS A 461 -5.167 -9.531 3.315 1.00 0.00 C ATOM 702 C CYS A 461 -6.180 -10.642 3.598 1.00 0.00 C ATOM 703 O CYS A 461 -5.804 -11.802 3.769 1.00 0.00 O ATOM 704 CB CYS A 461 -3.858 -9.745 4.077 1.00 0.00 C ATOM 705 SG CYS A 461 -2.520 -8.572 3.651 1.00 0.00 S ATOM 0 H CYS A 461 -6.030 -7.679 2.850 1.00 0.00 H new ATOM 0 HA CYS A 461 -4.902 -9.543 2.258 1.00 0.00 H new ATOM 0 HB2 CYS A 461 -4.060 -9.671 5.146 1.00 0.00 H new ATOM 0 HB3 CYS A 461 -3.506 -10.759 3.889 1.00 0.00 H new ATOM 710 N GLN A 462 -7.446 -10.251 3.637 1.00 0.00 N ATOM 711 CA GLN A 462 -8.516 -11.199 3.896 1.00 0.00 C ATOM 712 C GLN A 462 -8.629 -11.475 5.396 1.00 0.00 C ATOM 713 O GLN A 462 -7.919 -10.870 6.198 1.00 0.00 O ATOM 714 CB GLN A 462 -8.298 -12.497 3.114 1.00 0.00 C ATOM 715 CG GLN A 462 -9.544 -12.869 2.311 1.00 0.00 C ATOM 716 CD GLN A 462 -9.480 -14.323 1.839 1.00 0.00 C ATOM 717 OE1 GLN A 462 -8.540 -14.554 0.927 1.00 0.00 O flip ATOM 718 NE2 GLN A 462 -10.234 -15.178 2.274 1.00 0.00 N flip ATOM 0 H GLN A 462 -7.754 -9.289 3.493 1.00 0.00 H new ATOM 0 HA GLN A 462 -9.454 -10.761 3.556 1.00 0.00 H new ATOM 0 HB2 GLN A 462 -7.448 -12.382 2.441 1.00 0.00 H new ATOM 0 HB3 GLN A 462 -8.051 -13.304 3.804 1.00 0.00 H new ATOM 0 HG2 GLN A 462 -10.433 -12.721 2.924 1.00 0.00 H new ATOM 0 HG3 GLN A 462 -9.637 -12.207 1.450 1.00 0.00 H new ATOM 0 HE21 GLN A 462 -10.934 -14.932 2.974 1.00 0.00 H new ATOM 0 HE22 GLN A 462 -10.164 -16.138 1.938 1.00 0.00 H new ATOM 727 N ASN A 463 -9.529 -12.389 5.730 1.00 0.00 N ATOM 728 CA ASN A 463 -9.745 -12.751 7.121 1.00 0.00 C ATOM 729 C ASN A 463 -8.506 -13.471 7.654 1.00 0.00 C ATOM 730 O ASN A 463 -8.053 -13.198 8.764 1.00 0.00 O ATOM 731 CB ASN A 463 -10.940 -13.697 7.264 1.00 0.00 C ATOM 732 CG ASN A 463 -12.133 -13.201 6.442 1.00 0.00 C ATOM 733 OD1 ASN A 463 -12.144 -13.641 5.188 1.00 0.00 O flip ATOM 734 ND2 ASN A 463 -12.984 -12.469 6.917 1.00 0.00 N flip ATOM 0 H ASN A 463 -10.116 -12.889 5.062 1.00 0.00 H new ATOM 0 HA ASN A 463 -9.939 -11.837 7.682 1.00 0.00 H new ATOM 0 HB2 ASN A 463 -10.658 -14.697 6.935 1.00 0.00 H new ATOM 0 HB3 ASN A 463 -11.224 -13.774 8.314 1.00 0.00 H new ATOM 0 HD21 ASN A 463 -12.914 -12.169 7.889 1.00 0.00 H new ATOM 0 HD22 ASN A 463 -13.767 -12.157 6.342 1.00 0.00 H new ATOM 741 N ASP A 464 -7.992 -14.381 6.837 1.00 0.00 N ATOM 742 CA ASP A 464 -6.814 -15.143 7.212 1.00 0.00 C ATOM 743 C ASP A 464 -5.592 -14.222 7.207 1.00 0.00 C ATOM 744 O ASP A 464 -4.645 -14.447 6.455 1.00 0.00 O ATOM 745 CB ASP A 464 -6.554 -16.280 6.223 1.00 0.00 C ATOM 746 CG ASP A 464 -5.804 -17.482 6.800 1.00 0.00 C ATOM 747 OD1 ASP A 464 -4.565 -17.541 6.760 1.00 0.00 O ATOM 748 OD2 ASP A 464 -6.553 -18.397 7.314 1.00 0.00 O ATOM 0 H ASP A 464 -8.371 -14.607 5.917 1.00 0.00 H new ATOM 0 HA ASP A 464 -6.986 -15.561 8.204 1.00 0.00 H new ATOM 0 HB2 ASP A 464 -7.510 -16.623 5.828 1.00 0.00 H new ATOM 0 HB3 ASP A 464 -5.985 -15.886 5.381 1.00 0.00 H new ATOM 754 N ALA A 465 -5.653 -13.205 8.053 1.00 0.00 N ATOM 755 CA ALA A 465 -4.564 -12.248 8.153 1.00 0.00 C ATOM 756 C ALA A 465 -5.054 -11.000 8.890 1.00 0.00 C ATOM 757 O ALA A 465 -5.903 -10.269 8.384 1.00 0.00 O ATOM 758 CB ALA A 465 -4.033 -11.929 6.754 1.00 0.00 C ATOM 0 H ALA A 465 -6.440 -13.022 8.676 1.00 0.00 H new ATOM 0 HA ALA A 465 -3.737 -12.666 8.727 1.00 0.00 H new ATOM 0 HB1 ALA A 465 -3.216 -11.211 6.830 1.00 0.00 H new ATOM 0 HB2 ALA A 465 -3.670 -12.844 6.285 1.00 0.00 H new ATOM 0 HB3 ALA A 465 -4.834 -11.505 6.149 1.00 0.00 H new ATOM 764 N THR A 466 -4.496 -10.795 10.074 1.00 0.00 N ATOM 765 CA THR A 466 -4.864 -9.647 10.886 1.00 0.00 C ATOM 766 C THR A 466 -4.223 -8.374 10.333 1.00 0.00 C ATOM 767 O THR A 466 -3.016 -8.175 10.462 1.00 0.00 O ATOM 768 CB THR A 466 -4.471 -9.945 12.334 1.00 0.00 C ATOM 769 OG1 THR A 466 -5.510 -10.800 12.806 1.00 0.00 O ATOM 770 CG2 THR A 466 -4.566 -8.712 13.233 1.00 0.00 C ATOM 0 H THR A 466 -3.792 -11.404 10.491 1.00 0.00 H new ATOM 0 HA THR A 466 -5.939 -9.471 10.856 1.00 0.00 H new ATOM 0 HB THR A 466 -3.454 -10.335 12.361 1.00 0.00 H new ATOM 0 HG1 THR A 466 -5.334 -11.044 13.739 1.00 0.00 H new ATOM 0 HG21 THR A 466 -4.276 -8.979 14.249 1.00 0.00 H new ATOM 0 HG22 THR A 466 -3.899 -7.936 12.858 1.00 0.00 H new ATOM 0 HG23 THR A 466 -5.591 -8.340 13.234 1.00 0.00 H new ATOM 778 N CYS A 467 -5.058 -7.542 9.727 1.00 0.00 N ATOM 779 CA CYS A 467 -4.587 -6.293 9.153 1.00 0.00 C ATOM 780 C CYS A 467 -4.163 -5.369 10.297 1.00 0.00 C ATOM 781 O CYS A 467 -4.744 -5.410 11.381 1.00 0.00 O ATOM 782 CB CYS A 467 -5.648 -5.646 8.260 1.00 0.00 C ATOM 783 SG CYS A 467 -6.489 -4.196 8.994 1.00 0.00 S ATOM 0 H CYS A 467 -6.059 -7.709 9.621 1.00 0.00 H new ATOM 0 HA CYS A 467 -3.731 -6.486 8.507 1.00 0.00 H new ATOM 0 HB2 CYS A 467 -5.179 -5.341 7.325 1.00 0.00 H new ATOM 0 HB3 CYS A 467 -6.399 -6.396 8.010 1.00 0.00 H new ATOM 788 N LEU A 468 -3.154 -4.558 10.016 1.00 0.00 N ATOM 789 CA LEU A 468 -2.646 -3.624 11.007 1.00 0.00 C ATOM 790 C LEU A 468 -2.365 -2.279 10.337 1.00 0.00 C ATOM 791 O LEU A 468 -1.262 -2.042 9.848 1.00 0.00 O ATOM 792 CB LEU A 468 -1.433 -4.217 11.728 1.00 0.00 C ATOM 793 CG LEU A 468 -1.721 -5.381 12.679 1.00 0.00 C ATOM 794 CD1 LEU A 468 -0.449 -5.822 13.406 1.00 0.00 C ATOM 795 CD2 LEU A 468 -2.845 -5.027 13.655 1.00 0.00 C ATOM 0 H LEU A 468 -2.674 -4.528 9.116 1.00 0.00 H new ATOM 0 HA LEU A 468 -3.393 -3.445 11.780 1.00 0.00 H new ATOM 0 HB2 LEU A 468 -0.719 -4.555 10.977 1.00 0.00 H new ATOM 0 HB3 LEU A 468 -0.948 -3.422 12.295 1.00 0.00 H new ATOM 0 HG LEU A 468 -2.064 -6.229 12.087 1.00 0.00 H new ATOM 0 HD11 LEU A 468 -0.681 -6.650 14.075 1.00 0.00 H new ATOM 0 HD12 LEU A 468 0.295 -6.143 12.676 1.00 0.00 H new ATOM 0 HD13 LEU A 468 -0.053 -4.988 13.985 1.00 0.00 H new ATOM 0 HD21 LEU A 468 -3.029 -5.871 14.319 1.00 0.00 H new ATOM 0 HD22 LEU A 468 -2.554 -4.158 14.245 1.00 0.00 H new ATOM 0 HD23 LEU A 468 -3.753 -4.799 13.097 1.00 0.00 H new ATOM 807 N ASP A 469 -3.384 -1.431 10.336 1.00 0.00 N ATOM 808 CA ASP A 469 -3.261 -0.113 9.734 1.00 0.00 C ATOM 809 C ASP A 469 -2.230 0.704 10.516 1.00 0.00 C ATOM 810 O ASP A 469 -2.392 0.932 11.714 1.00 0.00 O ATOM 811 CB ASP A 469 -4.593 0.638 9.777 1.00 0.00 C ATOM 812 CG ASP A 469 -4.524 2.100 9.333 1.00 0.00 C ATOM 813 OD1 ASP A 469 -5.168 2.979 9.927 1.00 0.00 O ATOM 814 OD2 ASP A 469 -3.760 2.327 8.319 1.00 0.00 O ATOM 0 H ASP A 469 -4.298 -1.631 10.742 1.00 0.00 H new ATOM 0 HA ASP A 469 -2.954 -0.242 8.696 1.00 0.00 H new ATOM 0 HB2 ASP A 469 -5.309 0.115 9.143 1.00 0.00 H new ATOM 0 HB3 ASP A 469 -4.982 0.601 10.795 1.00 0.00 H new ATOM 820 N GLN A 470 -1.194 1.126 9.805 1.00 0.00 N ATOM 821 CA GLN A 470 -0.138 1.916 10.417 1.00 0.00 C ATOM 822 C GLN A 470 0.039 3.236 9.666 1.00 0.00 C ATOM 823 O GLN A 470 -0.679 3.511 8.706 1.00 0.00 O ATOM 824 CB GLN A 470 1.173 1.129 10.464 1.00 0.00 C ATOM 825 CG GLN A 470 1.423 0.561 11.862 1.00 0.00 C ATOM 826 CD GLN A 470 1.817 -0.916 11.791 1.00 0.00 C ATOM 827 OE1 GLN A 470 0.788 -1.754 11.879 1.00 0.00 O flip ATOM 828 NE2 GLN A 470 2.977 -1.269 11.666 1.00 0.00 N flip ATOM 0 H GLN A 470 -1.063 0.936 8.811 1.00 0.00 H new ATOM 0 HA GLN A 470 -0.425 2.143 11.444 1.00 0.00 H new ATOM 0 HB2 GLN A 470 1.139 0.316 9.738 1.00 0.00 H new ATOM 0 HB3 GLN A 470 2.001 1.778 10.178 1.00 0.00 H new ATOM 0 HG2 GLN A 470 2.213 1.129 12.353 1.00 0.00 H new ATOM 0 HG3 GLN A 470 0.525 0.673 12.470 1.00 0.00 H new ATOM 0 HE21 GLN A 470 3.719 -0.571 11.604 1.00 0.00 H new ATOM 0 HE22 GLN A 470 3.206 -2.262 11.623 1.00 0.00 H new ATOM 837 N ILE A 471 0.999 4.021 10.134 1.00 0.00 N ATOM 838 CA ILE A 471 1.280 5.307 9.520 1.00 0.00 C ATOM 839 C ILE A 471 1.589 5.102 8.035 1.00 0.00 C ATOM 840 O ILE A 471 2.530 4.392 7.686 1.00 0.00 O ATOM 841 CB ILE A 471 2.389 6.034 10.283 1.00 0.00 C ATOM 842 CG1 ILE A 471 3.387 5.041 10.880 1.00 0.00 C ATOM 843 CG2 ILE A 471 1.803 6.967 11.345 1.00 0.00 C ATOM 844 CD1 ILE A 471 3.847 4.028 9.828 1.00 0.00 C ATOM 0 H ILE A 471 1.592 3.791 10.931 1.00 0.00 H new ATOM 0 HA ILE A 471 0.406 5.956 9.578 1.00 0.00 H new ATOM 0 HB ILE A 471 2.939 6.656 9.576 1.00 0.00 H new ATOM 0 HG12 ILE A 471 4.249 5.579 11.274 1.00 0.00 H new ATOM 0 HG13 ILE A 471 2.928 4.517 11.718 1.00 0.00 H new ATOM 0 HG21 ILE A 471 2.612 7.471 11.873 1.00 0.00 H new ATOM 0 HG22 ILE A 471 1.165 7.709 10.865 1.00 0.00 H new ATOM 0 HG23 ILE A 471 1.214 6.386 12.055 1.00 0.00 H new ATOM 0 HD11 ILE A 471 4.556 3.333 10.278 1.00 0.00 H new ATOM 0 HD12 ILE A 471 2.985 3.475 9.454 1.00 0.00 H new ATOM 0 HD13 ILE A 471 4.328 4.553 9.003 1.00 0.00 H new ATOM 856 N GLY A 472 0.777 5.736 7.202 1.00 0.00 N ATOM 857 CA GLY A 472 0.950 5.631 5.763 1.00 0.00 C ATOM 858 C GLY A 472 1.455 4.241 5.370 1.00 0.00 C ATOM 859 O GLY A 472 2.319 4.113 4.504 1.00 0.00 O ATOM 0 H GLY A 472 -0.003 6.324 7.496 1.00 0.00 H new ATOM 0 HA2 GLY A 472 0.002 5.832 5.264 1.00 0.00 H new ATOM 0 HA3 GLY A 472 1.656 6.388 5.422 1.00 0.00 H new ATOM 863 N GLU A 473 0.895 3.236 6.029 1.00 0.00 N ATOM 864 CA GLU A 473 1.279 1.860 5.760 1.00 0.00 C ATOM 865 C GLU A 473 0.256 0.897 6.364 1.00 0.00 C ATOM 866 O GLU A 473 -0.584 1.301 7.168 1.00 0.00 O ATOM 867 CB GLU A 473 2.684 1.569 6.287 1.00 0.00 C ATOM 868 CG GLU A 473 2.665 1.334 7.799 1.00 0.00 C ATOM 869 CD GLU A 473 2.883 -0.144 8.127 1.00 0.00 C ATOM 870 OE1 GLU A 473 3.958 -0.519 8.618 1.00 0.00 O ATOM 871 OE2 GLU A 473 1.886 -0.916 7.854 1.00 0.00 O ATOM 0 H GLU A 473 0.180 3.347 6.747 1.00 0.00 H new ATOM 0 HA GLU A 473 1.295 1.712 4.680 1.00 0.00 H new ATOM 0 HB2 GLU A 473 3.090 0.691 5.784 1.00 0.00 H new ATOM 0 HB3 GLU A 473 3.344 2.404 6.053 1.00 0.00 H new ATOM 0 HG2 GLU A 473 3.442 1.934 8.274 1.00 0.00 H new ATOM 0 HG3 GLU A 473 1.711 1.665 8.210 1.00 0.00 H new ATOM 879 N PHE A 474 0.360 -0.358 5.955 1.00 0.00 N ATOM 880 CA PHE A 474 -0.546 -1.384 6.448 1.00 0.00 C ATOM 881 C PHE A 474 0.193 -2.702 6.682 1.00 0.00 C ATOM 882 O PHE A 474 1.270 -2.921 6.130 1.00 0.00 O ATOM 883 CB PHE A 474 -1.611 -1.594 5.369 1.00 0.00 C ATOM 884 CG PHE A 474 -1.248 -2.665 4.338 1.00 0.00 C ATOM 885 CD1 PHE A 474 -1.297 -3.981 4.679 1.00 0.00 C ATOM 886 CD2 PHE A 474 -0.877 -2.302 3.081 1.00 0.00 C ATOM 887 CE1 PHE A 474 -0.960 -4.975 3.722 1.00 0.00 C ATOM 888 CE2 PHE A 474 -0.542 -3.296 2.125 1.00 0.00 C ATOM 889 CZ PHE A 474 -0.590 -4.612 2.466 1.00 0.00 C ATOM 0 H PHE A 474 1.057 -0.689 5.288 1.00 0.00 H new ATOM 0 HA PHE A 474 -0.983 -1.071 7.396 1.00 0.00 H new ATOM 0 HB2 PHE A 474 -2.550 -1.869 5.849 1.00 0.00 H new ATOM 0 HB3 PHE A 474 -1.782 -0.650 4.852 1.00 0.00 H new ATOM 0 HD1 PHE A 474 -1.592 -4.270 5.677 1.00 0.00 H new ATOM 0 HD2 PHE A 474 -0.837 -1.257 2.810 1.00 0.00 H new ATOM 0 HE1 PHE A 474 -0.998 -6.020 3.993 1.00 0.00 H new ATOM 0 HE2 PHE A 474 -0.249 -3.007 1.126 1.00 0.00 H new ATOM 0 HZ PHE A 474 -0.334 -5.368 1.739 1.00 0.00 H new ATOM 899 N GLN A 475 -0.413 -3.545 7.503 1.00 0.00 N ATOM 900 CA GLN A 475 0.172 -4.837 7.819 1.00 0.00 C ATOM 901 C GLN A 475 -0.881 -5.940 7.710 1.00 0.00 C ATOM 902 O GLN A 475 -2.054 -5.662 7.461 1.00 0.00 O ATOM 903 CB GLN A 475 0.813 -4.824 9.208 1.00 0.00 C ATOM 904 CG GLN A 475 2.325 -5.034 9.118 1.00 0.00 C ATOM 905 CD GLN A 475 2.659 -6.264 8.272 1.00 0.00 C ATOM 906 OE1 GLN A 475 2.193 -7.406 8.771 1.00 0.00 O flip ATOM 907 NE2 GLN A 475 3.296 -6.182 7.235 1.00 0.00 N flip ATOM 0 H GLN A 475 -1.305 -3.359 7.960 1.00 0.00 H new ATOM 0 HA GLN A 475 0.959 -5.043 7.094 1.00 0.00 H new ATOM 0 HB2 GLN A 475 0.603 -3.874 9.700 1.00 0.00 H new ATOM 0 HB3 GLN A 475 0.370 -5.607 9.824 1.00 0.00 H new ATOM 0 HG2 GLN A 475 2.793 -4.151 8.683 1.00 0.00 H new ATOM 0 HG3 GLN A 475 2.739 -5.154 10.119 1.00 0.00 H new ATOM 0 HE21 GLN A 475 3.624 -5.273 6.909 1.00 0.00 H new ATOM 0 HE22 GLN A 475 3.500 -7.022 6.694 1.00 0.00 H new ATOM 916 N CYS A 476 -0.427 -7.170 7.903 1.00 0.00 N ATOM 917 CA CYS A 476 -1.318 -8.317 7.832 1.00 0.00 C ATOM 918 C CYS A 476 -0.505 -9.575 8.143 1.00 0.00 C ATOM 919 O CYS A 476 0.284 -10.030 7.317 1.00 0.00 O ATOM 920 CB CYS A 476 -2.013 -8.408 6.471 1.00 0.00 C ATOM 921 SG CYS A 476 -0.932 -8.933 5.091 1.00 0.00 S ATOM 0 H CYS A 476 0.546 -7.398 8.108 1.00 0.00 H new ATOM 0 HA CYS A 476 -2.115 -8.210 8.568 1.00 0.00 H new ATOM 0 HB2 CYS A 476 -2.844 -9.109 6.549 1.00 0.00 H new ATOM 0 HB3 CYS A 476 -2.439 -7.434 6.230 1.00 0.00 H new ATOM 926 N ILE A 477 -0.727 -10.102 9.338 1.00 0.00 N ATOM 927 CA ILE A 477 -0.026 -11.300 9.770 1.00 0.00 C ATOM 928 C ILE A 477 -0.530 -12.498 8.964 1.00 0.00 C ATOM 929 O ILE A 477 -1.620 -12.455 8.397 1.00 0.00 O ATOM 930 CB ILE A 477 -0.152 -11.479 11.283 1.00 0.00 C ATOM 931 CG1 ILE A 477 0.813 -10.553 12.029 1.00 0.00 C ATOM 932 CG2 ILE A 477 0.037 -12.944 11.680 1.00 0.00 C ATOM 933 CD1 ILE A 477 2.256 -10.793 11.579 1.00 0.00 C ATOM 0 H ILE A 477 -1.382 -9.722 10.021 1.00 0.00 H new ATOM 0 HA ILE A 477 1.042 -11.209 9.572 1.00 0.00 H new ATOM 0 HB ILE A 477 -1.162 -11.194 11.577 1.00 0.00 H new ATOM 0 HG12 ILE A 477 0.539 -9.514 11.848 1.00 0.00 H new ATOM 0 HG13 ILE A 477 0.729 -10.722 13.103 1.00 0.00 H new ATOM 0 HG21 ILE A 477 -0.058 -13.043 12.761 1.00 0.00 H new ATOM 0 HG22 ILE A 477 -0.723 -13.554 11.192 1.00 0.00 H new ATOM 0 HG23 ILE A 477 1.026 -13.280 11.370 1.00 0.00 H new ATOM 0 HD11 ILE A 477 2.923 -10.124 12.123 1.00 0.00 H new ATOM 0 HD12 ILE A 477 2.534 -11.827 11.784 1.00 0.00 H new ATOM 0 HD13 ILE A 477 2.341 -10.599 10.510 1.00 0.00 H new ATOM 945 N CYS A 478 0.287 -13.541 8.941 1.00 0.00 N ATOM 946 CA CYS A 478 -0.062 -14.750 8.213 1.00 0.00 C ATOM 947 C CYS A 478 -0.315 -15.864 9.230 1.00 0.00 C ATOM 948 O CYS A 478 0.197 -15.819 10.348 1.00 0.00 O ATOM 949 CB CYS A 478 1.020 -15.135 7.203 1.00 0.00 C ATOM 950 SG CYS A 478 0.396 -15.554 5.534 1.00 0.00 S ATOM 0 H CYS A 478 1.190 -13.574 9.415 1.00 0.00 H new ATOM 0 HA CYS A 478 -0.966 -14.578 7.629 1.00 0.00 H new ATOM 0 HB2 CYS A 478 1.726 -14.309 7.115 1.00 0.00 H new ATOM 0 HB3 CYS A 478 1.575 -15.988 7.593 1.00 0.00 H new ATOM 955 N MET A 479 -1.103 -16.841 8.806 1.00 0.00 N ATOM 956 CA MET A 479 -1.430 -17.967 9.665 1.00 0.00 C ATOM 957 C MET A 479 -0.536 -19.170 9.358 1.00 0.00 C ATOM 958 O MET A 479 -0.117 -19.360 8.216 1.00 0.00 O ATOM 959 CB MET A 479 -2.896 -18.354 9.462 1.00 0.00 C ATOM 960 CG MET A 479 -3.828 -17.204 9.854 1.00 0.00 C ATOM 961 SD MET A 479 -5.524 -17.758 9.831 1.00 0.00 S ATOM 962 CE MET A 479 -6.109 -17.023 11.349 1.00 0.00 C ATOM 0 H MET A 479 -1.525 -16.876 7.878 1.00 0.00 H new ATOM 0 HA MET A 479 -1.263 -17.671 10.701 1.00 0.00 H new ATOM 0 HB2 MET A 479 -3.064 -18.623 8.419 1.00 0.00 H new ATOM 0 HB3 MET A 479 -3.129 -19.235 10.060 1.00 0.00 H new ATOM 0 HG2 MET A 479 -3.570 -16.838 10.848 1.00 0.00 H new ATOM 0 HG3 MET A 479 -3.700 -16.370 9.164 1.00 0.00 H new ATOM 0 HE1 MET A 479 -7.161 -17.271 11.492 1.00 0.00 H new ATOM 0 HE2 MET A 479 -5.528 -17.408 12.187 1.00 0.00 H new ATOM 0 HE3 MET A 479 -5.996 -15.940 11.296 1.00 0.00 H new ATOM 972 N PRO A 480 -0.264 -19.971 10.422 1.00 0.00 N ATOM 973 CA PRO A 480 0.572 -21.149 10.276 1.00 0.00 C ATOM 974 C PRO A 480 -0.189 -22.278 9.578 1.00 0.00 C ATOM 975 O PRO A 480 -0.508 -23.293 10.197 1.00 0.00 O ATOM 976 CB PRO A 480 0.998 -21.507 11.692 1.00 0.00 C ATOM 977 CG PRO A 480 0.015 -20.802 12.613 1.00 0.00 C ATOM 978 CD PRO A 480 -0.744 -19.776 11.787 1.00 0.00 C ATOM 0 HA PRO A 480 1.443 -20.971 9.645 1.00 0.00 H new ATOM 0 HB2 PRO A 480 0.973 -22.586 11.846 1.00 0.00 H new ATOM 0 HB3 PRO A 480 2.019 -21.180 11.887 1.00 0.00 H new ATOM 0 HG2 PRO A 480 -0.674 -21.520 13.057 1.00 0.00 H new ATOM 0 HG3 PRO A 480 0.542 -20.316 13.434 1.00 0.00 H new ATOM 0 HD2 PRO A 480 -1.821 -19.932 11.854 1.00 0.00 H new ATOM 0 HD3 PRO A 480 -0.546 -18.762 12.135 1.00 0.00 H new ATOM 986 N GLY A 481 -0.455 -22.065 8.297 1.00 0.00 N ATOM 987 CA GLY A 481 -1.172 -23.053 7.508 1.00 0.00 C ATOM 988 C GLY A 481 -1.343 -22.579 6.063 1.00 0.00 C ATOM 989 O GLY A 481 -1.296 -23.383 5.133 1.00 0.00 O ATOM 0 H GLY A 481 -0.187 -21.224 7.786 1.00 0.00 H new ATOM 0 HA2 GLY A 481 -0.630 -23.999 7.523 1.00 0.00 H new ATOM 0 HA3 GLY A 481 -2.150 -23.239 7.952 1.00 0.00 H new ATOM 993 N TYR A 482 -1.537 -21.276 5.920 1.00 0.00 N ATOM 994 CA TYR A 482 -1.716 -20.686 4.603 1.00 0.00 C ATOM 995 C TYR A 482 -0.534 -19.785 4.243 1.00 0.00 C ATOM 996 O TYR A 482 0.318 -19.505 5.085 1.00 0.00 O ATOM 997 CB TYR A 482 -2.985 -19.835 4.692 1.00 0.00 C ATOM 998 CG TYR A 482 -4.274 -20.611 4.420 1.00 0.00 C ATOM 999 CD1 TYR A 482 -4.694 -20.817 3.121 1.00 0.00 C ATOM 1000 CD2 TYR A 482 -5.019 -21.103 5.472 1.00 0.00 C ATOM 1001 CE1 TYR A 482 -5.909 -21.546 2.863 1.00 0.00 C ATOM 1002 CE2 TYR A 482 -6.232 -21.832 5.214 1.00 0.00 C ATOM 1003 CZ TYR A 482 -6.618 -22.019 3.924 1.00 0.00 C ATOM 1004 OH TYR A 482 -7.765 -22.708 3.681 1.00 0.00 O ATOM 0 H TYR A 482 -1.574 -20.612 6.694 1.00 0.00 H new ATOM 0 HA TYR A 482 -1.786 -21.461 3.840 1.00 0.00 H new ATOM 0 HB2 TYR A 482 -3.043 -19.391 5.686 1.00 0.00 H new ATOM 0 HB3 TYR A 482 -2.910 -19.014 3.979 1.00 0.00 H new ATOM 0 HD1 TYR A 482 -4.111 -20.431 2.298 1.00 0.00 H new ATOM 0 HD2 TYR A 482 -4.692 -20.941 6.488 1.00 0.00 H new ATOM 0 HE1 TYR A 482 -6.249 -21.713 1.852 1.00 0.00 H new ATOM 0 HE2 TYR A 482 -6.824 -22.223 6.028 1.00 0.00 H new ATOM 0 HH TYR A 482 -8.166 -22.986 4.531 1.00 0.00 H new ATOM 1014 N GLU A 483 -0.521 -19.354 2.990 1.00 0.00 N ATOM 1015 CA GLU A 483 0.544 -18.490 2.507 1.00 0.00 C ATOM 1016 C GLU A 483 0.024 -17.583 1.389 1.00 0.00 C ATOM 1017 O GLU A 483 -1.157 -17.626 1.048 1.00 0.00 O ATOM 1018 CB GLU A 483 1.744 -19.311 2.034 1.00 0.00 C ATOM 1019 CG GLU A 483 3.056 -18.580 2.327 1.00 0.00 C ATOM 1020 CD GLU A 483 3.861 -19.309 3.406 1.00 0.00 C ATOM 1021 OE1 GLU A 483 3.331 -19.586 4.493 1.00 0.00 O ATOM 1022 OE2 GLU A 483 5.079 -19.588 3.084 1.00 0.00 O ATOM 0 H GLU A 483 -1.230 -19.587 2.295 1.00 0.00 H new ATOM 0 HA GLU A 483 0.879 -17.862 3.332 1.00 0.00 H new ATOM 0 HB2 GLU A 483 1.745 -20.281 2.531 1.00 0.00 H new ATOM 0 HB3 GLU A 483 1.660 -19.501 0.964 1.00 0.00 H new ATOM 0 HG2 GLU A 483 3.647 -18.507 1.414 1.00 0.00 H new ATOM 0 HG3 GLU A 483 2.844 -17.561 2.652 1.00 0.00 H new ATOM 1030 N GLY A 484 0.932 -16.783 0.849 1.00 0.00 N ATOM 1031 CA GLY A 484 0.580 -15.868 -0.223 1.00 0.00 C ATOM 1032 C GLY A 484 0.500 -14.429 0.289 1.00 0.00 C ATOM 1033 O GLY A 484 0.761 -14.168 1.462 1.00 0.00 O ATOM 0 H GLY A 484 1.911 -16.750 1.134 1.00 0.00 H new ATOM 0 HA2 GLY A 484 1.321 -15.934 -1.020 1.00 0.00 H new ATOM 0 HA3 GLY A 484 -0.378 -16.158 -0.654 1.00 0.00 H new ATOM 1037 N VAL A 485 0.137 -13.532 -0.616 1.00 0.00 N ATOM 1038 CA VAL A 485 0.019 -12.125 -0.272 1.00 0.00 C ATOM 1039 C VAL A 485 -1.313 -11.891 0.444 1.00 0.00 C ATOM 1040 O VAL A 485 -1.474 -10.897 1.152 1.00 0.00 O ATOM 1041 CB VAL A 485 0.185 -11.264 -1.525 1.00 0.00 C ATOM 1042 CG1 VAL A 485 -1.138 -10.597 -1.910 1.00 0.00 C ATOM 1043 CG2 VAL A 485 1.289 -10.222 -1.332 1.00 0.00 C ATOM 0 H VAL A 485 -0.080 -13.752 -1.588 1.00 0.00 H new ATOM 0 HA VAL A 485 0.813 -11.831 0.414 1.00 0.00 H new ATOM 0 HB VAL A 485 0.482 -11.918 -2.345 1.00 0.00 H new ATOM 0 HG11 VAL A 485 -0.993 -9.990 -2.804 1.00 0.00 H new ATOM 0 HG12 VAL A 485 -1.887 -11.363 -2.109 1.00 0.00 H new ATOM 0 HG13 VAL A 485 -1.477 -9.962 -1.092 1.00 0.00 H new ATOM 0 HG21 VAL A 485 1.386 -9.623 -2.238 1.00 0.00 H new ATOM 0 HG22 VAL A 485 1.035 -9.573 -0.494 1.00 0.00 H new ATOM 0 HG23 VAL A 485 2.233 -10.726 -1.127 1.00 0.00 H new ATOM 1053 N HIS A 486 -2.232 -12.820 0.236 1.00 0.00 N ATOM 1054 CA HIS A 486 -3.544 -12.727 0.851 1.00 0.00 C ATOM 1055 C HIS A 486 -3.637 -13.716 2.015 1.00 0.00 C ATOM 1056 O HIS A 486 -4.712 -13.923 2.576 1.00 0.00 O ATOM 1057 CB HIS A 486 -4.648 -12.930 -0.188 1.00 0.00 C ATOM 1058 CG HIS A 486 -4.309 -12.392 -1.558 1.00 0.00 C ATOM 1059 ND1 HIS A 486 -4.755 -11.162 -2.012 1.00 0.00 N ATOM 1060 CD2 HIS A 486 -3.563 -12.927 -2.565 1.00 0.00 C ATOM 1061 CE1 HIS A 486 -4.292 -10.978 -3.239 1.00 0.00 C ATOM 1062 NE2 HIS A 486 -3.554 -12.073 -3.580 1.00 0.00 N ATOM 0 H HIS A 486 -2.094 -13.643 -0.351 1.00 0.00 H new ATOM 0 HA HIS A 486 -3.688 -11.726 1.257 1.00 0.00 H new ATOM 0 HB2 HIS A 486 -4.864 -13.995 -0.270 1.00 0.00 H new ATOM 0 HB3 HIS A 486 -5.559 -12.447 0.166 1.00 0.00 H new ATOM 0 HD2 HIS A 486 -3.064 -13.884 -2.541 1.00 0.00 H new ATOM 0 HE1 HIS A 486 -4.468 -10.113 -3.861 1.00 0.00 H new ATOM 0 HE2 HIS A 486 -3.074 -12.212 -4.469 1.00 0.00 H new ATOM 1070 N CYS A 487 -2.495 -14.304 2.343 1.00 0.00 N ATOM 1071 CA CYS A 487 -2.434 -15.266 3.430 1.00 0.00 C ATOM 1072 C CYS A 487 -3.653 -16.185 3.327 1.00 0.00 C ATOM 1073 O CYS A 487 -4.164 -16.658 4.341 1.00 0.00 O ATOM 1074 CB CYS A 487 -2.350 -14.577 4.792 1.00 0.00 C ATOM 1075 SG CYS A 487 -0.730 -13.816 5.170 1.00 0.00 S ATOM 0 H CYS A 487 -1.605 -14.132 1.875 1.00 0.00 H new ATOM 0 HA CYS A 487 -1.525 -15.860 3.342 1.00 0.00 H new ATOM 0 HB2 CYS A 487 -3.118 -13.805 4.841 1.00 0.00 H new ATOM 0 HB3 CYS A 487 -2.582 -15.307 5.567 1.00 0.00 H new ATOM 1080 N GLU A 488 -4.083 -16.410 2.094 1.00 0.00 N ATOM 1081 CA GLU A 488 -5.234 -17.262 1.846 1.00 0.00 C ATOM 1082 C GLU A 488 -4.867 -18.375 0.862 1.00 0.00 C ATOM 1083 O GLU A 488 -5.736 -19.123 0.414 1.00 0.00 O ATOM 1084 CB GLU A 488 -6.422 -16.445 1.334 1.00 0.00 C ATOM 1085 CG GLU A 488 -6.327 -16.229 -0.178 1.00 0.00 C ATOM 1086 CD GLU A 488 -7.387 -17.047 -0.917 1.00 0.00 C ATOM 1087 OE1 GLU A 488 -8.026 -17.922 -0.314 1.00 0.00 O ATOM 1088 OE2 GLU A 488 -7.536 -16.747 -2.162 1.00 0.00 O ATOM 0 H GLU A 488 -3.655 -16.017 1.256 1.00 0.00 H new ATOM 0 HA GLU A 488 -5.532 -17.721 2.789 1.00 0.00 H new ATOM 0 HB2 GLU A 488 -7.352 -16.960 1.574 1.00 0.00 H new ATOM 0 HB3 GLU A 488 -6.451 -15.481 1.842 1.00 0.00 H new ATOM 0 HG2 GLU A 488 -6.455 -15.171 -0.406 1.00 0.00 H new ATOM 0 HG3 GLU A 488 -5.334 -16.513 -0.528 1.00 0.00 H new ATOM 1096 N VAL A 489 -3.580 -18.448 0.554 1.00 0.00 N ATOM 1097 CA VAL A 489 -3.089 -19.456 -0.371 1.00 0.00 C ATOM 1098 C VAL A 489 -2.724 -20.721 0.410 1.00 0.00 C ATOM 1099 O VAL A 489 -1.676 -20.778 1.051 1.00 0.00 O ATOM 1100 CB VAL A 489 -1.919 -18.896 -1.182 1.00 0.00 C ATOM 1101 CG1 VAL A 489 -1.655 -19.750 -2.423 1.00 0.00 C ATOM 1102 CG2 VAL A 489 -2.167 -17.435 -1.564 1.00 0.00 C ATOM 0 H VAL A 489 -2.863 -17.826 0.928 1.00 0.00 H new ATOM 0 HA VAL A 489 -3.863 -19.727 -1.088 1.00 0.00 H new ATOM 0 HB VAL A 489 -1.028 -18.932 -0.555 1.00 0.00 H new ATOM 0 HG11 VAL A 489 -0.819 -19.331 -2.982 1.00 0.00 H new ATOM 0 HG12 VAL A 489 -1.414 -20.769 -2.119 1.00 0.00 H new ATOM 0 HG13 VAL A 489 -2.544 -19.760 -3.053 1.00 0.00 H new ATOM 0 HG21 VAL A 489 -1.321 -17.061 -2.140 1.00 0.00 H new ATOM 0 HG22 VAL A 489 -3.074 -17.365 -2.165 1.00 0.00 H new ATOM 0 HG23 VAL A 489 -2.283 -16.837 -0.660 1.00 0.00 H new ATOM 1112 N ASN A 490 -3.610 -21.704 0.330 1.00 0.00 N ATOM 1113 CA ASN A 490 -3.394 -22.964 1.020 1.00 0.00 C ATOM 1114 C ASN A 490 -2.158 -23.653 0.438 1.00 0.00 C ATOM 1115 O ASN A 490 -2.264 -24.428 -0.512 1.00 0.00 O ATOM 1116 CB ASN A 490 -4.589 -23.902 0.839 1.00 0.00 C ATOM 1117 CG ASN A 490 -5.145 -23.814 -0.583 1.00 0.00 C ATOM 1118 OD1 ASN A 490 -4.603 -23.144 -1.449 1.00 0.00 O ATOM 1119 ND2 ASN A 490 -6.252 -24.523 -0.776 1.00 0.00 N ATOM 0 H ASN A 490 -4.479 -21.653 -0.202 1.00 0.00 H new ATOM 0 HA ASN A 490 -3.261 -22.750 2.081 1.00 0.00 H new ATOM 0 HB2 ASN A 490 -4.287 -24.927 1.052 1.00 0.00 H new ATOM 0 HB3 ASN A 490 -5.370 -23.645 1.555 1.00 0.00 H new ATOM 0 HD21 ASN A 490 -6.701 -24.529 -1.692 1.00 0.00 H new ATOM 0 HD22 ASN A 490 -6.653 -25.062 -0.008 1.00 0.00 H new ATOM 1126 N THR A 491 -1.014 -23.348 1.034 1.00 0.00 N ATOM 1127 CA THR A 491 0.240 -23.929 0.587 1.00 0.00 C ATOM 1128 C THR A 491 0.413 -23.731 -0.920 1.00 0.00 C ATOM 1129 O THR A 491 -0.535 -23.369 -1.616 1.00 0.00 O ATOM 1130 CB THR A 491 0.260 -25.397 1.013 1.00 0.00 C ATOM 1131 OG1 THR A 491 1.440 -25.516 1.801 1.00 0.00 O ATOM 1132 CG2 THR A 491 0.501 -26.344 -0.164 1.00 0.00 C ATOM 0 H THR A 491 -0.930 -22.706 1.822 1.00 0.00 H new ATOM 0 HA THR A 491 1.093 -23.431 1.048 1.00 0.00 H new ATOM 0 HB THR A 491 -0.686 -25.647 1.494 1.00 0.00 H new ATOM 0 HG1 THR A 491 1.529 -26.438 2.120 1.00 0.00 H new ATOM 0 HG21 THR A 491 0.506 -27.374 0.193 1.00 0.00 H new ATOM 0 HG22 THR A 491 -0.293 -26.219 -0.900 1.00 0.00 H new ATOM 0 HG23 THR A 491 1.462 -26.115 -0.624 1.00 0.00 H new ATOM 1140 N ASP A 492 1.631 -23.974 -1.382 1.00 0.00 N ATOM 1141 CA ASP A 492 1.940 -23.827 -2.793 1.00 0.00 C ATOM 1142 C ASP A 492 1.414 -25.044 -3.555 1.00 0.00 C ATOM 1143 O ASP A 492 0.707 -25.877 -2.991 1.00 0.00 O ATOM 1144 CB ASP A 492 3.452 -23.744 -3.020 1.00 0.00 C ATOM 1145 CG ASP A 492 4.234 -24.998 -2.626 1.00 0.00 C ATOM 1146 OD1 ASP A 492 4.642 -25.158 -1.467 1.00 0.00 O ATOM 1147 OD2 ASP A 492 4.426 -25.843 -3.581 1.00 0.00 O ATOM 0 H ASP A 492 2.416 -24.272 -0.803 1.00 0.00 H new ATOM 0 HA ASP A 492 1.471 -22.909 -3.147 1.00 0.00 H new ATOM 0 HB2 ASP A 492 3.635 -23.536 -4.074 1.00 0.00 H new ATOM 0 HB3 ASP A 492 3.843 -22.898 -2.455 1.00 0.00 H new ATOM 1153 N GLU A 493 1.779 -25.109 -4.827 1.00 0.00 N ATOM 1154 CA GLU A 493 1.354 -26.211 -5.673 1.00 0.00 C ATOM 1155 C GLU A 493 2.318 -26.384 -6.848 1.00 0.00 C ATOM 1156 O GLU A 493 1.898 -26.683 -7.964 1.00 0.00 O ATOM 1157 CB GLU A 493 -0.079 -25.999 -6.169 1.00 0.00 C ATOM 1158 CG GLU A 493 -1.095 -26.486 -5.134 1.00 0.00 C ATOM 1159 CD GLU A 493 -1.686 -25.312 -4.351 1.00 0.00 C ATOM 1160 OE1 GLU A 493 -1.611 -25.292 -3.113 1.00 0.00 O ATOM 1161 OE2 GLU A 493 -2.237 -24.397 -5.074 1.00 0.00 O ATOM 0 H GLU A 493 2.365 -24.416 -5.292 1.00 0.00 H new ATOM 0 HA GLU A 493 1.369 -27.125 -5.079 1.00 0.00 H new ATOM 0 HB2 GLU A 493 -0.243 -24.941 -6.376 1.00 0.00 H new ATOM 0 HB3 GLU A 493 -0.226 -26.534 -7.107 1.00 0.00 H new ATOM 0 HG2 GLU A 493 -1.894 -27.034 -5.633 1.00 0.00 H new ATOM 0 HG3 GLU A 493 -0.614 -27.181 -4.446 1.00 0.00 H new ATOM 1169 N CYS A 494 3.596 -26.188 -6.555 1.00 0.00 N ATOM 1170 CA CYS A 494 4.626 -26.319 -7.572 1.00 0.00 C ATOM 1171 C CYS A 494 5.987 -26.364 -6.875 1.00 0.00 C ATOM 1172 O CYS A 494 6.907 -25.641 -7.252 1.00 0.00 O ATOM 1173 CB CYS A 494 4.550 -25.190 -8.602 1.00 0.00 C ATOM 1174 SG CYS A 494 3.971 -25.702 -10.260 1.00 0.00 S ATOM 0 H CYS A 494 3.941 -25.940 -5.628 1.00 0.00 H new ATOM 0 HA CYS A 494 4.474 -27.243 -8.130 1.00 0.00 H new ATOM 0 HB2 CYS A 494 3.883 -24.416 -8.223 1.00 0.00 H new ATOM 0 HB3 CYS A 494 5.538 -24.740 -8.701 1.00 0.00 H new ATOM 1179 N ALA A 495 6.072 -27.222 -5.868 1.00 0.00 N ATOM 1180 CA ALA A 495 7.305 -27.371 -5.114 1.00 0.00 C ATOM 1181 C ALA A 495 8.323 -28.145 -5.957 1.00 0.00 C ATOM 1182 O ALA A 495 9.510 -27.830 -5.945 1.00 0.00 O ATOM 1183 CB ALA A 495 7.009 -28.059 -3.780 1.00 0.00 C ATOM 0 H ALA A 495 5.307 -27.821 -5.557 1.00 0.00 H new ATOM 0 HA ALA A 495 7.737 -26.396 -4.888 1.00 0.00 H new ATOM 0 HB1 ALA A 495 7.934 -28.170 -3.215 1.00 0.00 H new ATOM 0 HB2 ALA A 495 6.305 -27.455 -3.208 1.00 0.00 H new ATOM 0 HB3 ALA A 495 6.577 -29.042 -3.966 1.00 0.00 H new ATOM 1189 N SER A 496 7.818 -29.144 -6.665 1.00 0.00 N ATOM 1190 CA SER A 496 8.666 -29.965 -7.512 1.00 0.00 C ATOM 1191 C SER A 496 8.389 -29.661 -8.984 1.00 0.00 C ATOM 1192 O SER A 496 8.636 -30.496 -9.853 1.00 0.00 O ATOM 1193 CB SER A 496 8.453 -31.454 -7.227 1.00 0.00 C ATOM 1194 OG SER A 496 9.181 -31.889 -6.082 1.00 0.00 O ATOM 0 H SER A 496 6.832 -29.404 -6.670 1.00 0.00 H new ATOM 0 HA SER A 496 9.706 -29.725 -7.289 1.00 0.00 H new ATOM 0 HB2 SER A 496 7.391 -31.645 -7.075 1.00 0.00 H new ATOM 0 HB3 SER A 496 8.761 -32.037 -8.095 1.00 0.00 H new ATOM 0 HG SER A 496 9.017 -32.844 -5.933 1.00 0.00 H new ATOM 1200 N SER A 497 7.876 -28.462 -9.221 1.00 0.00 N ATOM 1201 CA SER A 497 7.561 -28.037 -10.575 1.00 0.00 C ATOM 1202 C SER A 497 7.924 -26.562 -10.757 1.00 0.00 C ATOM 1203 O SER A 497 7.083 -25.684 -10.564 1.00 0.00 O ATOM 1204 CB SER A 497 6.083 -28.265 -10.894 1.00 0.00 C ATOM 1205 OG SER A 497 5.849 -29.553 -11.453 1.00 0.00 O ATOM 0 H SER A 497 7.671 -27.772 -8.499 1.00 0.00 H new ATOM 0 HA SER A 497 8.150 -28.637 -11.269 1.00 0.00 H new ATOM 0 HB2 SER A 497 5.494 -28.153 -9.983 1.00 0.00 H new ATOM 0 HB3 SER A 497 5.741 -27.500 -11.591 1.00 0.00 H new ATOM 0 HG SER A 497 4.893 -29.659 -11.641 1.00 0.00 H new ATOM 1211 N PRO A 498 9.208 -26.328 -11.139 1.00 0.00 N ATOM 1212 CA PRO A 498 9.691 -24.975 -11.350 1.00 0.00 C ATOM 1213 C PRO A 498 9.161 -24.402 -12.665 1.00 0.00 C ATOM 1214 O PRO A 498 9.257 -23.199 -12.906 1.00 0.00 O ATOM 1215 CB PRO A 498 11.206 -25.088 -11.320 1.00 0.00 C ATOM 1216 CG PRO A 498 11.519 -26.556 -11.560 1.00 0.00 C ATOM 1217 CD PRO A 498 10.230 -27.343 -11.378 1.00 0.00 C ATOM 0 HA PRO A 498 9.342 -24.281 -10.586 1.00 0.00 H new ATOM 0 HB2 PRO A 498 11.660 -24.461 -12.088 1.00 0.00 H new ATOM 0 HB3 PRO A 498 11.604 -24.756 -10.361 1.00 0.00 H new ATOM 0 HG2 PRO A 498 11.917 -26.702 -12.564 1.00 0.00 H new ATOM 0 HG3 PRO A 498 12.280 -26.903 -10.861 1.00 0.00 H new ATOM 0 HD2 PRO A 498 10.000 -27.936 -12.263 1.00 0.00 H new ATOM 0 HD3 PRO A 498 10.304 -28.036 -10.540 1.00 0.00 H new ATOM 1225 N CYS A 499 8.613 -25.289 -13.483 1.00 0.00 N ATOM 1226 CA CYS A 499 8.067 -24.886 -14.768 1.00 0.00 C ATOM 1227 C CYS A 499 9.230 -24.516 -15.688 1.00 0.00 C ATOM 1228 O CYS A 499 9.344 -25.044 -16.794 1.00 0.00 O ATOM 1229 CB CYS A 499 7.066 -23.739 -14.622 1.00 0.00 C ATOM 1230 SG CYS A 499 5.369 -24.253 -14.166 1.00 0.00 S ATOM 0 H CYS A 499 8.535 -26.286 -13.281 1.00 0.00 H new ATOM 0 HA CYS A 499 7.509 -25.714 -15.205 1.00 0.00 H new ATOM 0 HB2 CYS A 499 7.436 -23.047 -13.866 1.00 0.00 H new ATOM 0 HB3 CYS A 499 7.024 -23.191 -15.563 1.00 0.00 H new ATOM 1235 N LEU A 500 10.065 -23.610 -15.199 1.00 0.00 N ATOM 1236 CA LEU A 500 11.215 -23.163 -15.966 1.00 0.00 C ATOM 1237 C LEU A 500 10.763 -22.136 -17.007 1.00 0.00 C ATOM 1238 O LEU A 500 9.720 -21.503 -16.846 1.00 0.00 O ATOM 1239 CB LEU A 500 11.959 -24.358 -16.565 1.00 0.00 C ATOM 1240 CG LEU A 500 13.432 -24.496 -16.177 1.00 0.00 C ATOM 1241 CD1 LEU A 500 14.308 -23.558 -17.009 1.00 0.00 C ATOM 1242 CD2 LEU A 500 13.625 -24.280 -14.675 1.00 0.00 C ATOM 0 H LEU A 500 9.968 -23.174 -14.282 1.00 0.00 H new ATOM 0 HA LEU A 500 11.933 -22.663 -15.316 1.00 0.00 H new ATOM 0 HB2 LEU A 500 11.439 -25.269 -16.269 1.00 0.00 H new ATOM 0 HB3 LEU A 500 11.895 -24.293 -17.651 1.00 0.00 H new ATOM 0 HG LEU A 500 13.751 -25.514 -16.399 1.00 0.00 H new ATOM 0 HD11 LEU A 500 15.350 -23.676 -16.713 1.00 0.00 H new ATOM 0 HD12 LEU A 500 14.201 -23.802 -18.066 1.00 0.00 H new ATOM 0 HD13 LEU A 500 13.998 -22.527 -16.842 1.00 0.00 H new ATOM 0 HD21 LEU A 500 14.681 -24.384 -14.425 1.00 0.00 H new ATOM 0 HD22 LEU A 500 13.284 -23.281 -14.404 1.00 0.00 H new ATOM 0 HD23 LEU A 500 13.047 -25.022 -14.124 1.00 0.00 H new ATOM 1254 N HIS A 501 11.568 -22.005 -18.050 1.00 0.00 N ATOM 1255 CA HIS A 501 11.263 -21.065 -19.116 1.00 0.00 C ATOM 1256 C HIS A 501 10.046 -21.559 -19.903 1.00 0.00 C ATOM 1257 O HIS A 501 9.558 -20.869 -20.796 1.00 0.00 O ATOM 1258 CB HIS A 501 12.487 -20.833 -20.003 1.00 0.00 C ATOM 1259 CG HIS A 501 13.433 -19.779 -19.481 1.00 0.00 C ATOM 1260 ND1 HIS A 501 13.473 -18.491 -19.985 1.00 0.00 N ATOM 1261 CD2 HIS A 501 14.373 -19.835 -18.494 1.00 0.00 C ATOM 1262 CE1 HIS A 501 14.398 -17.811 -19.326 1.00 0.00 C ATOM 1263 NE2 HIS A 501 14.956 -18.647 -18.402 1.00 0.00 N ATOM 0 H HIS A 501 12.431 -22.533 -18.180 1.00 0.00 H new ATOM 0 HA HIS A 501 11.008 -20.095 -18.688 1.00 0.00 H new ATOM 0 HB2 HIS A 501 13.029 -21.773 -20.109 1.00 0.00 H new ATOM 0 HB3 HIS A 501 12.152 -20.544 -20.999 1.00 0.00 H new ATOM 0 HD2 HIS A 501 14.604 -20.700 -17.890 1.00 0.00 H new ATOM 0 HE1 HIS A 501 14.664 -16.777 -19.490 1.00 0.00 H new ATOM 0 HE2 HIS A 501 15.699 -18.399 -17.749 1.00 0.00 H new ATOM 1271 N ASN A 502 9.591 -22.750 -19.541 1.00 0.00 N ATOM 1272 CA ASN A 502 8.442 -23.344 -20.202 1.00 0.00 C ATOM 1273 C ASN A 502 7.172 -22.612 -19.763 1.00 0.00 C ATOM 1274 O ASN A 502 6.118 -22.768 -20.376 1.00 0.00 O ATOM 1275 CB ASN A 502 8.291 -24.818 -19.823 1.00 0.00 C ATOM 1276 CG ASN A 502 9.472 -25.642 -20.343 1.00 0.00 C ATOM 1277 OD1 ASN A 502 10.406 -25.129 -20.936 1.00 0.00 O ATOM 1278 ND2 ASN A 502 9.377 -26.945 -20.089 1.00 0.00 N ATOM 0 H ASN A 502 9.998 -23.319 -18.799 1.00 0.00 H new ATOM 0 HA ASN A 502 8.592 -23.261 -21.278 1.00 0.00 H new ATOM 0 HB2 ASN A 502 8.225 -24.914 -18.739 1.00 0.00 H new ATOM 0 HB3 ASN A 502 7.361 -25.210 -20.234 1.00 0.00 H new ATOM 0 HD21 ASN A 502 10.114 -27.580 -20.396 1.00 0.00 H new ATOM 0 HD22 ASN A 502 8.567 -27.309 -19.587 1.00 0.00 H new ATOM 1285 N GLY A 503 7.316 -21.827 -18.705 1.00 0.00 N ATOM 1286 CA GLY A 503 6.194 -21.069 -18.177 1.00 0.00 C ATOM 1287 C GLY A 503 6.402 -20.740 -16.698 1.00 0.00 C ATOM 1288 O GLY A 503 7.510 -20.873 -16.179 1.00 0.00 O ATOM 0 H GLY A 503 8.193 -21.700 -18.199 1.00 0.00 H new ATOM 0 HA2 GLY A 503 6.074 -20.146 -18.745 1.00 0.00 H new ATOM 0 HA3 GLY A 503 5.274 -21.641 -18.300 1.00 0.00 H new ATOM 1292 N ARG A 504 5.321 -20.316 -16.061 1.00 0.00 N ATOM 1293 CA ARG A 504 5.372 -19.966 -14.651 1.00 0.00 C ATOM 1294 C ARG A 504 4.300 -20.733 -13.875 1.00 0.00 C ATOM 1295 O ARG A 504 3.195 -20.940 -14.375 1.00 0.00 O ATOM 1296 CB ARG A 504 5.161 -18.464 -14.448 1.00 0.00 C ATOM 1297 CG ARG A 504 6.361 -17.667 -14.966 1.00 0.00 C ATOM 1298 CD ARG A 504 7.071 -16.939 -13.823 1.00 0.00 C ATOM 1299 NE ARG A 504 8.480 -17.381 -13.740 1.00 0.00 N ATOM 1300 CZ ARG A 504 9.397 -16.834 -12.914 1.00 0.00 C ATOM 1301 NH1 ARG A 504 9.059 -15.816 -12.093 1.00 0.00 N ATOM 1302 NH2 ARG A 504 10.630 -17.306 -12.923 1.00 0.00 N ATOM 0 H ARG A 504 4.404 -20.207 -16.495 1.00 0.00 H new ATOM 0 HA ARG A 504 6.360 -20.237 -14.278 1.00 0.00 H new ATOM 0 HB2 ARG A 504 4.257 -18.146 -14.968 1.00 0.00 H new ATOM 0 HB3 ARG A 504 5.010 -18.254 -13.389 1.00 0.00 H new ATOM 0 HG2 ARG A 504 7.060 -18.339 -15.464 1.00 0.00 H new ATOM 0 HG3 ARG A 504 6.028 -16.944 -15.711 1.00 0.00 H new ATOM 0 HD2 ARG A 504 7.028 -15.862 -13.985 1.00 0.00 H new ATOM 0 HD3 ARG A 504 6.562 -17.141 -12.881 1.00 0.00 H new ATOM 0 HE ARG A 504 8.777 -18.147 -14.345 1.00 0.00 H new ATOM 0 HH11 ARG A 504 8.105 -15.455 -12.094 1.00 0.00 H new ATOM 0 HH12 ARG A 504 9.758 -15.408 -11.472 1.00 0.00 H new ATOM 0 HH21 ARG A 504 10.878 -18.073 -13.548 1.00 0.00 H new ATOM 0 HH22 ARG A 504 11.335 -16.904 -12.305 1.00 0.00 H new ATOM 1315 N CYS A 505 4.663 -21.135 -12.665 1.00 0.00 N ATOM 1316 CA CYS A 505 3.746 -21.875 -11.815 1.00 0.00 C ATOM 1317 C CYS A 505 2.908 -20.870 -11.024 1.00 0.00 C ATOM 1318 O CYS A 505 3.450 -20.042 -10.294 1.00 0.00 O ATOM 1319 CB CYS A 505 4.487 -22.849 -10.898 1.00 0.00 C ATOM 1320 SG CYS A 505 4.815 -24.495 -11.630 1.00 0.00 S ATOM 0 H CYS A 505 5.580 -20.962 -12.253 1.00 0.00 H new ATOM 0 HA CYS A 505 3.089 -22.488 -12.431 1.00 0.00 H new ATOM 0 HB2 CYS A 505 5.437 -22.401 -10.607 1.00 0.00 H new ATOM 0 HB3 CYS A 505 3.905 -22.982 -9.986 1.00 0.00 H new ATOM 1325 N LEU A 506 1.598 -20.975 -11.194 1.00 0.00 N ATOM 1326 CA LEU A 506 0.679 -20.085 -10.504 1.00 0.00 C ATOM 1327 C LEU A 506 0.188 -20.761 -9.223 1.00 0.00 C ATOM 1328 O LEU A 506 -0.234 -21.915 -9.248 1.00 0.00 O ATOM 1329 CB LEU A 506 -0.449 -19.648 -11.441 1.00 0.00 C ATOM 1330 CG LEU A 506 -0.154 -18.437 -12.327 1.00 0.00 C ATOM 1331 CD1 LEU A 506 -1.337 -18.132 -13.248 1.00 0.00 C ATOM 1332 CD2 LEU A 506 0.244 -17.225 -11.483 1.00 0.00 C ATOM 0 H LEU A 506 1.151 -21.663 -11.800 1.00 0.00 H new ATOM 0 HA LEU A 506 1.187 -19.168 -10.206 1.00 0.00 H new ATOM 0 HB2 LEU A 506 -0.707 -20.489 -12.084 1.00 0.00 H new ATOM 0 HB3 LEU A 506 -1.330 -19.426 -10.838 1.00 0.00 H new ATOM 0 HG LEU A 506 0.697 -18.678 -12.965 1.00 0.00 H new ATOM 0 HD11 LEU A 506 -1.102 -17.267 -13.868 1.00 0.00 H new ATOM 0 HD12 LEU A 506 -1.532 -18.993 -13.887 1.00 0.00 H new ATOM 0 HD13 LEU A 506 -2.221 -17.918 -12.647 1.00 0.00 H new ATOM 0 HD21 LEU A 506 0.448 -16.377 -12.137 1.00 0.00 H new ATOM 0 HD22 LEU A 506 -0.570 -16.971 -10.804 1.00 0.00 H new ATOM 0 HD23 LEU A 506 1.138 -17.461 -10.905 1.00 0.00 H new ATOM 1344 N ASP A 507 0.259 -20.012 -8.132 1.00 0.00 N ATOM 1345 CA ASP A 507 -0.172 -20.524 -6.843 1.00 0.00 C ATOM 1346 C ASP A 507 -1.633 -20.130 -6.605 1.00 0.00 C ATOM 1347 O ASP A 507 -1.910 -19.067 -6.055 1.00 0.00 O ATOM 1348 CB ASP A 507 0.666 -19.935 -5.707 1.00 0.00 C ATOM 1349 CG ASP A 507 0.874 -20.862 -4.508 1.00 0.00 C ATOM 1350 OD1 ASP A 507 1.985 -20.969 -3.967 1.00 0.00 O ATOM 1351 OD2 ASP A 507 -0.179 -21.504 -4.126 1.00 0.00 O ATOM 0 H ASP A 507 0.609 -19.054 -8.115 1.00 0.00 H new ATOM 0 HA ASP A 507 -0.053 -21.607 -6.854 1.00 0.00 H new ATOM 0 HB2 ASP A 507 1.642 -19.654 -6.104 1.00 0.00 H new ATOM 0 HB3 ASP A 507 0.188 -19.019 -5.360 1.00 0.00 H new ATOM 1357 N LYS A 508 -2.525 -21.009 -7.035 1.00 0.00 N ATOM 1358 CA LYS A 508 -3.950 -20.768 -6.876 1.00 0.00 C ATOM 1359 C LYS A 508 -4.437 -21.438 -5.590 1.00 0.00 C ATOM 1360 O LYS A 508 -3.923 -22.485 -5.199 1.00 0.00 O ATOM 1361 CB LYS A 508 -4.711 -21.210 -8.127 1.00 0.00 C ATOM 1362 CG LYS A 508 -4.156 -20.523 -9.377 1.00 0.00 C ATOM 1363 CD LYS A 508 -5.258 -19.772 -10.126 1.00 0.00 C ATOM 1364 CE LYS A 508 -4.719 -19.149 -11.415 1.00 0.00 C ATOM 1365 NZ LYS A 508 -5.764 -19.142 -12.464 1.00 0.00 N ATOM 0 H LYS A 508 -2.290 -21.889 -7.493 1.00 0.00 H new ATOM 0 HA LYS A 508 -4.146 -19.701 -6.773 1.00 0.00 H new ATOM 0 HB2 LYS A 508 -4.637 -22.292 -8.239 1.00 0.00 H new ATOM 0 HB3 LYS A 508 -5.769 -20.973 -8.016 1.00 0.00 H new ATOM 0 HG2 LYS A 508 -3.366 -19.828 -9.093 1.00 0.00 H new ATOM 0 HG3 LYS A 508 -3.706 -21.266 -10.035 1.00 0.00 H new ATOM 0 HD2 LYS A 508 -6.073 -20.456 -10.362 1.00 0.00 H new ATOM 0 HD3 LYS A 508 -5.671 -18.992 -9.486 1.00 0.00 H new ATOM 0 HE2 LYS A 508 -4.383 -18.130 -11.221 1.00 0.00 H new ATOM 0 HE3 LYS A 508 -3.851 -19.710 -11.762 1.00 0.00 H new ATOM 0 HZ1 LYS A 508 -5.382 -18.716 -13.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 508 -6.065 -20.118 -12.661 1.00 0.00 H new ATOM 0 HZ3 LYS A 508 -6.581 -18.587 -12.137 1.00 0.00 H new ATOM 1378 N ILE A 509 -5.422 -20.808 -4.968 1.00 0.00 N ATOM 1379 CA ILE A 509 -5.984 -21.330 -3.735 1.00 0.00 C ATOM 1380 C ILE A 509 -6.978 -22.446 -4.064 1.00 0.00 C ATOM 1381 O ILE A 509 -8.124 -22.411 -3.622 1.00 0.00 O ATOM 1382 CB ILE A 509 -6.585 -20.199 -2.898 1.00 0.00 C ATOM 1383 CG1 ILE A 509 -5.654 -18.987 -2.866 1.00 0.00 C ATOM 1384 CG2 ILE A 509 -6.939 -20.686 -1.491 1.00 0.00 C ATOM 1385 CD1 ILE A 509 -6.000 -17.999 -3.981 1.00 0.00 C ATOM 0 H ILE A 509 -5.846 -19.940 -5.295 1.00 0.00 H new ATOM 0 HA ILE A 509 -5.201 -21.771 -3.118 1.00 0.00 H new ATOM 0 HB ILE A 509 -7.513 -19.880 -3.372 1.00 0.00 H new ATOM 0 HG12 ILE A 509 -5.731 -18.490 -1.899 1.00 0.00 H new ATOM 0 HG13 ILE A 509 -4.620 -19.315 -2.974 1.00 0.00 H new ATOM 0 HG21 ILE A 509 -7.364 -19.863 -0.917 1.00 0.00 H new ATOM 0 HG22 ILE A 509 -7.666 -21.495 -1.558 1.00 0.00 H new ATOM 0 HG23 ILE A 509 -6.039 -21.048 -0.994 1.00 0.00 H new ATOM 0 HD11 ILE A 509 -5.322 -17.146 -3.935 1.00 0.00 H new ATOM 0 HD12 ILE A 509 -5.898 -18.492 -4.948 1.00 0.00 H new ATOM 0 HD13 ILE A 509 -7.026 -17.654 -3.856 1.00 0.00 H new ATOM 1397 N ASN A 510 -6.502 -23.409 -4.839 1.00 0.00 N ATOM 1398 CA ASN A 510 -7.334 -24.534 -5.233 1.00 0.00 C ATOM 1399 C ASN A 510 -6.479 -25.555 -5.986 1.00 0.00 C ATOM 1400 O ASN A 510 -6.633 -26.760 -5.791 1.00 0.00 O ATOM 1401 CB ASN A 510 -8.461 -24.083 -6.165 1.00 0.00 C ATOM 1402 CG ASN A 510 -9.677 -25.004 -6.038 1.00 0.00 C ATOM 1403 OD1 ASN A 510 -9.580 -26.218 -6.133 1.00 0.00 O ATOM 1404 ND2 ASN A 510 -10.822 -24.363 -5.823 1.00 0.00 N ATOM 0 H ASN A 510 -5.550 -23.434 -5.205 1.00 0.00 H new ATOM 0 HA ASN A 510 -7.763 -24.970 -4.331 1.00 0.00 H new ATOM 0 HB2 ASN A 510 -8.749 -23.059 -5.925 1.00 0.00 H new ATOM 0 HB3 ASN A 510 -8.107 -24.082 -7.196 1.00 0.00 H new ATOM 0 HD21 ASN A 510 -11.691 -24.889 -5.727 1.00 0.00 H new ATOM 0 HD22 ASN A 510 -10.832 -23.345 -5.754 1.00 0.00 H new ATOM 1411 N GLU A 511 -5.598 -25.037 -6.828 1.00 0.00 N ATOM 1412 CA GLU A 511 -4.720 -25.890 -7.611 1.00 0.00 C ATOM 1413 C GLU A 511 -3.535 -25.084 -8.146 1.00 0.00 C ATOM 1414 O GLU A 511 -3.304 -23.955 -7.717 1.00 0.00 O ATOM 1415 CB GLU A 511 -5.484 -26.565 -8.751 1.00 0.00 C ATOM 1416 CG GLU A 511 -5.361 -28.088 -8.669 1.00 0.00 C ATOM 1417 CD GLU A 511 -6.488 -28.772 -9.446 1.00 0.00 C ATOM 1418 OE1 GLU A 511 -6.918 -28.261 -10.491 1.00 0.00 O ATOM 1419 OE2 GLU A 511 -6.917 -29.873 -8.930 1.00 0.00 O ATOM 0 H GLU A 511 -5.473 -24.037 -6.986 1.00 0.00 H new ATOM 0 HA GLU A 511 -4.335 -26.676 -6.961 1.00 0.00 H new ATOM 0 HB2 GLU A 511 -6.535 -26.279 -8.708 1.00 0.00 H new ATOM 0 HB3 GLU A 511 -5.097 -26.217 -9.709 1.00 0.00 H new ATOM 0 HG2 GLU A 511 -4.397 -28.401 -9.069 1.00 0.00 H new ATOM 0 HG3 GLU A 511 -5.390 -28.403 -7.626 1.00 0.00 H new ATOM 1427 N PHE A 512 -2.816 -25.694 -9.076 1.00 0.00 N ATOM 1428 CA PHE A 512 -1.660 -25.047 -9.673 1.00 0.00 C ATOM 1429 C PHE A 512 -1.850 -24.869 -11.181 1.00 0.00 C ATOM 1430 O PHE A 512 -2.456 -25.715 -11.838 1.00 0.00 O ATOM 1431 CB PHE A 512 -0.457 -25.960 -9.427 1.00 0.00 C ATOM 1432 CG PHE A 512 0.314 -26.330 -10.697 1.00 0.00 C ATOM 1433 CD1 PHE A 512 1.198 -25.448 -11.236 1.00 0.00 C ATOM 1434 CD2 PHE A 512 0.115 -27.539 -11.286 1.00 0.00 C ATOM 1435 CE1 PHE A 512 1.913 -25.790 -12.413 1.00 0.00 C ATOM 1436 CE2 PHE A 512 0.830 -27.882 -12.462 1.00 0.00 C ATOM 1437 CZ PHE A 512 1.715 -27.000 -13.001 1.00 0.00 C ATOM 0 H PHE A 512 -3.011 -26.630 -9.431 1.00 0.00 H new ATOM 0 HA PHE A 512 -1.518 -24.060 -9.232 1.00 0.00 H new ATOM 0 HB2 PHE A 512 0.223 -25.468 -8.732 1.00 0.00 H new ATOM 0 HB3 PHE A 512 -0.801 -26.874 -8.944 1.00 0.00 H new ATOM 0 HD1 PHE A 512 1.356 -24.487 -10.768 1.00 0.00 H new ATOM 0 HD2 PHE A 512 -0.588 -28.239 -10.858 1.00 0.00 H new ATOM 0 HE1 PHE A 512 2.614 -25.089 -12.842 1.00 0.00 H new ATOM 0 HE2 PHE A 512 0.672 -28.843 -12.929 1.00 0.00 H new ATOM 0 HZ PHE A 512 2.260 -27.261 -13.896 1.00 0.00 H new ATOM 1447 N GLN A 513 -1.323 -23.764 -11.686 1.00 0.00 N ATOM 1448 CA GLN A 513 -1.427 -23.464 -13.104 1.00 0.00 C ATOM 1449 C GLN A 513 -0.075 -23.000 -13.648 1.00 0.00 C ATOM 1450 O GLN A 513 0.440 -21.961 -13.238 1.00 0.00 O ATOM 1451 CB GLN A 513 -2.513 -22.419 -13.364 1.00 0.00 C ATOM 1452 CG GLN A 513 -3.403 -22.833 -14.538 1.00 0.00 C ATOM 1453 CD GLN A 513 -4.577 -23.688 -14.061 1.00 0.00 C ATOM 1454 OE1 GLN A 513 -5.613 -23.193 -13.652 1.00 0.00 O ATOM 1455 NE2 GLN A 513 -4.357 -24.999 -14.135 1.00 0.00 N ATOM 0 H GLN A 513 -0.822 -23.065 -11.138 1.00 0.00 H new ATOM 0 HA GLN A 513 -1.714 -24.375 -13.630 1.00 0.00 H new ATOM 0 HB2 GLN A 513 -3.122 -22.292 -12.469 1.00 0.00 H new ATOM 0 HB3 GLN A 513 -2.051 -21.454 -13.575 1.00 0.00 H new ATOM 0 HG2 GLN A 513 -3.778 -21.944 -15.045 1.00 0.00 H new ATOM 0 HG3 GLN A 513 -2.814 -23.391 -15.266 1.00 0.00 H new ATOM 0 HE21 GLN A 513 -3.466 -25.347 -14.488 1.00 0.00 H new ATOM 0 HE22 GLN A 513 -5.080 -25.655 -13.839 1.00 0.00 H new ATOM 1464 N CYS A 514 0.462 -23.791 -14.565 1.00 0.00 N ATOM 1465 CA CYS A 514 1.744 -23.473 -15.171 1.00 0.00 C ATOM 1466 C CYS A 514 1.493 -22.577 -16.384 1.00 0.00 C ATOM 1467 O CYS A 514 1.615 -23.019 -17.525 1.00 0.00 O ATOM 1468 CB CYS A 514 2.520 -24.737 -15.547 1.00 0.00 C ATOM 1469 SG CYS A 514 4.313 -24.486 -15.810 1.00 0.00 S ATOM 0 H CYS A 514 0.032 -24.652 -14.903 1.00 0.00 H new ATOM 0 HA CYS A 514 2.368 -22.942 -14.451 1.00 0.00 H new ATOM 0 HB2 CYS A 514 2.383 -25.478 -14.760 1.00 0.00 H new ATOM 0 HB3 CYS A 514 2.088 -25.154 -16.457 1.00 0.00 H new ATOM 1474 N GLU A 515 1.148 -21.328 -16.097 1.00 0.00 N ATOM 1475 CA GLU A 515 0.878 -20.365 -17.150 1.00 0.00 C ATOM 1476 C GLU A 515 1.952 -20.454 -18.237 1.00 0.00 C ATOM 1477 O GLU A 515 2.968 -21.124 -18.058 1.00 0.00 O ATOM 1478 CB GLU A 515 0.786 -18.947 -16.585 1.00 0.00 C ATOM 1479 CG GLU A 515 2.124 -18.507 -15.987 1.00 0.00 C ATOM 1480 CD GLU A 515 2.839 -17.518 -16.913 1.00 0.00 C ATOM 1481 OE1 GLU A 515 2.243 -16.509 -17.318 1.00 0.00 O ATOM 1482 OE2 GLU A 515 4.054 -17.829 -17.206 1.00 0.00 O ATOM 0 H GLU A 515 1.050 -20.963 -15.150 1.00 0.00 H new ATOM 0 HA GLU A 515 -0.086 -20.605 -17.598 1.00 0.00 H new ATOM 0 HB2 GLU A 515 0.492 -18.256 -17.374 1.00 0.00 H new ATOM 0 HB3 GLU A 515 0.011 -18.906 -15.820 1.00 0.00 H new ATOM 0 HG2 GLU A 515 1.957 -18.045 -15.014 1.00 0.00 H new ATOM 0 HG3 GLU A 515 2.757 -19.379 -15.821 1.00 0.00 H new ATOM 1490 N CYS A 516 1.690 -19.768 -19.339 1.00 0.00 N ATOM 1491 CA CYS A 516 2.621 -19.760 -20.456 1.00 0.00 C ATOM 1492 C CYS A 516 3.485 -18.502 -20.351 1.00 0.00 C ATOM 1493 O CYS A 516 2.989 -17.430 -20.009 1.00 0.00 O ATOM 1494 CB CYS A 516 1.893 -19.842 -21.799 1.00 0.00 C ATOM 1495 SG CYS A 516 2.852 -19.222 -23.229 1.00 0.00 S ATOM 0 H CYS A 516 0.846 -19.213 -19.483 1.00 0.00 H new ATOM 0 HA CYS A 516 3.259 -20.643 -20.408 1.00 0.00 H new ATOM 0 HB2 CYS A 516 1.619 -20.880 -21.985 1.00 0.00 H new ATOM 0 HB3 CYS A 516 0.965 -19.275 -21.729 1.00 0.00 H new ATOM 0 HG CYS A 516 3.443 -18.110 -22.906 1.00 0.00 H new ATOM 1500 N PRO A 517 4.797 -18.678 -20.660 1.00 0.00 N ATOM 1501 CA PRO A 517 5.736 -17.571 -20.604 1.00 0.00 C ATOM 1502 C PRO A 517 5.546 -16.632 -21.797 1.00 0.00 C ATOM 1503 O PRO A 517 4.643 -16.827 -22.608 1.00 0.00 O ATOM 1504 CB PRO A 517 7.110 -18.219 -20.573 1.00 0.00 C ATOM 1505 CG PRO A 517 6.912 -19.639 -21.078 1.00 0.00 C ATOM 1506 CD PRO A 517 5.421 -19.934 -21.069 1.00 0.00 C ATOM 0 HA PRO A 517 5.589 -16.940 -19.728 1.00 0.00 H new ATOM 0 HB2 PRO A 517 7.813 -17.675 -21.204 1.00 0.00 H new ATOM 0 HB3 PRO A 517 7.520 -18.217 -19.563 1.00 0.00 H new ATOM 0 HG2 PRO A 517 7.316 -19.746 -22.085 1.00 0.00 H new ATOM 0 HG3 PRO A 517 7.445 -20.347 -20.444 1.00 0.00 H new ATOM 0 HD2 PRO A 517 5.073 -20.247 -22.054 1.00 0.00 H new ATOM 0 HD3 PRO A 517 5.181 -20.740 -20.375 1.00 0.00 H new