USER MOD reduce.3.24.130724 H: found=0, std=0, add=785, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 785 hydrogens (27 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 511 LYS NZ :NH3+ 171:sc= 1.1 (180deg=0) USER MOD Set 1.2: A 514 GLN : amide:sc= 0.947 K(o=2,f=-2.6) USER MOD Set 2.1: A 492 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 493 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 442 HIS : no HD1:sc= 0.126 K(o=4.6,f=-8) USER MOD Set 3.2: A 444 THR OG1 : rot 180:sc= 0 USER MOD Set 3.3: A 473 SER OG : rot -170:sc= 0.0173 USER MOD Set 3.4: A 500 GLN : amide:sc= 2.07 K(o=4.6,f=-5.4!) USER MOD Set 3.5: A 508 LYS NZ :NH3+ -156:sc= 2.35 (180deg=0.474) USER MOD Set 4.1: A 436 LYS NZ :NH3+ -161:sc= 0.805 (180deg=-0.00554) USER MOD Set 4.2: A 439 HIS : no HD1:sc= 0.621 K(o=1.4,f=-3.1) USER MOD Set 4.3: A 477 SER OG : rot 180:sc= 0 USER MOD Single : A 424 SER OG : rot 180:sc= 0 USER MOD Single : A 425 SER OG : rot 180:sc= 0 USER MOD Single : A 427 SER OG : rot 180:sc= 0 USER MOD Single : A 428 SER OG : rot 180:sc= 0 USER MOD Single : A 434 GLN : amide:sc= 0.82 K(o=0.82,f=-0.018) USER MOD Single : A 447 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 450 LYS NZ :NH3+ 179:sc= 0.933 (180deg=0.932) USER MOD Single : A 451 THR OG1 : rot 180:sc= 0.0534 USER MOD Single : A 452 SER OG : rot 180:sc= 0 USER MOD Single : A 455 TYR OH : rot -130:sc= 0.186 USER MOD Single : A 456 GLN : amide:sc= 0 X(o=0,f=-0.12) USER MOD Single : A 459 SER OG : rot 180:sc= 0 USER MOD Single : A 463 ASN : amide:sc= -0.0546 X(o=-0.055,f=-0.055) USER MOD Single : A 465 GLN : amide:sc= 0 X(o=0,f=-0.24) USER MOD Single : A 467 SER OG : rot 180:sc= 0 USER MOD Single : A 472 THR OG1 : rot 180:sc= 0 USER MOD Single : A 479 SER OG : rot 180:sc= 0 USER MOD Single : A 480 GLN : amide:sc= 0.836 K(o=0.84,f=-0.0082) USER MOD Single : A 483 GLN : amide:sc= 0.0531 K(o=0.053,f=-2.5) USER MOD Single : A 485 GLN : amide:sc= 0 X(o=0,f=-0.097) USER MOD Single : A 489 ASN : amide:sc= 0 X(o=0,f=-0.0017) USER MOD Single : A 490 THR OG1 : rot -76:sc= 0.898 USER MOD Single : A 491 SER OG : rot -75:sc= 0.887 USER MOD Single : A 496 SER OG : rot 180:sc= 0 USER MOD Single : A 497 TYR OH : rot 180:sc= 0 USER MOD Single : A 501 THR OG1 : rot 180:sc= 0.338 USER MOD Single : A 502 TYR OH : rot 180:sc= 0 USER MOD Single : A 505 TYR OH : rot 180:sc= 0 USER MOD Single : A 509 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.00339) USER MOD Single : A 510 GLN : amide:sc= 0.713 K(o=0.71,f=0) USER MOD Single : A 513 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 516 LYS NZ :NH3+ 173:sc= 0.782 (180deg=0.754) USER MOD Single : A 517 SER OG : rot 180:sc= 0 USER MOD Single : A 520 SER OG : rot 180:sc= 0 USER MOD Single : A 521 SER OG : rot 180:sc= 0 USER MOD Single : A 523 7MG O2' : rot -20:sc= 0.0271 USER MOD Single : A 523 7MG O3' : rot 180:sc= 0.0293 USER MOD Single : A 524 GDP O2' : rot 180:sc= 0 USER MOD Single : A 524 GDP O3' : rot 132:sc= 0.0597 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 423 -35.953 -8.898 11.909 1.00 0.00 N ATOM 2 CA GLY A 423 -34.681 -9.458 11.406 1.00 0.00 C ATOM 3 C GLY A 423 -33.474 -8.817 12.077 1.00 0.00 C ATOM 4 O GLY A 423 -33.557 -7.692 12.578 1.00 0.00 O ATOM 0 HA2 GLY A 423 -34.664 -10.534 11.580 1.00 0.00 H new ATOM 0 HA3 GLY A 423 -34.619 -9.308 10.328 1.00 0.00 H new ATOM 10 N SER A 424 -32.338 -9.522 12.083 1.00 0.00 N ATOM 11 CA SER A 424 -31.088 -9.114 12.765 1.00 0.00 C ATOM 12 C SER A 424 -29.803 -9.334 11.943 1.00 0.00 C ATOM 13 O SER A 424 -28.713 -8.954 12.387 1.00 0.00 O ATOM 14 CB SER A 424 -30.985 -9.840 14.114 1.00 0.00 C ATOM 15 OG SER A 424 -30.993 -11.251 13.935 1.00 0.00 O ATOM 0 H SER A 424 -32.252 -10.418 11.603 1.00 0.00 H new ATOM 0 HA SER A 424 -31.157 -8.035 12.904 1.00 0.00 H new ATOM 0 HB2 SER A 424 -30.070 -9.540 14.624 1.00 0.00 H new ATOM 0 HB3 SER A 424 -31.817 -9.546 14.754 1.00 0.00 H new ATOM 0 HG SER A 424 -30.925 -11.692 14.808 1.00 0.00 H new ATOM 21 N SER A 425 -29.906 -9.905 10.737 1.00 0.00 N ATOM 22 CA SER A 425 -28.795 -10.131 9.795 1.00 0.00 C ATOM 23 C SER A 425 -29.287 -10.235 8.340 1.00 0.00 C ATOM 24 O SER A 425 -30.484 -10.406 8.081 1.00 0.00 O ATOM 25 CB SER A 425 -28.019 -11.403 10.183 1.00 0.00 C ATOM 26 OG SER A 425 -28.843 -12.561 10.130 1.00 0.00 O ATOM 0 H SER A 425 -30.799 -10.237 10.373 1.00 0.00 H new ATOM 0 HA SER A 425 -28.132 -9.268 9.858 1.00 0.00 H new ATOM 0 HB2 SER A 425 -27.170 -11.530 9.511 1.00 0.00 H new ATOM 0 HB3 SER A 425 -27.615 -11.290 11.189 1.00 0.00 H new ATOM 0 HG SER A 425 -28.317 -13.349 10.381 1.00 0.00 H new ATOM 32 N GLY A 426 -28.364 -10.131 7.376 1.00 0.00 N ATOM 33 CA GLY A 426 -28.645 -10.252 5.940 1.00 0.00 C ATOM 34 C GLY A 426 -27.448 -9.906 5.044 1.00 0.00 C ATOM 35 O GLY A 426 -26.401 -9.457 5.524 1.00 0.00 O ATOM 0 H GLY A 426 -27.379 -9.957 7.577 1.00 0.00 H new ATOM 0 HA2 GLY A 426 -28.964 -11.272 5.726 1.00 0.00 H new ATOM 0 HA3 GLY A 426 -29.479 -9.597 5.686 1.00 0.00 H new ATOM 39 N SER A 427 -27.606 -10.112 3.735 1.00 0.00 N ATOM 40 CA SER A 427 -26.599 -9.827 2.697 1.00 0.00 C ATOM 41 C SER A 427 -27.233 -9.626 1.307 1.00 0.00 C ATOM 42 O SER A 427 -28.413 -9.932 1.097 1.00 0.00 O ATOM 43 CB SER A 427 -25.559 -10.962 2.644 1.00 0.00 C ATOM 44 OG SER A 427 -26.157 -12.205 2.300 1.00 0.00 O ATOM 0 H SER A 427 -28.469 -10.496 3.349 1.00 0.00 H new ATOM 0 HA SER A 427 -26.109 -8.892 2.969 1.00 0.00 H new ATOM 0 HB2 SER A 427 -24.787 -10.715 1.915 1.00 0.00 H new ATOM 0 HB3 SER A 427 -25.066 -11.050 3.612 1.00 0.00 H new ATOM 0 HG SER A 427 -25.469 -12.903 2.274 1.00 0.00 H new ATOM 50 N SER A 428 -26.439 -9.130 0.349 1.00 0.00 N ATOM 51 CA SER A 428 -26.866 -8.804 -1.030 1.00 0.00 C ATOM 52 C SER A 428 -25.893 -9.325 -2.110 1.00 0.00 C ATOM 53 O SER A 428 -26.004 -8.964 -3.286 1.00 0.00 O ATOM 54 CB SER A 428 -27.048 -7.282 -1.177 1.00 0.00 C ATOM 55 OG SER A 428 -27.975 -6.772 -0.225 1.00 0.00 O ATOM 0 H SER A 428 -25.451 -8.936 0.511 1.00 0.00 H new ATOM 0 HA SER A 428 -27.815 -9.315 -1.192 1.00 0.00 H new ATOM 0 HB2 SER A 428 -26.086 -6.786 -1.051 1.00 0.00 H new ATOM 0 HB3 SER A 428 -27.396 -7.052 -2.184 1.00 0.00 H new ATOM 0 HG SER A 428 -28.067 -5.804 -0.344 1.00 0.00 H new ATOM 61 N GLY A 429 -24.926 -10.163 -1.725 1.00 0.00 N ATOM 62 CA GLY A 429 -23.866 -10.704 -2.586 1.00 0.00 C ATOM 63 C GLY A 429 -22.774 -11.433 -1.790 1.00 0.00 C ATOM 64 O GLY A 429 -22.903 -11.640 -0.579 1.00 0.00 O ATOM 0 H GLY A 429 -24.856 -10.498 -0.764 1.00 0.00 H new ATOM 0 HA2 GLY A 429 -24.305 -11.393 -3.308 1.00 0.00 H new ATOM 0 HA3 GLY A 429 -23.415 -9.891 -3.155 1.00 0.00 H new ATOM 68 N GLY A 430 -21.683 -11.809 -2.465 1.00 0.00 N ATOM 69 CA GLY A 430 -20.504 -12.429 -1.844 1.00 0.00 C ATOM 70 C GLY A 430 -19.274 -12.499 -2.767 1.00 0.00 C ATOM 71 O GLY A 430 -19.383 -12.171 -3.957 1.00 0.00 O ATOM 0 H GLY A 430 -21.591 -11.690 -3.474 1.00 0.00 H new ATOM 0 HA2 GLY A 430 -20.241 -11.868 -0.947 1.00 0.00 H new ATOM 0 HA3 GLY A 430 -20.763 -13.438 -1.524 1.00 0.00 H new ATOM 75 N PRO A 431 -18.097 -12.898 -2.239 1.00 0.00 N ATOM 76 CA PRO A 431 -16.835 -12.981 -2.984 1.00 0.00 C ATOM 77 C PRO A 431 -16.909 -13.806 -4.282 1.00 0.00 C ATOM 78 O PRO A 431 -17.396 -14.941 -4.286 1.00 0.00 O ATOM 79 CB PRO A 431 -15.824 -13.596 -2.006 1.00 0.00 C ATOM 80 CG PRO A 431 -16.363 -13.204 -0.635 1.00 0.00 C ATOM 81 CD PRO A 431 -17.874 -13.247 -0.841 1.00 0.00 C ATOM 0 HA PRO A 431 -16.553 -11.985 -3.325 1.00 0.00 H new ATOM 0 HB2 PRO A 431 -15.766 -14.679 -2.119 1.00 0.00 H new ATOM 0 HB3 PRO A 431 -14.820 -13.204 -2.169 1.00 0.00 H new ATOM 0 HG2 PRO A 431 -16.041 -13.899 0.140 1.00 0.00 H new ATOM 0 HG3 PRO A 431 -16.024 -12.212 -0.335 1.00 0.00 H new ATOM 0 HD2 PRO A 431 -18.271 -14.237 -0.618 1.00 0.00 H new ATOM 0 HD3 PRO A 431 -18.379 -12.545 -0.178 1.00 0.00 H new ATOM 89 N ASP A 432 -16.367 -13.259 -5.376 1.00 0.00 N ATOM 90 CA ASP A 432 -16.223 -13.940 -6.679 1.00 0.00 C ATOM 91 C ASP A 432 -14.930 -13.590 -7.451 1.00 0.00 C ATOM 92 O ASP A 432 -14.723 -14.044 -8.581 1.00 0.00 O ATOM 93 CB ASP A 432 -17.478 -13.699 -7.541 1.00 0.00 C ATOM 94 CG ASP A 432 -17.515 -12.317 -8.226 1.00 0.00 C ATOM 95 OD1 ASP A 432 -17.162 -11.294 -7.591 1.00 0.00 O ATOM 96 OD2 ASP A 432 -17.923 -12.246 -9.413 1.00 0.00 O ATOM 0 H ASP A 432 -16.005 -12.305 -5.386 1.00 0.00 H new ATOM 0 HA ASP A 432 -16.128 -15.003 -6.457 1.00 0.00 H new ATOM 0 HB2 ASP A 432 -17.535 -14.473 -8.306 1.00 0.00 H new ATOM 0 HB3 ASP A 432 -18.363 -13.805 -6.913 1.00 0.00 H new ATOM 101 N LEU A 433 -14.048 -12.799 -6.834 1.00 0.00 N ATOM 102 CA LEU A 433 -12.682 -12.512 -7.278 1.00 0.00 C ATOM 103 C LEU A 433 -11.760 -13.754 -7.288 1.00 0.00 C ATOM 104 O LEU A 433 -12.129 -14.837 -6.821 1.00 0.00 O ATOM 105 CB LEU A 433 -12.103 -11.387 -6.389 1.00 0.00 C ATOM 106 CG LEU A 433 -11.791 -11.770 -4.922 1.00 0.00 C ATOM 107 CD1 LEU A 433 -10.826 -10.744 -4.325 1.00 0.00 C ATOM 108 CD2 LEU A 433 -13.028 -11.817 -4.018 1.00 0.00 C ATOM 0 H LEU A 433 -14.280 -12.316 -5.966 1.00 0.00 H new ATOM 0 HA LEU A 433 -12.727 -12.188 -8.318 1.00 0.00 H new ATOM 0 HB2 LEU A 433 -11.185 -11.023 -6.851 1.00 0.00 H new ATOM 0 HB3 LEU A 433 -12.809 -10.556 -6.384 1.00 0.00 H new ATOM 0 HG LEU A 433 -11.364 -12.772 -4.958 1.00 0.00 H new ATOM 0 HD11 LEU A 433 -10.604 -11.011 -3.292 1.00 0.00 H new ATOM 0 HD12 LEU A 433 -9.902 -10.734 -4.903 1.00 0.00 H new ATOM 0 HD13 LEU A 433 -11.283 -9.755 -4.354 1.00 0.00 H new ATOM 0 HD21 LEU A 433 -12.729 -12.092 -3.007 1.00 0.00 H new ATOM 0 HD22 LEU A 433 -13.504 -10.837 -4.002 1.00 0.00 H new ATOM 0 HD23 LEU A 433 -13.731 -12.556 -4.402 1.00 0.00 H new ATOM 120 N GLN A 434 -10.521 -13.570 -7.751 1.00 0.00 N ATOM 121 CA GLN A 434 -9.413 -14.533 -7.655 1.00 0.00 C ATOM 122 C GLN A 434 -8.125 -13.813 -7.193 1.00 0.00 C ATOM 123 O GLN A 434 -7.931 -12.639 -7.533 1.00 0.00 O ATOM 124 CB GLN A 434 -9.191 -15.220 -9.018 1.00 0.00 C ATOM 125 CG GLN A 434 -10.322 -16.172 -9.448 1.00 0.00 C ATOM 126 CD GLN A 434 -10.394 -17.438 -8.593 1.00 0.00 C ATOM 127 OE1 GLN A 434 -9.740 -18.439 -8.859 1.00 0.00 O ATOM 128 NE2 GLN A 434 -11.179 -17.452 -7.536 1.00 0.00 N ATOM 0 H GLN A 434 -10.247 -12.709 -8.224 1.00 0.00 H new ATOM 0 HA GLN A 434 -9.666 -15.297 -6.919 1.00 0.00 H new ATOM 0 HB2 GLN A 434 -9.071 -14.452 -9.782 1.00 0.00 H new ATOM 0 HB3 GLN A 434 -8.257 -15.781 -8.980 1.00 0.00 H new ATOM 0 HG2 GLN A 434 -11.275 -15.646 -9.389 1.00 0.00 H new ATOM 0 HG3 GLN A 434 -10.177 -16.452 -10.491 1.00 0.00 H new ATOM 0 HE21 GLN A 434 -11.731 -16.627 -7.300 1.00 0.00 H new ATOM 0 HE22 GLN A 434 -11.235 -18.287 -6.954 1.00 0.00 H new ATOM 137 N PRO A 435 -7.247 -14.471 -6.409 1.00 0.00 N ATOM 138 CA PRO A 435 -6.095 -13.820 -5.781 1.00 0.00 C ATOM 139 C PRO A 435 -4.989 -13.461 -6.790 1.00 0.00 C ATOM 140 O PRO A 435 -4.486 -14.318 -7.525 1.00 0.00 O ATOM 141 CB PRO A 435 -5.601 -14.806 -4.716 1.00 0.00 C ATOM 142 CG PRO A 435 -6.032 -16.168 -5.257 1.00 0.00 C ATOM 143 CD PRO A 435 -7.348 -15.856 -5.965 1.00 0.00 C ATOM 0 HA PRO A 435 -6.380 -12.863 -5.345 1.00 0.00 H new ATOM 0 HB2 PRO A 435 -4.520 -14.749 -4.588 1.00 0.00 H new ATOM 0 HB3 PRO A 435 -6.048 -14.602 -3.743 1.00 0.00 H new ATOM 0 HG2 PRO A 435 -5.293 -16.582 -5.943 1.00 0.00 H new ATOM 0 HG3 PRO A 435 -6.167 -16.896 -4.457 1.00 0.00 H new ATOM 0 HD2 PRO A 435 -7.505 -16.526 -6.810 1.00 0.00 H new ATOM 0 HD3 PRO A 435 -8.195 -15.989 -5.291 1.00 0.00 H new ATOM 151 N LYS A 436 -4.582 -12.185 -6.784 1.00 0.00 N ATOM 152 CA LYS A 436 -3.419 -11.623 -7.502 1.00 0.00 C ATOM 153 C LYS A 436 -2.907 -10.351 -6.800 1.00 0.00 C ATOM 154 O LYS A 436 -3.504 -9.926 -5.805 1.00 0.00 O ATOM 155 CB LYS A 436 -3.780 -11.402 -8.988 1.00 0.00 C ATOM 156 CG LYS A 436 -4.631 -10.152 -9.260 1.00 0.00 C ATOM 157 CD LYS A 436 -5.195 -10.157 -10.690 1.00 0.00 C ATOM 158 CE LYS A 436 -5.677 -8.775 -11.153 1.00 0.00 C ATOM 159 NZ LYS A 436 -6.716 -8.201 -10.261 1.00 0.00 N ATOM 0 H LYS A 436 -5.080 -11.473 -6.250 1.00 0.00 H new ATOM 0 HA LYS A 436 -2.591 -12.331 -7.478 1.00 0.00 H new ATOM 0 HB2 LYS A 436 -2.858 -11.331 -9.566 1.00 0.00 H new ATOM 0 HB3 LYS A 436 -4.317 -12.278 -9.352 1.00 0.00 H new ATOM 0 HG2 LYS A 436 -5.452 -10.106 -8.544 1.00 0.00 H new ATOM 0 HG3 LYS A 436 -4.026 -9.258 -9.109 1.00 0.00 H new ATOM 0 HD2 LYS A 436 -4.427 -10.516 -11.376 1.00 0.00 H new ATOM 0 HD3 LYS A 436 -6.025 -10.861 -10.744 1.00 0.00 H new ATOM 0 HE2 LYS A 436 -4.827 -8.095 -11.198 1.00 0.00 H new ATOM 0 HE3 LYS A 436 -6.076 -8.854 -12.164 1.00 0.00 H new ATOM 0 HZ1 LYS A 436 -7.230 -7.451 -10.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 436 -7.382 -8.948 -9.979 1.00 0.00 H new ATOM 0 HZ3 LYS A 436 -6.264 -7.802 -9.414 1.00 0.00 H new ATOM 173 N ARG A 437 -1.808 -9.755 -7.280 1.00 0.00 N ATOM 174 CA ARG A 437 -1.139 -8.588 -6.645 1.00 0.00 C ATOM 175 C ARG A 437 -0.709 -7.472 -7.609 1.00 0.00 C ATOM 176 O ARG A 437 -0.313 -6.399 -7.157 1.00 0.00 O ATOM 177 CB ARG A 437 0.070 -9.071 -5.816 1.00 0.00 C ATOM 178 CG ARG A 437 -0.276 -10.002 -4.641 1.00 0.00 C ATOM 179 CD ARG A 437 -1.125 -9.307 -3.568 1.00 0.00 C ATOM 180 NE ARG A 437 -1.418 -10.216 -2.445 1.00 0.00 N ATOM 181 CZ ARG A 437 -2.520 -10.916 -2.246 1.00 0.00 C ATOM 182 NH1 ARG A 437 -3.517 -10.918 -3.087 1.00 0.00 N ATOM 183 NH2 ARG A 437 -2.642 -11.646 -1.175 1.00 0.00 N ATOM 0 H ARG A 437 -1.343 -10.067 -8.133 1.00 0.00 H new ATOM 0 HA ARG A 437 -1.895 -8.131 -6.007 1.00 0.00 H new ATOM 0 HB2 ARG A 437 0.762 -9.590 -6.479 1.00 0.00 H new ATOM 0 HB3 ARG A 437 0.596 -8.199 -5.426 1.00 0.00 H new ATOM 0 HG2 ARG A 437 -0.814 -10.872 -5.018 1.00 0.00 H new ATOM 0 HG3 ARG A 437 0.646 -10.368 -4.189 1.00 0.00 H new ATOM 0 HD2 ARG A 437 -0.599 -8.427 -3.198 1.00 0.00 H new ATOM 0 HD3 ARG A 437 -2.059 -8.958 -4.009 1.00 0.00 H new ATOM 0 HE ARG A 437 -0.686 -10.316 -1.742 1.00 0.00 H new ATOM 0 HH11 ARG A 437 -3.465 -10.363 -3.941 1.00 0.00 H new ATOM 0 HH12 ARG A 437 -4.349 -11.475 -2.891 1.00 0.00 H new ATOM 0 HH21 ARG A 437 -1.887 -11.677 -0.490 1.00 0.00 H new ATOM 0 HH22 ARG A 437 -3.493 -12.187 -1.021 1.00 0.00 H new ATOM 197 N ASP A 438 -0.830 -7.673 -8.921 1.00 0.00 N ATOM 198 CA ASP A 438 -0.499 -6.681 -9.962 1.00 0.00 C ATOM 199 C ASP A 438 -1.421 -5.437 -9.999 1.00 0.00 C ATOM 200 O ASP A 438 -1.164 -4.502 -10.760 1.00 0.00 O ATOM 201 CB ASP A 438 -0.427 -7.381 -11.328 1.00 0.00 C ATOM 202 CG ASP A 438 -1.732 -8.100 -11.698 1.00 0.00 C ATOM 203 OD1 ASP A 438 -1.928 -9.243 -11.222 1.00 0.00 O ATOM 204 OD2 ASP A 438 -2.550 -7.533 -12.459 1.00 0.00 O ATOM 0 H ASP A 438 -1.170 -8.554 -9.307 1.00 0.00 H new ATOM 0 HA ASP A 438 0.476 -6.271 -9.700 1.00 0.00 H new ATOM 0 HB2 ASP A 438 -0.193 -6.644 -12.097 1.00 0.00 H new ATOM 0 HB3 ASP A 438 0.390 -8.103 -11.319 1.00 0.00 H new ATOM 209 N HIS A 439 -2.452 -5.384 -9.147 1.00 0.00 N ATOM 210 CA HIS A 439 -3.371 -4.251 -8.961 1.00 0.00 C ATOM 211 C HIS A 439 -3.312 -3.651 -7.538 1.00 0.00 C ATOM 212 O HIS A 439 -4.194 -2.874 -7.164 1.00 0.00 O ATOM 213 CB HIS A 439 -4.793 -4.725 -9.310 1.00 0.00 C ATOM 214 CG HIS A 439 -5.363 -5.675 -8.280 1.00 0.00 C ATOM 215 ND1 HIS A 439 -4.951 -6.994 -8.067 1.00 0.00 N ATOM 216 CD2 HIS A 439 -6.283 -5.350 -7.330 1.00 0.00 C ATOM 217 CE1 HIS A 439 -5.620 -7.423 -6.981 1.00 0.00 C ATOM 218 NE2 HIS A 439 -6.432 -6.456 -6.525 1.00 0.00 N ATOM 0 H HIS A 439 -2.681 -6.169 -8.537 1.00 0.00 H new ATOM 0 HA HIS A 439 -3.065 -3.443 -9.626 1.00 0.00 H new ATOM 0 HB2 HIS A 439 -5.448 -3.858 -9.400 1.00 0.00 H new ATOM 0 HB3 HIS A 439 -4.779 -5.217 -10.283 1.00 0.00 H new ATOM 0 HD2 HIS A 439 -6.797 -4.406 -7.228 1.00 0.00 H new ATOM 0 HE1 HIS A 439 -5.518 -8.404 -6.540 1.00 0.00 H new ATOM 0 HE2 HIS A 439 -7.053 -6.529 -5.719 1.00 0.00 H new ATOM 226 N VAL A 440 -2.300 -4.010 -6.735 1.00 0.00 N ATOM 227 CA VAL A 440 -2.222 -3.700 -5.293 1.00 0.00 C ATOM 228 C VAL A 440 -1.037 -2.788 -4.970 1.00 0.00 C ATOM 229 O VAL A 440 0.121 -3.087 -5.278 1.00 0.00 O ATOM 230 CB VAL A 440 -2.160 -4.991 -4.444 1.00 0.00 C ATOM 231 CG1 VAL A 440 -2.170 -4.694 -2.937 1.00 0.00 C ATOM 232 CG2 VAL A 440 -3.358 -5.905 -4.732 1.00 0.00 C ATOM 0 H VAL A 440 -1.494 -4.535 -7.073 1.00 0.00 H new ATOM 0 HA VAL A 440 -3.134 -3.163 -5.034 1.00 0.00 H new ATOM 0 HB VAL A 440 -1.225 -5.479 -4.720 1.00 0.00 H new ATOM 0 HG11 VAL A 440 -2.125 -5.631 -2.381 1.00 0.00 H new ATOM 0 HG12 VAL A 440 -1.307 -4.079 -2.682 1.00 0.00 H new ATOM 0 HG13 VAL A 440 -3.085 -4.161 -2.677 1.00 0.00 H new ATOM 0 HG21 VAL A 440 -3.285 -6.804 -4.120 1.00 0.00 H new ATOM 0 HG22 VAL A 440 -4.283 -5.378 -4.495 1.00 0.00 H new ATOM 0 HG23 VAL A 440 -3.358 -6.183 -5.786 1.00 0.00 H new ATOM 242 N LEU A 441 -1.343 -1.674 -4.306 1.00 0.00 N ATOM 243 CA LEU A 441 -0.388 -0.748 -3.698 1.00 0.00 C ATOM 244 C LEU A 441 -0.144 -1.075 -2.219 1.00 0.00 C ATOM 245 O LEU A 441 -0.918 -1.782 -1.573 1.00 0.00 O ATOM 246 CB LEU A 441 -0.966 0.683 -3.743 1.00 0.00 C ATOM 247 CG LEU A 441 -1.288 1.263 -5.125 1.00 0.00 C ATOM 248 CD1 LEU A 441 -1.999 2.601 -4.921 1.00 0.00 C ATOM 249 CD2 LEU A 441 -0.014 1.487 -5.938 1.00 0.00 C ATOM 0 H LEU A 441 -2.310 -1.378 -4.171 1.00 0.00 H new ATOM 0 HA LEU A 441 0.545 -0.835 -4.256 1.00 0.00 H new ATOM 0 HB2 LEU A 441 -1.880 0.698 -3.149 1.00 0.00 H new ATOM 0 HB3 LEU A 441 -0.257 1.350 -3.253 1.00 0.00 H new ATOM 0 HG LEU A 441 -1.918 0.562 -5.673 1.00 0.00 H new ATOM 0 HD11 LEU A 441 -2.240 3.036 -5.891 1.00 0.00 H new ATOM 0 HD12 LEU A 441 -2.918 2.442 -4.356 1.00 0.00 H new ATOM 0 HD13 LEU A 441 -1.347 3.279 -4.371 1.00 0.00 H new ATOM 0 HD21 LEU A 441 -0.273 1.899 -6.913 1.00 0.00 H new ATOM 0 HD22 LEU A 441 0.636 2.185 -5.410 1.00 0.00 H new ATOM 0 HD23 LEU A 441 0.504 0.537 -6.071 1.00 0.00 H new ATOM 261 N HIS A 442 0.886 -0.444 -1.671 1.00 0.00 N ATOM 262 CA HIS A 442 1.191 -0.329 -0.249 1.00 0.00 C ATOM 263 C HIS A 442 1.399 1.164 0.041 1.00 0.00 C ATOM 264 O HIS A 442 2.021 1.877 -0.752 1.00 0.00 O ATOM 265 CB HIS A 442 2.429 -1.159 0.106 1.00 0.00 C ATOM 266 CG HIS A 442 2.878 -0.915 1.525 1.00 0.00 C ATOM 267 ND1 HIS A 442 3.842 0.022 1.910 1.00 0.00 N ATOM 268 CD2 HIS A 442 2.322 -1.464 2.643 1.00 0.00 C ATOM 269 CE1 HIS A 442 3.842 0.018 3.254 1.00 0.00 C ATOM 270 NE2 HIS A 442 2.950 -0.872 3.716 1.00 0.00 N ATOM 0 H HIS A 442 1.579 0.034 -2.247 1.00 0.00 H new ATOM 0 HA HIS A 442 0.378 -0.719 0.364 1.00 0.00 H new ATOM 0 HB2 HIS A 442 2.208 -2.218 -0.028 1.00 0.00 H new ATOM 0 HB3 HIS A 442 3.240 -0.913 -0.579 1.00 0.00 H new ATOM 0 HD2 HIS A 442 1.545 -2.213 2.679 1.00 0.00 H new ATOM 0 HE1 HIS A 442 4.470 0.642 3.873 1.00 0.00 H new ATOM 0 HE2 HIS A 442 2.768 -1.076 4.699 1.00 0.00 H new ATOM 278 N VAL A 443 0.841 1.648 1.148 1.00 0.00 N ATOM 279 CA VAL A 443 0.748 3.077 1.480 1.00 0.00 C ATOM 280 C VAL A 443 1.189 3.284 2.924 1.00 0.00 C ATOM 281 O VAL A 443 0.777 2.528 3.806 1.00 0.00 O ATOM 282 CB VAL A 443 -0.694 3.602 1.299 1.00 0.00 C ATOM 283 CG1 VAL A 443 -0.762 5.135 1.355 1.00 0.00 C ATOM 284 CG2 VAL A 443 -1.312 3.187 -0.039 1.00 0.00 C ATOM 0 H VAL A 443 0.429 1.046 1.861 1.00 0.00 H new ATOM 0 HA VAL A 443 1.398 3.633 0.804 1.00 0.00 H new ATOM 0 HB VAL A 443 -1.250 3.158 2.124 1.00 0.00 H new ATOM 0 HG11 VAL A 443 -1.795 5.458 1.223 1.00 0.00 H new ATOM 0 HG12 VAL A 443 -0.394 5.480 2.321 1.00 0.00 H new ATOM 0 HG13 VAL A 443 -0.146 5.556 0.561 1.00 0.00 H new ATOM 0 HG21 VAL A 443 -2.325 3.584 -0.111 1.00 0.00 H new ATOM 0 HG22 VAL A 443 -0.709 3.582 -0.856 1.00 0.00 H new ATOM 0 HG23 VAL A 443 -1.343 2.099 -0.104 1.00 0.00 H new ATOM 294 N THR A 444 1.984 4.325 3.167 1.00 0.00 N ATOM 295 CA THR A 444 2.576 4.650 4.476 1.00 0.00 C ATOM 296 C THR A 444 2.225 6.089 4.849 1.00 0.00 C ATOM 297 O THR A 444 2.325 6.995 4.016 1.00 0.00 O ATOM 298 CB THR A 444 4.104 4.468 4.455 1.00 0.00 C ATOM 299 OG1 THR A 444 4.458 3.214 3.909 1.00 0.00 O ATOM 300 CG2 THR A 444 4.713 4.506 5.857 1.00 0.00 C ATOM 0 H THR A 444 2.246 4.990 2.439 1.00 0.00 H new ATOM 0 HA THR A 444 2.167 3.967 5.221 1.00 0.00 H new ATOM 0 HB THR A 444 4.485 5.293 3.852 1.00 0.00 H new ATOM 0 HG1 THR A 444 5.434 3.123 3.905 1.00 0.00 H new ATOM 0 HG21 THR A 444 5.793 4.373 5.788 1.00 0.00 H new ATOM 0 HG22 THR A 444 4.494 5.467 6.323 1.00 0.00 H new ATOM 0 HG23 THR A 444 4.287 3.705 6.461 1.00 0.00 H new ATOM 308 N PHE A 445 1.797 6.304 6.092 1.00 0.00 N ATOM 309 CA PHE A 445 1.197 7.561 6.556 1.00 0.00 C ATOM 310 C PHE A 445 1.322 7.746 8.088 1.00 0.00 C ATOM 311 O PHE A 445 1.460 6.758 8.819 1.00 0.00 O ATOM 312 CB PHE A 445 -0.291 7.555 6.138 1.00 0.00 C ATOM 313 CG PHE A 445 -1.016 6.231 6.359 1.00 0.00 C ATOM 314 CD1 PHE A 445 -1.333 5.805 7.662 1.00 0.00 C ATOM 315 CD2 PHE A 445 -1.303 5.383 5.269 1.00 0.00 C ATOM 316 CE1 PHE A 445 -1.895 4.537 7.880 1.00 0.00 C ATOM 317 CE2 PHE A 445 -1.879 4.118 5.484 1.00 0.00 C ATOM 318 CZ PHE A 445 -2.170 3.691 6.791 1.00 0.00 C ATOM 0 H PHE A 445 1.858 5.596 6.823 1.00 0.00 H new ATOM 0 HA PHE A 445 1.731 8.396 6.102 1.00 0.00 H new ATOM 0 HB2 PHE A 445 -0.812 8.335 6.693 1.00 0.00 H new ATOM 0 HB3 PHE A 445 -0.358 7.817 5.082 1.00 0.00 H new ATOM 0 HD1 PHE A 445 -1.143 6.458 8.501 1.00 0.00 H new ATOM 0 HD2 PHE A 445 -1.079 5.707 4.263 1.00 0.00 H new ATOM 0 HE1 PHE A 445 -2.116 4.211 8.886 1.00 0.00 H new ATOM 0 HE2 PHE A 445 -2.098 3.475 4.645 1.00 0.00 H new ATOM 0 HZ PHE A 445 -2.604 2.716 6.958 1.00 0.00 H new ATOM 328 N PRO A 446 1.263 8.990 8.608 1.00 0.00 N ATOM 329 CA PRO A 446 1.121 9.263 10.041 1.00 0.00 C ATOM 330 C PRO A 446 -0.109 8.566 10.646 1.00 0.00 C ATOM 331 O PRO A 446 -1.162 8.488 10.006 1.00 0.00 O ATOM 332 CB PRO A 446 0.989 10.788 10.161 1.00 0.00 C ATOM 333 CG PRO A 446 1.665 11.315 8.898 1.00 0.00 C ATOM 334 CD PRO A 446 1.367 10.233 7.864 1.00 0.00 C ATOM 0 HA PRO A 446 1.979 8.878 10.592 1.00 0.00 H new ATOM 0 HB2 PRO A 446 -0.055 11.096 10.213 1.00 0.00 H new ATOM 0 HB3 PRO A 446 1.477 11.162 11.061 1.00 0.00 H new ATOM 0 HG2 PRO A 446 1.259 12.281 8.598 1.00 0.00 H new ATOM 0 HG3 PRO A 446 2.737 11.450 9.042 1.00 0.00 H new ATOM 0 HD2 PRO A 446 0.441 10.447 7.330 1.00 0.00 H new ATOM 0 HD3 PRO A 446 2.160 10.177 7.118 1.00 0.00 H new ATOM 342 N LYS A 447 -0.012 8.117 11.904 1.00 0.00 N ATOM 343 CA LYS A 447 -1.091 7.403 12.625 1.00 0.00 C ATOM 344 C LYS A 447 -2.433 8.146 12.704 1.00 0.00 C ATOM 345 O LYS A 447 -3.481 7.519 12.861 1.00 0.00 O ATOM 346 CB LYS A 447 -0.602 6.986 14.023 1.00 0.00 C ATOM 347 CG LYS A 447 -0.277 8.167 14.955 1.00 0.00 C ATOM 348 CD LYS A 447 0.222 7.668 16.317 1.00 0.00 C ATOM 349 CE LYS A 447 0.538 8.858 17.230 1.00 0.00 C ATOM 350 NZ LYS A 447 1.029 8.410 18.558 1.00 0.00 N ATOM 0 H LYS A 447 0.831 8.238 12.465 1.00 0.00 H new ATOM 0 HA LYS A 447 -1.310 6.521 12.024 1.00 0.00 H new ATOM 0 HB2 LYS A 447 -1.366 6.366 14.493 1.00 0.00 H new ATOM 0 HB3 LYS A 447 0.289 6.367 13.915 1.00 0.00 H new ATOM 0 HG2 LYS A 447 0.482 8.800 14.495 1.00 0.00 H new ATOM 0 HG3 LYS A 447 -1.166 8.783 15.092 1.00 0.00 H new ATOM 0 HD2 LYS A 447 -0.534 7.035 16.781 1.00 0.00 H new ATOM 0 HD3 LYS A 447 1.113 7.055 16.184 1.00 0.00 H new ATOM 0 HE2 LYS A 447 1.289 9.491 16.758 1.00 0.00 H new ATOM 0 HE3 LYS A 447 -0.357 9.467 17.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 447 1.233 9.240 19.151 1.00 0.00 H new ATOM 0 HZ2 LYS A 447 0.302 7.826 19.018 1.00 0.00 H new ATOM 0 HZ3 LYS A 447 1.897 7.849 18.436 1.00 0.00 H new ATOM 364 N GLU A 448 -2.407 9.472 12.570 1.00 0.00 N ATOM 365 CA GLU A 448 -3.585 10.349 12.557 1.00 0.00 C ATOM 366 C GLU A 448 -4.494 10.175 11.321 1.00 0.00 C ATOM 367 O GLU A 448 -5.621 10.676 11.331 1.00 0.00 O ATOM 368 CB GLU A 448 -3.131 11.816 12.671 1.00 0.00 C ATOM 369 CG GLU A 448 -2.406 12.109 13.993 1.00 0.00 C ATOM 370 CD GLU A 448 -2.072 13.607 14.119 1.00 0.00 C ATOM 371 OE1 GLU A 448 -0.985 14.034 13.655 1.00 0.00 O ATOM 372 OE2 GLU A 448 -2.888 14.371 14.692 1.00 0.00 O ATOM 0 H GLU A 448 -1.533 9.987 12.463 1.00 0.00 H new ATOM 0 HA GLU A 448 -4.192 10.059 13.414 1.00 0.00 H new ATOM 0 HB2 GLU A 448 -2.470 12.054 11.838 1.00 0.00 H new ATOM 0 HB3 GLU A 448 -3.999 12.469 12.585 1.00 0.00 H new ATOM 0 HG2 GLU A 448 -3.031 11.800 14.831 1.00 0.00 H new ATOM 0 HG3 GLU A 448 -1.489 11.522 14.047 1.00 0.00 H new ATOM 379 N TRP A 449 -4.043 9.478 10.269 1.00 0.00 N ATOM 380 CA TRP A 449 -4.859 9.122 9.096 1.00 0.00 C ATOM 381 C TRP A 449 -5.931 8.062 9.405 1.00 0.00 C ATOM 382 O TRP A 449 -5.784 7.241 10.321 1.00 0.00 O ATOM 383 CB TRP A 449 -3.952 8.610 7.963 1.00 0.00 C ATOM 384 CG TRP A 449 -3.252 9.653 7.144 1.00 0.00 C ATOM 385 CD1 TRP A 449 -2.447 10.634 7.616 1.00 0.00 C ATOM 386 CD2 TRP A 449 -3.275 9.825 5.691 1.00 0.00 C ATOM 387 NE1 TRP A 449 -1.987 11.406 6.565 1.00 0.00 N ATOM 388 CE2 TRP A 449 -2.466 10.954 5.355 1.00 0.00 C ATOM 389 CE3 TRP A 449 -3.896 9.143 4.620 1.00 0.00 C ATOM 390 CZ2 TRP A 449 -2.295 11.390 4.034 1.00 0.00 C ATOM 391 CZ3 TRP A 449 -3.734 9.575 3.290 1.00 0.00 C ATOM 392 CH2 TRP A 449 -2.936 10.695 2.993 1.00 0.00 C ATOM 0 H TRP A 449 -3.083 9.139 10.207 1.00 0.00 H new ATOM 0 HA TRP A 449 -5.379 10.030 8.792 1.00 0.00 H new ATOM 0 HB2 TRP A 449 -3.197 7.956 8.399 1.00 0.00 H new ATOM 0 HB3 TRP A 449 -4.556 7.998 7.293 1.00 0.00 H new ATOM 0 HD1 TRP A 449 -2.201 10.790 8.656 1.00 0.00 H new ATOM 0 HE1 TRP A 449 -1.369 12.211 6.672 1.00 0.00 H new ATOM 0 HE3 TRP A 449 -4.505 8.275 4.826 1.00 0.00 H new ATOM 0 HZ2 TRP A 449 -1.678 12.250 3.818 1.00 0.00 H new ATOM 0 HZ3 TRP A 449 -4.227 9.042 2.490 1.00 0.00 H new ATOM 0 HH2 TRP A 449 -2.816 11.020 1.970 1.00 0.00 H new ATOM 403 N LYS A 450 -6.989 8.046 8.583 1.00 0.00 N ATOM 404 CA LYS A 450 -8.092 7.071 8.598 1.00 0.00 C ATOM 405 C LYS A 450 -8.389 6.527 7.193 1.00 0.00 C ATOM 406 O LYS A 450 -7.941 7.075 6.184 1.00 0.00 O ATOM 407 CB LYS A 450 -9.378 7.680 9.204 1.00 0.00 C ATOM 408 CG LYS A 450 -9.271 8.172 10.658 1.00 0.00 C ATOM 409 CD LYS A 450 -8.808 9.628 10.746 1.00 0.00 C ATOM 410 CE LYS A 450 -8.845 10.131 12.191 1.00 0.00 C ATOM 411 NZ LYS A 450 -8.203 11.465 12.299 1.00 0.00 N ATOM 0 H LYS A 450 -7.106 8.748 7.852 1.00 0.00 H new ATOM 0 HA LYS A 450 -7.767 6.243 9.227 1.00 0.00 H new ATOM 0 HB2 LYS A 450 -9.689 8.518 8.580 1.00 0.00 H new ATOM 0 HB3 LYS A 450 -10.170 6.933 9.152 1.00 0.00 H new ATOM 0 HG2 LYS A 450 -10.241 8.071 11.146 1.00 0.00 H new ATOM 0 HG3 LYS A 450 -8.573 7.537 11.203 1.00 0.00 H new ATOM 0 HD2 LYS A 450 -7.795 9.715 10.353 1.00 0.00 H new ATOM 0 HD3 LYS A 450 -9.447 10.254 10.123 1.00 0.00 H new ATOM 0 HE2 LYS A 450 -9.878 10.190 12.534 1.00 0.00 H new ATOM 0 HE3 LYS A 450 -8.333 9.422 12.841 1.00 0.00 H new ATOM 0 HZ1 LYS A 450 -8.254 11.796 13.284 1.00 0.00 H new ATOM 0 HZ2 LYS A 450 -7.207 11.396 12.008 1.00 0.00 H new ATOM 0 HZ3 LYS A 450 -8.698 12.140 11.681 1.00 0.00 H new ATOM 425 N THR A 451 -9.229 5.495 7.127 1.00 0.00 N ATOM 426 CA THR A 451 -9.840 4.947 5.903 1.00 0.00 C ATOM 427 C THR A 451 -10.445 6.050 5.023 1.00 0.00 C ATOM 428 O THR A 451 -10.306 6.021 3.804 1.00 0.00 O ATOM 429 CB THR A 451 -10.945 3.942 6.281 1.00 0.00 C ATOM 430 OG1 THR A 451 -10.557 3.129 7.372 1.00 0.00 O ATOM 431 CG2 THR A 451 -11.316 3.001 5.140 1.00 0.00 C ATOM 0 H THR A 451 -9.520 4.989 7.963 1.00 0.00 H new ATOM 0 HA THR A 451 -9.053 4.452 5.335 1.00 0.00 H new ATOM 0 HB THR A 451 -11.804 4.562 6.537 1.00 0.00 H new ATOM 0 HG1 THR A 451 -11.280 2.504 7.588 1.00 0.00 H new ATOM 0 HG21 THR A 451 -12.099 2.319 5.471 1.00 0.00 H new ATOM 0 HG22 THR A 451 -11.676 3.582 4.291 1.00 0.00 H new ATOM 0 HG23 THR A 451 -10.438 2.428 4.841 1.00 0.00 H new ATOM 439 N SER A 452 -11.055 7.073 5.631 1.00 0.00 N ATOM 440 CA SER A 452 -11.592 8.245 4.927 1.00 0.00 C ATOM 441 C SER A 452 -10.527 9.064 4.189 1.00 0.00 C ATOM 442 O SER A 452 -10.722 9.417 3.026 1.00 0.00 O ATOM 443 CB SER A 452 -12.290 9.175 5.919 1.00 0.00 C ATOM 444 OG SER A 452 -13.406 8.528 6.512 1.00 0.00 O ATOM 0 H SER A 452 -11.192 7.112 6.641 1.00 0.00 H new ATOM 0 HA SER A 452 -12.285 7.849 4.185 1.00 0.00 H new ATOM 0 HB2 SER A 452 -11.587 9.482 6.694 1.00 0.00 H new ATOM 0 HB3 SER A 452 -12.617 10.081 5.408 1.00 0.00 H new ATOM 0 HG SER A 452 -13.839 9.138 7.145 1.00 0.00 H new ATOM 450 N ASP A 453 -9.384 9.341 4.826 1.00 0.00 N ATOM 451 CA ASP A 453 -8.252 10.034 4.189 1.00 0.00 C ATOM 452 C ASP A 453 -7.652 9.201 3.046 1.00 0.00 C ATOM 453 O ASP A 453 -7.173 9.747 2.053 1.00 0.00 O ATOM 454 CB ASP A 453 -7.150 10.340 5.212 1.00 0.00 C ATOM 455 CG ASP A 453 -7.646 11.191 6.387 1.00 0.00 C ATOM 456 OD1 ASP A 453 -7.912 12.402 6.198 1.00 0.00 O ATOM 457 OD2 ASP A 453 -7.758 10.638 7.506 1.00 0.00 O ATOM 0 H ASP A 453 -9.215 9.091 5.800 1.00 0.00 H new ATOM 0 HA ASP A 453 -8.642 10.967 3.781 1.00 0.00 H new ATOM 0 HB2 ASP A 453 -6.746 9.403 5.594 1.00 0.00 H new ATOM 0 HB3 ASP A 453 -6.332 10.860 4.713 1.00 0.00 H new ATOM 462 N LEU A 454 -7.722 7.873 3.164 1.00 0.00 N ATOM 463 CA LEU A 454 -7.253 6.935 2.137 1.00 0.00 C ATOM 464 C LEU A 454 -8.192 6.907 0.912 1.00 0.00 C ATOM 465 O LEU A 454 -7.730 7.058 -0.221 1.00 0.00 O ATOM 466 CB LEU A 454 -7.062 5.547 2.780 1.00 0.00 C ATOM 467 CG LEU A 454 -5.845 5.461 3.725 1.00 0.00 C ATOM 468 CD1 LEU A 454 -5.896 4.156 4.522 1.00 0.00 C ATOM 469 CD2 LEU A 454 -4.518 5.500 2.961 1.00 0.00 C ATOM 0 H LEU A 454 -8.111 7.411 3.986 1.00 0.00 H new ATOM 0 HA LEU A 454 -6.291 7.270 1.750 1.00 0.00 H new ATOM 0 HB2 LEU A 454 -7.962 5.288 3.337 1.00 0.00 H new ATOM 0 HB3 LEU A 454 -6.951 4.803 1.991 1.00 0.00 H new ATOM 0 HG LEU A 454 -5.895 6.326 4.386 1.00 0.00 H new ATOM 0 HD11 LEU A 454 -5.034 4.102 5.187 1.00 0.00 H new ATOM 0 HD12 LEU A 454 -6.812 4.126 5.112 1.00 0.00 H new ATOM 0 HD13 LEU A 454 -5.878 3.310 3.836 1.00 0.00 H new ATOM 0 HD21 LEU A 454 -3.690 5.437 3.667 1.00 0.00 H new ATOM 0 HD22 LEU A 454 -4.471 4.658 2.270 1.00 0.00 H new ATOM 0 HD23 LEU A 454 -4.448 6.433 2.402 1.00 0.00 H new ATOM 481 N TYR A 455 -9.512 6.824 1.107 1.00 0.00 N ATOM 482 CA TYR A 455 -10.479 7.005 0.012 1.00 0.00 C ATOM 483 C TYR A 455 -10.408 8.408 -0.622 1.00 0.00 C ATOM 484 O TYR A 455 -10.600 8.536 -1.831 1.00 0.00 O ATOM 485 CB TYR A 455 -11.905 6.667 0.476 1.00 0.00 C ATOM 486 CG TYR A 455 -12.271 5.200 0.308 1.00 0.00 C ATOM 487 CD1 TYR A 455 -11.944 4.267 1.309 1.00 0.00 C ATOM 488 CD2 TYR A 455 -12.937 4.765 -0.857 1.00 0.00 C ATOM 489 CE1 TYR A 455 -12.281 2.908 1.157 1.00 0.00 C ATOM 490 CE2 TYR A 455 -13.278 3.405 -1.015 1.00 0.00 C ATOM 491 CZ TYR A 455 -12.946 2.471 -0.007 1.00 0.00 C ATOM 492 OH TYR A 455 -13.252 1.153 -0.148 1.00 0.00 O ATOM 0 H TYR A 455 -9.939 6.632 2.013 1.00 0.00 H new ATOM 0 HA TYR A 455 -10.201 6.302 -0.773 1.00 0.00 H new ATOM 0 HB2 TYR A 455 -12.010 6.941 1.526 1.00 0.00 H new ATOM 0 HB3 TYR A 455 -12.614 7.276 -0.085 1.00 0.00 H new ATOM 0 HD1 TYR A 455 -11.431 4.595 2.201 1.00 0.00 H new ATOM 0 HD2 TYR A 455 -13.187 5.476 -1.631 1.00 0.00 H new ATOM 0 HE1 TYR A 455 -12.030 2.200 1.933 1.00 0.00 H new ATOM 0 HE2 TYR A 455 -13.793 3.077 -1.906 1.00 0.00 H new ATOM 0 HH TYR A 455 -12.953 0.840 -1.027 1.00 0.00 H new ATOM 502 N GLN A 456 -10.071 9.453 0.145 1.00 0.00 N ATOM 503 CA GLN A 456 -9.818 10.804 -0.381 1.00 0.00 C ATOM 504 C GLN A 456 -8.514 10.891 -1.204 1.00 0.00 C ATOM 505 O GLN A 456 -8.473 11.594 -2.216 1.00 0.00 O ATOM 506 CB GLN A 456 -9.825 11.803 0.790 1.00 0.00 C ATOM 507 CG GLN A 456 -9.796 13.270 0.329 1.00 0.00 C ATOM 508 CD GLN A 456 -9.873 14.260 1.494 1.00 0.00 C ATOM 509 OE1 GLN A 456 -10.626 14.101 2.449 1.00 0.00 O ATOM 510 NE2 GLN A 456 -9.104 15.330 1.468 1.00 0.00 N ATOM 0 H GLN A 456 -9.965 9.386 1.157 1.00 0.00 H new ATOM 0 HA GLN A 456 -10.615 11.058 -1.080 1.00 0.00 H new ATOM 0 HB2 GLN A 456 -10.715 11.636 1.397 1.00 0.00 H new ATOM 0 HB3 GLN A 456 -8.963 11.612 1.429 1.00 0.00 H new ATOM 0 HG2 GLN A 456 -8.881 13.451 -0.235 1.00 0.00 H new ATOM 0 HG3 GLN A 456 -10.630 13.449 -0.350 1.00 0.00 H new ATOM 0 HE21 GLN A 456 -8.470 15.483 0.684 1.00 0.00 H new ATOM 0 HE22 GLN A 456 -9.143 16.005 2.232 1.00 0.00 H new ATOM 519 N LEU A 457 -7.461 10.158 -0.820 1.00 0.00 N ATOM 520 CA LEU A 457 -6.191 10.065 -1.556 1.00 0.00 C ATOM 521 C LEU A 457 -6.362 9.392 -2.933 1.00 0.00 C ATOM 522 O LEU A 457 -5.690 9.774 -3.894 1.00 0.00 O ATOM 523 CB LEU A 457 -5.165 9.325 -0.671 1.00 0.00 C ATOM 524 CG LEU A 457 -3.796 9.035 -1.318 1.00 0.00 C ATOM 525 CD1 LEU A 457 -3.069 10.308 -1.749 1.00 0.00 C ATOM 526 CD2 LEU A 457 -2.898 8.290 -0.328 1.00 0.00 C ATOM 0 H LEU A 457 -7.468 9.598 0.033 1.00 0.00 H new ATOM 0 HA LEU A 457 -5.826 11.070 -1.769 1.00 0.00 H new ATOM 0 HB2 LEU A 457 -5.000 9.915 0.230 1.00 0.00 H new ATOM 0 HB3 LEU A 457 -5.603 8.378 -0.356 1.00 0.00 H new ATOM 0 HG LEU A 457 -3.993 8.432 -2.204 1.00 0.00 H new ATOM 0 HD11 LEU A 457 -2.111 10.046 -2.198 1.00 0.00 H new ATOM 0 HD12 LEU A 457 -3.676 10.845 -2.478 1.00 0.00 H new ATOM 0 HD13 LEU A 457 -2.900 10.943 -0.879 1.00 0.00 H new ATOM 0 HD21 LEU A 457 -1.933 8.089 -0.793 1.00 0.00 H new ATOM 0 HD22 LEU A 457 -2.752 8.902 0.562 1.00 0.00 H new ATOM 0 HD23 LEU A 457 -3.369 7.348 -0.047 1.00 0.00 H new ATOM 538 N PHE A 458 -7.293 8.440 -3.046 1.00 0.00 N ATOM 539 CA PHE A 458 -7.491 7.619 -4.254 1.00 0.00 C ATOM 540 C PHE A 458 -8.833 7.845 -4.980 1.00 0.00 C ATOM 541 O PHE A 458 -9.193 7.074 -5.874 1.00 0.00 O ATOM 542 CB PHE A 458 -7.268 6.147 -3.884 1.00 0.00 C ATOM 543 CG PHE A 458 -5.862 5.835 -3.404 1.00 0.00 C ATOM 544 CD1 PHE A 458 -4.775 5.990 -4.284 1.00 0.00 C ATOM 545 CD2 PHE A 458 -5.629 5.405 -2.084 1.00 0.00 C ATOM 546 CE1 PHE A 458 -3.466 5.717 -3.850 1.00 0.00 C ATOM 547 CE2 PHE A 458 -4.319 5.150 -1.644 1.00 0.00 C ATOM 548 CZ PHE A 458 -3.237 5.301 -2.527 1.00 0.00 C ATOM 0 H PHE A 458 -7.942 8.211 -2.293 1.00 0.00 H new ATOM 0 HA PHE A 458 -6.754 7.939 -4.991 1.00 0.00 H new ATOM 0 HB2 PHE A 458 -7.977 5.868 -3.104 1.00 0.00 H new ATOM 0 HB3 PHE A 458 -7.490 5.527 -4.753 1.00 0.00 H new ATOM 0 HD1 PHE A 458 -4.947 6.320 -5.298 1.00 0.00 H new ATOM 0 HD2 PHE A 458 -6.460 5.271 -1.407 1.00 0.00 H new ATOM 0 HE1 PHE A 458 -2.637 5.827 -4.533 1.00 0.00 H new ATOM 0 HE2 PHE A 458 -4.144 4.837 -0.625 1.00 0.00 H new ATOM 0 HZ PHE A 458 -2.231 5.098 -2.190 1.00 0.00 H new ATOM 558 N SER A 459 -9.569 8.912 -4.652 1.00 0.00 N ATOM 559 CA SER A 459 -10.858 9.261 -5.280 1.00 0.00 C ATOM 560 C SER A 459 -10.793 9.433 -6.807 1.00 0.00 C ATOM 561 O SER A 459 -11.780 9.175 -7.501 1.00 0.00 O ATOM 562 CB SER A 459 -11.437 10.528 -4.638 1.00 0.00 C ATOM 563 OG SER A 459 -10.578 11.639 -4.850 1.00 0.00 O ATOM 0 H SER A 459 -9.284 9.573 -3.929 1.00 0.00 H new ATOM 0 HA SER A 459 -11.512 8.408 -5.099 1.00 0.00 H new ATOM 0 HB2 SER A 459 -12.420 10.737 -5.059 1.00 0.00 H new ATOM 0 HB3 SER A 459 -11.575 10.369 -3.569 1.00 0.00 H new ATOM 0 HG SER A 459 -10.966 12.437 -4.434 1.00 0.00 H new ATOM 569 N ALA A 460 -9.623 9.792 -7.350 1.00 0.00 N ATOM 570 CA ALA A 460 -9.351 9.893 -8.788 1.00 0.00 C ATOM 571 C ALA A 460 -9.555 8.575 -9.573 1.00 0.00 C ATOM 572 O ALA A 460 -9.787 8.611 -10.785 1.00 0.00 O ATOM 573 CB ALA A 460 -7.918 10.414 -8.960 1.00 0.00 C ATOM 0 H ALA A 460 -8.811 10.028 -6.779 1.00 0.00 H new ATOM 0 HA ALA A 460 -10.081 10.581 -9.215 1.00 0.00 H new ATOM 0 HB1 ALA A 460 -7.687 10.500 -10.022 1.00 0.00 H new ATOM 0 HB2 ALA A 460 -7.828 11.393 -8.489 1.00 0.00 H new ATOM 0 HB3 ALA A 460 -7.220 9.720 -8.492 1.00 0.00 H new ATOM 579 N PHE A 461 -9.506 7.418 -8.899 1.00 0.00 N ATOM 580 CA PHE A 461 -9.742 6.092 -9.490 1.00 0.00 C ATOM 581 C PHE A 461 -11.205 5.615 -9.379 1.00 0.00 C ATOM 582 O PHE A 461 -11.542 4.539 -9.880 1.00 0.00 O ATOM 583 CB PHE A 461 -8.777 5.085 -8.840 1.00 0.00 C ATOM 584 CG PHE A 461 -7.295 5.398 -8.994 1.00 0.00 C ATOM 585 CD1 PHE A 461 -6.774 5.896 -10.208 1.00 0.00 C ATOM 586 CD2 PHE A 461 -6.420 5.162 -7.916 1.00 0.00 C ATOM 587 CE1 PHE A 461 -5.401 6.170 -10.334 1.00 0.00 C ATOM 588 CE2 PHE A 461 -5.044 5.415 -8.049 1.00 0.00 C ATOM 589 CZ PHE A 461 -4.534 5.928 -9.254 1.00 0.00 C ATOM 0 H PHE A 461 -9.296 7.376 -7.902 1.00 0.00 H new ATOM 0 HA PHE A 461 -9.550 6.166 -10.560 1.00 0.00 H new ATOM 0 HB2 PHE A 461 -9.008 5.023 -7.777 1.00 0.00 H new ATOM 0 HB3 PHE A 461 -8.968 4.100 -9.266 1.00 0.00 H new ATOM 0 HD1 PHE A 461 -7.434 6.068 -11.045 1.00 0.00 H new ATOM 0 HD2 PHE A 461 -6.809 4.784 -6.982 1.00 0.00 H new ATOM 0 HE1 PHE A 461 -5.012 6.566 -11.260 1.00 0.00 H new ATOM 0 HE2 PHE A 461 -4.377 5.215 -7.223 1.00 0.00 H new ATOM 0 HZ PHE A 461 -3.479 6.136 -9.350 1.00 0.00 H new ATOM 599 N GLY A 462 -12.081 6.395 -8.736 1.00 0.00 N ATOM 600 CA GLY A 462 -13.514 6.122 -8.565 1.00 0.00 C ATOM 601 C GLY A 462 -13.835 5.107 -7.458 1.00 0.00 C ATOM 602 O GLY A 462 -14.712 5.359 -6.627 1.00 0.00 O ATOM 0 H GLY A 462 -11.799 7.273 -8.301 1.00 0.00 H new ATOM 0 HA2 GLY A 462 -14.027 7.058 -8.344 1.00 0.00 H new ATOM 0 HA3 GLY A 462 -13.917 5.753 -9.508 1.00 0.00 H new ATOM 606 N ASN A 463 -13.099 3.992 -7.403 1.00 0.00 N ATOM 607 CA ASN A 463 -13.238 2.925 -6.408 1.00 0.00 C ATOM 608 C ASN A 463 -11.871 2.295 -6.062 1.00 0.00 C ATOM 609 O ASN A 463 -10.965 2.240 -6.898 1.00 0.00 O ATOM 610 CB ASN A 463 -14.194 1.841 -6.950 1.00 0.00 C ATOM 611 CG ASN A 463 -15.628 2.315 -7.116 1.00 0.00 C ATOM 612 OD1 ASN A 463 -16.061 2.713 -8.190 1.00 0.00 O ATOM 613 ND2 ASN A 463 -16.423 2.274 -6.068 1.00 0.00 N ATOM 0 H ASN A 463 -12.360 3.801 -8.079 1.00 0.00 H new ATOM 0 HA ASN A 463 -13.647 3.358 -5.495 1.00 0.00 H new ATOM 0 HB2 ASN A 463 -13.823 1.491 -7.913 1.00 0.00 H new ATOM 0 HB3 ASN A 463 -14.180 0.986 -6.274 1.00 0.00 H new ATOM 0 HD21 ASN A 463 -17.395 2.573 -6.153 1.00 0.00 H new ATOM 0 HD22 ASN A 463 -16.068 1.943 -5.171 1.00 0.00 H new ATOM 620 N ILE A 464 -11.759 1.787 -4.831 1.00 0.00 N ATOM 621 CA ILE A 464 -10.623 1.023 -4.279 1.00 0.00 C ATOM 622 C ILE A 464 -11.121 0.013 -3.222 1.00 0.00 C ATOM 623 O ILE A 464 -12.313 -0.025 -2.900 1.00 0.00 O ATOM 624 CB ILE A 464 -9.560 1.962 -3.643 1.00 0.00 C ATOM 625 CG1 ILE A 464 -10.147 2.847 -2.519 1.00 0.00 C ATOM 626 CG2 ILE A 464 -8.840 2.819 -4.696 1.00 0.00 C ATOM 627 CD1 ILE A 464 -9.081 3.402 -1.571 1.00 0.00 C ATOM 0 H ILE A 464 -12.505 1.903 -4.145 1.00 0.00 H new ATOM 0 HA ILE A 464 -10.155 0.487 -5.104 1.00 0.00 H new ATOM 0 HB ILE A 464 -8.819 1.307 -3.185 1.00 0.00 H new ATOM 0 HG12 ILE A 464 -10.694 3.677 -2.967 1.00 0.00 H new ATOM 0 HG13 ILE A 464 -10.867 2.264 -1.945 1.00 0.00 H new ATOM 0 HG21 ILE A 464 -8.107 3.459 -4.205 1.00 0.00 H new ATOM 0 HG22 ILE A 464 -8.334 2.169 -5.410 1.00 0.00 H new ATOM 0 HG23 ILE A 464 -9.568 3.438 -5.221 1.00 0.00 H new ATOM 0 HD11 ILE A 464 -9.558 4.014 -0.806 1.00 0.00 H new ATOM 0 HD12 ILE A 464 -8.550 2.576 -1.097 1.00 0.00 H new ATOM 0 HD13 ILE A 464 -8.374 4.011 -2.135 1.00 0.00 H new ATOM 639 N GLN A 465 -10.208 -0.771 -2.645 1.00 0.00 N ATOM 640 CA GLN A 465 -10.437 -1.602 -1.455 1.00 0.00 C ATOM 641 C GLN A 465 -9.177 -1.571 -0.572 1.00 0.00 C ATOM 642 O GLN A 465 -8.065 -1.519 -1.100 1.00 0.00 O ATOM 643 CB GLN A 465 -10.803 -3.037 -1.879 1.00 0.00 C ATOM 644 CG GLN A 465 -11.516 -3.811 -0.758 1.00 0.00 C ATOM 645 CD GLN A 465 -11.964 -5.211 -1.189 1.00 0.00 C ATOM 646 OE1 GLN A 465 -11.380 -5.861 -2.048 1.00 0.00 O ATOM 647 NE2 GLN A 465 -13.023 -5.737 -0.608 1.00 0.00 N ATOM 0 H GLN A 465 -9.256 -0.849 -3.003 1.00 0.00 H new ATOM 0 HA GLN A 465 -11.273 -1.210 -0.875 1.00 0.00 H new ATOM 0 HB2 GLN A 465 -11.446 -3.001 -2.759 1.00 0.00 H new ATOM 0 HB3 GLN A 465 -9.897 -3.571 -2.167 1.00 0.00 H new ATOM 0 HG2 GLN A 465 -10.847 -3.897 0.099 1.00 0.00 H new ATOM 0 HG3 GLN A 465 -12.386 -3.243 -0.428 1.00 0.00 H new ATOM 0 HE21 GLN A 465 -13.524 -5.213 0.110 1.00 0.00 H new ATOM 0 HE22 GLN A 465 -13.342 -6.668 -0.876 1.00 0.00 H new ATOM 656 N ILE A 466 -9.325 -1.596 0.758 1.00 0.00 N ATOM 657 CA ILE A 466 -8.226 -1.350 1.714 1.00 0.00 C ATOM 658 C ILE A 466 -8.075 -2.534 2.679 1.00 0.00 C ATOM 659 O ILE A 466 -9.064 -3.053 3.205 1.00 0.00 O ATOM 660 CB ILE A 466 -8.454 -0.015 2.478 1.00 0.00 C ATOM 661 CG1 ILE A 466 -8.569 1.169 1.485 1.00 0.00 C ATOM 662 CG2 ILE A 466 -7.325 0.241 3.501 1.00 0.00 C ATOM 663 CD1 ILE A 466 -8.849 2.529 2.135 1.00 0.00 C ATOM 0 H ILE A 466 -10.218 -1.789 1.211 1.00 0.00 H new ATOM 0 HA ILE A 466 -7.294 -1.257 1.157 1.00 0.00 H new ATOM 0 HB ILE A 466 -9.392 -0.098 3.027 1.00 0.00 H new ATOM 0 HG12 ILE A 466 -7.642 1.238 0.915 1.00 0.00 H new ATOM 0 HG13 ILE A 466 -9.365 0.952 0.773 1.00 0.00 H new ATOM 0 HG21 ILE A 466 -7.511 1.181 4.020 1.00 0.00 H new ATOM 0 HG22 ILE A 466 -7.298 -0.574 4.224 1.00 0.00 H new ATOM 0 HG23 ILE A 466 -6.369 0.296 2.981 1.00 0.00 H new ATOM 0 HD11 ILE A 466 -8.913 3.295 1.362 1.00 0.00 H new ATOM 0 HD12 ILE A 466 -9.792 2.484 2.680 1.00 0.00 H new ATOM 0 HD13 ILE A 466 -8.042 2.776 2.825 1.00 0.00 H new ATOM 675 N SER A 467 -6.824 -2.922 2.940 1.00 0.00 N ATOM 676 CA SER A 467 -6.425 -4.004 3.842 1.00 0.00 C ATOM 677 C SER A 467 -5.256 -3.546 4.723 1.00 0.00 C ATOM 678 O SER A 467 -4.094 -3.579 4.311 1.00 0.00 O ATOM 679 CB SER A 467 -6.035 -5.244 3.026 1.00 0.00 C ATOM 680 OG SER A 467 -7.154 -5.801 2.350 1.00 0.00 O ATOM 0 H SER A 467 -6.022 -2.466 2.505 1.00 0.00 H new ATOM 0 HA SER A 467 -7.264 -4.263 4.488 1.00 0.00 H new ATOM 0 HB2 SER A 467 -5.268 -4.975 2.300 1.00 0.00 H new ATOM 0 HB3 SER A 467 -5.600 -5.993 3.688 1.00 0.00 H new ATOM 0 HG SER A 467 -6.869 -6.587 1.839 1.00 0.00 H new ATOM 686 N TRP A 468 -5.563 -3.069 5.932 1.00 0.00 N ATOM 687 CA TRP A 468 -4.568 -2.621 6.915 1.00 0.00 C ATOM 688 C TRP A 468 -3.567 -3.719 7.308 1.00 0.00 C ATOM 689 O TRP A 468 -3.906 -4.907 7.332 1.00 0.00 O ATOM 690 CB TRP A 468 -5.271 -2.139 8.185 1.00 0.00 C ATOM 691 CG TRP A 468 -6.204 -0.975 8.041 1.00 0.00 C ATOM 692 CD1 TRP A 468 -7.536 -1.059 7.835 1.00 0.00 C ATOM 693 CD2 TRP A 468 -5.920 0.446 8.214 1.00 0.00 C ATOM 694 NE1 TRP A 468 -8.079 0.211 7.766 1.00 0.00 N ATOM 695 CE2 TRP A 468 -7.127 1.179 8.007 1.00 0.00 C ATOM 696 CE3 TRP A 468 -4.777 1.186 8.581 1.00 0.00 C ATOM 697 CZ2 TRP A 468 -7.183 2.577 8.103 1.00 0.00 C ATOM 698 CZ3 TRP A 468 -4.835 2.586 8.717 1.00 0.00 C ATOM 699 CH2 TRP A 468 -6.024 3.287 8.453 1.00 0.00 C ATOM 0 H TRP A 468 -6.524 -2.981 6.262 1.00 0.00 H new ATOM 0 HA TRP A 468 -4.012 -1.814 6.438 1.00 0.00 H new ATOM 0 HB2 TRP A 468 -5.833 -2.975 8.600 1.00 0.00 H new ATOM 0 HB3 TRP A 468 -4.507 -1.874 8.916 1.00 0.00 H new ATOM 0 HD1 TRP A 468 -8.093 -1.979 7.739 1.00 0.00 H new ATOM 0 HE1 TRP A 468 -9.059 0.407 7.563 1.00 0.00 H new ATOM 0 HE3 TRP A 468 -3.844 0.672 8.760 1.00 0.00 H new ATOM 0 HZ2 TRP A 468 -8.107 3.101 7.910 1.00 0.00 H new ATOM 0 HZ3 TRP A 468 -3.954 3.128 9.028 1.00 0.00 H new ATOM 0 HH2 TRP A 468 -6.046 4.365 8.519 1.00 0.00 H new ATOM 710 N ILE A 469 -2.358 -3.303 7.701 1.00 0.00 N ATOM 711 CA ILE A 469 -1.316 -4.174 8.266 1.00 0.00 C ATOM 712 C ILE A 469 -0.634 -3.586 9.513 1.00 0.00 C ATOM 713 O ILE A 469 -0.084 -4.340 10.318 1.00 0.00 O ATOM 714 CB ILE A 469 -0.267 -4.541 7.197 1.00 0.00 C ATOM 715 CG1 ILE A 469 0.382 -3.311 6.527 1.00 0.00 C ATOM 716 CG2 ILE A 469 -0.882 -5.488 6.156 1.00 0.00 C ATOM 717 CD1 ILE A 469 1.552 -3.672 5.609 1.00 0.00 C ATOM 0 H ILE A 469 -2.068 -2.327 7.634 1.00 0.00 H new ATOM 0 HA ILE A 469 -1.827 -5.079 8.594 1.00 0.00 H new ATOM 0 HB ILE A 469 0.545 -5.055 7.712 1.00 0.00 H new ATOM 0 HG12 ILE A 469 -0.374 -2.779 5.949 1.00 0.00 H new ATOM 0 HG13 ILE A 469 0.733 -2.627 7.300 1.00 0.00 H new ATOM 0 HG21 ILE A 469 -0.132 -5.740 5.406 1.00 0.00 H new ATOM 0 HG22 ILE A 469 -1.223 -6.398 6.649 1.00 0.00 H new ATOM 0 HG23 ILE A 469 -1.728 -4.998 5.673 1.00 0.00 H new ATOM 0 HD11 ILE A 469 1.964 -2.763 5.170 1.00 0.00 H new ATOM 0 HD12 ILE A 469 2.325 -4.178 6.187 1.00 0.00 H new ATOM 0 HD13 ILE A 469 1.202 -4.332 4.816 1.00 0.00 H new ATOM 729 N ASP A 470 -0.699 -2.267 9.715 1.00 0.00 N ATOM 730 CA ASP A 470 -0.218 -1.582 10.923 1.00 0.00 C ATOM 731 C ASP A 470 -0.977 -0.261 11.170 1.00 0.00 C ATOM 732 O ASP A 470 -1.776 0.195 10.350 1.00 0.00 O ATOM 733 CB ASP A 470 1.300 -1.330 10.787 1.00 0.00 C ATOM 734 CG ASP A 470 2.061 -1.128 12.114 1.00 0.00 C ATOM 735 OD1 ASP A 470 1.452 -1.198 13.208 1.00 0.00 O ATOM 736 OD2 ASP A 470 3.296 -0.914 12.063 1.00 0.00 O ATOM 0 H ASP A 470 -1.097 -1.628 9.027 1.00 0.00 H new ATOM 0 HA ASP A 470 -0.407 -2.219 11.787 1.00 0.00 H new ATOM 0 HB2 ASP A 470 1.745 -2.173 10.258 1.00 0.00 H new ATOM 0 HB3 ASP A 470 1.450 -0.448 10.164 1.00 0.00 H new ATOM 741 N ASP A 471 -0.677 0.390 12.291 1.00 0.00 N ATOM 742 CA ASP A 471 -1.185 1.715 12.679 1.00 0.00 C ATOM 743 C ASP A 471 -0.720 2.856 11.740 1.00 0.00 C ATOM 744 O ASP A 471 -1.262 3.960 11.781 1.00 0.00 O ATOM 745 CB ASP A 471 -0.734 1.973 14.125 1.00 0.00 C ATOM 746 CG ASP A 471 -1.310 3.255 14.745 1.00 0.00 C ATOM 747 OD1 ASP A 471 -2.517 3.543 14.546 1.00 0.00 O ATOM 748 OD2 ASP A 471 -0.572 3.938 15.493 1.00 0.00 O ATOM 0 H ASP A 471 -0.046 -0.004 12.989 1.00 0.00 H new ATOM 0 HA ASP A 471 -2.272 1.711 12.597 1.00 0.00 H new ATOM 0 HB2 ASP A 471 -1.024 1.122 14.742 1.00 0.00 H new ATOM 0 HB3 ASP A 471 0.354 2.028 14.150 1.00 0.00 H new ATOM 753 N THR A 472 0.272 2.597 10.881 1.00 0.00 N ATOM 754 CA THR A 472 0.929 3.584 10.001 1.00 0.00 C ATOM 755 C THR A 472 1.107 3.106 8.553 1.00 0.00 C ATOM 756 O THR A 472 1.675 3.836 7.736 1.00 0.00 O ATOM 757 CB THR A 472 2.298 4.000 10.571 1.00 0.00 C ATOM 758 OG1 THR A 472 3.099 2.855 10.803 1.00 0.00 O ATOM 759 CG2 THR A 472 2.168 4.760 11.893 1.00 0.00 C ATOM 0 H THR A 472 0.658 1.659 10.771 1.00 0.00 H new ATOM 0 HA THR A 472 0.254 4.440 9.973 1.00 0.00 H new ATOM 0 HB THR A 472 2.758 4.655 9.831 1.00 0.00 H new ATOM 0 HG1 THR A 472 3.967 3.131 11.164 1.00 0.00 H new ATOM 0 HG21 THR A 472 3.159 5.032 12.255 1.00 0.00 H new ATOM 0 HG22 THR A 472 1.578 5.663 11.737 1.00 0.00 H new ATOM 0 HG23 THR A 472 1.674 4.127 12.630 1.00 0.00 H new ATOM 767 N SER A 473 0.616 1.909 8.192 1.00 0.00 N ATOM 768 CA SER A 473 0.580 1.463 6.792 1.00 0.00 C ATOM 769 C SER A 473 -0.501 0.417 6.474 1.00 0.00 C ATOM 770 O SER A 473 -0.998 -0.301 7.349 1.00 0.00 O ATOM 771 CB SER A 473 1.962 0.977 6.329 1.00 0.00 C ATOM 772 OG SER A 473 2.304 -0.300 6.841 1.00 0.00 O ATOM 0 H SER A 473 0.238 1.232 8.854 1.00 0.00 H new ATOM 0 HA SER A 473 0.298 2.349 6.224 1.00 0.00 H new ATOM 0 HB2 SER A 473 1.982 0.942 5.240 1.00 0.00 H new ATOM 0 HB3 SER A 473 2.717 1.700 6.639 1.00 0.00 H new ATOM 0 HG SER A 473 3.246 -0.489 6.647 1.00 0.00 H new ATOM 778 N ALA A 474 -0.875 0.345 5.194 1.00 0.00 N ATOM 779 CA ALA A 474 -1.940 -0.510 4.665 1.00 0.00 C ATOM 780 C ALA A 474 -1.706 -0.867 3.185 1.00 0.00 C ATOM 781 O ALA A 474 -1.031 -0.134 2.457 1.00 0.00 O ATOM 782 CB ALA A 474 -3.274 0.239 4.816 1.00 0.00 C ATOM 0 H ALA A 474 -0.426 0.904 4.469 1.00 0.00 H new ATOM 0 HA ALA A 474 -1.953 -1.446 5.224 1.00 0.00 H new ATOM 0 HB1 ALA A 474 -4.084 -0.379 4.428 1.00 0.00 H new ATOM 0 HB2 ALA A 474 -3.454 0.453 5.869 1.00 0.00 H new ATOM 0 HB3 ALA A 474 -3.231 1.174 4.258 1.00 0.00 H new ATOM 788 N PHE A 475 -2.303 -1.970 2.726 1.00 0.00 N ATOM 789 CA PHE A 475 -2.395 -2.306 1.303 1.00 0.00 C ATOM 790 C PHE A 475 -3.676 -1.711 0.700 1.00 0.00 C ATOM 791 O PHE A 475 -4.700 -1.609 1.384 1.00 0.00 O ATOM 792 CB PHE A 475 -2.395 -3.829 1.104 1.00 0.00 C ATOM 793 CG PHE A 475 -1.119 -4.538 1.515 1.00 0.00 C ATOM 794 CD1 PHE A 475 0.107 -4.189 0.917 1.00 0.00 C ATOM 795 CD2 PHE A 475 -1.164 -5.587 2.454 1.00 0.00 C ATOM 796 CE1 PHE A 475 1.287 -4.867 1.275 1.00 0.00 C ATOM 797 CE2 PHE A 475 0.011 -6.281 2.791 1.00 0.00 C ATOM 798 CZ PHE A 475 1.237 -5.915 2.210 1.00 0.00 C ATOM 0 H PHE A 475 -2.740 -2.661 3.337 1.00 0.00 H new ATOM 0 HA PHE A 475 -1.527 -1.884 0.797 1.00 0.00 H new ATOM 0 HB2 PHE A 475 -3.225 -4.252 1.670 1.00 0.00 H new ATOM 0 HB3 PHE A 475 -2.586 -4.041 0.052 1.00 0.00 H new ATOM 0 HD1 PHE A 475 0.142 -3.399 0.182 1.00 0.00 H new ATOM 0 HD2 PHE A 475 -2.102 -5.858 2.915 1.00 0.00 H new ATOM 0 HE1 PHE A 475 2.230 -4.582 0.832 1.00 0.00 H new ATOM 0 HE2 PHE A 475 -0.029 -7.097 3.498 1.00 0.00 H new ATOM 0 HZ PHE A 475 2.141 -6.439 2.482 1.00 0.00 H new ATOM 808 N VAL A 476 -3.641 -1.360 -0.590 1.00 0.00 N ATOM 809 CA VAL A 476 -4.778 -0.766 -1.317 1.00 0.00 C ATOM 810 C VAL A 476 -4.900 -1.376 -2.715 1.00 0.00 C ATOM 811 O VAL A 476 -4.060 -1.151 -3.587 1.00 0.00 O ATOM 812 CB VAL A 476 -4.681 0.776 -1.388 1.00 0.00 C ATOM 813 CG1 VAL A 476 -5.928 1.368 -2.056 1.00 0.00 C ATOM 814 CG2 VAL A 476 -4.560 1.412 0.005 1.00 0.00 C ATOM 0 H VAL A 476 -2.811 -1.481 -1.171 1.00 0.00 H new ATOM 0 HA VAL A 476 -5.683 -1.001 -0.757 1.00 0.00 H new ATOM 0 HB VAL A 476 -3.786 0.997 -1.969 1.00 0.00 H new ATOM 0 HG11 VAL A 476 -5.839 2.454 -2.096 1.00 0.00 H new ATOM 0 HG12 VAL A 476 -6.020 0.974 -3.068 1.00 0.00 H new ATOM 0 HG13 VAL A 476 -6.813 1.097 -1.480 1.00 0.00 H new ATOM 0 HG21 VAL A 476 -4.495 2.496 -0.094 1.00 0.00 H new ATOM 0 HG22 VAL A 476 -5.436 1.154 0.600 1.00 0.00 H new ATOM 0 HG23 VAL A 476 -3.663 1.038 0.499 1.00 0.00 H new ATOM 824 N SER A 477 -5.960 -2.153 -2.929 1.00 0.00 N ATOM 825 CA SER A 477 -6.372 -2.688 -4.233 1.00 0.00 C ATOM 826 C SER A 477 -7.035 -1.604 -5.088 1.00 0.00 C ATOM 827 O SER A 477 -7.869 -0.844 -4.590 1.00 0.00 O ATOM 828 CB SER A 477 -7.400 -3.803 -4.022 1.00 0.00 C ATOM 829 OG SER A 477 -6.799 -4.944 -3.433 1.00 0.00 O ATOM 0 H SER A 477 -6.581 -2.440 -2.173 1.00 0.00 H new ATOM 0 HA SER A 477 -5.481 -3.060 -4.739 1.00 0.00 H new ATOM 0 HB2 SER A 477 -8.207 -3.442 -3.384 1.00 0.00 H new ATOM 0 HB3 SER A 477 -7.847 -4.076 -4.978 1.00 0.00 H new ATOM 0 HG SER A 477 -7.476 -5.642 -3.307 1.00 0.00 H new ATOM 835 N LEU A 478 -6.723 -1.580 -6.386 1.00 0.00 N ATOM 836 CA LEU A 478 -7.285 -0.649 -7.375 1.00 0.00 C ATOM 837 C LEU A 478 -8.161 -1.385 -8.407 1.00 0.00 C ATOM 838 O LEU A 478 -8.025 -2.596 -8.601 1.00 0.00 O ATOM 839 CB LEU A 478 -6.134 0.094 -8.081 1.00 0.00 C ATOM 840 CG LEU A 478 -5.101 0.779 -7.165 1.00 0.00 C ATOM 841 CD1 LEU A 478 -4.099 1.525 -8.039 1.00 0.00 C ATOM 842 CD2 LEU A 478 -5.731 1.783 -6.202 1.00 0.00 C ATOM 0 H LEU A 478 -6.050 -2.229 -6.794 1.00 0.00 H new ATOM 0 HA LEU A 478 -7.923 0.067 -6.857 1.00 0.00 H new ATOM 0 HB2 LEU A 478 -5.608 -0.617 -8.719 1.00 0.00 H new ATOM 0 HB3 LEU A 478 -6.566 0.851 -8.736 1.00 0.00 H new ATOM 0 HG LEU A 478 -4.628 -0.001 -6.568 1.00 0.00 H new ATOM 0 HD11 LEU A 478 -3.360 2.016 -7.407 1.00 0.00 H new ATOM 0 HD12 LEU A 478 -3.598 0.819 -8.702 1.00 0.00 H new ATOM 0 HD13 LEU A 478 -4.622 2.273 -8.634 1.00 0.00 H new ATOM 0 HD21 LEU A 478 -4.953 2.232 -5.584 1.00 0.00 H new ATOM 0 HD22 LEU A 478 -6.238 2.563 -6.770 1.00 0.00 H new ATOM 0 HD23 LEU A 478 -6.452 1.272 -5.564 1.00 0.00 H new ATOM 854 N SER A 479 -9.050 -0.659 -9.092 1.00 0.00 N ATOM 855 CA SER A 479 -9.982 -1.229 -10.083 1.00 0.00 C ATOM 856 C SER A 479 -9.305 -1.778 -11.349 1.00 0.00 C ATOM 857 O SER A 479 -9.854 -2.689 -11.974 1.00 0.00 O ATOM 858 CB SER A 479 -11.030 -0.190 -10.501 1.00 0.00 C ATOM 859 OG SER A 479 -11.843 0.177 -9.396 1.00 0.00 O ATOM 0 H SER A 479 -9.148 0.350 -8.977 1.00 0.00 H new ATOM 0 HA SER A 479 -10.447 -2.074 -9.576 1.00 0.00 H new ATOM 0 HB2 SER A 479 -10.533 0.693 -10.902 1.00 0.00 H new ATOM 0 HB3 SER A 479 -11.653 -0.595 -11.298 1.00 0.00 H new ATOM 0 HG SER A 479 -12.504 0.842 -9.683 1.00 0.00 H new ATOM 865 N GLN A 480 -8.126 -1.269 -11.729 1.00 0.00 N ATOM 866 CA GLN A 480 -7.328 -1.752 -12.870 1.00 0.00 C ATOM 867 C GLN A 480 -5.812 -1.702 -12.575 1.00 0.00 C ATOM 868 O GLN A 480 -5.358 -0.769 -11.905 1.00 0.00 O ATOM 869 CB GLN A 480 -7.620 -0.899 -14.123 1.00 0.00 C ATOM 870 CG GLN A 480 -8.997 -1.126 -14.767 1.00 0.00 C ATOM 871 CD GLN A 480 -9.134 -2.506 -15.412 1.00 0.00 C ATOM 872 OE1 GLN A 480 -8.770 -2.726 -16.561 1.00 0.00 O ATOM 873 NE2 GLN A 480 -9.657 -3.490 -14.711 1.00 0.00 N ATOM 0 H GLN A 480 -7.687 -0.489 -11.240 1.00 0.00 H new ATOM 0 HA GLN A 480 -7.613 -2.790 -13.044 1.00 0.00 H new ATOM 0 HB2 GLN A 480 -7.532 0.154 -13.854 1.00 0.00 H new ATOM 0 HB3 GLN A 480 -6.851 -1.103 -14.868 1.00 0.00 H new ATOM 0 HG2 GLN A 480 -9.771 -1.007 -14.009 1.00 0.00 H new ATOM 0 HG3 GLN A 480 -9.170 -0.359 -15.522 1.00 0.00 H new ATOM 0 HE21 GLN A 480 -9.966 -3.326 -13.753 1.00 0.00 H new ATOM 0 HE22 GLN A 480 -9.753 -4.417 -15.126 1.00 0.00 H new ATOM 882 N PRO A 481 -4.999 -2.638 -13.116 1.00 0.00 N ATOM 883 CA PRO A 481 -3.533 -2.612 -13.008 1.00 0.00 C ATOM 884 C PRO A 481 -2.875 -1.314 -13.503 1.00 0.00 C ATOM 885 O PRO A 481 -1.870 -0.876 -12.948 1.00 0.00 O ATOM 886 CB PRO A 481 -3.034 -3.804 -13.834 1.00 0.00 C ATOM 887 CG PRO A 481 -4.218 -4.763 -13.834 1.00 0.00 C ATOM 888 CD PRO A 481 -5.422 -3.828 -13.845 1.00 0.00 C ATOM 0 HA PRO A 481 -3.258 -2.668 -11.955 1.00 0.00 H new ATOM 0 HB2 PRO A 481 -2.761 -3.504 -14.846 1.00 0.00 H new ATOM 0 HB3 PRO A 481 -2.150 -4.259 -13.387 1.00 0.00 H new ATOM 0 HG2 PRO A 481 -4.207 -5.416 -14.706 1.00 0.00 H new ATOM 0 HG3 PRO A 481 -4.215 -5.406 -12.954 1.00 0.00 H new ATOM 0 HD2 PRO A 481 -5.716 -3.579 -14.865 1.00 0.00 H new ATOM 0 HD3 PRO A 481 -6.285 -4.294 -13.369 1.00 0.00 H new ATOM 896 N GLU A 482 -3.441 -0.663 -14.523 1.00 0.00 N ATOM 897 CA GLU A 482 -2.919 0.602 -15.073 1.00 0.00 C ATOM 898 C GLU A 482 -2.918 1.754 -14.049 1.00 0.00 C ATOM 899 O GLU A 482 -2.050 2.628 -14.092 1.00 0.00 O ATOM 900 CB GLU A 482 -3.728 1.012 -16.315 1.00 0.00 C ATOM 901 CG GLU A 482 -3.586 0.010 -17.470 1.00 0.00 C ATOM 902 CD GLU A 482 -4.307 0.516 -18.734 1.00 0.00 C ATOM 903 OE1 GLU A 482 -5.529 0.264 -18.886 1.00 0.00 O ATOM 904 OE2 GLU A 482 -3.659 1.165 -19.592 1.00 0.00 O ATOM 0 H GLU A 482 -4.280 -0.997 -14.997 1.00 0.00 H new ATOM 0 HA GLU A 482 -1.880 0.417 -15.344 1.00 0.00 H new ATOM 0 HB2 GLU A 482 -4.780 1.103 -16.045 1.00 0.00 H new ATOM 0 HB3 GLU A 482 -3.399 1.996 -16.650 1.00 0.00 H new ATOM 0 HG2 GLU A 482 -2.530 -0.150 -17.689 1.00 0.00 H new ATOM 0 HG3 GLU A 482 -4.000 -0.954 -17.173 1.00 0.00 H new ATOM 911 N GLN A 483 -3.851 1.739 -13.091 1.00 0.00 N ATOM 912 CA GLN A 483 -3.953 2.743 -12.023 1.00 0.00 C ATOM 913 C GLN A 483 -2.785 2.660 -11.022 1.00 0.00 C ATOM 914 O GLN A 483 -2.419 3.668 -10.413 1.00 0.00 O ATOM 915 CB GLN A 483 -5.309 2.589 -11.311 1.00 0.00 C ATOM 916 CG GLN A 483 -6.502 2.830 -12.257 1.00 0.00 C ATOM 917 CD GLN A 483 -7.859 2.583 -11.596 1.00 0.00 C ATOM 918 OE1 GLN A 483 -8.038 1.702 -10.767 1.00 0.00 O ATOM 919 NE2 GLN A 483 -8.880 3.332 -11.956 1.00 0.00 N ATOM 0 H GLN A 483 -4.569 1.017 -13.034 1.00 0.00 H new ATOM 0 HA GLN A 483 -3.890 3.731 -12.478 1.00 0.00 H new ATOM 0 HB2 GLN A 483 -5.382 1.587 -10.887 1.00 0.00 H new ATOM 0 HB3 GLN A 483 -5.361 3.292 -10.479 1.00 0.00 H new ATOM 0 HG2 GLN A 483 -6.465 3.856 -12.622 1.00 0.00 H new ATOM 0 HG3 GLN A 483 -6.405 2.179 -13.126 1.00 0.00 H new ATOM 0 HE21 GLN A 483 -8.751 4.072 -12.646 1.00 0.00 H new ATOM 0 HE22 GLN A 483 -9.800 3.172 -11.545 1.00 0.00 H new ATOM 928 N VAL A 484 -2.143 1.489 -10.890 1.00 0.00 N ATOM 929 CA VAL A 484 -0.955 1.285 -10.039 1.00 0.00 C ATOM 930 C VAL A 484 0.209 2.152 -10.525 1.00 0.00 C ATOM 931 O VAL A 484 0.862 2.821 -9.725 1.00 0.00 O ATOM 932 CB VAL A 484 -0.548 -0.206 -10.009 1.00 0.00 C ATOM 933 CG1 VAL A 484 0.685 -0.502 -9.152 1.00 0.00 C ATOM 934 CG2 VAL A 484 -1.679 -1.078 -9.448 1.00 0.00 C ATOM 0 H VAL A 484 -2.437 0.643 -11.378 1.00 0.00 H new ATOM 0 HA VAL A 484 -1.209 1.587 -9.023 1.00 0.00 H new ATOM 0 HB VAL A 484 -0.324 -0.439 -11.050 1.00 0.00 H new ATOM 0 HG11 VAL A 484 0.903 -1.569 -9.185 1.00 0.00 H new ATOM 0 HG12 VAL A 484 1.539 0.055 -9.538 1.00 0.00 H new ATOM 0 HG13 VAL A 484 0.493 -0.202 -8.122 1.00 0.00 H new ATOM 0 HG21 VAL A 484 -1.364 -2.121 -9.439 1.00 0.00 H new ATOM 0 HG22 VAL A 484 -1.913 -0.761 -8.432 1.00 0.00 H new ATOM 0 HG23 VAL A 484 -2.565 -0.972 -10.074 1.00 0.00 H new ATOM 944 N GLN A 485 0.427 2.210 -11.843 1.00 0.00 N ATOM 945 CA GLN A 485 1.465 3.045 -12.460 1.00 0.00 C ATOM 946 C GLN A 485 1.214 4.544 -12.219 1.00 0.00 C ATOM 947 O GLN A 485 2.151 5.289 -11.927 1.00 0.00 O ATOM 948 CB GLN A 485 1.547 2.757 -13.969 1.00 0.00 C ATOM 949 CG GLN A 485 1.917 1.297 -14.288 1.00 0.00 C ATOM 950 CD GLN A 485 1.970 1.019 -15.793 1.00 0.00 C ATOM 951 OE1 GLN A 485 2.436 1.816 -16.599 1.00 0.00 O ATOM 952 NE2 GLN A 485 1.491 -0.125 -16.240 1.00 0.00 N ATOM 0 H GLN A 485 -0.117 1.674 -12.519 1.00 0.00 H new ATOM 0 HA GLN A 485 2.415 2.791 -11.990 1.00 0.00 H new ATOM 0 HB2 GLN A 485 0.587 2.991 -14.430 1.00 0.00 H new ATOM 0 HB3 GLN A 485 2.287 3.419 -14.419 1.00 0.00 H new ATOM 0 HG2 GLN A 485 2.886 1.066 -13.845 1.00 0.00 H new ATOM 0 HG3 GLN A 485 1.188 0.632 -13.825 1.00 0.00 H new ATOM 0 HE21 GLN A 485 1.098 -0.803 -15.587 1.00 0.00 H new ATOM 0 HE22 GLN A 485 1.513 -0.332 -17.239 1.00 0.00 H new ATOM 961 N ILE A 486 -0.051 4.982 -12.285 1.00 0.00 N ATOM 962 CA ILE A 486 -0.456 6.371 -12.004 1.00 0.00 C ATOM 963 C ILE A 486 -0.169 6.733 -10.539 1.00 0.00 C ATOM 964 O ILE A 486 0.443 7.768 -10.276 1.00 0.00 O ATOM 965 CB ILE A 486 -1.943 6.605 -12.374 1.00 0.00 C ATOM 966 CG1 ILE A 486 -2.188 6.317 -13.877 1.00 0.00 C ATOM 967 CG2 ILE A 486 -2.366 8.049 -12.034 1.00 0.00 C ATOM 968 CD1 ILE A 486 -3.660 6.370 -14.306 1.00 0.00 C ATOM 0 H ILE A 486 -0.832 4.377 -12.538 1.00 0.00 H new ATOM 0 HA ILE A 486 0.139 7.035 -12.631 1.00 0.00 H new ATOM 0 HB ILE A 486 -2.549 5.916 -11.786 1.00 0.00 H new ATOM 0 HG12 ILE A 486 -1.625 7.039 -14.468 1.00 0.00 H new ATOM 0 HG13 ILE A 486 -1.789 5.331 -14.114 1.00 0.00 H new ATOM 0 HG21 ILE A 486 -3.413 8.194 -12.301 1.00 0.00 H new ATOM 0 HG22 ILE A 486 -2.236 8.224 -10.966 1.00 0.00 H new ATOM 0 HG23 ILE A 486 -1.748 8.751 -12.594 1.00 0.00 H new ATOM 0 HD11 ILE A 486 -3.736 6.156 -15.372 1.00 0.00 H new ATOM 0 HD12 ILE A 486 -4.229 5.628 -13.746 1.00 0.00 H new ATOM 0 HD13 ILE A 486 -4.062 7.363 -14.105 1.00 0.00 H new ATOM 980 N ALA A 487 -0.547 5.882 -9.582 1.00 0.00 N ATOM 981 CA ALA A 487 -0.299 6.115 -8.156 1.00 0.00 C ATOM 982 C ALA A 487 1.202 6.139 -7.800 1.00 0.00 C ATOM 983 O ALA A 487 1.644 6.985 -7.019 1.00 0.00 O ATOM 984 CB ALA A 487 -1.029 5.030 -7.365 1.00 0.00 C ATOM 0 H ALA A 487 -1.036 5.008 -9.775 1.00 0.00 H new ATOM 0 HA ALA A 487 -0.677 7.104 -7.896 1.00 0.00 H new ATOM 0 HB1 ALA A 487 -0.860 5.181 -6.299 1.00 0.00 H new ATOM 0 HB2 ALA A 487 -2.097 5.084 -7.574 1.00 0.00 H new ATOM 0 HB3 ALA A 487 -0.651 4.050 -7.657 1.00 0.00 H new ATOM 990 N VAL A 488 2.005 5.251 -8.400 1.00 0.00 N ATOM 991 CA VAL A 488 3.473 5.253 -8.254 1.00 0.00 C ATOM 992 C VAL A 488 4.090 6.536 -8.831 1.00 0.00 C ATOM 993 O VAL A 488 4.934 7.149 -8.175 1.00 0.00 O ATOM 994 CB VAL A 488 4.081 3.979 -8.880 1.00 0.00 C ATOM 995 CG1 VAL A 488 5.612 4.023 -8.989 1.00 0.00 C ATOM 996 CG2 VAL A 488 3.730 2.749 -8.027 1.00 0.00 C ATOM 0 H VAL A 488 1.657 4.506 -9.004 1.00 0.00 H new ATOM 0 HA VAL A 488 3.714 5.242 -7.191 1.00 0.00 H new ATOM 0 HB VAL A 488 3.658 3.919 -9.883 1.00 0.00 H new ATOM 0 HG11 VAL A 488 5.972 3.097 -9.437 1.00 0.00 H new ATOM 0 HG12 VAL A 488 5.908 4.867 -9.612 1.00 0.00 H new ATOM 0 HG13 VAL A 488 6.044 4.137 -7.995 1.00 0.00 H new ATOM 0 HG21 VAL A 488 4.164 1.857 -8.479 1.00 0.00 H new ATOM 0 HG22 VAL A 488 4.130 2.878 -7.021 1.00 0.00 H new ATOM 0 HG23 VAL A 488 2.647 2.639 -7.976 1.00 0.00 H new ATOM 1006 N ASN A 489 3.643 7.001 -10.004 1.00 0.00 N ATOM 1007 CA ASN A 489 4.103 8.263 -10.601 1.00 0.00 C ATOM 1008 C ASN A 489 3.753 9.492 -9.737 1.00 0.00 C ATOM 1009 O ASN A 489 4.598 10.355 -9.491 1.00 0.00 O ATOM 1010 CB ASN A 489 3.485 8.396 -12.005 1.00 0.00 C ATOM 1011 CG ASN A 489 3.970 9.639 -12.738 1.00 0.00 C ATOM 1012 OD1 ASN A 489 5.158 9.915 -12.833 1.00 0.00 O ATOM 1013 ND2 ASN A 489 3.071 10.434 -13.274 1.00 0.00 N ATOM 0 H ASN A 489 2.949 6.511 -10.569 1.00 0.00 H new ATOM 0 HA ASN A 489 5.191 8.235 -10.664 1.00 0.00 H new ATOM 0 HB2 ASN A 489 3.732 7.512 -12.593 1.00 0.00 H new ATOM 0 HB3 ASN A 489 2.399 8.429 -11.919 1.00 0.00 H new ATOM 0 HD21 ASN A 489 3.365 11.277 -13.767 1.00 0.00 H new ATOM 0 HD22 ASN A 489 2.079 10.208 -13.197 1.00 0.00 H new ATOM 1020 N THR A 490 2.506 9.568 -9.264 1.00 0.00 N ATOM 1021 CA THR A 490 1.973 10.714 -8.503 1.00 0.00 C ATOM 1022 C THR A 490 2.482 10.797 -7.060 1.00 0.00 C ATOM 1023 O THR A 490 2.499 11.888 -6.484 1.00 0.00 O ATOM 1024 CB THR A 490 0.434 10.738 -8.523 1.00 0.00 C ATOM 1025 OG1 THR A 490 -0.123 9.504 -8.146 1.00 0.00 O ATOM 1026 CG2 THR A 490 -0.093 11.084 -9.917 1.00 0.00 C ATOM 0 H THR A 490 1.822 8.824 -9.399 1.00 0.00 H new ATOM 0 HA THR A 490 2.355 11.596 -9.018 1.00 0.00 H new ATOM 0 HB THR A 490 0.138 11.501 -7.803 1.00 0.00 H new ATOM 0 HG1 THR A 490 -0.047 8.870 -8.890 1.00 0.00 H new ATOM 0 HG21 THR A 490 -1.183 11.094 -9.902 1.00 0.00 H new ATOM 0 HG22 THR A 490 0.275 12.067 -10.211 1.00 0.00 H new ATOM 0 HG23 THR A 490 0.253 10.338 -10.632 1.00 0.00 H new ATOM 1034 N SER A 491 2.982 9.695 -6.485 1.00 0.00 N ATOM 1035 CA SER A 491 3.623 9.677 -5.156 1.00 0.00 C ATOM 1036 C SER A 491 4.832 10.619 -5.027 1.00 0.00 C ATOM 1037 O SER A 491 5.129 11.105 -3.932 1.00 0.00 O ATOM 1038 CB SER A 491 4.032 8.249 -4.780 1.00 0.00 C ATOM 1039 OG SER A 491 5.226 7.837 -5.424 1.00 0.00 O ATOM 0 H SER A 491 2.954 8.779 -6.932 1.00 0.00 H new ATOM 0 HA SER A 491 2.871 10.051 -4.461 1.00 0.00 H new ATOM 0 HB2 SER A 491 4.165 8.186 -3.700 1.00 0.00 H new ATOM 0 HB3 SER A 491 3.227 7.563 -5.043 1.00 0.00 H new ATOM 0 HG SER A 491 5.038 7.635 -6.364 1.00 0.00 H new ATOM 1045 N LYS A 492 5.486 10.940 -6.155 1.00 0.00 N ATOM 1046 CA LYS A 492 6.594 11.903 -6.287 1.00 0.00 C ATOM 1047 C LYS A 492 6.257 13.319 -5.784 1.00 0.00 C ATOM 1048 O LYS A 492 7.165 14.083 -5.451 1.00 0.00 O ATOM 1049 CB LYS A 492 7.018 11.907 -7.768 1.00 0.00 C ATOM 1050 CG LYS A 492 8.336 12.649 -8.046 1.00 0.00 C ATOM 1051 CD LYS A 492 8.837 12.436 -9.483 1.00 0.00 C ATOM 1052 CE LYS A 492 7.853 12.993 -10.519 1.00 0.00 C ATOM 1053 NZ LYS A 492 8.353 12.824 -11.905 1.00 0.00 N ATOM 0 H LYS A 492 5.244 10.512 -7.049 1.00 0.00 H new ATOM 0 HA LYS A 492 7.415 11.586 -5.644 1.00 0.00 H new ATOM 0 HB2 LYS A 492 7.116 10.876 -8.109 1.00 0.00 H new ATOM 0 HB3 LYS A 492 6.225 12.364 -8.360 1.00 0.00 H new ATOM 0 HG2 LYS A 492 8.194 13.715 -7.868 1.00 0.00 H new ATOM 0 HG3 LYS A 492 9.097 12.307 -7.344 1.00 0.00 H new ATOM 0 HD2 LYS A 492 9.806 12.920 -9.605 1.00 0.00 H new ATOM 0 HD3 LYS A 492 8.988 11.371 -9.661 1.00 0.00 H new ATOM 0 HE2 LYS A 492 6.893 12.488 -10.416 1.00 0.00 H new ATOM 0 HE3 LYS A 492 7.679 14.051 -10.322 1.00 0.00 H new ATOM 0 HZ1 LYS A 492 7.659 13.213 -12.574 1.00 0.00 H new ATOM 0 HZ2 LYS A 492 9.257 13.327 -12.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 492 8.495 11.813 -12.102 1.00 0.00 H new ATOM 1067 N TYR A 493 4.968 13.655 -5.688 1.00 0.00 N ATOM 1068 CA TYR A 493 4.462 14.987 -5.330 1.00 0.00 C ATOM 1069 C TYR A 493 3.814 15.049 -3.928 1.00 0.00 C ATOM 1070 O TYR A 493 3.272 16.091 -3.546 1.00 0.00 O ATOM 1071 CB TYR A 493 3.485 15.452 -6.425 1.00 0.00 C ATOM 1072 CG TYR A 493 3.984 15.267 -7.852 1.00 0.00 C ATOM 1073 CD1 TYR A 493 5.164 15.910 -8.280 1.00 0.00 C ATOM 1074 CD2 TYR A 493 3.278 14.435 -8.742 1.00 0.00 C ATOM 1075 CE1 TYR A 493 5.637 15.717 -9.593 1.00 0.00 C ATOM 1076 CE2 TYR A 493 3.747 14.239 -10.056 1.00 0.00 C ATOM 1077 CZ TYR A 493 4.929 14.882 -10.486 1.00 0.00 C ATOM 1078 OH TYR A 493 5.395 14.699 -11.752 1.00 0.00 O ATOM 0 H TYR A 493 4.220 12.985 -5.863 1.00 0.00 H new ATOM 0 HA TYR A 493 5.314 15.665 -5.272 1.00 0.00 H new ATOM 0 HB2 TYR A 493 2.548 14.907 -6.310 1.00 0.00 H new ATOM 0 HB3 TYR A 493 3.262 16.507 -6.268 1.00 0.00 H new ATOM 0 HD1 TYR A 493 5.706 16.551 -7.600 1.00 0.00 H new ATOM 0 HD2 TYR A 493 2.373 13.945 -8.416 1.00 0.00 H new ATOM 0 HE1 TYR A 493 6.542 16.208 -9.917 1.00 0.00 H new ATOM 0 HE2 TYR A 493 3.203 13.598 -10.734 1.00 0.00 H new ATOM 0 HH TYR A 493 4.794 14.096 -12.238 1.00 0.00 H new ATOM 1088 N ALA A 494 3.858 13.957 -3.153 1.00 0.00 N ATOM 1089 CA ALA A 494 3.356 13.907 -1.778 1.00 0.00 C ATOM 1090 C ALA A 494 4.142 14.821 -0.811 1.00 0.00 C ATOM 1091 O ALA A 494 5.308 15.160 -1.041 1.00 0.00 O ATOM 1092 CB ALA A 494 3.405 12.455 -1.285 1.00 0.00 C ATOM 0 H ALA A 494 4.250 13.071 -3.471 1.00 0.00 H new ATOM 0 HA ALA A 494 2.332 14.279 -1.788 1.00 0.00 H new ATOM 0 HB1 ALA A 494 3.033 12.406 -0.262 1.00 0.00 H new ATOM 0 HB2 ALA A 494 2.783 11.831 -1.927 1.00 0.00 H new ATOM 0 HB3 ALA A 494 4.433 12.095 -1.315 1.00 0.00 H new ATOM 1098 N GLU A 495 3.514 15.154 0.319 1.00 0.00 N ATOM 1099 CA GLU A 495 4.114 15.926 1.426 1.00 0.00 C ATOM 1100 C GLU A 495 3.755 15.394 2.832 1.00 0.00 C ATOM 1101 O GLU A 495 4.236 15.920 3.839 1.00 0.00 O ATOM 1102 CB GLU A 495 3.749 17.415 1.273 1.00 0.00 C ATOM 1103 CG GLU A 495 2.247 17.710 1.424 1.00 0.00 C ATOM 1104 CD GLU A 495 1.969 19.219 1.277 1.00 0.00 C ATOM 1105 OE1 GLU A 495 2.013 19.954 2.295 1.00 0.00 O ATOM 1106 OE2 GLU A 495 1.696 19.686 0.143 1.00 0.00 O ATOM 0 H GLU A 495 2.546 14.890 0.501 1.00 0.00 H new ATOM 0 HA GLU A 495 5.194 15.803 1.351 1.00 0.00 H new ATOM 0 HB2 GLU A 495 4.299 17.991 2.017 1.00 0.00 H new ATOM 0 HB3 GLU A 495 4.080 17.761 0.294 1.00 0.00 H new ATOM 0 HG2 GLU A 495 1.686 17.157 0.671 1.00 0.00 H new ATOM 0 HG3 GLU A 495 1.900 17.365 2.398 1.00 0.00 H new ATOM 1113 N SER A 496 2.920 14.350 2.912 1.00 0.00 N ATOM 1114 CA SER A 496 2.340 13.819 4.161 1.00 0.00 C ATOM 1115 C SER A 496 2.078 12.300 4.145 1.00 0.00 C ATOM 1116 O SER A 496 1.504 11.756 5.092 1.00 0.00 O ATOM 1117 CB SER A 496 1.042 14.581 4.458 1.00 0.00 C ATOM 1118 OG SER A 496 0.111 14.459 3.393 1.00 0.00 O ATOM 0 H SER A 496 2.618 13.833 2.086 1.00 0.00 H new ATOM 0 HA SER A 496 3.079 13.972 4.947 1.00 0.00 H new ATOM 0 HB2 SER A 496 0.597 14.199 5.377 1.00 0.00 H new ATOM 0 HB3 SER A 496 1.268 15.634 4.626 1.00 0.00 H new ATOM 0 HG SER A 496 -0.705 14.954 3.614 1.00 0.00 H new ATOM 1124 N TYR A 497 2.501 11.604 3.085 1.00 0.00 N ATOM 1125 CA TYR A 497 2.330 10.161 2.862 1.00 0.00 C ATOM 1126 C TYR A 497 3.362 9.640 1.841 1.00 0.00 C ATOM 1127 O TYR A 497 4.073 10.426 1.206 1.00 0.00 O ATOM 1128 CB TYR A 497 0.894 9.885 2.365 1.00 0.00 C ATOM 1129 CG TYR A 497 0.562 10.512 1.018 1.00 0.00 C ATOM 1130 CD1 TYR A 497 0.077 11.832 0.953 1.00 0.00 C ATOM 1131 CD2 TYR A 497 0.777 9.788 -0.171 1.00 0.00 C ATOM 1132 CE1 TYR A 497 -0.165 12.440 -0.294 1.00 0.00 C ATOM 1133 CE2 TYR A 497 0.545 10.393 -1.421 1.00 0.00 C ATOM 1134 CZ TYR A 497 0.076 11.725 -1.486 1.00 0.00 C ATOM 1135 OH TYR A 497 -0.135 12.328 -2.688 1.00 0.00 O ATOM 0 H TYR A 497 2.999 12.054 2.317 1.00 0.00 H new ATOM 0 HA TYR A 497 2.493 9.635 3.803 1.00 0.00 H new ATOM 0 HB2 TYR A 497 0.748 8.807 2.296 1.00 0.00 H new ATOM 0 HB3 TYR A 497 0.188 10.256 3.108 1.00 0.00 H new ATOM 0 HD1 TYR A 497 -0.110 12.381 1.864 1.00 0.00 H new ATOM 0 HD2 TYR A 497 1.121 8.765 -0.124 1.00 0.00 H new ATOM 0 HE1 TYR A 497 -0.535 13.454 -0.338 1.00 0.00 H new ATOM 0 HE2 TYR A 497 0.725 9.839 -2.331 1.00 0.00 H new ATOM 0 HH TYR A 497 0.079 11.701 -3.410 1.00 0.00 H new ATOM 1145 N ARG A 498 3.413 8.316 1.646 1.00 0.00 N ATOM 1146 CA ARG A 498 4.160 7.620 0.578 1.00 0.00 C ATOM 1147 C ARG A 498 3.358 6.439 0.029 1.00 0.00 C ATOM 1148 O ARG A 498 2.515 5.876 0.727 1.00 0.00 O ATOM 1149 CB ARG A 498 5.533 7.136 1.087 1.00 0.00 C ATOM 1150 CG ARG A 498 6.547 8.280 1.196 1.00 0.00 C ATOM 1151 CD ARG A 498 7.929 7.764 1.612 1.00 0.00 C ATOM 1152 NE ARG A 498 8.910 8.865 1.679 1.00 0.00 N ATOM 1153 CZ ARG A 498 10.212 8.752 1.870 1.00 0.00 C ATOM 1154 NH1 ARG A 498 10.793 7.597 2.043 1.00 0.00 N ATOM 1155 NH2 ARG A 498 10.968 9.813 1.890 1.00 0.00 N ATOM 0 H ARG A 498 2.913 7.667 2.254 1.00 0.00 H new ATOM 0 HA ARG A 498 4.322 8.335 -0.229 1.00 0.00 H new ATOM 0 HB2 ARG A 498 5.412 6.666 2.063 1.00 0.00 H new ATOM 0 HB3 ARG A 498 5.920 6.373 0.412 1.00 0.00 H new ATOM 0 HG2 ARG A 498 6.622 8.794 0.238 1.00 0.00 H new ATOM 0 HG3 ARG A 498 6.196 9.012 1.924 1.00 0.00 H new ATOM 0 HD2 ARG A 498 7.860 7.274 2.583 1.00 0.00 H new ATOM 0 HD3 ARG A 498 8.269 7.012 0.900 1.00 0.00 H new ATOM 0 HE ARG A 498 8.545 9.811 1.566 1.00 0.00 H new ATOM 0 HH11 ARG A 498 10.239 6.741 2.034 1.00 0.00 H new ATOM 0 HH12 ARG A 498 11.802 7.550 2.188 1.00 0.00 H new ATOM 0 HH21 ARG A 498 10.555 10.736 1.758 1.00 0.00 H new ATOM 0 HH22 ARG A 498 11.973 9.720 2.038 1.00 0.00 H new ATOM 1169 N ILE A 499 3.647 6.066 -1.218 1.00 0.00 N ATOM 1170 CA ILE A 499 3.008 4.963 -1.963 1.00 0.00 C ATOM 1171 C ILE A 499 4.094 4.151 -2.687 1.00 0.00 C ATOM 1172 O ILE A 499 5.057 4.713 -3.215 1.00 0.00 O ATOM 1173 CB ILE A 499 1.970 5.493 -2.986 1.00 0.00 C ATOM 1174 CG1 ILE A 499 0.868 6.362 -2.336 1.00 0.00 C ATOM 1175 CG2 ILE A 499 1.314 4.331 -3.758 1.00 0.00 C ATOM 1176 CD1 ILE A 499 0.054 7.173 -3.350 1.00 0.00 C ATOM 0 H ILE A 499 4.364 6.541 -1.767 1.00 0.00 H new ATOM 0 HA ILE A 499 2.476 4.328 -1.254 1.00 0.00 H new ATOM 0 HB ILE A 499 2.527 6.128 -3.675 1.00 0.00 H new ATOM 0 HG12 ILE A 499 0.193 5.718 -1.772 1.00 0.00 H new ATOM 0 HG13 ILE A 499 1.328 7.045 -1.622 1.00 0.00 H new ATOM 0 HG21 ILE A 499 0.590 4.729 -4.469 1.00 0.00 H new ATOM 0 HG22 ILE A 499 2.081 3.772 -4.295 1.00 0.00 H new ATOM 0 HG23 ILE A 499 0.807 3.669 -3.057 1.00 0.00 H new ATOM 0 HD11 ILE A 499 -0.701 7.759 -2.825 1.00 0.00 H new ATOM 0 HD12 ILE A 499 0.718 7.842 -3.897 1.00 0.00 H new ATOM 0 HD13 ILE A 499 -0.435 6.495 -4.050 1.00 0.00 H new ATOM 1188 N GLN A 500 3.918 2.832 -2.743 1.00 0.00 N ATOM 1189 CA GLN A 500 4.734 1.880 -3.505 1.00 0.00 C ATOM 1190 C GLN A 500 3.888 0.671 -3.947 1.00 0.00 C ATOM 1191 O GLN A 500 2.724 0.555 -3.558 1.00 0.00 O ATOM 1192 CB GLN A 500 5.948 1.470 -2.654 1.00 0.00 C ATOM 1193 CG GLN A 500 5.598 0.718 -1.358 1.00 0.00 C ATOM 1194 CD GLN A 500 6.812 0.506 -0.459 1.00 0.00 C ATOM 1195 OE1 GLN A 500 7.960 0.657 -0.857 1.00 0.00 O ATOM 1196 NE2 GLN A 500 6.616 0.170 0.795 1.00 0.00 N ATOM 0 H GLN A 500 3.164 2.372 -2.233 1.00 0.00 H new ATOM 0 HA GLN A 500 5.101 2.348 -4.418 1.00 0.00 H new ATOM 0 HB2 GLN A 500 6.602 0.841 -3.258 1.00 0.00 H new ATOM 0 HB3 GLN A 500 6.514 2.365 -2.397 1.00 0.00 H new ATOM 0 HG2 GLN A 500 4.838 1.277 -0.811 1.00 0.00 H new ATOM 0 HG3 GLN A 500 5.163 -0.249 -1.609 1.00 0.00 H new ATOM 0 HE21 GLN A 500 5.667 0.040 1.146 1.00 0.00 H new ATOM 0 HE22 GLN A 500 7.413 0.039 1.419 1.00 0.00 H new ATOM 1205 N THR A 501 4.429 -0.239 -4.760 1.00 0.00 N ATOM 1206 CA THR A 501 3.734 -1.498 -5.103 1.00 0.00 C ATOM 1207 C THR A 501 3.753 -2.506 -3.946 1.00 0.00 C ATOM 1208 O THR A 501 4.576 -2.419 -3.026 1.00 0.00 O ATOM 1209 CB THR A 501 4.325 -2.164 -6.358 1.00 0.00 C ATOM 1210 OG1 THR A 501 5.627 -2.640 -6.103 1.00 0.00 O ATOM 1211 CG2 THR A 501 4.384 -1.218 -7.557 1.00 0.00 C ATOM 0 H THR A 501 5.345 -0.135 -5.197 1.00 0.00 H new ATOM 0 HA THR A 501 2.701 -1.214 -5.306 1.00 0.00 H new ATOM 0 HB THR A 501 3.657 -2.989 -6.603 1.00 0.00 H new ATOM 0 HG1 THR A 501 5.985 -3.062 -6.912 1.00 0.00 H new ATOM 0 HG21 THR A 501 4.809 -1.742 -8.413 1.00 0.00 H new ATOM 0 HG22 THR A 501 3.378 -0.879 -7.803 1.00 0.00 H new ATOM 0 HG23 THR A 501 5.007 -0.358 -7.312 1.00 0.00 H new ATOM 1219 N TYR A 502 2.883 -3.520 -4.006 1.00 0.00 N ATOM 1220 CA TYR A 502 2.932 -4.679 -3.105 1.00 0.00 C ATOM 1221 C TYR A 502 4.304 -5.388 -3.146 1.00 0.00 C ATOM 1222 O TYR A 502 4.863 -5.735 -2.103 1.00 0.00 O ATOM 1223 CB TYR A 502 1.802 -5.641 -3.498 1.00 0.00 C ATOM 1224 CG TYR A 502 1.651 -6.846 -2.588 1.00 0.00 C ATOM 1225 CD1 TYR A 502 0.800 -6.770 -1.470 1.00 0.00 C ATOM 1226 CD2 TYR A 502 2.342 -8.042 -2.866 1.00 0.00 C ATOM 1227 CE1 TYR A 502 0.639 -7.883 -0.624 1.00 0.00 C ATOM 1228 CE2 TYR A 502 2.179 -9.161 -2.024 1.00 0.00 C ATOM 1229 CZ TYR A 502 1.330 -9.083 -0.899 1.00 0.00 C ATOM 1230 OH TYR A 502 1.147 -10.179 -0.112 1.00 0.00 O ATOM 0 H TYR A 502 2.122 -3.561 -4.683 1.00 0.00 H new ATOM 0 HA TYR A 502 2.796 -4.339 -2.078 1.00 0.00 H new ATOM 0 HB2 TYR A 502 0.861 -5.090 -3.508 1.00 0.00 H new ATOM 0 HB3 TYR A 502 1.978 -5.991 -4.515 1.00 0.00 H new ATOM 0 HD1 TYR A 502 0.268 -5.854 -1.260 1.00 0.00 H new ATOM 0 HD2 TYR A 502 2.996 -8.102 -3.723 1.00 0.00 H new ATOM 0 HE1 TYR A 502 -0.013 -7.819 0.235 1.00 0.00 H new ATOM 0 HE2 TYR A 502 2.705 -10.079 -2.240 1.00 0.00 H new ATOM 0 HH TYR A 502 1.699 -10.917 -0.445 1.00 0.00 H new ATOM 1240 N ALA A 503 4.878 -5.552 -4.344 1.00 0.00 N ATOM 1241 CA ALA A 503 6.186 -6.176 -4.549 1.00 0.00 C ATOM 1242 C ALA A 503 7.347 -5.378 -3.921 1.00 0.00 C ATOM 1243 O ALA A 503 8.256 -5.972 -3.335 1.00 0.00 O ATOM 1244 CB ALA A 503 6.397 -6.370 -6.056 1.00 0.00 C ATOM 0 H ALA A 503 4.437 -5.249 -5.212 1.00 0.00 H new ATOM 0 HA ALA A 503 6.190 -7.138 -4.037 1.00 0.00 H new ATOM 0 HB1 ALA A 503 7.368 -6.834 -6.231 1.00 0.00 H new ATOM 0 HB2 ALA A 503 5.611 -7.012 -6.454 1.00 0.00 H new ATOM 0 HB3 ALA A 503 6.363 -5.402 -6.556 1.00 0.00 H new ATOM 1250 N GLU A 504 7.314 -4.041 -3.985 1.00 0.00 N ATOM 1251 CA GLU A 504 8.287 -3.187 -3.288 1.00 0.00 C ATOM 1252 C GLU A 504 8.212 -3.350 -1.764 1.00 0.00 C ATOM 1253 O GLU A 504 9.254 -3.495 -1.120 1.00 0.00 O ATOM 1254 CB GLU A 504 8.086 -1.710 -3.656 1.00 0.00 C ATOM 1255 CG GLU A 504 8.707 -1.341 -5.006 1.00 0.00 C ATOM 1256 CD GLU A 504 8.640 0.181 -5.220 1.00 0.00 C ATOM 1257 OE1 GLU A 504 9.556 0.892 -4.733 1.00 0.00 O ATOM 1258 OE2 GLU A 504 7.672 0.673 -5.845 1.00 0.00 O ATOM 0 H GLU A 504 6.616 -3.522 -4.518 1.00 0.00 H new ATOM 0 HA GLU A 504 9.275 -3.510 -3.616 1.00 0.00 H new ATOM 0 HB2 GLU A 504 7.019 -1.489 -3.680 1.00 0.00 H new ATOM 0 HB3 GLU A 504 8.523 -1.084 -2.878 1.00 0.00 H new ATOM 0 HG2 GLU A 504 9.744 -1.676 -5.042 1.00 0.00 H new ATOM 0 HG3 GLU A 504 8.179 -1.853 -5.810 1.00 0.00 H new ATOM 1265 N TYR A 505 7.007 -3.392 -1.180 1.00 0.00 N ATOM 1266 CA TYR A 505 6.848 -3.646 0.255 1.00 0.00 C ATOM 1267 C TYR A 505 7.407 -5.020 0.662 1.00 0.00 C ATOM 1268 O TYR A 505 8.197 -5.101 1.601 1.00 0.00 O ATOM 1269 CB TYR A 505 5.381 -3.513 0.680 1.00 0.00 C ATOM 1270 CG TYR A 505 5.174 -3.888 2.138 1.00 0.00 C ATOM 1271 CD1 TYR A 505 5.551 -2.989 3.154 1.00 0.00 C ATOM 1272 CD2 TYR A 505 4.704 -5.173 2.477 1.00 0.00 C ATOM 1273 CE1 TYR A 505 5.443 -3.365 4.507 1.00 0.00 C ATOM 1274 CE2 TYR A 505 4.600 -5.555 3.828 1.00 0.00 C ATOM 1275 CZ TYR A 505 4.970 -4.650 4.848 1.00 0.00 C ATOM 1276 OH TYR A 505 4.892 -5.014 6.158 1.00 0.00 O ATOM 0 H TYR A 505 6.129 -3.253 -1.681 1.00 0.00 H new ATOM 0 HA TYR A 505 7.429 -2.887 0.779 1.00 0.00 H new ATOM 0 HB2 TYR A 505 5.048 -2.488 0.519 1.00 0.00 H new ATOM 0 HB3 TYR A 505 4.762 -4.152 0.050 1.00 0.00 H new ATOM 0 HD1 TYR A 505 5.924 -2.009 2.895 1.00 0.00 H new ATOM 0 HD2 TYR A 505 4.423 -5.866 1.698 1.00 0.00 H new ATOM 0 HE1 TYR A 505 5.722 -2.669 5.284 1.00 0.00 H new ATOM 0 HE2 TYR A 505 4.238 -6.539 4.085 1.00 0.00 H new ATOM 0 HH TYR A 505 4.546 -5.929 6.223 1.00 0.00 H new ATOM 1286 N VAL A 506 7.061 -6.088 -0.070 1.00 0.00 N ATOM 1287 CA VAL A 506 7.545 -7.463 0.175 1.00 0.00 C ATOM 1288 C VAL A 506 9.074 -7.554 0.264 1.00 0.00 C ATOM 1289 O VAL A 506 9.603 -8.295 1.099 1.00 0.00 O ATOM 1290 CB VAL A 506 6.984 -8.408 -0.911 1.00 0.00 C ATOM 1291 CG1 VAL A 506 7.760 -9.722 -1.071 1.00 0.00 C ATOM 1292 CG2 VAL A 506 5.522 -8.749 -0.596 1.00 0.00 C ATOM 0 H VAL A 506 6.425 -6.024 -0.865 1.00 0.00 H new ATOM 0 HA VAL A 506 7.176 -7.775 1.152 1.00 0.00 H new ATOM 0 HB VAL A 506 7.082 -7.863 -1.850 1.00 0.00 H new ATOM 0 HG11 VAL A 506 7.298 -10.324 -1.853 1.00 0.00 H new ATOM 0 HG12 VAL A 506 8.793 -9.504 -1.343 1.00 0.00 H new ATOM 0 HG13 VAL A 506 7.741 -10.273 -0.131 1.00 0.00 H new ATOM 0 HG21 VAL A 506 5.130 -9.416 -1.364 1.00 0.00 H new ATOM 0 HG22 VAL A 506 5.464 -9.241 0.375 1.00 0.00 H new ATOM 0 HG23 VAL A 506 4.931 -7.833 -0.575 1.00 0.00 H new ATOM 1302 N GLY A 507 9.798 -6.787 -0.555 1.00 0.00 N ATOM 1303 CA GLY A 507 11.260 -6.743 -0.524 1.00 0.00 C ATOM 1304 C GLY A 507 11.817 -5.890 0.626 1.00 0.00 C ATOM 1305 O GLY A 507 12.697 -6.344 1.360 1.00 0.00 O ATOM 0 H GLY A 507 9.384 -6.177 -1.260 1.00 0.00 H new ATOM 0 HA2 GLY A 507 11.646 -7.759 -0.434 1.00 0.00 H new ATOM 0 HA3 GLY A 507 11.625 -6.346 -1.471 1.00 0.00 H new ATOM 1309 N LYS A 508 11.278 -4.680 0.833 1.00 0.00 N ATOM 1310 CA LYS A 508 11.747 -3.713 1.852 1.00 0.00 C ATOM 1311 C LYS A 508 11.382 -4.092 3.298 1.00 0.00 C ATOM 1312 O LYS A 508 12.079 -3.681 4.228 1.00 0.00 O ATOM 1313 CB LYS A 508 11.203 -2.317 1.515 1.00 0.00 C ATOM 1314 CG LYS A 508 11.761 -1.774 0.184 1.00 0.00 C ATOM 1315 CD LYS A 508 11.048 -0.475 -0.204 1.00 0.00 C ATOM 1316 CE LYS A 508 11.268 -0.149 -1.686 1.00 0.00 C ATOM 1317 NZ LYS A 508 10.480 1.040 -2.092 1.00 0.00 N ATOM 0 H LYS A 508 10.488 -4.333 0.289 1.00 0.00 H new ATOM 0 HA LYS A 508 12.836 -3.725 1.813 1.00 0.00 H new ATOM 0 HB2 LYS A 508 10.115 -2.358 1.460 1.00 0.00 H new ATOM 0 HB3 LYS A 508 11.456 -1.627 2.320 1.00 0.00 H new ATOM 0 HG2 LYS A 508 12.832 -1.594 0.278 1.00 0.00 H new ATOM 0 HG3 LYS A 508 11.630 -2.517 -0.603 1.00 0.00 H new ATOM 0 HD2 LYS A 508 9.981 -0.568 -0.003 1.00 0.00 H new ATOM 0 HD3 LYS A 508 11.418 0.345 0.411 1.00 0.00 H new ATOM 0 HE2 LYS A 508 12.327 0.033 -1.869 1.00 0.00 H new ATOM 0 HE3 LYS A 508 10.982 -1.005 -2.297 1.00 0.00 H new ATOM 0 HZ1 LYS A 508 10.310 1.010 -3.118 1.00 0.00 H new ATOM 0 HZ2 LYS A 508 9.569 1.041 -1.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 508 11.008 1.904 -1.854 1.00 0.00 H new ATOM 1331 N LYS A 509 10.326 -4.892 3.498 1.00 0.00 N ATOM 1332 CA LYS A 509 9.876 -5.448 4.793 1.00 0.00 C ATOM 1333 C LYS A 509 10.941 -6.302 5.496 1.00 0.00 C ATOM 1334 O LYS A 509 10.971 -6.366 6.726 1.00 0.00 O ATOM 1335 CB LYS A 509 8.571 -6.233 4.528 1.00 0.00 C ATOM 1336 CG LYS A 509 7.931 -6.935 5.738 1.00 0.00 C ATOM 1337 CD LYS A 509 8.392 -8.393 5.927 1.00 0.00 C ATOM 1338 CE LYS A 509 7.699 -9.072 7.116 1.00 0.00 C ATOM 1339 NZ LYS A 509 8.131 -8.506 8.422 1.00 0.00 N ATOM 0 H LYS A 509 9.729 -5.187 2.726 1.00 0.00 H new ATOM 0 HA LYS A 509 9.694 -4.632 5.492 1.00 0.00 H new ATOM 0 HB2 LYS A 509 7.839 -5.544 4.107 1.00 0.00 H new ATOM 0 HB3 LYS A 509 8.775 -6.986 3.766 1.00 0.00 H new ATOM 0 HG2 LYS A 509 8.166 -6.370 6.640 1.00 0.00 H new ATOM 0 HG3 LYS A 509 6.847 -6.918 5.624 1.00 0.00 H new ATOM 0 HD2 LYS A 509 8.186 -8.958 5.018 1.00 0.00 H new ATOM 0 HD3 LYS A 509 9.471 -8.414 6.078 1.00 0.00 H new ATOM 0 HE2 LYS A 509 6.619 -8.962 7.015 1.00 0.00 H new ATOM 0 HE3 LYS A 509 7.914 -10.140 7.097 1.00 0.00 H new ATOM 0 HZ1 LYS A 509 7.649 -9.008 9.195 1.00 0.00 H new ATOM 0 HZ2 LYS A 509 9.160 -8.618 8.526 1.00 0.00 H new ATOM 0 HZ3 LYS A 509 7.887 -7.496 8.460 1.00 0.00 H new ATOM 1353 N GLN A 510 11.801 -6.964 4.723 1.00 0.00 N ATOM 1354 CA GLN A 510 12.846 -7.876 5.198 1.00 0.00 C ATOM 1355 C GLN A 510 13.988 -7.097 5.886 1.00 0.00 C ATOM 1356 O GLN A 510 14.841 -6.502 5.218 1.00 0.00 O ATOM 1357 CB GLN A 510 13.344 -8.725 4.014 1.00 0.00 C ATOM 1358 CG GLN A 510 12.229 -9.621 3.439 1.00 0.00 C ATOM 1359 CD GLN A 510 12.642 -10.316 2.142 1.00 0.00 C ATOM 1360 OE1 GLN A 510 13.654 -11.003 2.057 1.00 0.00 O ATOM 1361 NE2 GLN A 510 11.873 -10.175 1.081 1.00 0.00 N ATOM 0 H GLN A 510 11.790 -6.877 3.707 1.00 0.00 H new ATOM 0 HA GLN A 510 12.437 -8.547 5.953 1.00 0.00 H new ATOM 0 HB2 GLN A 510 13.722 -8.068 3.230 1.00 0.00 H new ATOM 0 HB3 GLN A 510 14.178 -9.347 4.339 1.00 0.00 H new ATOM 0 HG2 GLN A 510 11.955 -10.373 4.179 1.00 0.00 H new ATOM 0 HG3 GLN A 510 11.341 -9.016 3.256 1.00 0.00 H new ATOM 0 HE21 GLN A 510 11.028 -9.607 1.136 1.00 0.00 H new ATOM 0 HE22 GLN A 510 12.123 -10.634 0.205 1.00 0.00 H new ATOM 1370 N LYS A 511 13.985 -7.079 7.228 1.00 0.00 N ATOM 1371 CA LYS A 511 14.886 -6.281 8.086 1.00 0.00 C ATOM 1372 C LYS A 511 15.353 -7.055 9.328 1.00 0.00 C ATOM 1373 O LYS A 511 14.716 -8.024 9.750 1.00 0.00 O ATOM 1374 CB LYS A 511 14.161 -4.992 8.536 1.00 0.00 C ATOM 1375 CG LYS A 511 13.875 -4.005 7.394 1.00 0.00 C ATOM 1376 CD LYS A 511 13.252 -2.717 7.946 1.00 0.00 C ATOM 1377 CE LYS A 511 13.006 -1.713 6.816 1.00 0.00 C ATOM 1378 NZ LYS A 511 12.442 -0.444 7.340 1.00 0.00 N ATOM 0 H LYS A 511 13.330 -7.642 7.771 1.00 0.00 H new ATOM 0 HA LYS A 511 15.769 -6.042 7.494 1.00 0.00 H new ATOM 0 HB2 LYS A 511 13.219 -5.264 9.012 1.00 0.00 H new ATOM 0 HB3 LYS A 511 14.767 -4.492 9.292 1.00 0.00 H new ATOM 0 HG2 LYS A 511 14.799 -3.772 6.866 1.00 0.00 H new ATOM 0 HG3 LYS A 511 13.200 -4.462 6.670 1.00 0.00 H new ATOM 0 HD2 LYS A 511 12.312 -2.947 8.447 1.00 0.00 H new ATOM 0 HD3 LYS A 511 13.913 -2.278 8.693 1.00 0.00 H new ATOM 0 HE2 LYS A 511 13.942 -1.511 6.295 1.00 0.00 H new ATOM 0 HE3 LYS A 511 12.322 -2.144 6.085 1.00 0.00 H new ATOM 0 HZ1 LYS A 511 12.428 0.268 6.582 1.00 0.00 H new ATOM 0 HZ2 LYS A 511 11.473 -0.609 7.679 1.00 0.00 H new ATOM 0 HZ3 LYS A 511 13.030 -0.101 8.126 1.00 0.00 H new ATOM 1392 N GLY A 512 16.434 -6.567 9.942 1.00 0.00 N ATOM 1393 CA GLY A 512 17.000 -7.068 11.209 1.00 0.00 C ATOM 1394 C GLY A 512 17.595 -5.987 12.127 1.00 0.00 C ATOM 1395 O GLY A 512 18.131 -6.317 13.188 1.00 0.00 O ATOM 0 H GLY A 512 16.963 -5.783 9.561 1.00 0.00 H new ATOM 0 HA2 GLY A 512 16.219 -7.597 11.755 1.00 0.00 H new ATOM 0 HA3 GLY A 512 17.777 -7.797 10.979 1.00 0.00 H new ATOM 1399 N LYS A 513 17.495 -4.700 11.753 1.00 0.00 N ATOM 1400 CA LYS A 513 18.159 -3.549 12.413 1.00 0.00 C ATOM 1401 C LYS A 513 17.178 -2.536 13.037 1.00 0.00 C ATOM 1402 O LYS A 513 17.593 -1.667 13.805 1.00 0.00 O ATOM 1403 CB LYS A 513 19.096 -2.905 11.366 1.00 0.00 C ATOM 1404 CG LYS A 513 20.102 -1.856 11.874 1.00 0.00 C ATOM 1405 CD LYS A 513 21.094 -2.409 12.907 1.00 0.00 C ATOM 1406 CE LYS A 513 22.154 -1.347 13.225 1.00 0.00 C ATOM 1407 NZ LYS A 513 23.164 -1.859 14.185 1.00 0.00 N ATOM 0 H LYS A 513 16.929 -4.416 10.953 1.00 0.00 H new ATOM 0 HA LYS A 513 18.730 -3.905 13.271 1.00 0.00 H new ATOM 0 HB2 LYS A 513 19.657 -3.702 10.878 1.00 0.00 H new ATOM 0 HB3 LYS A 513 18.477 -2.437 10.601 1.00 0.00 H new ATOM 0 HG2 LYS A 513 20.658 -1.457 11.026 1.00 0.00 H new ATOM 0 HG3 LYS A 513 19.555 -1.024 12.317 1.00 0.00 H new ATOM 0 HD2 LYS A 513 20.566 -2.693 13.817 1.00 0.00 H new ATOM 0 HD3 LYS A 513 21.572 -3.310 12.521 1.00 0.00 H new ATOM 0 HE2 LYS A 513 22.649 -1.038 12.304 1.00 0.00 H new ATOM 0 HE3 LYS A 513 21.671 -0.462 13.640 1.00 0.00 H new ATOM 0 HZ1 LYS A 513 23.866 -1.117 14.379 1.00 0.00 H new ATOM 0 HZ2 LYS A 513 22.694 -2.131 15.072 1.00 0.00 H new ATOM 0 HZ3 LYS A 513 23.641 -2.689 13.778 1.00 0.00 H new ATOM 1421 N GLN A 514 15.879 -2.676 12.756 1.00 0.00 N ATOM 1422 CA GLN A 514 14.791 -1.788 13.210 1.00 0.00 C ATOM 1423 C GLN A 514 13.627 -2.570 13.867 1.00 0.00 C ATOM 1424 O GLN A 514 12.518 -2.052 14.010 1.00 0.00 O ATOM 1425 CB GLN A 514 14.302 -0.934 12.020 1.00 0.00 C ATOM 1426 CG GLN A 514 15.395 -0.028 11.424 1.00 0.00 C ATOM 1427 CD GLN A 514 14.850 0.907 10.344 1.00 0.00 C ATOM 1428 OE1 GLN A 514 14.108 0.518 9.449 1.00 0.00 O ATOM 1429 NE2 GLN A 514 15.189 2.180 10.374 1.00 0.00 N ATOM 0 H GLN A 514 15.536 -3.445 12.180 1.00 0.00 H new ATOM 0 HA GLN A 514 15.184 -1.131 13.986 1.00 0.00 H new ATOM 0 HB2 GLN A 514 13.924 -1.595 11.240 1.00 0.00 H new ATOM 0 HB3 GLN A 514 13.466 -0.315 12.346 1.00 0.00 H new ATOM 0 HG2 GLN A 514 15.846 0.564 12.220 1.00 0.00 H new ATOM 0 HG3 GLN A 514 16.185 -0.647 11.000 1.00 0.00 H new ATOM 0 HE21 GLN A 514 15.805 2.526 11.109 1.00 0.00 H new ATOM 0 HE22 GLN A 514 14.835 2.819 9.662 1.00 0.00 H new ATOM 1438 N VAL A 515 13.873 -3.831 14.256 1.00 0.00 N ATOM 1439 CA VAL A 515 12.853 -4.808 14.705 1.00 0.00 C ATOM 1440 C VAL A 515 13.187 -5.494 16.044 1.00 0.00 C ATOM 1441 O VAL A 515 12.419 -6.334 16.518 1.00 0.00 O ATOM 1442 CB VAL A 515 12.579 -5.859 13.602 1.00 0.00 C ATOM 1443 CG1 VAL A 515 12.006 -5.214 12.333 1.00 0.00 C ATOM 1444 CG2 VAL A 515 13.833 -6.654 13.212 1.00 0.00 C ATOM 0 H VAL A 515 14.817 -4.217 14.269 1.00 0.00 H new ATOM 0 HA VAL A 515 11.947 -4.230 14.887 1.00 0.00 H new ATOM 0 HB VAL A 515 11.849 -6.543 14.035 1.00 0.00 H new ATOM 0 HG11 VAL A 515 11.827 -5.984 11.582 1.00 0.00 H new ATOM 0 HG12 VAL A 515 11.067 -4.714 12.571 1.00 0.00 H new ATOM 0 HG13 VAL A 515 12.716 -4.485 11.943 1.00 0.00 H new ATOM 0 HG21 VAL A 515 13.580 -7.375 12.435 1.00 0.00 H new ATOM 0 HG22 VAL A 515 14.595 -5.971 12.838 1.00 0.00 H new ATOM 0 HG23 VAL A 515 14.216 -7.181 14.086 1.00 0.00 H new ATOM 1454 N LYS A 516 14.309 -5.129 16.684 1.00 0.00 N ATOM 1455 CA LYS A 516 14.738 -5.638 18.007 1.00 0.00 C ATOM 1456 C LYS A 516 13.968 -5.034 19.201 1.00 0.00 C ATOM 1457 O LYS A 516 14.211 -5.425 20.345 1.00 0.00 O ATOM 1458 CB LYS A 516 16.256 -5.425 18.179 1.00 0.00 C ATOM 1459 CG LYS A 516 17.098 -6.291 17.224 1.00 0.00 C ATOM 1460 CD LYS A 516 18.580 -6.249 17.631 1.00 0.00 C ATOM 1461 CE LYS A 516 19.447 -7.233 16.832 1.00 0.00 C ATOM 1462 NZ LYS A 516 19.760 -6.744 15.465 1.00 0.00 N ATOM 0 H LYS A 516 14.964 -4.454 16.290 1.00 0.00 H new ATOM 0 HA LYS A 516 14.500 -6.702 18.017 1.00 0.00 H new ATOM 0 HB2 LYS A 516 16.491 -4.374 18.010 1.00 0.00 H new ATOM 0 HB3 LYS A 516 16.535 -5.653 19.208 1.00 0.00 H new ATOM 0 HG2 LYS A 516 16.738 -7.320 17.242 1.00 0.00 H new ATOM 0 HG3 LYS A 516 16.985 -5.932 16.201 1.00 0.00 H new ATOM 0 HD2 LYS A 516 18.962 -5.238 17.489 1.00 0.00 H new ATOM 0 HD3 LYS A 516 18.666 -6.476 18.694 1.00 0.00 H new ATOM 0 HE2 LYS A 516 20.377 -7.411 17.371 1.00 0.00 H new ATOM 0 HE3 LYS A 516 18.931 -8.191 16.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 516 20.441 -7.387 15.014 1.00 0.00 H new ATOM 0 HZ2 LYS A 516 18.888 -6.712 14.900 1.00 0.00 H new ATOM 0 HZ3 LYS A 516 20.170 -5.790 15.523 1.00 0.00 H new ATOM 1476 N SER A 517 13.050 -4.096 18.957 1.00 0.00 N ATOM 1477 CA SER A 517 12.293 -3.343 19.973 1.00 0.00 C ATOM 1478 C SER A 517 10.825 -3.111 19.570 1.00 0.00 C ATOM 1479 O SER A 517 10.414 -3.423 18.448 1.00 0.00 O ATOM 1480 CB SER A 517 13.004 -2.007 20.249 1.00 0.00 C ATOM 1481 OG SER A 517 13.061 -1.206 19.077 1.00 0.00 O ATOM 0 H SER A 517 12.799 -3.825 18.006 1.00 0.00 H new ATOM 0 HA SER A 517 12.266 -3.942 20.883 1.00 0.00 H new ATOM 0 HB2 SER A 517 12.478 -1.468 21.037 1.00 0.00 H new ATOM 0 HB3 SER A 517 14.014 -2.197 20.613 1.00 0.00 H new ATOM 0 HG SER A 517 13.516 -0.362 19.279 1.00 0.00 H new ATOM 1487 N GLY A 518 10.026 -2.569 20.497 1.00 0.00 N ATOM 1488 CA GLY A 518 8.577 -2.357 20.350 1.00 0.00 C ATOM 1489 C GLY A 518 8.080 -1.106 21.091 1.00 0.00 C ATOM 1490 O GLY A 518 7.359 -1.237 22.085 1.00 0.00 O ATOM 0 H GLY A 518 10.380 -2.255 21.401 1.00 0.00 H new ATOM 0 HA2 GLY A 518 8.333 -2.268 19.291 1.00 0.00 H new ATOM 0 HA3 GLY A 518 8.046 -3.232 20.727 1.00 0.00 H new ATOM 1494 N PRO A 519 8.480 0.112 20.664 1.00 0.00 N ATOM 1495 CA PRO A 519 8.154 1.366 21.356 1.00 0.00 C ATOM 1496 C PRO A 519 6.669 1.778 21.262 1.00 0.00 C ATOM 1497 O PRO A 519 6.214 2.611 22.051 1.00 0.00 O ATOM 1498 CB PRO A 519 9.065 2.419 20.715 1.00 0.00 C ATOM 1499 CG PRO A 519 9.269 1.895 19.294 1.00 0.00 C ATOM 1500 CD PRO A 519 9.306 0.382 19.493 1.00 0.00 C ATOM 0 HA PRO A 519 8.318 1.253 22.428 1.00 0.00 H new ATOM 0 HB2 PRO A 519 8.601 3.406 20.717 1.00 0.00 H new ATOM 0 HB3 PRO A 519 10.011 2.510 21.249 1.00 0.00 H new ATOM 0 HG2 PRO A 519 8.457 2.196 18.632 1.00 0.00 H new ATOM 0 HG3 PRO A 519 10.194 2.268 18.854 1.00 0.00 H new ATOM 0 HD2 PRO A 519 8.921 -0.137 18.615 1.00 0.00 H new ATOM 0 HD3 PRO A 519 10.327 0.033 19.647 1.00 0.00 H new ATOM 1508 N SER A 520 5.909 1.203 20.321 1.00 0.00 N ATOM 1509 CA SER A 520 4.500 1.543 20.039 1.00 0.00 C ATOM 1510 C SER A 520 3.609 0.333 19.690 1.00 0.00 C ATOM 1511 O SER A 520 2.416 0.500 19.419 1.00 0.00 O ATOM 1512 CB SER A 520 4.451 2.583 18.909 1.00 0.00 C ATOM 1513 OG SER A 520 5.077 2.086 17.732 1.00 0.00 O ATOM 0 H SER A 520 6.265 0.465 19.714 1.00 0.00 H new ATOM 0 HA SER A 520 4.087 1.948 20.963 1.00 0.00 H new ATOM 0 HB2 SER A 520 3.414 2.842 18.693 1.00 0.00 H new ATOM 0 HB3 SER A 520 4.948 3.499 19.231 1.00 0.00 H new ATOM 0 HG SER A 520 5.032 2.764 17.026 1.00 0.00 H new ATOM 1519 N SER A 521 4.157 -0.888 19.716 1.00 0.00 N ATOM 1520 CA SER A 521 3.460 -2.146 19.395 1.00 0.00 C ATOM 1521 C SER A 521 4.121 -3.367 20.061 1.00 0.00 C ATOM 1522 O SER A 521 5.263 -3.291 20.534 1.00 0.00 O ATOM 1523 CB SER A 521 3.409 -2.344 17.870 1.00 0.00 C ATOM 1524 OG SER A 521 4.713 -2.431 17.309 1.00 0.00 O ATOM 0 H SER A 521 5.134 -1.036 19.970 1.00 0.00 H new ATOM 0 HA SER A 521 2.448 -2.067 19.792 1.00 0.00 H new ATOM 0 HB2 SER A 521 2.852 -3.252 17.639 1.00 0.00 H new ATOM 0 HB3 SER A 521 2.870 -1.514 17.413 1.00 0.00 H new ATOM 0 HG SER A 521 4.644 -2.558 16.340 1.00 0.00 H new ATOM 1530 N GLY A 522 3.408 -4.500 20.104 1.00 0.00 N ATOM 1531 CA GLY A 522 3.867 -5.766 20.701 1.00 0.00 C ATOM 1532 C GLY A 522 2.826 -6.880 20.603 1.00 0.00 C ATOM 1533 O GLY A 522 2.976 -7.756 19.721 1.00 0.00 O ATOM 1534 OXT GLY A 522 1.864 -6.864 21.402 1.00 0.00 O ATOM 0 H GLY A 522 2.468 -4.565 19.714 1.00 0.00 H new ATOM 0 HA2 GLY A 522 4.782 -6.086 20.203 1.00 0.00 H new ATOM 0 HA3 GLY A 522 4.116 -5.599 21.749 1.00 0.00 H new TER 1538 GLY A 522 HETATM 1539 P 7MG A 523 -8.289 -5.184 10.068 1.00 0.00 P HETATM 1540 OP1 7MG A 523 -8.755 -4.379 8.913 1.00 0.00 O HETATM 1541 OP2 7MG A 523 -7.806 -6.567 9.822 1.00 0.00 O HETATM 1542 O5' 7MG A 523 -7.085 -4.392 10.799 1.00 0.00 O HETATM 1543 C5' 7MG A 523 -7.332 -3.245 11.600 1.00 0.00 C HETATM 1544 C4' 7MG A 523 -6.025 -2.494 11.900 1.00 0.00 C HETATM 1545 O4' 7MG A 523 -5.837 -1.388 11.029 1.00 0.00 O HETATM 1546 C3' 7MG A 523 -5.965 -1.918 13.320 1.00 0.00 C HETATM 1547 O3' 7MG A 523 -5.575 -2.855 14.321 1.00 0.00 O HETATM 1548 C2' 7MG A 523 -4.952 -0.782 13.143 1.00 0.00 C HETATM 1549 O2' 7MG A 523 -3.597 -1.239 13.134 1.00 0.00 O HETATM 1550 C1' 7MG A 523 -5.325 -0.271 11.748 1.00 0.00 C HETATM 1551 N9 7MG A 523 -6.380 0.775 11.764 1.00 0.00 N HETATM 1552 C8 7MG A 523 -7.730 0.606 11.528 1.00 0.00 C HETATM 1553 N7 7MG A 523 -8.330 1.877 11.379 1.00 0.00 N HETATM 1554 C5 7MG A 523 -7.319 2.776 11.577 1.00 0.00 C HETATM 1555 C6 7MG A 523 -7.331 4.182 11.506 1.00 0.00 C HETATM 1556 O6 7MG A 523 -8.270 4.921 11.252 1.00 0.00 O HETATM 1557 N1 7MG A 523 -6.128 4.746 11.733 1.00 0.00 N HETATM 1558 C2 7MG A 523 -5.061 4.047 12.057 1.00 0.00 C HETATM 1559 N2 7MG A 523 -4.075 4.740 12.483 1.00 0.00 N HETATM 1560 N3 7MG A 523 -4.974 2.740 12.151 1.00 0.00 N HETATM 1561 C4 7MG A 523 -6.147 2.137 11.851 1.00 0.00 C HETATM 1562 CM7 7MG A 523 -9.784 2.008 11.039 1.00 0.00 C HETATM 0 HO3' 7MG A 523 -5.559 -2.412 15.195 1.00 0.00 H new HETATM 0 HO2' 7MG A 523 -3.548 -2.127 13.547 1.00 0.00 H new HETATM 0 HN22 7MG A 523 -3.208 4.278 12.757 1.00 0.00 H new HETATM 0 HN21 7MG A 523 -4.156 5.755 12.549 1.00 0.00 H new HETATM 0 HM73 7MG A 523 -9.979 1.522 10.083 1.00 0.00 H new HETATM 0 HM72 7MG A 523 -10.384 1.534 11.816 1.00 0.00 H new HETATM 0 HM71 7MG A 523 -10.048 3.063 10.970 1.00 0.00 H new HETATM 0 H5'' 7MG A 523 -8.028 -2.581 11.087 1.00 0.00 H new HETATM 0 HN1 7MG A 523 -6.041 5.759 11.650 1.00 0.00 H new HETATM 0 H82 7MG A 523 -7.884 0.009 10.629 1.00 0.00 H new HETATM 0 H81 7MG A 523 -8.192 0.065 12.354 1.00 0.00 H new HETATM 0 H5' 7MG A 523 -7.807 -3.544 12.534 1.00 0.00 H new HETATM 0 H4' 7MG A 523 -5.253 -3.251 11.766 1.00 0.00 H new HETATM 0 H3' 7MG A 523 -6.940 -1.601 13.689 1.00 0.00 H new HETATM 0 H2' 7MG A 523 -4.995 -0.050 13.950 1.00 0.00 H new HETATM 0 H1' 7MG A 523 -4.437 0.174 11.300 1.00 0.00 H new HETATM 1578 PB GDP A 524 -10.874 -4.783 11.212 1.00 0.00 P HETATM 1579 O1B GDP A 524 -11.677 -5.716 10.377 1.00 0.00 O HETATM 1580 O2B GDP A 524 -10.881 -3.323 10.944 1.00 0.00 O HETATM 1581 O3B GDP A 524 -9.403 -5.286 11.157 1.00 0.00 O HETATM 1582 O3A GDP A 524 -11.136 -5.045 12.705 1.00 0.00 O HETATM 1583 PA GDP A 524 -12.511 -4.853 13.381 1.00 0.00 P HETATM 1584 O1A GDP A 524 -12.906 -6.145 14.011 1.00 0.00 O HETATM 1585 O2A GDP A 524 -13.514 -4.156 12.528 1.00 0.00 O HETATM 1586 O5' GDP A 524 -12.185 -3.861 14.616 1.00 0.00 O HETATM 1587 C5' GDP A 524 -11.541 -2.607 14.412 1.00 0.00 C HETATM 1588 C4' GDP A 524 -10.072 -2.661 14.865 1.00 0.00 C HETATM 1589 O4' GDP A 524 -9.391 -1.494 14.399 1.00 0.00 O HETATM 1590 C3' GDP A 524 -9.957 -2.685 16.400 1.00 0.00 C HETATM 1591 O3' GDP A 524 -8.818 -3.446 16.805 1.00 0.00 O HETATM 1592 C2' GDP A 524 -9.786 -1.191 16.707 1.00 0.00 C HETATM 1593 O2' GDP A 524 -9.185 -0.935 17.977 1.00 0.00 O HETATM 1594 C1' GDP A 524 -8.909 -0.772 15.525 1.00 0.00 C HETATM 1595 N9 GDP A 524 -8.922 0.686 15.264 1.00 0.00 N HETATM 1596 C8 GDP A 524 -9.979 1.500 14.938 1.00 0.00 C HETATM 1597 N7 GDP A 524 -9.657 2.757 14.763 1.00 0.00 N HETATM 1598 C5 GDP A 524 -8.275 2.783 15.006 1.00 0.00 C HETATM 1599 C6 GDP A 524 -7.311 3.857 14.977 1.00 0.00 C HETATM 1600 O6 GDP A 524 -7.483 5.052 14.731 1.00 0.00 O HETATM 1601 N1 GDP A 524 -6.018 3.446 15.247 1.00 0.00 N HETATM 1602 C2 GDP A 524 -5.688 2.170 15.561 1.00 0.00 C HETATM 1603 N2 GDP A 524 -4.426 1.904 15.751 1.00 0.00 N HETATM 1604 N3 GDP A 524 -6.545 1.152 15.619 1.00 0.00 N HETATM 1605 C4 GDP A 524 -7.827 1.518 15.322 1.00 0.00 C HETATM 0 HO3' GDP A 524 -8.307 -2.941 17.471 1.00 0.00 H new HETATM 0 HO2' GDP A 524 -9.103 0.032 18.111 1.00 0.00 H new HETATM 0 HN22 GDP A 524 -4.135 0.956 15.989 1.00 0.00 H new HETATM 0 HN21 GDP A 524 -3.730 2.644 15.662 1.00 0.00 H new HETATM 0 H5'' GDP A 524 -11.590 -2.336 13.357 1.00 0.00 H new HETATM 0 HN1 GDP A 524 -5.273 4.141 15.208 1.00 0.00 H new HETATM 0 H8 GDP A 524 -10.999 1.131 14.834 1.00 0.00 H new HETATM 0 H5' GDP A 524 -12.068 -1.830 14.966 1.00 0.00 H new HETATM 0 H4' GDP A 524 -9.633 -3.571 14.455 1.00 0.00 H new HETATM 0 H3' GDP A 524 -10.798 -3.145 16.918 1.00 0.00 H new HETATM 0 H2' GDP A 524 -10.722 -0.639 16.795 1.00 0.00 H new HETATM 0 H1' GDP A 524 -7.867 -1.001 15.747 1.00 0.00 H new