USER MOD reduce.3.24.130724 H: found=0, std=0, add=689, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 689 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj-H: A 455 HIS HE2 : A 455 HIS NE2 : A 622 ZNZN :(H bumps) USER MOD NoAdj-H: A 479 HIS HE2 : A 479 HIS NE2 : A 822 ZNZN :(H bumps) USER MOD Set 1.1: A 483 THR OG1 : rot 180:sc= 0.776 USER MOD Set 1.2: A 486 THR OG1 : rot -71:sc= 1.51 USER MOD Single : A 423 SER OG : rot 180:sc= 0 USER MOD Single : A 424 SER OG : rot 180:sc= 0 USER MOD Single : A 426 SER OG : rot 180:sc= 0 USER MOD Single : A 427 SER OG : rot 180:sc= 0.0024 USER MOD Single : A 432 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 433 LYS NZ :NH3+ 165:sc= -0.01 (180deg=-0.185) USER MOD Single : A 438 LYS NZ :NH3+ 159:sc= -0.0761 (180deg=-0.394) USER MOD Single : A 440 TYR OH : rot -144:sc= 0.114 USER MOD Single : A 442 THR OG1 : rot -10:sc= 0.203 USER MOD Single : A 450 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 453 TYR OH : rot 180:sc= 0 USER MOD Single : A 454 MET CE :methyl -179:sc= -0.158 (180deg=-0.16) USER MOD Single : A 461 LYS NZ :NH3+ 143:sc= -0.294 (180deg=-1.65!) USER MOD Single : A 463 TYR OH : rot 180:sc= 0 USER MOD Single : A 464 HIS : no HD1:sc= -2.94! C(o=-2.9!,f=-2.7!) USER MOD Single : A 465 THR OG1 : rot -38:sc= 0.128 USER MOD Single : A 466 THR OG1 : rot 180:sc= 0 USER MOD Single : A 468 ASN : amide:sc= -0.062 K(o=-0.062,f=-1.5!) USER MOD Single : A 471 ASN : amide:sc= -0.27 X(o=-0.27,f=-0.75) USER MOD Single : A 476 MET CE :methyl 180:sc= -2.2 (180deg=-2.2) USER MOD Single : A 478 SER OG : rot 167:sc= -0.41 USER MOD Single : A 492 LYS NZ :NH3+ -177:sc= -0.655 (180deg=-0.723) USER MOD Single : A 493 MET CE :methyl -126:sc= 0 (180deg=-0.0656) USER MOD Single : A 506 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 512 LYS NZ :NH3+ -163:sc= -0.249 (180deg=-0.737) USER MOD Single : A 513 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 514 SER OG : rot 180:sc= 0 USER MOD Single : A 517 SER OG : rot 180:sc= 0 USER MOD Single : A 518 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 422 32.318 -17.127 -3.385 1.00 0.00 N ATOM 2 CA GLY A 422 32.647 -18.540 -3.348 1.00 0.00 C ATOM 3 C GLY A 422 31.423 -19.424 -3.483 1.00 0.00 C ATOM 4 O GLY A 422 30.904 -19.614 -4.583 1.00 0.00 O ATOM 0 HA2 GLY A 422 33.347 -18.768 -4.152 1.00 0.00 H new ATOM 0 HA3 GLY A 422 33.154 -18.767 -2.410 1.00 0.00 H new ATOM 8 N SER A 423 30.962 -19.969 -2.361 1.00 0.00 N ATOM 9 CA SER A 423 29.795 -20.843 -2.359 1.00 0.00 C ATOM 10 C SER A 423 28.638 -20.206 -3.124 1.00 0.00 C ATOM 11 O SER A 423 27.954 -20.870 -3.902 1.00 0.00 O ATOM 12 CB SER A 423 29.364 -21.151 -0.924 1.00 0.00 C ATOM 13 OG SER A 423 28.204 -21.965 -0.903 1.00 0.00 O ATOM 0 H SER A 423 31.379 -19.820 -1.442 1.00 0.00 H new ATOM 0 HA SER A 423 30.068 -21.774 -2.856 1.00 0.00 H new ATOM 0 HB2 SER A 423 30.175 -21.655 -0.398 1.00 0.00 H new ATOM 0 HB3 SER A 423 29.168 -20.220 -0.392 1.00 0.00 H new ATOM 0 HG SER A 423 27.950 -22.149 0.026 1.00 0.00 H new ATOM 19 N SER A 424 28.426 -18.914 -2.895 1.00 0.00 N ATOM 20 CA SER A 424 27.350 -18.187 -3.558 1.00 0.00 C ATOM 21 C SER A 424 27.727 -17.852 -4.998 1.00 0.00 C ATOM 22 O SER A 424 28.906 -17.753 -5.335 1.00 0.00 O ATOM 23 CB SER A 424 27.027 -16.902 -2.792 1.00 0.00 C ATOM 24 OG SER A 424 26.545 -17.192 -1.491 1.00 0.00 O ATOM 0 H SER A 424 28.985 -18.349 -2.255 1.00 0.00 H new ATOM 0 HA SER A 424 26.467 -18.826 -3.571 1.00 0.00 H new ATOM 0 HB2 SER A 424 27.921 -16.282 -2.722 1.00 0.00 H new ATOM 0 HB3 SER A 424 26.281 -16.326 -3.340 1.00 0.00 H new ATOM 0 HG SER A 424 26.347 -16.355 -1.021 1.00 0.00 H new ATOM 30 N GLY A 425 26.716 -17.680 -5.843 1.00 0.00 N ATOM 31 CA GLY A 425 26.961 -17.359 -7.237 1.00 0.00 C ATOM 32 C GLY A 425 26.361 -18.382 -8.182 1.00 0.00 C ATOM 33 O GLY A 425 27.052 -19.291 -8.643 1.00 0.00 O ATOM 0 H GLY A 425 25.732 -17.757 -5.588 1.00 0.00 H new ATOM 0 HA2 GLY A 425 26.545 -16.376 -7.459 1.00 0.00 H new ATOM 0 HA3 GLY A 425 28.036 -17.297 -7.409 1.00 0.00 H new ATOM 37 N SER A 426 25.072 -18.236 -8.470 1.00 0.00 N ATOM 38 CA SER A 426 24.378 -19.158 -9.361 1.00 0.00 C ATOM 39 C SER A 426 23.538 -18.398 -10.382 1.00 0.00 C ATOM 40 O SER A 426 22.930 -17.375 -10.065 1.00 0.00 O ATOM 41 CB SER A 426 23.488 -20.106 -8.556 1.00 0.00 C ATOM 42 OG SER A 426 24.249 -21.149 -7.972 1.00 0.00 O ATOM 0 H SER A 426 24.487 -17.488 -8.099 1.00 0.00 H new ATOM 0 HA SER A 426 25.128 -19.741 -9.895 1.00 0.00 H new ATOM 0 HB2 SER A 426 22.970 -19.549 -7.775 1.00 0.00 H new ATOM 0 HB3 SER A 426 22.722 -20.530 -9.206 1.00 0.00 H new ATOM 0 HG SER A 426 23.657 -21.740 -7.462 1.00 0.00 H new ATOM 48 N SER A 427 23.509 -18.905 -11.611 1.00 0.00 N ATOM 49 CA SER A 427 22.746 -18.272 -12.681 1.00 0.00 C ATOM 50 C SER A 427 21.365 -18.906 -12.812 1.00 0.00 C ATOM 51 O SER A 427 21.224 -20.128 -12.774 1.00 0.00 O ATOM 52 CB SER A 427 23.500 -18.385 -14.008 1.00 0.00 C ATOM 53 OG SER A 427 23.887 -19.724 -14.262 1.00 0.00 O ATOM 0 H SER A 427 24.005 -19.752 -11.890 1.00 0.00 H new ATOM 0 HA SER A 427 22.620 -17.219 -12.431 1.00 0.00 H new ATOM 0 HB2 SER A 427 22.869 -18.025 -14.820 1.00 0.00 H new ATOM 0 HB3 SER A 427 24.383 -17.746 -13.984 1.00 0.00 H new ATOM 0 HG SER A 427 24.365 -19.770 -15.116 1.00 0.00 H new ATOM 59 N GLY A 428 20.347 -18.065 -12.966 1.00 0.00 N ATOM 60 CA GLY A 428 18.989 -18.561 -13.100 1.00 0.00 C ATOM 61 C GLY A 428 17.955 -17.459 -12.979 1.00 0.00 C ATOM 62 O GLY A 428 17.228 -17.388 -11.990 1.00 0.00 O ATOM 0 H GLY A 428 20.438 -17.050 -13.000 1.00 0.00 H new ATOM 0 HA2 GLY A 428 18.879 -19.054 -14.066 1.00 0.00 H new ATOM 0 HA3 GLY A 428 18.804 -19.315 -12.335 1.00 0.00 H new ATOM 66 N GLU A 429 17.892 -16.596 -13.989 1.00 0.00 N ATOM 67 CA GLU A 429 16.940 -15.491 -13.989 1.00 0.00 C ATOM 68 C GLU A 429 15.588 -15.936 -14.539 1.00 0.00 C ATOM 69 O GLU A 429 15.473 -16.311 -15.706 1.00 0.00 O ATOM 70 CB GLU A 429 17.481 -14.323 -14.818 1.00 0.00 C ATOM 71 CG GLU A 429 18.605 -13.562 -14.136 1.00 0.00 C ATOM 72 CD GLU A 429 19.831 -14.422 -13.896 1.00 0.00 C ATOM 73 OE1 GLU A 429 20.161 -15.242 -14.778 1.00 0.00 O ATOM 74 OE2 GLU A 429 20.459 -14.276 -12.827 1.00 0.00 O ATOM 0 H GLU A 429 18.488 -16.641 -14.816 1.00 0.00 H new ATOM 0 HA GLU A 429 16.803 -15.164 -12.958 1.00 0.00 H new ATOM 0 HB2 GLU A 429 17.839 -14.703 -15.775 1.00 0.00 H new ATOM 0 HB3 GLU A 429 16.665 -13.633 -15.034 1.00 0.00 H new ATOM 0 HG2 GLU A 429 18.882 -12.704 -14.749 1.00 0.00 H new ATOM 0 HG3 GLU A 429 18.248 -13.171 -13.183 1.00 0.00 H new ATOM 81 N LEU A 430 14.568 -15.893 -13.690 1.00 0.00 N ATOM 82 CA LEU A 430 13.223 -16.292 -14.089 1.00 0.00 C ATOM 83 C LEU A 430 12.523 -15.168 -14.846 1.00 0.00 C ATOM 84 O LEU A 430 12.846 -13.989 -14.694 1.00 0.00 O ATOM 85 CB LEU A 430 12.400 -16.685 -12.861 1.00 0.00 C ATOM 86 CG LEU A 430 12.678 -18.073 -12.283 1.00 0.00 C ATOM 87 CD1 LEU A 430 12.207 -19.155 -13.243 1.00 0.00 C ATOM 88 CD2 LEU A 430 14.159 -18.237 -11.977 1.00 0.00 C ATOM 0 H LEU A 430 14.646 -15.586 -12.721 1.00 0.00 H new ATOM 0 HA LEU A 430 13.309 -17.153 -14.752 1.00 0.00 H new ATOM 0 HB2 LEU A 430 12.575 -15.946 -12.079 1.00 0.00 H new ATOM 0 HB3 LEU A 430 11.343 -16.627 -13.123 1.00 0.00 H new ATOM 0 HG LEU A 430 12.122 -18.175 -11.351 1.00 0.00 H new ATOM 0 HD11 LEU A 430 12.413 -20.136 -12.815 1.00 0.00 H new ATOM 0 HD12 LEU A 430 11.135 -19.050 -13.412 1.00 0.00 H new ATOM 0 HD13 LEU A 430 12.735 -19.055 -14.191 1.00 0.00 H new ATOM 0 HD21 LEU A 430 14.338 -19.231 -11.566 1.00 0.00 H new ATOM 0 HD22 LEU A 430 14.736 -18.114 -12.894 1.00 0.00 H new ATOM 0 HD23 LEU A 430 14.466 -17.484 -11.251 1.00 0.00 H new ATOM 100 N PRO A 431 11.538 -15.538 -15.678 1.00 0.00 N ATOM 101 CA PRO A 431 10.770 -14.575 -16.473 1.00 0.00 C ATOM 102 C PRO A 431 9.851 -13.714 -15.611 1.00 0.00 C ATOM 103 O PRO A 431 9.085 -12.899 -16.125 1.00 0.00 O ATOM 104 CB PRO A 431 9.947 -15.463 -17.409 1.00 0.00 C ATOM 105 CG PRO A 431 9.824 -16.761 -16.688 1.00 0.00 C ATOM 106 CD PRO A 431 11.099 -16.924 -15.907 1.00 0.00 C ATOM 0 HA PRO A 431 11.417 -13.869 -16.993 1.00 0.00 H new ATOM 0 HB2 PRO A 431 8.968 -15.027 -17.609 1.00 0.00 H new ATOM 0 HB3 PRO A 431 10.442 -15.590 -18.372 1.00 0.00 H new ATOM 0 HG2 PRO A 431 8.958 -16.759 -16.026 1.00 0.00 H new ATOM 0 HG3 PRO A 431 9.687 -17.585 -17.388 1.00 0.00 H new ATOM 0 HD2 PRO A 431 10.931 -17.452 -14.969 1.00 0.00 H new ATOM 0 HD3 PRO A 431 11.842 -17.494 -16.465 1.00 0.00 H new ATOM 114 N LYS A 432 9.934 -13.901 -14.298 1.00 0.00 N ATOM 115 CA LYS A 432 9.112 -13.141 -13.364 1.00 0.00 C ATOM 116 C LYS A 432 9.773 -11.812 -13.013 1.00 0.00 C ATOM 117 O LYS A 432 10.831 -11.473 -13.545 1.00 0.00 O ATOM 118 CB LYS A 432 8.867 -13.953 -12.090 1.00 0.00 C ATOM 119 CG LYS A 432 7.848 -15.066 -12.264 1.00 0.00 C ATOM 120 CD LYS A 432 7.149 -15.392 -10.955 1.00 0.00 C ATOM 121 CE LYS A 432 6.105 -16.482 -11.138 1.00 0.00 C ATOM 122 NZ LYS A 432 4.859 -15.958 -11.762 1.00 0.00 N ATOM 0 H LYS A 432 10.562 -14.572 -13.857 1.00 0.00 H new ATOM 0 HA LYS A 432 8.156 -12.935 -13.846 1.00 0.00 H new ATOM 0 HB2 LYS A 432 9.811 -14.385 -11.757 1.00 0.00 H new ATOM 0 HB3 LYS A 432 8.528 -13.282 -11.301 1.00 0.00 H new ATOM 0 HG2 LYS A 432 7.109 -14.770 -13.008 1.00 0.00 H new ATOM 0 HG3 LYS A 432 8.344 -15.959 -12.645 1.00 0.00 H new ATOM 0 HD2 LYS A 432 7.885 -15.712 -10.218 1.00 0.00 H new ATOM 0 HD3 LYS A 432 6.674 -14.494 -10.561 1.00 0.00 H new ATOM 0 HE2 LYS A 432 6.516 -17.277 -11.760 1.00 0.00 H new ATOM 0 HE3 LYS A 432 5.868 -16.924 -10.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 432 4.173 -16.732 -11.870 1.00 0.00 H new ATOM 0 HZ2 LYS A 432 4.453 -15.217 -11.156 1.00 0.00 H new ATOM 0 HZ3 LYS A 432 5.080 -15.559 -12.697 1.00 0.00 H new ATOM 136 N LYS A 433 9.145 -11.063 -12.114 1.00 0.00 N ATOM 137 CA LYS A 433 9.673 -9.772 -11.689 1.00 0.00 C ATOM 138 C LYS A 433 9.398 -9.532 -10.208 1.00 0.00 C ATOM 139 O LYS A 433 8.297 -9.789 -9.722 1.00 0.00 O ATOM 140 CB LYS A 433 9.057 -8.646 -12.522 1.00 0.00 C ATOM 141 CG LYS A 433 9.628 -8.545 -13.926 1.00 0.00 C ATOM 142 CD LYS A 433 9.101 -7.320 -14.655 1.00 0.00 C ATOM 143 CE LYS A 433 9.431 -7.370 -16.139 1.00 0.00 C ATOM 144 NZ LYS A 433 8.638 -8.412 -16.848 1.00 0.00 N ATOM 0 H LYS A 433 8.268 -11.328 -11.665 1.00 0.00 H new ATOM 0 HA LYS A 433 10.752 -9.781 -11.843 1.00 0.00 H new ATOM 0 HB2 LYS A 433 7.980 -8.801 -12.587 1.00 0.00 H new ATOM 0 HB3 LYS A 433 9.212 -7.698 -12.007 1.00 0.00 H new ATOM 0 HG2 LYS A 433 10.716 -8.499 -13.875 1.00 0.00 H new ATOM 0 HG3 LYS A 433 9.373 -9.443 -14.489 1.00 0.00 H new ATOM 0 HD2 LYS A 433 8.021 -7.253 -14.523 1.00 0.00 H new ATOM 0 HD3 LYS A 433 9.532 -6.420 -14.215 1.00 0.00 H new ATOM 0 HE2 LYS A 433 9.235 -6.396 -16.588 1.00 0.00 H new ATOM 0 HE3 LYS A 433 10.494 -7.572 -16.268 1.00 0.00 H new ATOM 0 HZ1 LYS A 433 8.694 -8.253 -17.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 433 9.020 -9.353 -16.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 433 7.645 -8.360 -16.543 1.00 0.00 H new ATOM 158 N ARG A 434 10.406 -9.037 -9.496 1.00 0.00 N ATOM 159 CA ARG A 434 10.271 -8.762 -8.071 1.00 0.00 C ATOM 160 C ARG A 434 9.811 -7.327 -7.835 1.00 0.00 C ATOM 161 O ARG A 434 10.193 -6.697 -6.849 1.00 0.00 O ATOM 162 CB ARG A 434 11.601 -9.007 -7.355 1.00 0.00 C ATOM 163 CG ARG A 434 12.809 -8.493 -8.122 1.00 0.00 C ATOM 164 CD ARG A 434 12.577 -7.086 -8.649 1.00 0.00 C ATOM 165 NE ARG A 434 13.823 -6.441 -9.055 1.00 0.00 N ATOM 166 CZ ARG A 434 14.643 -5.828 -8.208 1.00 0.00 C ATOM 167 NH1 ARG A 434 14.350 -5.778 -6.916 1.00 0.00 N ATOM 168 NH2 ARG A 434 15.758 -5.264 -8.653 1.00 0.00 N ATOM 0 H ARG A 434 11.324 -8.819 -9.883 1.00 0.00 H new ATOM 0 HA ARG A 434 9.518 -9.438 -7.666 1.00 0.00 H new ATOM 0 HB2 ARG A 434 11.571 -8.527 -6.377 1.00 0.00 H new ATOM 0 HB3 ARG A 434 11.719 -10.077 -7.182 1.00 0.00 H new ATOM 0 HG2 ARG A 434 13.684 -8.499 -7.472 1.00 0.00 H new ATOM 0 HG3 ARG A 434 13.025 -9.163 -8.954 1.00 0.00 H new ATOM 0 HD2 ARG A 434 11.895 -7.125 -9.499 1.00 0.00 H new ATOM 0 HD3 ARG A 434 12.092 -6.486 -7.879 1.00 0.00 H new ATOM 0 HE ARG A 434 14.078 -6.462 -10.043 1.00 0.00 H new ATOM 0 HH11 ARG A 434 13.494 -6.211 -6.570 1.00 0.00 H new ATOM 0 HH12 ARG A 434 14.981 -5.307 -6.268 1.00 0.00 H new ATOM 0 HH21 ARG A 434 15.987 -5.301 -9.646 1.00 0.00 H new ATOM 0 HH22 ARG A 434 16.387 -4.794 -8.002 1.00 0.00 H new ATOM 182 N GLU A 435 8.988 -6.817 -8.746 1.00 0.00 N ATOM 183 CA GLU A 435 8.477 -5.456 -8.637 1.00 0.00 C ATOM 184 C GLU A 435 6.998 -5.458 -8.265 1.00 0.00 C ATOM 185 O GLU A 435 6.237 -6.322 -8.703 1.00 0.00 O ATOM 186 CB GLU A 435 8.682 -4.703 -9.953 1.00 0.00 C ATOM 187 CG GLU A 435 8.439 -3.207 -9.844 1.00 0.00 C ATOM 188 CD GLU A 435 9.607 -2.470 -9.217 1.00 0.00 C ATOM 189 OE1 GLU A 435 10.357 -3.099 -8.442 1.00 0.00 O ATOM 190 OE2 GLU A 435 9.770 -1.266 -9.502 1.00 0.00 O ATOM 0 H GLU A 435 8.661 -7.326 -9.567 1.00 0.00 H new ATOM 0 HA GLU A 435 9.032 -4.950 -7.847 1.00 0.00 H new ATOM 0 HB2 GLU A 435 9.700 -4.872 -10.304 1.00 0.00 H new ATOM 0 HB3 GLU A 435 8.012 -5.117 -10.707 1.00 0.00 H new ATOM 0 HG2 GLU A 435 8.249 -2.800 -10.837 1.00 0.00 H new ATOM 0 HG3 GLU A 435 7.542 -3.031 -9.250 1.00 0.00 H new ATOM 197 N LEU A 436 6.596 -4.485 -7.454 1.00 0.00 N ATOM 198 CA LEU A 436 5.207 -4.374 -7.021 1.00 0.00 C ATOM 199 C LEU A 436 4.297 -4.029 -8.196 1.00 0.00 C ATOM 200 O LEU A 436 4.468 -2.997 -8.845 1.00 0.00 O ATOM 201 CB LEU A 436 5.076 -3.311 -5.930 1.00 0.00 C ATOM 202 CG LEU A 436 3.650 -2.946 -5.516 1.00 0.00 C ATOM 203 CD1 LEU A 436 3.012 -4.088 -4.739 1.00 0.00 C ATOM 204 CD2 LEU A 436 3.644 -1.668 -4.690 1.00 0.00 C ATOM 0 H LEU A 436 7.212 -3.762 -7.083 1.00 0.00 H new ATOM 0 HA LEU A 436 4.899 -5.339 -6.618 1.00 0.00 H new ATOM 0 HB2 LEU A 436 5.612 -3.658 -5.046 1.00 0.00 H new ATOM 0 HB3 LEU A 436 5.577 -2.405 -6.271 1.00 0.00 H new ATOM 0 HG LEU A 436 3.063 -2.774 -6.418 1.00 0.00 H new ATOM 0 HD11 LEU A 436 1.998 -3.811 -4.452 1.00 0.00 H new ATOM 0 HD12 LEU A 436 2.982 -4.981 -5.364 1.00 0.00 H new ATOM 0 HD13 LEU A 436 3.599 -4.292 -3.844 1.00 0.00 H new ATOM 0 HD21 LEU A 436 2.621 -1.424 -4.405 1.00 0.00 H new ATOM 0 HD22 LEU A 436 4.246 -1.812 -3.793 1.00 0.00 H new ATOM 0 HD23 LEU A 436 4.061 -0.852 -5.280 1.00 0.00 H new ATOM 216 N CYS A 437 3.328 -4.899 -8.462 1.00 0.00 N ATOM 217 CA CYS A 437 2.389 -4.686 -9.557 1.00 0.00 C ATOM 218 C CYS A 437 1.627 -3.377 -9.373 1.00 0.00 C ATOM 219 O CYS A 437 1.139 -3.077 -8.284 1.00 0.00 O ATOM 220 CB CYS A 437 1.405 -5.854 -9.646 1.00 0.00 C ATOM 221 SG CYS A 437 0.361 -5.835 -11.139 1.00 0.00 S ATOM 0 H CYS A 437 3.173 -5.758 -7.934 1.00 0.00 H new ATOM 0 HA CYS A 437 2.958 -4.627 -10.485 1.00 0.00 H new ATOM 0 HB2 CYS A 437 1.964 -6.789 -9.619 1.00 0.00 H new ATOM 0 HB3 CYS A 437 0.762 -5.841 -8.766 1.00 0.00 H new ATOM 226 N LYS A 438 1.529 -2.601 -10.447 1.00 0.00 N ATOM 227 CA LYS A 438 0.826 -1.324 -10.407 1.00 0.00 C ATOM 228 C LYS A 438 -0.683 -1.531 -10.495 1.00 0.00 C ATOM 229 O LYS A 438 -1.439 -0.581 -10.699 1.00 0.00 O ATOM 230 CB LYS A 438 1.295 -0.424 -11.552 1.00 0.00 C ATOM 231 CG LYS A 438 2.763 -0.044 -11.464 1.00 0.00 C ATOM 232 CD LYS A 438 3.261 0.562 -12.766 1.00 0.00 C ATOM 233 CE LYS A 438 2.803 2.004 -12.920 1.00 0.00 C ATOM 234 NZ LYS A 438 3.430 2.897 -11.907 1.00 0.00 N ATOM 0 H LYS A 438 1.928 -2.834 -11.356 1.00 0.00 H new ATOM 0 HA LYS A 438 1.055 -0.842 -9.457 1.00 0.00 H new ATOM 0 HB2 LYS A 438 1.116 -0.932 -12.499 1.00 0.00 H new ATOM 0 HB3 LYS A 438 0.693 0.485 -11.559 1.00 0.00 H new ATOM 0 HG2 LYS A 438 2.907 0.668 -10.651 1.00 0.00 H new ATOM 0 HG3 LYS A 438 3.355 -0.927 -11.223 1.00 0.00 H new ATOM 0 HD2 LYS A 438 4.350 0.520 -12.795 1.00 0.00 H new ATOM 0 HD3 LYS A 438 2.896 -0.029 -13.606 1.00 0.00 H new ATOM 0 HE2 LYS A 438 3.051 2.359 -13.920 1.00 0.00 H new ATOM 0 HE3 LYS A 438 1.718 2.052 -12.825 1.00 0.00 H new ATOM 0 HZ1 LYS A 438 3.391 3.881 -12.241 1.00 0.00 H new ATOM 0 HZ2 LYS A 438 2.915 2.816 -11.007 1.00 0.00 H new ATOM 0 HZ3 LYS A 438 4.422 2.618 -11.765 1.00 0.00 H new ATOM 248 N PHE A 439 -1.115 -2.778 -10.340 1.00 0.00 N ATOM 249 CA PHE A 439 -2.534 -3.110 -10.401 1.00 0.00 C ATOM 250 C PHE A 439 -3.016 -3.683 -9.072 1.00 0.00 C ATOM 251 O PHE A 439 -4.102 -3.348 -8.597 1.00 0.00 O ATOM 252 CB PHE A 439 -2.797 -4.112 -11.527 1.00 0.00 C ATOM 253 CG PHE A 439 -2.636 -3.525 -12.901 1.00 0.00 C ATOM 254 CD1 PHE A 439 -3.488 -2.527 -13.346 1.00 0.00 C ATOM 255 CD2 PHE A 439 -1.635 -3.973 -13.747 1.00 0.00 C ATOM 256 CE1 PHE A 439 -3.343 -1.986 -14.610 1.00 0.00 C ATOM 257 CE2 PHE A 439 -1.484 -3.435 -15.011 1.00 0.00 C ATOM 258 CZ PHE A 439 -2.340 -2.441 -15.443 1.00 0.00 C ATOM 0 H PHE A 439 -0.502 -3.576 -10.171 1.00 0.00 H new ATOM 0 HA PHE A 439 -3.088 -2.193 -10.603 1.00 0.00 H new ATOM 0 HB2 PHE A 439 -2.115 -4.956 -11.419 1.00 0.00 H new ATOM 0 HB3 PHE A 439 -3.809 -4.505 -11.424 1.00 0.00 H new ATOM 0 HD1 PHE A 439 -4.274 -2.168 -12.698 1.00 0.00 H new ATOM 0 HD2 PHE A 439 -0.965 -4.752 -13.415 1.00 0.00 H new ATOM 0 HE1 PHE A 439 -4.013 -1.209 -14.946 1.00 0.00 H new ATOM 0 HE2 PHE A 439 -0.698 -3.791 -15.660 1.00 0.00 H new ATOM 0 HZ PHE A 439 -2.225 -2.020 -16.431 1.00 0.00 H new ATOM 268 N TYR A 440 -2.203 -4.548 -8.477 1.00 0.00 N ATOM 269 CA TYR A 440 -2.547 -5.171 -7.205 1.00 0.00 C ATOM 270 C TYR A 440 -2.766 -4.116 -6.124 1.00 0.00 C ATOM 271 O TYR A 440 -3.595 -4.290 -5.230 1.00 0.00 O ATOM 272 CB TYR A 440 -1.445 -6.139 -6.772 1.00 0.00 C ATOM 273 CG TYR A 440 -1.838 -7.025 -5.611 1.00 0.00 C ATOM 274 CD1 TYR A 440 -2.971 -7.827 -5.677 1.00 0.00 C ATOM 275 CD2 TYR A 440 -1.078 -7.058 -4.449 1.00 0.00 C ATOM 276 CE1 TYR A 440 -3.334 -8.637 -4.618 1.00 0.00 C ATOM 277 CE2 TYR A 440 -1.433 -7.866 -3.386 1.00 0.00 C ATOM 278 CZ TYR A 440 -2.562 -8.653 -3.476 1.00 0.00 C ATOM 279 OH TYR A 440 -2.920 -9.458 -2.419 1.00 0.00 O ATOM 0 H TYR A 440 -1.300 -4.834 -8.856 1.00 0.00 H new ATOM 0 HA TYR A 440 -3.475 -5.726 -7.341 1.00 0.00 H new ATOM 0 HB2 TYR A 440 -1.170 -6.766 -7.620 1.00 0.00 H new ATOM 0 HB3 TYR A 440 -0.558 -5.568 -6.498 1.00 0.00 H new ATOM 0 HD1 TYR A 440 -3.578 -7.817 -6.570 1.00 0.00 H new ATOM 0 HD2 TYR A 440 -0.194 -6.441 -4.375 1.00 0.00 H new ATOM 0 HE1 TYR A 440 -4.218 -9.254 -4.685 1.00 0.00 H new ATOM 0 HE2 TYR A 440 -0.830 -7.881 -2.490 1.00 0.00 H new ATOM 0 HH TYR A 440 -2.702 -9.008 -1.576 1.00 0.00 H new ATOM 289 N ILE A 441 -2.016 -3.023 -6.213 1.00 0.00 N ATOM 290 CA ILE A 441 -2.129 -1.939 -5.245 1.00 0.00 C ATOM 291 C ILE A 441 -3.588 -1.641 -4.921 1.00 0.00 C ATOM 292 O ILE A 441 -3.922 -1.260 -3.798 1.00 0.00 O ATOM 293 CB ILE A 441 -1.455 -0.653 -5.759 1.00 0.00 C ATOM 294 CG1 ILE A 441 0.018 -0.915 -6.079 1.00 0.00 C ATOM 295 CG2 ILE A 441 -1.590 0.462 -4.732 1.00 0.00 C ATOM 296 CD1 ILE A 441 0.724 0.275 -6.690 1.00 0.00 C ATOM 0 H ILE A 441 -1.324 -2.865 -6.945 1.00 0.00 H new ATOM 0 HA ILE A 441 -1.619 -2.270 -4.340 1.00 0.00 H new ATOM 0 HB ILE A 441 -1.955 -0.339 -6.675 1.00 0.00 H new ATOM 0 HG12 ILE A 441 0.535 -1.203 -5.164 1.00 0.00 H new ATOM 0 HG13 ILE A 441 0.088 -1.760 -6.764 1.00 0.00 H new ATOM 0 HG21 ILE A 441 -1.109 1.364 -5.109 1.00 0.00 H new ATOM 0 HG22 ILE A 441 -2.646 0.663 -4.550 1.00 0.00 H new ATOM 0 HG23 ILE A 441 -1.112 0.158 -3.801 1.00 0.00 H new ATOM 0 HD11 ILE A 441 1.764 0.017 -6.891 1.00 0.00 H new ATOM 0 HD12 ILE A 441 0.232 0.550 -7.623 1.00 0.00 H new ATOM 0 HD13 ILE A 441 0.686 1.116 -5.997 1.00 0.00 H new ATOM 308 N THR A 442 -4.457 -1.817 -5.912 1.00 0.00 N ATOM 309 CA THR A 442 -5.882 -1.568 -5.733 1.00 0.00 C ATOM 310 C THR A 442 -6.648 -2.872 -5.540 1.00 0.00 C ATOM 311 O THR A 442 -7.598 -2.936 -4.760 1.00 0.00 O ATOM 312 CB THR A 442 -6.475 -0.810 -6.935 1.00 0.00 C ATOM 313 OG1 THR A 442 -6.148 -1.490 -8.152 1.00 0.00 O ATOM 314 CG2 THR A 442 -5.950 0.617 -6.988 1.00 0.00 C ATOM 0 H THR A 442 -4.198 -2.131 -6.847 1.00 0.00 H new ATOM 0 HA THR A 442 -5.986 -0.953 -4.839 1.00 0.00 H new ATOM 0 HB THR A 442 -7.558 -0.777 -6.817 1.00 0.00 H new ATOM 0 HG1 THR A 442 -5.490 -2.192 -7.968 1.00 0.00 H new ATOM 0 HG21 THR A 442 -6.383 1.132 -7.845 1.00 0.00 H new ATOM 0 HG22 THR A 442 -6.226 1.140 -6.073 1.00 0.00 H new ATOM 0 HG23 THR A 442 -4.864 0.602 -7.084 1.00 0.00 H new ATOM 322 N GLY A 443 -6.229 -3.911 -6.256 1.00 0.00 N ATOM 323 CA GLY A 443 -6.887 -5.200 -6.149 1.00 0.00 C ATOM 324 C GLY A 443 -7.534 -5.631 -7.450 1.00 0.00 C ATOM 325 O GLY A 443 -8.000 -6.764 -7.575 1.00 0.00 O ATOM 0 H GLY A 443 -5.445 -3.883 -6.908 1.00 0.00 H new ATOM 0 HA2 GLY A 443 -6.159 -5.951 -5.842 1.00 0.00 H new ATOM 0 HA3 GLY A 443 -7.646 -5.153 -5.368 1.00 0.00 H new ATOM 329 N PHE A 444 -7.564 -4.725 -8.423 1.00 0.00 N ATOM 330 CA PHE A 444 -8.161 -5.017 -9.721 1.00 0.00 C ATOM 331 C PHE A 444 -7.086 -5.355 -10.750 1.00 0.00 C ATOM 332 O PHE A 444 -6.688 -4.508 -11.550 1.00 0.00 O ATOM 333 CB PHE A 444 -8.989 -3.825 -10.205 1.00 0.00 C ATOM 334 CG PHE A 444 -9.382 -3.916 -11.651 1.00 0.00 C ATOM 335 CD1 PHE A 444 -10.010 -5.049 -12.143 1.00 0.00 C ATOM 336 CD2 PHE A 444 -9.123 -2.868 -12.520 1.00 0.00 C ATOM 337 CE1 PHE A 444 -10.373 -5.135 -13.474 1.00 0.00 C ATOM 338 CE2 PHE A 444 -9.484 -2.949 -13.852 1.00 0.00 C ATOM 339 CZ PHE A 444 -10.109 -4.084 -14.329 1.00 0.00 C ATOM 0 H PHE A 444 -7.182 -3.783 -8.337 1.00 0.00 H new ATOM 0 HA PHE A 444 -8.814 -5.882 -9.606 1.00 0.00 H new ATOM 0 HB2 PHE A 444 -9.890 -3.747 -9.596 1.00 0.00 H new ATOM 0 HB3 PHE A 444 -8.419 -2.909 -10.049 1.00 0.00 H new ATOM 0 HD1 PHE A 444 -10.218 -5.875 -11.479 1.00 0.00 H new ATOM 0 HD2 PHE A 444 -8.634 -1.978 -12.153 1.00 0.00 H new ATOM 0 HE1 PHE A 444 -10.863 -6.023 -13.845 1.00 0.00 H new ATOM 0 HE2 PHE A 444 -9.277 -2.125 -14.519 1.00 0.00 H new ATOM 0 HZ PHE A 444 -10.391 -4.149 -15.370 1.00 0.00 H new ATOM 349 N CYS A 445 -6.619 -6.599 -10.723 1.00 0.00 N ATOM 350 CA CYS A 445 -5.590 -7.051 -11.651 1.00 0.00 C ATOM 351 C CYS A 445 -6.108 -8.189 -12.525 1.00 0.00 C ATOM 352 O CYS A 445 -6.232 -9.327 -12.072 1.00 0.00 O ATOM 353 CB CYS A 445 -4.347 -7.506 -10.885 1.00 0.00 C ATOM 354 SG CYS A 445 -2.938 -7.951 -11.951 1.00 0.00 S ATOM 0 H CYS A 445 -6.938 -7.313 -10.067 1.00 0.00 H new ATOM 0 HA CYS A 445 -5.324 -6.213 -12.296 1.00 0.00 H new ATOM 0 HB2 CYS A 445 -4.039 -6.710 -10.208 1.00 0.00 H new ATOM 0 HB3 CYS A 445 -4.608 -8.366 -10.268 1.00 0.00 H new ATOM 359 N ALA A 446 -6.408 -7.875 -13.781 1.00 0.00 N ATOM 360 CA ALA A 446 -6.910 -8.871 -14.719 1.00 0.00 C ATOM 361 C ALA A 446 -6.185 -10.201 -14.547 1.00 0.00 C ATOM 362 O ALA A 446 -6.793 -11.207 -14.177 1.00 0.00 O ATOM 363 CB ALA A 446 -6.765 -8.370 -16.149 1.00 0.00 C ATOM 0 H ALA A 446 -6.312 -6.938 -14.172 1.00 0.00 H new ATOM 0 HA ALA A 446 -7.967 -9.033 -14.508 1.00 0.00 H new ATOM 0 HB1 ALA A 446 -7.144 -9.124 -16.839 1.00 0.00 H new ATOM 0 HB2 ALA A 446 -7.334 -7.448 -16.271 1.00 0.00 H new ATOM 0 HB3 ALA A 446 -5.713 -8.179 -16.363 1.00 0.00 H new ATOM 369 N ARG A 447 -4.884 -10.201 -14.817 1.00 0.00 N ATOM 370 CA ARG A 447 -4.077 -11.409 -14.694 1.00 0.00 C ATOM 371 C ARG A 447 -3.736 -11.688 -13.233 1.00 0.00 C ATOM 372 O ARG A 447 -2.892 -11.014 -12.642 1.00 0.00 O ATOM 373 CB ARG A 447 -2.792 -11.275 -15.512 1.00 0.00 C ATOM 374 CG ARG A 447 -2.996 -11.475 -17.005 1.00 0.00 C ATOM 375 CD ARG A 447 -1.768 -11.053 -17.796 1.00 0.00 C ATOM 376 NE ARG A 447 -2.072 -10.851 -19.211 1.00 0.00 N ATOM 377 CZ ARG A 447 -1.242 -10.260 -20.063 1.00 0.00 C ATOM 378 NH1 ARG A 447 -0.064 -9.816 -19.647 1.00 0.00 N ATOM 379 NH2 ARG A 447 -1.589 -10.112 -21.335 1.00 0.00 N ATOM 0 H ARG A 447 -4.366 -9.377 -15.123 1.00 0.00 H new ATOM 0 HA ARG A 447 -4.659 -12.246 -15.080 1.00 0.00 H new ATOM 0 HB2 ARG A 447 -2.364 -10.287 -15.342 1.00 0.00 H new ATOM 0 HB3 ARG A 447 -2.065 -12.003 -15.153 1.00 0.00 H new ATOM 0 HG2 ARG A 447 -3.217 -12.523 -17.206 1.00 0.00 H new ATOM 0 HG3 ARG A 447 -3.859 -10.898 -17.336 1.00 0.00 H new ATOM 0 HD2 ARG A 447 -1.365 -10.131 -17.376 1.00 0.00 H new ATOM 0 HD3 ARG A 447 -0.993 -11.813 -17.696 1.00 0.00 H new ATOM 0 HE ARG A 447 -2.970 -11.182 -19.563 1.00 0.00 H new ATOM 0 HH11 ARG A 447 0.207 -9.928 -18.670 1.00 0.00 H new ATOM 0 HH12 ARG A 447 0.571 -9.363 -20.304 1.00 0.00 H new ATOM 0 HH21 ARG A 447 -2.494 -10.452 -21.660 1.00 0.00 H new ATOM 0 HH22 ARG A 447 -0.951 -9.658 -21.988 1.00 0.00 H new ATOM 393 N ALA A 448 -4.399 -12.685 -12.656 1.00 0.00 N ATOM 394 CA ALA A 448 -4.166 -13.054 -11.265 1.00 0.00 C ATOM 395 C ALA A 448 -2.932 -13.940 -11.132 1.00 0.00 C ATOM 396 O ALA A 448 -1.864 -13.476 -10.734 1.00 0.00 O ATOM 397 CB ALA A 448 -5.387 -13.758 -10.694 1.00 0.00 C ATOM 0 H ALA A 448 -5.102 -13.252 -13.131 1.00 0.00 H new ATOM 0 HA ALA A 448 -3.989 -12.141 -10.697 1.00 0.00 H new ATOM 0 HB1 ALA A 448 -5.199 -14.028 -9.655 1.00 0.00 H new ATOM 0 HB2 ALA A 448 -6.248 -13.092 -10.746 1.00 0.00 H new ATOM 0 HB3 ALA A 448 -5.590 -14.660 -11.272 1.00 0.00 H new ATOM 403 N GLU A 449 -3.087 -15.217 -11.468 1.00 0.00 N ATOM 404 CA GLU A 449 -1.985 -16.168 -11.383 1.00 0.00 C ATOM 405 C GLU A 449 -1.088 -16.071 -12.614 1.00 0.00 C ATOM 406 O GLU A 449 -0.264 -16.950 -12.866 1.00 0.00 O ATOM 407 CB GLU A 449 -2.521 -17.593 -11.241 1.00 0.00 C ATOM 408 CG GLU A 449 -3.604 -17.733 -10.183 1.00 0.00 C ATOM 409 CD GLU A 449 -4.085 -19.163 -10.027 1.00 0.00 C ATOM 410 OE1 GLU A 449 -3.445 -19.926 -9.275 1.00 0.00 O ATOM 411 OE2 GLU A 449 -5.104 -19.517 -10.658 1.00 0.00 O ATOM 0 H GLU A 449 -3.964 -15.616 -11.801 1.00 0.00 H new ATOM 0 HA GLU A 449 -1.393 -15.921 -10.502 1.00 0.00 H new ATOM 0 HB2 GLU A 449 -2.919 -17.920 -12.202 1.00 0.00 H new ATOM 0 HB3 GLU A 449 -1.695 -18.260 -10.994 1.00 0.00 H new ATOM 0 HG2 GLU A 449 -3.221 -17.376 -9.227 1.00 0.00 H new ATOM 0 HG3 GLU A 449 -4.448 -17.096 -10.446 1.00 0.00 H new ATOM 418 N ASN A 450 -1.255 -14.996 -13.378 1.00 0.00 N ATOM 419 CA ASN A 450 -0.462 -14.785 -14.584 1.00 0.00 C ATOM 420 C ASN A 450 0.462 -13.581 -14.423 1.00 0.00 C ATOM 421 O ASN A 450 1.424 -13.418 -15.174 1.00 0.00 O ATOM 422 CB ASN A 450 -1.378 -14.580 -15.792 1.00 0.00 C ATOM 423 CG ASN A 450 -1.928 -15.887 -16.329 1.00 0.00 C ATOM 424 OD1 ASN A 450 -1.500 -16.369 -17.378 1.00 0.00 O ATOM 425 ND2 ASN A 450 -2.881 -16.468 -15.610 1.00 0.00 N ATOM 0 H ASN A 450 -1.932 -14.258 -13.184 1.00 0.00 H new ATOM 0 HA ASN A 450 0.150 -15.672 -14.747 1.00 0.00 H new ATOM 0 HB2 ASN A 450 -2.206 -13.929 -15.511 1.00 0.00 H new ATOM 0 HB3 ASN A 450 -0.825 -14.070 -16.581 1.00 0.00 H new ATOM 0 HD21 ASN A 450 -3.289 -17.350 -15.921 1.00 0.00 H new ATOM 0 HD22 ASN A 450 -3.205 -16.033 -14.746 1.00 0.00 H new ATOM 432 N CYS A 451 0.164 -12.742 -13.437 1.00 0.00 N ATOM 433 CA CYS A 451 0.967 -11.553 -13.175 1.00 0.00 C ATOM 434 C CYS A 451 2.369 -11.935 -12.708 1.00 0.00 C ATOM 435 O CYS A 451 2.562 -12.461 -11.611 1.00 0.00 O ATOM 436 CB CYS A 451 0.288 -10.675 -12.123 1.00 0.00 C ATOM 437 SG CYS A 451 0.894 -8.957 -12.085 1.00 0.00 S ATOM 0 H CYS A 451 -0.628 -12.863 -12.806 1.00 0.00 H new ATOM 0 HA CYS A 451 1.054 -10.992 -14.105 1.00 0.00 H new ATOM 0 HB2 CYS A 451 -0.786 -10.666 -12.311 1.00 0.00 H new ATOM 0 HB3 CYS A 451 0.436 -11.123 -11.141 1.00 0.00 H new ATOM 442 N PRO A 452 3.370 -11.666 -13.558 1.00 0.00 N ATOM 443 CA PRO A 452 4.771 -11.972 -13.254 1.00 0.00 C ATOM 444 C PRO A 452 5.334 -11.079 -12.153 1.00 0.00 C ATOM 445 O PRO A 452 6.517 -11.158 -11.820 1.00 0.00 O ATOM 446 CB PRO A 452 5.489 -11.704 -14.579 1.00 0.00 C ATOM 447 CG PRO A 452 4.625 -10.717 -15.285 1.00 0.00 C ATOM 448 CD PRO A 452 3.212 -11.040 -14.882 1.00 0.00 C ATOM 0 HA PRO A 452 4.894 -12.990 -12.885 1.00 0.00 H new ATOM 0 HB2 PRO A 452 6.490 -11.306 -14.413 1.00 0.00 H new ATOM 0 HB3 PRO A 452 5.601 -12.619 -15.161 1.00 0.00 H new ATOM 0 HG2 PRO A 452 4.888 -9.697 -15.004 1.00 0.00 H new ATOM 0 HG3 PRO A 452 4.749 -10.792 -16.365 1.00 0.00 H new ATOM 0 HD2 PRO A 452 2.594 -10.144 -14.832 1.00 0.00 H new ATOM 0 HD3 PRO A 452 2.736 -11.716 -15.592 1.00 0.00 H new ATOM 456 N TYR A 453 4.480 -10.231 -11.591 1.00 0.00 N ATOM 457 CA TYR A 453 4.893 -9.322 -10.529 1.00 0.00 C ATOM 458 C TYR A 453 4.482 -9.859 -9.161 1.00 0.00 C ATOM 459 O TYR A 453 3.738 -10.835 -9.063 1.00 0.00 O ATOM 460 CB TYR A 453 4.283 -7.936 -10.749 1.00 0.00 C ATOM 461 CG TYR A 453 4.799 -7.238 -11.987 1.00 0.00 C ATOM 462 CD1 TYR A 453 4.313 -7.566 -13.247 1.00 0.00 C ATOM 463 CD2 TYR A 453 5.772 -6.250 -11.897 1.00 0.00 C ATOM 464 CE1 TYR A 453 4.781 -6.931 -14.381 1.00 0.00 C ATOM 465 CE2 TYR A 453 6.245 -5.609 -13.026 1.00 0.00 C ATOM 466 CZ TYR A 453 5.747 -5.953 -14.265 1.00 0.00 C ATOM 467 OH TYR A 453 6.216 -5.318 -15.391 1.00 0.00 O ATOM 0 H TYR A 453 3.497 -10.154 -11.853 1.00 0.00 H new ATOM 0 HA TYR A 453 5.980 -9.242 -10.557 1.00 0.00 H new ATOM 0 HB2 TYR A 453 3.200 -8.032 -10.821 1.00 0.00 H new ATOM 0 HB3 TYR A 453 4.491 -7.314 -9.878 1.00 0.00 H new ATOM 0 HD1 TYR A 453 3.556 -8.331 -13.341 1.00 0.00 H new ATOM 0 HD2 TYR A 453 6.165 -5.979 -10.928 1.00 0.00 H new ATOM 0 HE1 TYR A 453 4.393 -7.199 -15.353 1.00 0.00 H new ATOM 0 HE2 TYR A 453 7.001 -4.843 -12.938 1.00 0.00 H new ATOM 0 HH TYR A 453 6.892 -4.656 -15.136 1.00 0.00 H new ATOM 477 N MET A 454 4.971 -9.214 -8.108 1.00 0.00 N ATOM 478 CA MET A 454 4.654 -9.625 -6.745 1.00 0.00 C ATOM 479 C MET A 454 3.300 -9.071 -6.311 1.00 0.00 C ATOM 480 O MET A 454 2.950 -7.936 -6.636 1.00 0.00 O ATOM 481 CB MET A 454 5.743 -9.153 -5.780 1.00 0.00 C ATOM 482 CG MET A 454 7.029 -9.959 -5.873 1.00 0.00 C ATOM 483 SD MET A 454 6.940 -11.515 -4.966 1.00 0.00 S ATOM 484 CE MET A 454 7.944 -11.129 -3.534 1.00 0.00 C ATOM 0 H MET A 454 5.588 -8.405 -8.172 1.00 0.00 H new ATOM 0 HA MET A 454 4.606 -10.714 -6.723 1.00 0.00 H new ATOM 0 HB2 MET A 454 5.965 -8.105 -5.981 1.00 0.00 H new ATOM 0 HB3 MET A 454 5.362 -9.208 -4.760 1.00 0.00 H new ATOM 0 HG2 MET A 454 7.249 -10.165 -6.920 1.00 0.00 H new ATOM 0 HG3 MET A 454 7.855 -9.363 -5.485 1.00 0.00 H new ATOM 0 HE1 MET A 454 8.000 -12.002 -2.883 1.00 0.00 H new ATOM 0 HE2 MET A 454 8.947 -10.852 -3.857 1.00 0.00 H new ATOM 0 HE3 MET A 454 7.496 -10.298 -2.989 1.00 0.00 H new ATOM 494 N HIS A 455 2.543 -9.880 -5.577 1.00 0.00 N ATOM 495 CA HIS A 455 1.227 -9.470 -5.099 1.00 0.00 C ATOM 496 C HIS A 455 1.163 -9.520 -3.576 1.00 0.00 C ATOM 497 O HIS A 455 1.241 -8.490 -2.907 1.00 0.00 O ATOM 498 CB HIS A 455 0.142 -10.367 -5.697 1.00 0.00 C ATOM 499 CG HIS A 455 -0.240 -9.993 -7.096 1.00 0.00 C ATOM 500 ND1 HIS A 455 -1.428 -10.380 -7.680 1.00 0.00 N ATOM 501 CD2 HIS A 455 0.416 -9.263 -8.028 1.00 0.00 C ATOM 502 CE1 HIS A 455 -1.486 -9.904 -8.911 1.00 0.00 C ATOM 503 NE2 HIS A 455 -0.379 -9.222 -9.147 1.00 0.00 N ATOM 0 H HIS A 455 2.818 -10.823 -5.300 1.00 0.00 H new ATOM 0 HA HIS A 455 1.055 -8.442 -5.419 1.00 0.00 H new ATOM 0 HB2 HIS A 455 0.490 -11.400 -5.688 1.00 0.00 H new ATOM 0 HB3 HIS A 455 -0.744 -10.324 -5.063 1.00 0.00 H new ATOM 0 HD1 HIS A 455 -2.149 -10.945 -7.232 1.00 0.00 H new ATOM 0 HD2 HIS A 455 1.384 -8.799 -7.913 1.00 0.00 H new ATOM 0 HE1 HIS A 455 -2.300 -10.048 -9.606 1.00 0.00 H new ATOM 511 N GLY A 456 1.018 -10.725 -3.033 1.00 0.00 N ATOM 512 CA GLY A 456 0.944 -10.887 -1.593 1.00 0.00 C ATOM 513 C GLY A 456 2.311 -10.871 -0.937 1.00 0.00 C ATOM 514 O GLY A 456 2.593 -10.021 -0.093 1.00 0.00 O ATOM 0 H GLY A 456 0.950 -11.592 -3.565 1.00 0.00 H new ATOM 0 HA2 GLY A 456 0.333 -10.089 -1.172 1.00 0.00 H new ATOM 0 HA3 GLY A 456 0.444 -11.828 -1.361 1.00 0.00 H new ATOM 518 N ASP A 457 3.161 -11.815 -1.324 1.00 0.00 N ATOM 519 CA ASP A 457 4.506 -11.908 -0.768 1.00 0.00 C ATOM 520 C ASP A 457 5.065 -10.521 -0.465 1.00 0.00 C ATOM 521 O ASP A 457 5.617 -10.285 0.611 1.00 0.00 O ATOM 522 CB ASP A 457 5.433 -12.644 -1.737 1.00 0.00 C ATOM 523 CG ASP A 457 4.940 -14.041 -2.061 1.00 0.00 C ATOM 524 OD1 ASP A 457 5.232 -14.970 -1.279 1.00 0.00 O ATOM 525 OD2 ASP A 457 4.260 -14.204 -3.096 1.00 0.00 O ATOM 0 H ASP A 457 2.943 -12.527 -2.021 1.00 0.00 H new ATOM 0 HA ASP A 457 4.449 -12.470 0.164 1.00 0.00 H new ATOM 0 HB2 ASP A 457 5.520 -12.069 -2.659 1.00 0.00 H new ATOM 0 HB3 ASP A 457 6.432 -12.705 -1.304 1.00 0.00 H new ATOM 530 N PHE A 458 4.920 -9.609 -1.419 1.00 0.00 N ATOM 531 CA PHE A 458 5.413 -8.246 -1.255 1.00 0.00 C ATOM 532 C PHE A 458 5.014 -7.684 0.107 1.00 0.00 C ATOM 533 O PHE A 458 3.843 -7.679 0.486 1.00 0.00 O ATOM 534 CB PHE A 458 4.870 -7.347 -2.369 1.00 0.00 C ATOM 535 CG PHE A 458 5.662 -6.086 -2.560 1.00 0.00 C ATOM 536 CD1 PHE A 458 6.927 -6.125 -3.124 1.00 0.00 C ATOM 537 CD2 PHE A 458 5.141 -4.860 -2.177 1.00 0.00 C ATOM 538 CE1 PHE A 458 7.658 -4.965 -3.300 1.00 0.00 C ATOM 539 CE2 PHE A 458 5.867 -3.697 -2.351 1.00 0.00 C ATOM 540 CZ PHE A 458 7.127 -3.750 -2.915 1.00 0.00 C ATOM 0 H PHE A 458 4.465 -9.788 -2.314 1.00 0.00 H new ATOM 0 HA PHE A 458 6.501 -8.270 -1.315 1.00 0.00 H new ATOM 0 HB2 PHE A 458 4.861 -7.906 -3.305 1.00 0.00 H new ATOM 0 HB3 PHE A 458 3.836 -7.087 -2.143 1.00 0.00 H new ATOM 0 HD1 PHE A 458 7.347 -7.072 -3.429 1.00 0.00 H new ATOM 0 HD2 PHE A 458 4.156 -4.813 -1.737 1.00 0.00 H new ATOM 0 HE1 PHE A 458 8.644 -5.009 -3.738 1.00 0.00 H new ATOM 0 HE2 PHE A 458 5.450 -2.748 -2.047 1.00 0.00 H new ATOM 0 HZ PHE A 458 7.696 -2.843 -3.055 1.00 0.00 H new ATOM 550 N PRO A 459 6.012 -7.199 0.861 1.00 0.00 N ATOM 551 CA PRO A 459 5.792 -6.626 2.192 1.00 0.00 C ATOM 552 C PRO A 459 5.056 -5.292 2.134 1.00 0.00 C ATOM 553 O PRO A 459 5.386 -4.424 1.325 1.00 0.00 O ATOM 554 CB PRO A 459 7.210 -6.431 2.733 1.00 0.00 C ATOM 555 CG PRO A 459 8.064 -6.299 1.520 1.00 0.00 C ATOM 556 CD PRO A 459 7.432 -7.173 0.472 1.00 0.00 C ATOM 0 HA PRO A 459 5.168 -7.268 2.814 1.00 0.00 H new ATOM 0 HB2 PRO A 459 7.275 -5.543 3.361 1.00 0.00 H new ATOM 0 HB3 PRO A 459 7.520 -7.278 3.345 1.00 0.00 H new ATOM 0 HG2 PRO A 459 8.111 -5.262 1.187 1.00 0.00 H new ATOM 0 HG3 PRO A 459 9.087 -6.614 1.726 1.00 0.00 H new ATOM 0 HD2 PRO A 459 7.567 -6.762 -0.529 1.00 0.00 H new ATOM 0 HD3 PRO A 459 7.866 -8.173 0.468 1.00 0.00 H new ATOM 564 N CYS A 460 4.058 -5.134 2.996 1.00 0.00 N ATOM 565 CA CYS A 460 3.275 -3.905 3.044 1.00 0.00 C ATOM 566 C CYS A 460 4.182 -2.687 3.191 1.00 0.00 C ATOM 567 O CYS A 460 5.218 -2.746 3.853 1.00 0.00 O ATOM 568 CB CYS A 460 2.278 -3.955 4.204 1.00 0.00 C ATOM 569 SG CYS A 460 0.924 -2.743 4.074 1.00 0.00 S ATOM 0 H CYS A 460 3.772 -5.842 3.672 1.00 0.00 H new ATOM 0 HA CYS A 460 2.727 -3.817 2.106 1.00 0.00 H new ATOM 0 HB2 CYS A 460 1.851 -4.956 4.259 1.00 0.00 H new ATOM 0 HB3 CYS A 460 2.814 -3.786 5.138 1.00 0.00 H new ATOM 574 N LYS A 461 3.785 -1.582 2.568 1.00 0.00 N ATOM 575 CA LYS A 461 4.560 -0.348 2.630 1.00 0.00 C ATOM 576 C LYS A 461 4.303 0.391 3.939 1.00 0.00 C ATOM 577 O LYS A 461 5.190 0.501 4.786 1.00 0.00 O ATOM 578 CB LYS A 461 4.213 0.555 1.444 1.00 0.00 C ATOM 579 CG LYS A 461 5.063 1.811 1.368 1.00 0.00 C ATOM 580 CD LYS A 461 4.504 2.803 0.362 1.00 0.00 C ATOM 581 CE LYS A 461 4.939 4.226 0.680 1.00 0.00 C ATOM 582 NZ LYS A 461 3.974 4.912 1.584 1.00 0.00 N ATOM 0 H LYS A 461 2.931 -1.516 2.014 1.00 0.00 H new ATOM 0 HA LYS A 461 5.617 -0.609 2.583 1.00 0.00 H new ATOM 0 HB2 LYS A 461 4.332 -0.011 0.520 1.00 0.00 H new ATOM 0 HB3 LYS A 461 3.163 0.840 1.510 1.00 0.00 H new ATOM 0 HG2 LYS A 461 5.112 2.278 2.352 1.00 0.00 H new ATOM 0 HG3 LYS A 461 6.083 1.545 1.090 1.00 0.00 H new ATOM 0 HD2 LYS A 461 4.839 2.534 -0.640 1.00 0.00 H new ATOM 0 HD3 LYS A 461 3.415 2.746 0.360 1.00 0.00 H new ATOM 0 HE2 LYS A 461 5.924 4.209 1.146 1.00 0.00 H new ATOM 0 HE3 LYS A 461 5.034 4.792 -0.246 1.00 0.00 H new ATOM 0 HZ1 LYS A 461 4.493 5.520 2.249 1.00 0.00 H new ATOM 0 HZ2 LYS A 461 3.323 5.494 1.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 461 3.431 4.202 2.116 1.00 0.00 H new ATOM 596 N LEU A 462 3.084 0.895 4.098 1.00 0.00 N ATOM 597 CA LEU A 462 2.709 1.623 5.306 1.00 0.00 C ATOM 598 C LEU A 462 3.199 0.897 6.554 1.00 0.00 C ATOM 599 O LEU A 462 3.963 1.448 7.346 1.00 0.00 O ATOM 600 CB LEU A 462 1.191 1.801 5.367 1.00 0.00 C ATOM 601 CG LEU A 462 0.612 2.932 4.516 1.00 0.00 C ATOM 602 CD1 LEU A 462 -0.908 2.912 4.565 1.00 0.00 C ATOM 603 CD2 LEU A 462 1.145 4.278 4.984 1.00 0.00 C ATOM 0 H LEU A 462 2.339 0.813 3.406 1.00 0.00 H new ATOM 0 HA LEU A 462 3.182 2.604 5.271 1.00 0.00 H new ATOM 0 HB2 LEU A 462 0.723 0.866 5.059 1.00 0.00 H new ATOM 0 HB3 LEU A 462 0.907 1.973 6.405 1.00 0.00 H new ATOM 0 HG LEU A 462 0.924 2.780 3.483 1.00 0.00 H new ATOM 0 HD11 LEU A 462 -1.302 3.724 3.954 1.00 0.00 H new ATOM 0 HD12 LEU A 462 -1.272 1.959 4.181 1.00 0.00 H new ATOM 0 HD13 LEU A 462 -1.241 3.039 5.595 1.00 0.00 H new ATOM 0 HD21 LEU A 462 0.722 5.071 4.367 1.00 0.00 H new ATOM 0 HD22 LEU A 462 0.864 4.439 6.025 1.00 0.00 H new ATOM 0 HD23 LEU A 462 2.231 4.290 4.896 1.00 0.00 H new ATOM 615 N TYR A 463 2.756 -0.345 6.721 1.00 0.00 N ATOM 616 CA TYR A 463 3.150 -1.147 7.873 1.00 0.00 C ATOM 617 C TYR A 463 4.621 -0.928 8.213 1.00 0.00 C ATOM 618 O TYR A 463 5.040 -1.114 9.356 1.00 0.00 O ATOM 619 CB TYR A 463 2.893 -2.630 7.599 1.00 0.00 C ATOM 620 CG TYR A 463 3.145 -3.520 8.796 1.00 0.00 C ATOM 621 CD1 TYR A 463 4.438 -3.853 9.178 1.00 0.00 C ATOM 622 CD2 TYR A 463 2.090 -4.027 9.543 1.00 0.00 C ATOM 623 CE1 TYR A 463 4.673 -4.666 10.270 1.00 0.00 C ATOM 624 CE2 TYR A 463 2.315 -4.839 10.638 1.00 0.00 C ATOM 625 CZ TYR A 463 3.609 -5.156 10.997 1.00 0.00 C ATOM 626 OH TYR A 463 3.837 -5.966 12.086 1.00 0.00 O ATOM 0 H TYR A 463 2.125 -0.817 6.074 1.00 0.00 H new ATOM 0 HA TYR A 463 2.549 -0.832 8.726 1.00 0.00 H new ATOM 0 HB2 TYR A 463 1.861 -2.757 7.273 1.00 0.00 H new ATOM 0 HB3 TYR A 463 3.529 -2.954 6.775 1.00 0.00 H new ATOM 0 HD1 TYR A 463 5.274 -3.470 8.612 1.00 0.00 H new ATOM 0 HD2 TYR A 463 1.076 -3.782 9.263 1.00 0.00 H new ATOM 0 HE1 TYR A 463 5.685 -4.916 10.553 1.00 0.00 H new ATOM 0 HE2 TYR A 463 1.483 -5.223 11.209 1.00 0.00 H new ATOM 0 HH TYR A 463 2.981 -6.224 12.487 1.00 0.00 H new ATOM 636 N HIS A 464 5.400 -0.531 7.212 1.00 0.00 N ATOM 637 CA HIS A 464 6.825 -0.285 7.404 1.00 0.00 C ATOM 638 C HIS A 464 7.103 1.208 7.555 1.00 0.00 C ATOM 639 O HIS A 464 7.719 1.640 8.529 1.00 0.00 O ATOM 640 CB HIS A 464 7.624 -0.848 6.229 1.00 0.00 C ATOM 641 CG HIS A 464 7.852 -2.326 6.313 1.00 0.00 C ATOM 642 ND1 HIS A 464 8.315 -2.953 7.450 1.00 0.00 N ATOM 643 CD2 HIS A 464 7.675 -3.303 5.392 1.00 0.00 C ATOM 644 CE1 HIS A 464 8.415 -4.251 7.225 1.00 0.00 C ATOM 645 NE2 HIS A 464 8.032 -4.489 5.984 1.00 0.00 N ATOM 0 H HIS A 464 5.069 -0.373 6.260 1.00 0.00 H new ATOM 0 HA HIS A 464 7.136 -0.789 8.319 1.00 0.00 H new ATOM 0 HB2 HIS A 464 7.098 -0.622 5.301 1.00 0.00 H new ATOM 0 HB3 HIS A 464 8.588 -0.342 6.180 1.00 0.00 H new ATOM 0 HD2 HIS A 464 7.319 -3.173 4.381 1.00 0.00 H new ATOM 0 HE1 HIS A 464 8.753 -4.991 7.935 1.00 0.00 H new ATOM 0 HE2 HIS A 464 8.006 -5.406 5.537 1.00 0.00 H new ATOM 653 N THR A 465 6.644 1.991 6.584 1.00 0.00 N ATOM 654 CA THR A 465 6.845 3.434 6.607 1.00 0.00 C ATOM 655 C THR A 465 6.820 3.970 8.034 1.00 0.00 C ATOM 656 O THR A 465 7.609 4.843 8.395 1.00 0.00 O ATOM 657 CB THR A 465 5.772 4.164 5.778 1.00 0.00 C ATOM 658 OG1 THR A 465 4.497 4.055 6.421 1.00 0.00 O ATOM 659 CG2 THR A 465 5.688 3.587 4.373 1.00 0.00 C ATOM 0 H THR A 465 6.130 1.650 5.772 1.00 0.00 H new ATOM 0 HA THR A 465 7.824 3.624 6.168 1.00 0.00 H new ATOM 0 HB THR A 465 6.053 5.215 5.706 1.00 0.00 H new ATOM 0 HG1 THR A 465 4.407 3.164 6.819 1.00 0.00 H new ATOM 0 HG21 THR A 465 4.923 4.119 3.806 1.00 0.00 H new ATOM 0 HG22 THR A 465 6.651 3.699 3.876 1.00 0.00 H new ATOM 0 HG23 THR A 465 5.429 2.530 4.429 1.00 0.00 H new ATOM 667 N THR A 466 5.908 3.441 8.844 1.00 0.00 N ATOM 668 CA THR A 466 5.779 3.866 10.232 1.00 0.00 C ATOM 669 C THR A 466 5.832 2.673 11.179 1.00 0.00 C ATOM 670 O THR A 466 6.332 2.778 12.298 1.00 0.00 O ATOM 671 CB THR A 466 4.465 4.635 10.465 1.00 0.00 C ATOM 672 OG1 THR A 466 3.345 3.789 10.177 1.00 0.00 O ATOM 673 CG2 THR A 466 4.404 5.880 9.592 1.00 0.00 C ATOM 0 H THR A 466 5.247 2.717 8.562 1.00 0.00 H new ATOM 0 HA THR A 466 6.620 4.528 10.439 1.00 0.00 H new ATOM 0 HB THR A 466 4.430 4.942 11.510 1.00 0.00 H new ATOM 0 HG1 THR A 466 2.513 4.284 10.329 1.00 0.00 H new ATOM 0 HG21 THR A 466 3.467 6.406 9.774 1.00 0.00 H new ATOM 0 HG22 THR A 466 5.241 6.535 9.833 1.00 0.00 H new ATOM 0 HG23 THR A 466 4.460 5.591 8.542 1.00 0.00 H new ATOM 681 N GLY A 467 5.312 1.537 10.723 1.00 0.00 N ATOM 682 CA GLY A 467 5.310 0.340 11.544 1.00 0.00 C ATOM 683 C GLY A 467 3.956 -0.339 11.576 1.00 0.00 C ATOM 684 O GLY A 467 3.868 -1.565 11.533 1.00 0.00 O ATOM 0 H GLY A 467 4.892 1.424 9.800 1.00 0.00 H new ATOM 0 HA2 GLY A 467 6.055 -0.359 11.163 1.00 0.00 H new ATOM 0 HA3 GLY A 467 5.607 0.600 12.560 1.00 0.00 H new ATOM 688 N ASN A 468 2.896 0.460 11.653 1.00 0.00 N ATOM 689 CA ASN A 468 1.539 -0.072 11.693 1.00 0.00 C ATOM 690 C ASN A 468 0.798 0.229 10.394 1.00 0.00 C ATOM 691 O ASN A 468 1.059 1.238 9.737 1.00 0.00 O ATOM 692 CB ASN A 468 0.773 0.517 12.879 1.00 0.00 C ATOM 693 CG ASN A 468 -0.440 -0.313 13.252 1.00 0.00 C ATOM 694 OD1 ASN A 468 -0.470 -1.524 13.033 1.00 0.00 O ATOM 695 ND2 ASN A 468 -1.449 0.338 13.820 1.00 0.00 N ATOM 0 H ASN A 468 2.951 1.478 11.689 1.00 0.00 H new ATOM 0 HA ASN A 468 1.603 -1.154 11.811 1.00 0.00 H new ATOM 0 HB2 ASN A 468 1.439 0.589 13.739 1.00 0.00 H new ATOM 0 HB3 ASN A 468 0.455 1.531 12.636 1.00 0.00 H new ATOM 0 HD21 ASN A 468 -2.292 -0.167 14.094 1.00 0.00 H new ATOM 0 HD22 ASN A 468 -1.381 1.343 13.983 1.00 0.00 H new ATOM 702 N CYS A 469 -0.128 -0.651 10.029 1.00 0.00 N ATOM 703 CA CYS A 469 -0.908 -0.481 8.809 1.00 0.00 C ATOM 704 C CYS A 469 -2.301 0.054 9.125 1.00 0.00 C ATOM 705 O CYS A 469 -2.899 -0.302 10.141 1.00 0.00 O ATOM 706 CB CYS A 469 -1.018 -1.810 8.059 1.00 0.00 C ATOM 707 SG CYS A 469 -1.534 -1.642 6.320 1.00 0.00 S ATOM 0 H CYS A 469 -0.357 -1.490 10.562 1.00 0.00 H new ATOM 0 HA CYS A 469 -0.394 0.243 8.177 1.00 0.00 H new ATOM 0 HB2 CYS A 469 -0.053 -2.315 8.093 1.00 0.00 H new ATOM 0 HB3 CYS A 469 -1.731 -2.450 8.578 1.00 0.00 H new ATOM 712 N ILE A 470 -2.813 0.911 8.247 1.00 0.00 N ATOM 713 CA ILE A 470 -4.136 1.494 8.432 1.00 0.00 C ATOM 714 C ILE A 470 -5.230 0.455 8.208 1.00 0.00 C ATOM 715 O ILE A 470 -6.233 0.432 8.921 1.00 0.00 O ATOM 716 CB ILE A 470 -4.367 2.680 7.477 1.00 0.00 C ATOM 717 CG1 ILE A 470 -5.736 3.313 7.736 1.00 0.00 C ATOM 718 CG2 ILE A 470 -4.254 2.224 6.030 1.00 0.00 C ATOM 719 CD1 ILE A 470 -5.805 4.094 9.030 1.00 0.00 C ATOM 0 H ILE A 470 -2.332 1.217 7.401 1.00 0.00 H new ATOM 0 HA ILE A 470 -4.183 1.852 9.460 1.00 0.00 H new ATOM 0 HB ILE A 470 -3.599 3.431 7.662 1.00 0.00 H new ATOM 0 HG12 ILE A 470 -5.983 3.976 6.907 1.00 0.00 H new ATOM 0 HG13 ILE A 470 -6.493 2.529 7.754 1.00 0.00 H new ATOM 0 HG21 ILE A 470 -4.420 3.073 5.367 1.00 0.00 H new ATOM 0 HG22 ILE A 470 -3.259 1.815 5.854 1.00 0.00 H new ATOM 0 HG23 ILE A 470 -5.002 1.457 5.831 1.00 0.00 H new ATOM 0 HD11 ILE A 470 -6.804 4.515 9.148 1.00 0.00 H new ATOM 0 HD12 ILE A 470 -5.589 3.430 9.867 1.00 0.00 H new ATOM 0 HD13 ILE A 470 -5.072 4.900 9.008 1.00 0.00 H new ATOM 731 N ASN A 471 -5.029 -0.404 7.214 1.00 0.00 N ATOM 732 CA ASN A 471 -5.998 -1.446 6.897 1.00 0.00 C ATOM 733 C ASN A 471 -6.397 -2.218 8.151 1.00 0.00 C ATOM 734 O ASN A 471 -7.534 -2.130 8.613 1.00 0.00 O ATOM 735 CB ASN A 471 -5.422 -2.407 5.855 1.00 0.00 C ATOM 736 CG ASN A 471 -6.499 -3.211 5.152 1.00 0.00 C ATOM 737 OD1 ASN A 471 -7.039 -4.167 5.709 1.00 0.00 O ATOM 738 ND2 ASN A 471 -6.816 -2.825 3.921 1.00 0.00 N ATOM 0 H ASN A 471 -4.204 -0.399 6.614 1.00 0.00 H new ATOM 0 HA ASN A 471 -6.888 -0.967 6.488 1.00 0.00 H new ATOM 0 HB2 ASN A 471 -4.855 -1.840 5.116 1.00 0.00 H new ATOM 0 HB3 ASN A 471 -4.723 -3.088 6.340 1.00 0.00 H new ATOM 0 HD21 ASN A 471 -7.533 -3.327 3.398 1.00 0.00 H new ATOM 0 HD22 ASN A 471 -6.342 -2.026 3.499 1.00 0.00 H new ATOM 745 N GLY A 472 -5.451 -2.976 8.699 1.00 0.00 N ATOM 746 CA GLY A 472 -5.722 -3.752 9.895 1.00 0.00 C ATOM 747 C GLY A 472 -5.053 -5.112 9.868 1.00 0.00 C ATOM 748 O GLY A 472 -4.041 -5.300 9.192 1.00 0.00 O ATOM 0 H GLY A 472 -4.502 -3.066 8.336 1.00 0.00 H new ATOM 0 HA2 GLY A 472 -5.378 -3.199 10.769 1.00 0.00 H new ATOM 0 HA3 GLY A 472 -6.799 -3.882 10.004 1.00 0.00 H new ATOM 752 N ASP A 473 -5.618 -6.062 10.605 1.00 0.00 N ATOM 753 CA ASP A 473 -5.070 -7.412 10.663 1.00 0.00 C ATOM 754 C ASP A 473 -5.367 -8.175 9.377 1.00 0.00 C ATOM 755 O ASP A 473 -4.656 -9.116 9.023 1.00 0.00 O ATOM 756 CB ASP A 473 -5.643 -8.167 11.863 1.00 0.00 C ATOM 757 CG ASP A 473 -7.134 -7.945 12.029 1.00 0.00 C ATOM 758 OD1 ASP A 473 -7.804 -7.644 11.019 1.00 0.00 O ATOM 759 OD2 ASP A 473 -7.630 -8.070 13.168 1.00 0.00 O ATOM 0 H ASP A 473 -6.455 -5.922 11.171 1.00 0.00 H new ATOM 0 HA ASP A 473 -3.989 -7.334 10.776 1.00 0.00 H new ATOM 0 HB2 ASP A 473 -5.448 -9.233 11.745 1.00 0.00 H new ATOM 0 HB3 ASP A 473 -5.128 -7.848 12.769 1.00 0.00 H new ATOM 764 N ASP A 474 -6.422 -7.764 8.682 1.00 0.00 N ATOM 765 CA ASP A 474 -6.814 -8.410 7.434 1.00 0.00 C ATOM 766 C ASP A 474 -6.368 -7.584 6.232 1.00 0.00 C ATOM 767 O ASP A 474 -7.155 -7.314 5.323 1.00 0.00 O ATOM 768 CB ASP A 474 -8.330 -8.613 7.395 1.00 0.00 C ATOM 769 CG ASP A 474 -8.793 -9.702 8.342 1.00 0.00 C ATOM 770 OD1 ASP A 474 -8.383 -10.867 8.154 1.00 0.00 O ATOM 771 OD2 ASP A 474 -9.564 -9.389 9.273 1.00 0.00 O ATOM 0 H ASP A 474 -7.021 -6.987 8.961 1.00 0.00 H new ATOM 0 HA ASP A 474 -6.323 -9.382 7.386 1.00 0.00 H new ATOM 0 HB2 ASP A 474 -8.826 -7.677 7.652 1.00 0.00 H new ATOM 0 HB3 ASP A 474 -8.634 -8.866 6.379 1.00 0.00 H new ATOM 776 N CYS A 475 -5.101 -7.184 6.233 1.00 0.00 N ATOM 777 CA CYS A 475 -4.549 -6.387 5.143 1.00 0.00 C ATOM 778 C CYS A 475 -4.208 -7.267 3.944 1.00 0.00 C ATOM 779 O CYS A 475 -3.839 -8.431 4.101 1.00 0.00 O ATOM 780 CB CYS A 475 -3.300 -5.639 5.613 1.00 0.00 C ATOM 781 SG CYS A 475 -2.721 -4.358 4.454 1.00 0.00 S ATOM 0 H CYS A 475 -4.437 -7.399 6.977 1.00 0.00 H new ATOM 0 HA CYS A 475 -5.304 -5.663 4.836 1.00 0.00 H new ATOM 0 HB2 CYS A 475 -3.509 -5.174 6.577 1.00 0.00 H new ATOM 0 HB3 CYS A 475 -2.497 -6.359 5.773 1.00 0.00 H new ATOM 786 N MET A 476 -4.334 -6.702 2.748 1.00 0.00 N ATOM 787 CA MET A 476 -4.038 -7.435 1.523 1.00 0.00 C ATOM 788 C MET A 476 -2.536 -7.464 1.256 1.00 0.00 C ATOM 789 O MET A 476 -2.099 -7.742 0.139 1.00 0.00 O ATOM 790 CB MET A 476 -4.766 -6.802 0.335 1.00 0.00 C ATOM 791 CG MET A 476 -4.412 -5.341 0.114 1.00 0.00 C ATOM 792 SD MET A 476 -2.764 -5.125 -0.587 1.00 0.00 S ATOM 793 CE MET A 476 -3.108 -5.344 -2.332 1.00 0.00 C ATOM 0 H MET A 476 -4.639 -5.740 2.601 1.00 0.00 H new ATOM 0 HA MET A 476 -4.387 -8.460 1.650 1.00 0.00 H new ATOM 0 HB2 MET A 476 -4.529 -7.365 -0.568 1.00 0.00 H new ATOM 0 HB3 MET A 476 -5.841 -6.887 0.491 1.00 0.00 H new ATOM 0 HG2 MET A 476 -5.148 -4.889 -0.551 1.00 0.00 H new ATOM 0 HG3 MET A 476 -4.472 -4.809 1.063 1.00 0.00 H new ATOM 0 HE1 MET A 476 -2.184 -5.239 -2.901 1.00 0.00 H new ATOM 0 HE2 MET A 476 -3.526 -6.337 -2.499 1.00 0.00 H new ATOM 0 HE3 MET A 476 -3.823 -4.589 -2.659 1.00 0.00 H new ATOM 803 N PHE A 477 -1.751 -7.174 2.288 1.00 0.00 N ATOM 804 CA PHE A 477 -0.298 -7.165 2.164 1.00 0.00 C ATOM 805 C PHE A 477 0.347 -7.999 3.268 1.00 0.00 C ATOM 806 O PHE A 477 -0.251 -8.224 4.320 1.00 0.00 O ATOM 807 CB PHE A 477 0.231 -5.731 2.218 1.00 0.00 C ATOM 808 CG PHE A 477 0.095 -4.992 0.917 1.00 0.00 C ATOM 809 CD1 PHE A 477 0.519 -5.568 -0.269 1.00 0.00 C ATOM 810 CD2 PHE A 477 -0.458 -3.722 0.881 1.00 0.00 C ATOM 811 CE1 PHE A 477 0.395 -4.892 -1.468 1.00 0.00 C ATOM 812 CE2 PHE A 477 -0.586 -3.041 -0.315 1.00 0.00 C ATOM 813 CZ PHE A 477 -0.158 -3.626 -1.491 1.00 0.00 C ATOM 0 H PHE A 477 -2.096 -6.942 3.219 1.00 0.00 H new ATOM 0 HA PHE A 477 -0.038 -7.605 1.201 1.00 0.00 H new ATOM 0 HB2 PHE A 477 -0.303 -5.184 2.995 1.00 0.00 H new ATOM 0 HB3 PHE A 477 1.282 -5.751 2.507 1.00 0.00 H new ATOM 0 HD1 PHE A 477 0.952 -6.557 -0.257 1.00 0.00 H new ATOM 0 HD2 PHE A 477 -0.793 -3.259 1.798 1.00 0.00 H new ATOM 0 HE1 PHE A 477 0.730 -5.353 -2.386 1.00 0.00 H new ATOM 0 HE2 PHE A 477 -1.020 -2.052 -0.330 1.00 0.00 H new ATOM 0 HZ PHE A 477 -0.255 -3.095 -2.426 1.00 0.00 H new ATOM 823 N SER A 478 1.571 -8.454 3.019 1.00 0.00 N ATOM 824 CA SER A 478 2.296 -9.266 3.989 1.00 0.00 C ATOM 825 C SER A 478 2.923 -8.391 5.070 1.00 0.00 C ATOM 826 O SER A 478 3.620 -7.420 4.772 1.00 0.00 O ATOM 827 CB SER A 478 3.380 -10.087 3.289 1.00 0.00 C ATOM 828 OG SER A 478 4.035 -9.323 2.292 1.00 0.00 O ATOM 0 H SER A 478 2.081 -8.274 2.154 1.00 0.00 H new ATOM 0 HA SER A 478 1.585 -9.944 4.462 1.00 0.00 H new ATOM 0 HB2 SER A 478 4.108 -10.434 4.022 1.00 0.00 H new ATOM 0 HB3 SER A 478 2.934 -10.974 2.838 1.00 0.00 H new ATOM 0 HG SER A 478 4.846 -9.791 2.002 1.00 0.00 H new ATOM 834 N HIS A 479 2.670 -8.741 6.327 1.00 0.00 N ATOM 835 CA HIS A 479 3.210 -7.989 7.454 1.00 0.00 C ATOM 836 C HIS A 479 4.380 -8.731 8.092 1.00 0.00 C ATOM 837 O HIS A 479 4.714 -8.500 9.255 1.00 0.00 O ATOM 838 CB HIS A 479 2.120 -7.739 8.496 1.00 0.00 C ATOM 839 CG HIS A 479 1.165 -6.649 8.116 1.00 0.00 C ATOM 840 ND1 HIS A 479 0.054 -6.326 8.865 1.00 0.00 N ATOM 841 CD2 HIS A 479 1.162 -5.805 7.057 1.00 0.00 C ATOM 842 CE1 HIS A 479 -0.592 -5.331 8.284 1.00 0.00 C ATOM 843 NE2 HIS A 479 0.060 -4.996 7.185 1.00 0.00 N ATOM 0 H HIS A 479 2.094 -9.541 6.591 1.00 0.00 H new ATOM 0 HA HIS A 479 3.571 -7.031 7.080 1.00 0.00 H new ATOM 0 HB2 HIS A 479 1.561 -8.662 8.653 1.00 0.00 H new ATOM 0 HB3 HIS A 479 2.589 -7.484 9.446 1.00 0.00 H new ATOM 0 HD1 HIS A 479 -0.226 -6.784 9.733 1.00 0.00 H new ATOM 0 HD2 HIS A 479 1.891 -5.774 6.260 1.00 0.00 H new ATOM 0 HE1 HIS A 479 -1.499 -4.870 8.646 1.00 0.00 H new ATOM 851 N ASP A 480 4.998 -9.623 7.326 1.00 0.00 N ATOM 852 CA ASP A 480 6.131 -10.399 7.816 1.00 0.00 C ATOM 853 C ASP A 480 7.355 -9.509 8.011 1.00 0.00 C ATOM 854 O ASP A 480 7.466 -8.429 7.432 1.00 0.00 O ATOM 855 CB ASP A 480 6.459 -11.533 6.844 1.00 0.00 C ATOM 856 CG ASP A 480 5.613 -12.767 7.087 1.00 0.00 C ATOM 857 OD1 ASP A 480 4.383 -12.621 7.249 1.00 0.00 O ATOM 858 OD2 ASP A 480 6.180 -13.879 7.115 1.00 0.00 O ATOM 0 H ASP A 480 4.733 -9.827 6.362 1.00 0.00 H new ATOM 0 HA ASP A 480 5.857 -10.826 8.781 1.00 0.00 H new ATOM 0 HB2 ASP A 480 6.306 -11.187 5.822 1.00 0.00 H new ATOM 0 HB3 ASP A 480 7.513 -11.794 6.938 1.00 0.00 H new ATOM 863 N PRO A 481 8.296 -9.972 8.848 1.00 0.00 N ATOM 864 CA PRO A 481 9.528 -9.234 9.139 1.00 0.00 C ATOM 865 C PRO A 481 10.474 -9.189 7.944 1.00 0.00 C ATOM 866 O PRO A 481 10.926 -10.227 7.457 1.00 0.00 O ATOM 867 CB PRO A 481 10.155 -10.029 10.287 1.00 0.00 C ATOM 868 CG PRO A 481 9.617 -11.410 10.130 1.00 0.00 C ATOM 869 CD PRO A 481 8.229 -11.252 9.573 1.00 0.00 C ATOM 0 HA PRO A 481 9.329 -8.190 9.383 1.00 0.00 H new ATOM 0 HB2 PRO A 481 11.243 -10.019 10.227 1.00 0.00 H new ATOM 0 HB3 PRO A 481 9.885 -9.607 11.255 1.00 0.00 H new ATOM 0 HG2 PRO A 481 10.242 -11.999 9.459 1.00 0.00 H new ATOM 0 HG3 PRO A 481 9.597 -11.932 11.087 1.00 0.00 H new ATOM 0 HD2 PRO A 481 7.966 -12.076 8.910 1.00 0.00 H new ATOM 0 HD3 PRO A 481 7.479 -11.227 10.364 1.00 0.00 H new ATOM 877 N LEU A 482 10.769 -7.983 7.474 1.00 0.00 N ATOM 878 CA LEU A 482 11.663 -7.803 6.335 1.00 0.00 C ATOM 879 C LEU A 482 12.871 -8.727 6.439 1.00 0.00 C ATOM 880 O LEU A 482 13.311 -9.071 7.536 1.00 0.00 O ATOM 881 CB LEU A 482 12.125 -6.347 6.249 1.00 0.00 C ATOM 882 CG LEU A 482 11.110 -5.352 5.685 1.00 0.00 C ATOM 883 CD1 LEU A 482 11.542 -3.924 5.981 1.00 0.00 C ATOM 884 CD2 LEU A 482 10.935 -5.560 4.188 1.00 0.00 C ATOM 0 H LEU A 482 10.402 -7.114 7.864 1.00 0.00 H new ATOM 0 HA LEU A 482 11.112 -8.057 5.429 1.00 0.00 H new ATOM 0 HB2 LEU A 482 12.410 -6.018 7.248 1.00 0.00 H new ATOM 0 HB3 LEU A 482 13.023 -6.308 5.633 1.00 0.00 H new ATOM 0 HG LEU A 482 10.150 -5.527 6.170 1.00 0.00 H new ATOM 0 HD11 LEU A 482 10.808 -3.230 5.572 1.00 0.00 H new ATOM 0 HD12 LEU A 482 11.615 -3.782 7.059 1.00 0.00 H new ATOM 0 HD13 LEU A 482 12.513 -3.736 5.524 1.00 0.00 H new ATOM 0 HD21 LEU A 482 10.209 -4.843 3.803 1.00 0.00 H new ATOM 0 HD22 LEU A 482 11.891 -5.413 3.686 1.00 0.00 H new ATOM 0 HD23 LEU A 482 10.579 -6.573 4.001 1.00 0.00 H new ATOM 896 N THR A 483 13.406 -9.125 5.289 1.00 0.00 N ATOM 897 CA THR A 483 14.565 -10.009 5.250 1.00 0.00 C ATOM 898 C THR A 483 15.659 -9.442 4.353 1.00 0.00 C ATOM 899 O THR A 483 15.384 -8.664 3.440 1.00 0.00 O ATOM 900 CB THR A 483 14.183 -11.415 4.749 1.00 0.00 C ATOM 901 OG1 THR A 483 13.673 -11.337 3.414 1.00 0.00 O ATOM 902 CG2 THR A 483 13.142 -12.049 5.659 1.00 0.00 C ATOM 0 H THR A 483 13.055 -8.849 4.372 1.00 0.00 H new ATOM 0 HA THR A 483 14.939 -10.085 6.271 1.00 0.00 H new ATOM 0 HB THR A 483 15.078 -12.036 4.760 1.00 0.00 H new ATOM 0 HG1 THR A 483 13.434 -12.235 3.102 1.00 0.00 H new ATOM 0 HG21 THR A 483 12.888 -13.041 5.285 1.00 0.00 H new ATOM 0 HG22 THR A 483 13.544 -12.134 6.669 1.00 0.00 H new ATOM 0 HG23 THR A 483 12.247 -11.427 5.676 1.00 0.00 H new ATOM 910 N GLU A 484 16.900 -9.837 4.618 1.00 0.00 N ATOM 911 CA GLU A 484 18.035 -9.367 3.833 1.00 0.00 C ATOM 912 C GLU A 484 17.681 -9.300 2.351 1.00 0.00 C ATOM 913 O GLU A 484 18.212 -8.471 1.613 1.00 0.00 O ATOM 914 CB GLU A 484 19.242 -10.286 4.040 1.00 0.00 C ATOM 915 CG GLU A 484 18.999 -11.718 3.596 1.00 0.00 C ATOM 916 CD GLU A 484 20.283 -12.445 3.245 1.00 0.00 C ATOM 917 OE1 GLU A 484 21.214 -12.439 4.077 1.00 0.00 O ATOM 918 OE2 GLU A 484 20.356 -13.021 2.139 1.00 0.00 O ATOM 0 H GLU A 484 17.145 -10.481 5.370 1.00 0.00 H new ATOM 0 HA GLU A 484 18.289 -8.363 4.173 1.00 0.00 H new ATOM 0 HB2 GLU A 484 20.093 -9.884 3.491 1.00 0.00 H new ATOM 0 HB3 GLU A 484 19.514 -10.283 5.096 1.00 0.00 H new ATOM 0 HG2 GLU A 484 18.485 -12.259 4.391 1.00 0.00 H new ATOM 0 HG3 GLU A 484 18.337 -11.719 2.730 1.00 0.00 H new ATOM 925 N GLU A 485 16.781 -10.180 1.923 1.00 0.00 N ATOM 926 CA GLU A 485 16.357 -10.221 0.528 1.00 0.00 C ATOM 927 C GLU A 485 15.311 -9.146 0.245 1.00 0.00 C ATOM 928 O GLU A 485 15.609 -8.118 -0.365 1.00 0.00 O ATOM 929 CB GLU A 485 15.791 -11.600 0.185 1.00 0.00 C ATOM 930 CG GLU A 485 15.363 -11.739 -1.266 1.00 0.00 C ATOM 931 CD GLU A 485 16.541 -11.849 -2.214 1.00 0.00 C ATOM 932 OE1 GLU A 485 17.477 -11.031 -2.094 1.00 0.00 O ATOM 933 OE2 GLU A 485 16.528 -12.753 -3.076 1.00 0.00 O ATOM 0 H GLU A 485 16.332 -10.873 2.521 1.00 0.00 H new ATOM 0 HA GLU A 485 17.230 -10.028 -0.096 1.00 0.00 H new ATOM 0 HB2 GLU A 485 16.543 -12.357 0.407 1.00 0.00 H new ATOM 0 HB3 GLU A 485 14.935 -11.802 0.828 1.00 0.00 H new ATOM 0 HG2 GLU A 485 14.733 -12.622 -1.372 1.00 0.00 H new ATOM 0 HG3 GLU A 485 14.756 -10.878 -1.546 1.00 0.00 H new ATOM 940 N THR A 486 14.083 -9.390 0.693 1.00 0.00 N ATOM 941 CA THR A 486 12.993 -8.445 0.487 1.00 0.00 C ATOM 942 C THR A 486 13.422 -7.025 0.840 1.00 0.00 C ATOM 943 O THR A 486 13.174 -6.086 0.083 1.00 0.00 O ATOM 944 CB THR A 486 11.758 -8.820 1.329 1.00 0.00 C ATOM 945 OG1 THR A 486 12.148 -9.079 2.682 1.00 0.00 O ATOM 946 CG2 THR A 486 11.063 -10.044 0.753 1.00 0.00 C ATOM 0 H THR A 486 13.819 -10.234 1.201 1.00 0.00 H new ATOM 0 HA THR A 486 12.731 -8.490 -0.570 1.00 0.00 H new ATOM 0 HB THR A 486 11.062 -7.982 1.307 1.00 0.00 H new ATOM 0 HG1 THR A 486 12.640 -9.925 2.724 1.00 0.00 H new ATOM 0 HG21 THR A 486 10.194 -10.290 1.364 1.00 0.00 H new ATOM 0 HG22 THR A 486 10.742 -9.834 -0.267 1.00 0.00 H new ATOM 0 HG23 THR A 486 11.754 -10.887 0.749 1.00 0.00 H new ATOM 954 N ARG A 487 14.067 -6.876 1.992 1.00 0.00 N ATOM 955 CA ARG A 487 14.530 -5.569 2.445 1.00 0.00 C ATOM 956 C ARG A 487 15.079 -4.753 1.278 1.00 0.00 C ATOM 957 O ARG A 487 14.798 -3.562 1.156 1.00 0.00 O ATOM 958 CB ARG A 487 15.606 -5.730 3.520 1.00 0.00 C ATOM 959 CG ARG A 487 15.822 -4.480 4.357 1.00 0.00 C ATOM 960 CD ARG A 487 16.398 -3.345 3.524 1.00 0.00 C ATOM 961 NE ARG A 487 17.241 -2.456 4.319 1.00 0.00 N ATOM 962 CZ ARG A 487 18.528 -2.683 4.558 1.00 0.00 C ATOM 963 NH1 ARG A 487 19.116 -3.764 4.066 1.00 0.00 N ATOM 964 NH2 ARG A 487 19.228 -1.827 5.291 1.00 0.00 N ATOM 0 H ARG A 487 14.281 -7.643 2.629 1.00 0.00 H new ATOM 0 HA ARG A 487 13.679 -5.037 2.870 1.00 0.00 H new ATOM 0 HB2 ARG A 487 15.330 -6.554 4.178 1.00 0.00 H new ATOM 0 HB3 ARG A 487 16.547 -6.004 3.042 1.00 0.00 H new ATOM 0 HG2 ARG A 487 14.875 -4.166 4.796 1.00 0.00 H new ATOM 0 HG3 ARG A 487 16.497 -4.706 5.183 1.00 0.00 H new ATOM 0 HD2 ARG A 487 16.982 -3.759 2.702 1.00 0.00 H new ATOM 0 HD3 ARG A 487 15.584 -2.772 3.080 1.00 0.00 H new ATOM 0 HE ARG A 487 16.819 -1.615 4.712 1.00 0.00 H new ATOM 0 HH11 ARG A 487 18.580 -4.424 3.502 1.00 0.00 H new ATOM 0 HH12 ARG A 487 20.104 -3.936 4.251 1.00 0.00 H new ATOM 0 HH21 ARG A 487 18.778 -0.994 5.671 1.00 0.00 H new ATOM 0 HH22 ARG A 487 20.216 -2.002 5.474 1.00 0.00 H new ATOM 978 N GLU A 488 15.864 -5.404 0.425 1.00 0.00 N ATOM 979 CA GLU A 488 16.453 -4.738 -0.730 1.00 0.00 C ATOM 980 C GLU A 488 15.371 -4.145 -1.628 1.00 0.00 C ATOM 981 O GLU A 488 15.516 -3.037 -2.147 1.00 0.00 O ATOM 982 CB GLU A 488 17.313 -5.719 -1.530 1.00 0.00 C ATOM 983 CG GLU A 488 17.900 -5.122 -2.798 1.00 0.00 C ATOM 984 CD GLU A 488 16.955 -5.218 -3.980 1.00 0.00 C ATOM 985 OE1 GLU A 488 16.205 -6.214 -4.059 1.00 0.00 O ATOM 986 OE2 GLU A 488 16.965 -4.299 -4.825 1.00 0.00 O ATOM 0 H GLU A 488 16.106 -6.391 0.512 1.00 0.00 H new ATOM 0 HA GLU A 488 17.083 -3.927 -0.365 1.00 0.00 H new ATOM 0 HB2 GLU A 488 18.125 -6.076 -0.897 1.00 0.00 H new ATOM 0 HB3 GLU A 488 16.709 -6.587 -1.793 1.00 0.00 H new ATOM 0 HG2 GLU A 488 18.149 -4.076 -2.621 1.00 0.00 H new ATOM 0 HG3 GLU A 488 18.831 -5.635 -3.039 1.00 0.00 H new ATOM 993 N LEU A 489 14.285 -4.890 -1.806 1.00 0.00 N ATOM 994 CA LEU A 489 13.177 -4.440 -2.641 1.00 0.00 C ATOM 995 C LEU A 489 12.752 -3.024 -2.264 1.00 0.00 C ATOM 996 O LEU A 489 12.872 -2.095 -3.064 1.00 0.00 O ATOM 997 CB LEU A 489 11.990 -5.395 -2.506 1.00 0.00 C ATOM 998 CG LEU A 489 12.214 -6.820 -3.010 1.00 0.00 C ATOM 999 CD1 LEU A 489 10.916 -7.612 -2.969 1.00 0.00 C ATOM 1000 CD2 LEU A 489 12.786 -6.804 -4.420 1.00 0.00 C ATOM 0 H LEU A 489 14.148 -5.808 -1.383 1.00 0.00 H new ATOM 0 HA LEU A 489 13.514 -4.434 -3.678 1.00 0.00 H new ATOM 0 HB2 LEU A 489 11.706 -5.443 -1.455 1.00 0.00 H new ATOM 0 HB3 LEU A 489 11.144 -4.969 -3.045 1.00 0.00 H new ATOM 0 HG LEU A 489 12.934 -7.307 -2.353 1.00 0.00 H new ATOM 0 HD11 LEU A 489 11.096 -8.624 -3.332 1.00 0.00 H new ATOM 0 HD12 LEU A 489 10.548 -7.654 -1.944 1.00 0.00 H new ATOM 0 HD13 LEU A 489 10.173 -7.126 -3.602 1.00 0.00 H new ATOM 0 HD21 LEU A 489 12.939 -7.828 -4.762 1.00 0.00 H new ATOM 0 HD22 LEU A 489 12.090 -6.298 -5.089 1.00 0.00 H new ATOM 0 HD23 LEU A 489 13.739 -6.275 -4.420 1.00 0.00 H new ATOM 1012 N LEU A 490 12.256 -2.867 -1.042 1.00 0.00 N ATOM 1013 CA LEU A 490 11.814 -1.564 -0.558 1.00 0.00 C ATOM 1014 C LEU A 490 12.805 -0.472 -0.951 1.00 0.00 C ATOM 1015 O LEU A 490 12.430 0.528 -1.563 1.00 0.00 O ATOM 1016 CB LEU A 490 11.647 -1.593 0.963 1.00 0.00 C ATOM 1017 CG LEU A 490 10.463 -2.401 1.492 1.00 0.00 C ATOM 1018 CD1 LEU A 490 10.521 -2.503 3.009 1.00 0.00 C ATOM 1019 CD2 LEU A 490 9.148 -1.776 1.048 1.00 0.00 C ATOM 0 H LEU A 490 12.150 -3.625 -0.368 1.00 0.00 H new ATOM 0 HA LEU A 490 10.852 -1.340 -1.019 1.00 0.00 H new ATOM 0 HB2 LEU A 490 12.560 -1.995 1.401 1.00 0.00 H new ATOM 0 HB3 LEU A 490 11.548 -0.567 1.317 1.00 0.00 H new ATOM 0 HG LEU A 490 10.522 -3.407 1.078 1.00 0.00 H new ATOM 0 HD11 LEU A 490 9.670 -3.082 3.368 1.00 0.00 H new ATOM 0 HD12 LEU A 490 11.446 -2.997 3.305 1.00 0.00 H new ATOM 0 HD13 LEU A 490 10.488 -1.503 3.442 1.00 0.00 H new ATOM 0 HD21 LEU A 490 8.316 -2.365 1.434 1.00 0.00 H new ATOM 0 HD22 LEU A 490 9.081 -0.758 1.432 1.00 0.00 H new ATOM 0 HD23 LEU A 490 9.104 -1.756 -0.041 1.00 0.00 H new ATOM 1031 N ASP A 491 14.069 -0.673 -0.597 1.00 0.00 N ATOM 1032 CA ASP A 491 15.115 0.293 -0.916 1.00 0.00 C ATOM 1033 C ASP A 491 14.939 0.836 -2.330 1.00 0.00 C ATOM 1034 O ASP A 491 15.047 2.041 -2.562 1.00 0.00 O ATOM 1035 CB ASP A 491 16.494 -0.351 -0.771 1.00 0.00 C ATOM 1036 CG ASP A 491 16.809 -0.730 0.663 1.00 0.00 C ATOM 1037 OD1 ASP A 491 15.857 -0.967 1.436 1.00 0.00 O ATOM 1038 OD2 ASP A 491 18.007 -0.789 1.012 1.00 0.00 O ATOM 0 H ASP A 491 14.395 -1.495 -0.089 1.00 0.00 H new ATOM 0 HA ASP A 491 15.035 1.124 -0.215 1.00 0.00 H new ATOM 0 HB2 ASP A 491 16.544 -1.241 -1.398 1.00 0.00 H new ATOM 0 HB3 ASP A 491 17.254 0.339 -1.137 1.00 0.00 H new ATOM 1043 N LYS A 492 14.669 -0.060 -3.274 1.00 0.00 N ATOM 1044 CA LYS A 492 14.479 0.329 -4.666 1.00 0.00 C ATOM 1045 C LYS A 492 13.090 0.922 -4.880 1.00 0.00 C ATOM 1046 O LYS A 492 12.954 2.070 -5.304 1.00 0.00 O ATOM 1047 CB LYS A 492 14.675 -0.879 -5.585 1.00 0.00 C ATOM 1048 CG LYS A 492 14.942 -0.505 -7.033 1.00 0.00 C ATOM 1049 CD LYS A 492 15.546 -1.664 -7.807 1.00 0.00 C ATOM 1050 CE LYS A 492 15.396 -1.471 -9.308 1.00 0.00 C ATOM 1051 NZ LYS A 492 15.480 -2.762 -10.045 1.00 0.00 N ATOM 0 H LYS A 492 14.577 -1.061 -3.100 1.00 0.00 H new ATOM 0 HA LYS A 492 15.222 1.089 -4.910 1.00 0.00 H new ATOM 0 HB2 LYS A 492 15.508 -1.476 -5.213 1.00 0.00 H new ATOM 0 HB3 LYS A 492 13.786 -1.508 -5.539 1.00 0.00 H new ATOM 0 HG2 LYS A 492 14.011 -0.196 -7.507 1.00 0.00 H new ATOM 0 HG3 LYS A 492 15.618 0.350 -7.070 1.00 0.00 H new ATOM 0 HD2 LYS A 492 16.602 -1.760 -7.555 1.00 0.00 H new ATOM 0 HD3 LYS A 492 15.062 -2.594 -7.509 1.00 0.00 H new ATOM 0 HE2 LYS A 492 14.439 -0.994 -9.519 1.00 0.00 H new ATOM 0 HE3 LYS A 492 16.174 -0.797 -9.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 492 15.424 -2.582 -11.068 1.00 0.00 H new ATOM 0 HZ2 LYS A 492 16.382 -3.230 -9.824 1.00 0.00 H new ATOM 0 HZ3 LYS A 492 14.692 -3.377 -9.758 1.00 0.00 H new ATOM 1065 N MET A 493 12.062 0.135 -4.582 1.00 0.00 N ATOM 1066 CA MET A 493 10.684 0.585 -4.740 1.00 0.00 C ATOM 1067 C MET A 493 10.510 2.002 -4.205 1.00 0.00 C ATOM 1068 O MET A 493 10.134 2.914 -4.943 1.00 0.00 O ATOM 1069 CB MET A 493 9.728 -0.367 -4.017 1.00 0.00 C ATOM 1070 CG MET A 493 8.280 -0.221 -4.454 1.00 0.00 C ATOM 1071 SD MET A 493 7.522 1.301 -3.853 1.00 0.00 S ATOM 1072 CE MET A 493 7.152 0.849 -2.160 1.00 0.00 C ATOM 0 H MET A 493 12.157 -0.818 -4.230 1.00 0.00 H new ATOM 0 HA MET A 493 10.448 0.586 -5.804 1.00 0.00 H new ATOM 0 HB2 MET A 493 10.050 -1.394 -4.191 1.00 0.00 H new ATOM 0 HB3 MET A 493 9.795 -0.190 -2.944 1.00 0.00 H new ATOM 0 HG2 MET A 493 8.229 -0.242 -5.543 1.00 0.00 H new ATOM 0 HG3 MET A 493 7.708 -1.075 -4.092 1.00 0.00 H new ATOM 0 HE1 MET A 493 6.096 1.027 -1.958 1.00 0.00 H new ATOM 0 HE2 MET A 493 7.377 -0.207 -2.008 1.00 0.00 H new ATOM 0 HE3 MET A 493 7.757 1.451 -1.482 1.00 0.00 H new ATOM 1082 N LEU A 494 10.786 2.182 -2.918 1.00 0.00 N ATOM 1083 CA LEU A 494 10.660 3.489 -2.283 1.00 0.00 C ATOM 1084 C LEU A 494 11.191 4.591 -3.195 1.00 0.00 C ATOM 1085 O LEU A 494 10.459 5.505 -3.572 1.00 0.00 O ATOM 1086 CB LEU A 494 11.413 3.507 -0.952 1.00 0.00 C ATOM 1087 CG LEU A 494 10.759 2.744 0.200 1.00 0.00 C ATOM 1088 CD1 LEU A 494 11.751 2.533 1.333 1.00 0.00 C ATOM 1089 CD2 LEU A 494 9.527 3.485 0.698 1.00 0.00 C ATOM 0 H LEU A 494 11.099 1.439 -2.293 1.00 0.00 H new ATOM 0 HA LEU A 494 9.602 3.674 -2.097 1.00 0.00 H new ATOM 0 HB2 LEU A 494 12.409 3.095 -1.115 1.00 0.00 H new ATOM 0 HB3 LEU A 494 11.544 4.545 -0.646 1.00 0.00 H new ATOM 0 HG LEU A 494 10.447 1.767 -0.168 1.00 0.00 H new ATOM 0 HD11 LEU A 494 11.267 1.988 2.144 1.00 0.00 H new ATOM 0 HD12 LEU A 494 12.603 1.959 0.968 1.00 0.00 H new ATOM 0 HD13 LEU A 494 12.095 3.500 1.700 1.00 0.00 H new ATOM 0 HD21 LEU A 494 9.074 2.928 1.518 1.00 0.00 H new ATOM 0 HD22 LEU A 494 9.815 4.476 1.048 1.00 0.00 H new ATOM 0 HD23 LEU A 494 8.808 3.583 -0.115 1.00 0.00 H new ATOM 1101 N ALA A 495 12.469 4.495 -3.548 1.00 0.00 N ATOM 1102 CA ALA A 495 13.097 5.480 -4.420 1.00 0.00 C ATOM 1103 C ALA A 495 12.251 5.731 -5.664 1.00 0.00 C ATOM 1104 O ALA A 495 11.932 6.875 -5.989 1.00 0.00 O ATOM 1105 CB ALA A 495 14.494 5.023 -4.813 1.00 0.00 C ATOM 0 H ALA A 495 13.090 3.745 -3.243 1.00 0.00 H new ATOM 0 HA ALA A 495 13.175 6.418 -3.870 1.00 0.00 H new ATOM 0 HB1 ALA A 495 14.951 5.768 -5.464 1.00 0.00 H new ATOM 0 HB2 ALA A 495 15.103 4.902 -3.917 1.00 0.00 H new ATOM 0 HB3 ALA A 495 14.431 4.071 -5.340 1.00 0.00 H new ATOM 1111 N ASP A 496 11.891 4.656 -6.355 1.00 0.00 N ATOM 1112 CA ASP A 496 11.082 4.759 -7.564 1.00 0.00 C ATOM 1113 C ASP A 496 9.956 5.772 -7.379 1.00 0.00 C ATOM 1114 O ASP A 496 9.835 6.728 -8.145 1.00 0.00 O ATOM 1115 CB ASP A 496 10.501 3.393 -7.933 1.00 0.00 C ATOM 1116 CG ASP A 496 10.124 3.301 -9.399 1.00 0.00 C ATOM 1117 OD1 ASP A 496 10.754 4.003 -10.218 1.00 0.00 O ATOM 1118 OD2 ASP A 496 9.202 2.527 -9.726 1.00 0.00 O ATOM 0 H ASP A 496 12.147 3.702 -6.099 1.00 0.00 H new ATOM 0 HA ASP A 496 11.725 5.102 -8.374 1.00 0.00 H new ATOM 0 HB2 ASP A 496 11.229 2.616 -7.699 1.00 0.00 H new ATOM 0 HB3 ASP A 496 9.620 3.199 -7.321 1.00 0.00 H new ATOM 1123 N ASP A 497 9.134 5.554 -6.358 1.00 0.00 N ATOM 1124 CA ASP A 497 8.017 6.448 -6.072 1.00 0.00 C ATOM 1125 C ASP A 497 8.511 7.758 -5.467 1.00 0.00 C ATOM 1126 O ASP A 497 8.348 8.826 -6.057 1.00 0.00 O ATOM 1127 CB ASP A 497 7.028 5.773 -5.120 1.00 0.00 C ATOM 1128 CG ASP A 497 5.615 6.298 -5.286 1.00 0.00 C ATOM 1129 OD1 ASP A 497 5.457 7.417 -5.818 1.00 0.00 O ATOM 1130 OD2 ASP A 497 4.669 5.590 -4.884 1.00 0.00 O ATOM 0 H ASP A 497 9.220 4.767 -5.715 1.00 0.00 H new ATOM 0 HA ASP A 497 7.511 6.671 -7.012 1.00 0.00 H new ATOM 0 HB2 ASP A 497 7.036 4.697 -5.295 1.00 0.00 H new ATOM 0 HB3 ASP A 497 7.353 5.931 -4.092 1.00 0.00 H new ATOM 1135 N ALA A 498 9.114 7.669 -4.286 1.00 0.00 N ATOM 1136 CA ALA A 498 9.633 8.847 -3.603 1.00 0.00 C ATOM 1137 C ALA A 498 10.150 9.878 -4.600 1.00 0.00 C ATOM 1138 O ALA A 498 9.967 11.080 -4.414 1.00 0.00 O ATOM 1139 CB ALA A 498 10.734 8.452 -2.631 1.00 0.00 C ATOM 0 H ALA A 498 9.255 6.793 -3.783 1.00 0.00 H new ATOM 0 HA ALA A 498 8.815 9.300 -3.043 1.00 0.00 H new ATOM 0 HB1 ALA A 498 11.112 9.342 -2.128 1.00 0.00 H new ATOM 0 HB2 ALA A 498 10.334 7.759 -1.891 1.00 0.00 H new ATOM 0 HB3 ALA A 498 11.546 7.971 -3.177 1.00 0.00 H new ATOM 1145 N GLU A 499 10.797 9.398 -5.658 1.00 0.00 N ATOM 1146 CA GLU A 499 11.342 10.280 -6.684 1.00 0.00 C ATOM 1147 C GLU A 499 10.242 10.769 -7.621 1.00 0.00 C ATOM 1148 O GLU A 499 9.986 11.968 -7.723 1.00 0.00 O ATOM 1149 CB GLU A 499 12.427 9.557 -7.485 1.00 0.00 C ATOM 1150 CG GLU A 499 13.372 10.497 -8.215 1.00 0.00 C ATOM 1151 CD GLU A 499 14.149 11.392 -7.270 1.00 0.00 C ATOM 1152 OE1 GLU A 499 13.616 12.454 -6.885 1.00 0.00 O ATOM 1153 OE2 GLU A 499 15.291 11.031 -6.915 1.00 0.00 O ATOM 0 H GLU A 499 10.956 8.405 -5.827 1.00 0.00 H new ATOM 0 HA GLU A 499 11.783 11.145 -6.188 1.00 0.00 H new ATOM 0 HB2 GLU A 499 13.005 8.926 -6.810 1.00 0.00 H new ATOM 0 HB3 GLU A 499 11.952 8.897 -8.211 1.00 0.00 H new ATOM 0 HG2 GLU A 499 14.071 9.912 -8.812 1.00 0.00 H new ATOM 0 HG3 GLU A 499 12.801 11.115 -8.908 1.00 0.00 H new ATOM 1160 N ALA A 500 9.595 9.830 -8.305 1.00 0.00 N ATOM 1161 CA ALA A 500 8.522 10.164 -9.233 1.00 0.00 C ATOM 1162 C ALA A 500 8.859 11.417 -10.035 1.00 0.00 C ATOM 1163 O ALA A 500 7.997 12.260 -10.279 1.00 0.00 O ATOM 1164 CB ALA A 500 7.213 10.353 -8.481 1.00 0.00 C ATOM 0 H ALA A 500 9.796 8.832 -8.233 1.00 0.00 H new ATOM 0 HA ALA A 500 8.410 9.336 -9.933 1.00 0.00 H new ATOM 0 HB1 ALA A 500 6.421 10.602 -9.187 1.00 0.00 H new ATOM 0 HB2 ALA A 500 6.957 9.431 -7.959 1.00 0.00 H new ATOM 0 HB3 ALA A 500 7.322 11.161 -7.758 1.00 0.00 H new ATOM 1170 N GLY A 501 10.120 11.532 -10.441 1.00 0.00 N ATOM 1171 CA GLY A 501 10.549 12.686 -11.210 1.00 0.00 C ATOM 1172 C GLY A 501 9.677 12.928 -12.427 1.00 0.00 C ATOM 1173 O GLY A 501 9.304 14.065 -12.715 1.00 0.00 O ATOM 0 H GLY A 501 10.852 10.847 -10.251 1.00 0.00 H new ATOM 0 HA2 GLY A 501 10.532 13.570 -10.573 1.00 0.00 H new ATOM 0 HA3 GLY A 501 11.581 12.543 -11.529 1.00 0.00 H new ATOM 1177 N ALA A 502 9.353 11.857 -13.143 1.00 0.00 N ATOM 1178 CA ALA A 502 8.521 11.958 -14.335 1.00 0.00 C ATOM 1179 C ALA A 502 7.264 11.105 -14.201 1.00 0.00 C ATOM 1180 O ALA A 502 7.229 9.960 -14.651 1.00 0.00 O ATOM 1181 CB ALA A 502 9.311 11.546 -15.568 1.00 0.00 C ATOM 0 H ALA A 502 9.654 10.909 -12.918 1.00 0.00 H new ATOM 0 HA ALA A 502 8.213 12.998 -14.445 1.00 0.00 H new ATOM 0 HB1 ALA A 502 8.676 11.627 -16.450 1.00 0.00 H new ATOM 0 HB2 ALA A 502 10.175 12.200 -15.682 1.00 0.00 H new ATOM 0 HB3 ALA A 502 9.648 10.515 -15.457 1.00 0.00 H new ATOM 1187 N GLU A 503 6.234 11.671 -13.579 1.00 0.00 N ATOM 1188 CA GLU A 503 4.975 10.960 -13.385 1.00 0.00 C ATOM 1189 C GLU A 503 3.889 11.518 -14.300 1.00 0.00 C ATOM 1190 O GLU A 503 3.431 12.646 -14.122 1.00 0.00 O ATOM 1191 CB GLU A 503 4.528 11.059 -11.925 1.00 0.00 C ATOM 1192 CG GLU A 503 3.587 9.944 -11.500 1.00 0.00 C ATOM 1193 CD GLU A 503 2.925 10.217 -10.164 1.00 0.00 C ATOM 1194 OE1 GLU A 503 2.115 11.164 -10.084 1.00 0.00 O ATOM 1195 OE2 GLU A 503 3.218 9.483 -9.196 1.00 0.00 O ATOM 0 H GLU A 503 6.246 12.618 -13.201 1.00 0.00 H new ATOM 0 HA GLU A 503 5.136 9.912 -13.638 1.00 0.00 H new ATOM 0 HB2 GLU A 503 5.408 11.045 -11.282 1.00 0.00 H new ATOM 0 HB3 GLU A 503 4.035 12.018 -11.769 1.00 0.00 H new ATOM 0 HG2 GLU A 503 2.819 9.812 -12.262 1.00 0.00 H new ATOM 0 HG3 GLU A 503 4.142 9.008 -11.442 1.00 0.00 H new ATOM 1202 N ASP A 504 3.482 10.718 -15.280 1.00 0.00 N ATOM 1203 CA ASP A 504 2.449 11.130 -16.223 1.00 0.00 C ATOM 1204 C ASP A 504 1.058 10.911 -15.636 1.00 0.00 C ATOM 1205 O ASP A 504 0.446 9.863 -15.841 1.00 0.00 O ATOM 1206 CB ASP A 504 2.589 10.358 -17.536 1.00 0.00 C ATOM 1207 CG ASP A 504 2.902 8.891 -17.314 1.00 0.00 C ATOM 1208 OD1 ASP A 504 2.482 8.346 -16.272 1.00 0.00 O ATOM 1209 OD2 ASP A 504 3.566 8.289 -18.183 1.00 0.00 O ATOM 0 H ASP A 504 3.852 9.781 -15.442 1.00 0.00 H new ATOM 0 HA ASP A 504 2.577 12.194 -16.421 1.00 0.00 H new ATOM 0 HB2 ASP A 504 1.665 10.447 -18.107 1.00 0.00 H new ATOM 0 HB3 ASP A 504 3.379 10.808 -18.137 1.00 0.00 H new ATOM 1214 N GLU A 505 0.565 11.906 -14.906 1.00 0.00 N ATOM 1215 CA GLU A 505 -0.752 11.820 -14.288 1.00 0.00 C ATOM 1216 C GLU A 505 -1.791 11.323 -15.289 1.00 0.00 C ATOM 1217 O GLU A 505 -1.643 11.504 -16.497 1.00 0.00 O ATOM 1218 CB GLU A 505 -1.172 13.184 -13.736 1.00 0.00 C ATOM 1219 CG GLU A 505 -0.678 13.448 -12.323 1.00 0.00 C ATOM 1220 CD GLU A 505 -1.534 12.771 -11.270 1.00 0.00 C ATOM 1221 OE1 GLU A 505 -1.943 11.613 -11.492 1.00 0.00 O ATOM 1222 OE2 GLU A 505 -1.794 13.402 -10.224 1.00 0.00 O ATOM 0 H GLU A 505 1.058 12.781 -14.728 1.00 0.00 H new ATOM 0 HA GLU A 505 -0.693 11.106 -13.466 1.00 0.00 H new ATOM 0 HB2 GLU A 505 -0.794 13.965 -14.396 1.00 0.00 H new ATOM 0 HB3 GLU A 505 -2.260 13.253 -13.750 1.00 0.00 H new ATOM 0 HG2 GLU A 505 0.350 13.098 -12.230 1.00 0.00 H new ATOM 0 HG3 GLU A 505 -0.667 14.523 -12.141 1.00 0.00 H new ATOM 1229 N LYS A 506 -2.844 10.694 -14.777 1.00 0.00 N ATOM 1230 CA LYS A 506 -3.909 10.170 -15.624 1.00 0.00 C ATOM 1231 C LYS A 506 -5.199 9.994 -14.829 1.00 0.00 C ATOM 1232 O LYS A 506 -5.328 9.062 -14.037 1.00 0.00 O ATOM 1233 CB LYS A 506 -3.490 8.833 -16.238 1.00 0.00 C ATOM 1234 CG LYS A 506 -4.181 8.525 -17.555 1.00 0.00 C ATOM 1235 CD LYS A 506 -5.576 7.964 -17.335 1.00 0.00 C ATOM 1236 CE LYS A 506 -6.155 7.391 -18.619 1.00 0.00 C ATOM 1237 NZ LYS A 506 -6.614 8.462 -19.547 1.00 0.00 N ATOM 0 H LYS A 506 -2.982 10.535 -13.779 1.00 0.00 H new ATOM 0 HA LYS A 506 -4.090 10.889 -16.423 1.00 0.00 H new ATOM 0 HB2 LYS A 506 -2.411 8.837 -16.396 1.00 0.00 H new ATOM 0 HB3 LYS A 506 -3.705 8.034 -15.529 1.00 0.00 H new ATOM 0 HG2 LYS A 506 -4.243 9.433 -18.155 1.00 0.00 H new ATOM 0 HG3 LYS A 506 -3.585 7.809 -18.121 1.00 0.00 H new ATOM 0 HD2 LYS A 506 -5.540 7.186 -16.572 1.00 0.00 H new ATOM 0 HD3 LYS A 506 -6.230 8.750 -16.959 1.00 0.00 H new ATOM 0 HE2 LYS A 506 -5.402 6.779 -19.115 1.00 0.00 H new ATOM 0 HE3 LYS A 506 -6.992 6.735 -18.379 1.00 0.00 H new ATOM 0 HZ1 LYS A 506 -7.002 8.031 -20.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 506 -7.351 9.031 -19.083 1.00 0.00 H new ATOM 0 HZ3 LYS A 506 -5.810 9.073 -19.797 1.00 0.00 H new ATOM 1251 N GLU A 507 -6.151 10.896 -15.047 1.00 0.00 N ATOM 1252 CA GLU A 507 -7.431 10.838 -14.351 1.00 0.00 C ATOM 1253 C GLU A 507 -8.470 10.090 -15.182 1.00 0.00 C ATOM 1254 O GLU A 507 -8.958 10.599 -16.190 1.00 0.00 O ATOM 1255 CB GLU A 507 -7.932 12.250 -14.040 1.00 0.00 C ATOM 1256 CG GLU A 507 -9.084 12.283 -13.049 1.00 0.00 C ATOM 1257 CD GLU A 507 -9.393 13.685 -12.561 1.00 0.00 C ATOM 1258 OE1 GLU A 507 -8.673 14.173 -11.665 1.00 0.00 O ATOM 1259 OE2 GLU A 507 -10.355 14.294 -13.075 1.00 0.00 O ATOM 0 H GLU A 507 -6.060 11.675 -15.699 1.00 0.00 H new ATOM 0 HA GLU A 507 -7.282 10.298 -13.416 1.00 0.00 H new ATOM 0 HB2 GLU A 507 -7.106 12.840 -13.644 1.00 0.00 H new ATOM 0 HB3 GLU A 507 -8.248 12.727 -14.968 1.00 0.00 H new ATOM 0 HG2 GLU A 507 -9.973 11.861 -13.517 1.00 0.00 H new ATOM 0 HG3 GLU A 507 -8.842 11.650 -12.195 1.00 0.00 H new ATOM 1266 N VAL A 508 -8.802 8.877 -14.750 1.00 0.00 N ATOM 1267 CA VAL A 508 -9.782 8.058 -15.453 1.00 0.00 C ATOM 1268 C VAL A 508 -11.199 8.559 -15.201 1.00 0.00 C ATOM 1269 O VAL A 508 -11.891 8.071 -14.308 1.00 0.00 O ATOM 1270 CB VAL A 508 -9.688 6.581 -15.026 1.00 0.00 C ATOM 1271 CG1 VAL A 508 -8.727 5.823 -15.930 1.00 0.00 C ATOM 1272 CG2 VAL A 508 -9.260 6.473 -13.570 1.00 0.00 C ATOM 0 H VAL A 508 -8.407 8.440 -13.917 1.00 0.00 H new ATOM 0 HA VAL A 508 -9.556 8.137 -16.516 1.00 0.00 H new ATOM 0 HB VAL A 508 -10.675 6.129 -15.125 1.00 0.00 H new ATOM 0 HG11 VAL A 508 -8.674 4.782 -15.613 1.00 0.00 H new ATOM 0 HG12 VAL A 508 -9.082 5.871 -16.960 1.00 0.00 H new ATOM 0 HG13 VAL A 508 -7.736 6.273 -15.866 1.00 0.00 H new ATOM 0 HG21 VAL A 508 -9.199 5.423 -13.286 1.00 0.00 H new ATOM 0 HG22 VAL A 508 -8.284 6.941 -13.442 1.00 0.00 H new ATOM 0 HG23 VAL A 508 -9.990 6.978 -12.938 1.00 0.00 H new ATOM 1282 N GLU A 509 -11.625 9.536 -15.995 1.00 0.00 N ATOM 1283 CA GLU A 509 -12.961 10.104 -15.857 1.00 0.00 C ATOM 1284 C GLU A 509 -14.020 9.005 -15.837 1.00 0.00 C ATOM 1285 O GLU A 509 -13.919 8.019 -16.565 1.00 0.00 O ATOM 1286 CB GLU A 509 -13.245 11.080 -17.000 1.00 0.00 C ATOM 1287 CG GLU A 509 -14.365 12.062 -16.698 1.00 0.00 C ATOM 1288 CD GLU A 509 -14.683 12.965 -17.875 1.00 0.00 C ATOM 1289 OE1 GLU A 509 -14.358 12.585 -19.019 1.00 0.00 O ATOM 1290 OE2 GLU A 509 -15.256 14.051 -17.650 1.00 0.00 O ATOM 0 H GLU A 509 -11.065 9.950 -16.740 1.00 0.00 H new ATOM 0 HA GLU A 509 -13.003 10.643 -14.910 1.00 0.00 H new ATOM 0 HB2 GLU A 509 -12.336 11.637 -17.225 1.00 0.00 H new ATOM 0 HB3 GLU A 509 -13.502 10.513 -17.895 1.00 0.00 H new ATOM 0 HG2 GLU A 509 -15.261 11.509 -16.416 1.00 0.00 H new ATOM 0 HG3 GLU A 509 -14.085 12.674 -15.841 1.00 0.00 H new ATOM 1297 N GLU A 510 -15.035 9.184 -14.997 1.00 0.00 N ATOM 1298 CA GLU A 510 -16.111 8.208 -14.881 1.00 0.00 C ATOM 1299 C GLU A 510 -16.632 7.806 -16.258 1.00 0.00 C ATOM 1300 O GLU A 510 -16.600 8.597 -17.201 1.00 0.00 O ATOM 1301 CB GLU A 510 -17.254 8.773 -14.036 1.00 0.00 C ATOM 1302 CG GLU A 510 -17.919 9.993 -14.650 1.00 0.00 C ATOM 1303 CD GLU A 510 -19.074 10.511 -13.815 1.00 0.00 C ATOM 1304 OE1 GLU A 510 -19.821 9.680 -13.256 1.00 0.00 O ATOM 1305 OE2 GLU A 510 -19.232 11.746 -13.719 1.00 0.00 O ATOM 0 H GLU A 510 -15.134 9.996 -14.387 1.00 0.00 H new ATOM 0 HA GLU A 510 -15.710 7.321 -14.390 1.00 0.00 H new ATOM 0 HB2 GLU A 510 -18.004 7.996 -13.889 1.00 0.00 H new ATOM 0 HB3 GLU A 510 -16.870 9.036 -13.050 1.00 0.00 H new ATOM 0 HG2 GLU A 510 -17.179 10.784 -14.769 1.00 0.00 H new ATOM 0 HG3 GLU A 510 -18.281 9.742 -15.647 1.00 0.00 H new ATOM 1312 N LEU A 511 -17.112 6.572 -16.366 1.00 0.00 N ATOM 1313 CA LEU A 511 -17.640 6.064 -17.627 1.00 0.00 C ATOM 1314 C LEU A 511 -19.071 6.543 -17.850 1.00 0.00 C ATOM 1315 O LEU A 511 -19.904 5.814 -18.389 1.00 0.00 O ATOM 1316 CB LEU A 511 -17.593 4.535 -17.643 1.00 0.00 C ATOM 1317 CG LEU A 511 -18.033 3.836 -16.356 1.00 0.00 C ATOM 1318 CD1 LEU A 511 -16.878 3.756 -15.370 1.00 0.00 C ATOM 1319 CD2 LEU A 511 -19.218 4.561 -15.733 1.00 0.00 C ATOM 0 H LEU A 511 -17.146 5.905 -15.595 1.00 0.00 H new ATOM 0 HA LEU A 511 -17.018 6.449 -18.435 1.00 0.00 H new ATOM 0 HB2 LEU A 511 -18.223 4.181 -18.459 1.00 0.00 H new ATOM 0 HB3 LEU A 511 -16.573 4.225 -17.870 1.00 0.00 H new ATOM 0 HG LEU A 511 -18.343 2.821 -16.605 1.00 0.00 H new ATOM 0 HD11 LEU A 511 -17.210 3.256 -14.460 1.00 0.00 H new ATOM 0 HD12 LEU A 511 -16.058 3.193 -15.815 1.00 0.00 H new ATOM 0 HD13 LEU A 511 -16.537 4.762 -15.127 1.00 0.00 H new ATOM 0 HD21 LEU A 511 -19.517 4.050 -14.818 1.00 0.00 H new ATOM 0 HD22 LEU A 511 -18.935 5.587 -15.499 1.00 0.00 H new ATOM 0 HD23 LEU A 511 -20.052 4.566 -16.435 1.00 0.00 H new ATOM 1331 N LYS A 512 -19.348 7.774 -17.435 1.00 0.00 N ATOM 1332 CA LYS A 512 -20.677 8.353 -17.593 1.00 0.00 C ATOM 1333 C LYS A 512 -21.756 7.370 -17.148 1.00 0.00 C ATOM 1334 O LYS A 512 -22.800 7.248 -17.788 1.00 0.00 O ATOM 1335 CB LYS A 512 -20.910 8.758 -19.050 1.00 0.00 C ATOM 1336 CG LYS A 512 -20.396 10.147 -19.386 1.00 0.00 C ATOM 1337 CD LYS A 512 -21.241 10.810 -20.460 1.00 0.00 C ATOM 1338 CE LYS A 512 -22.378 11.620 -19.855 1.00 0.00 C ATOM 1339 NZ LYS A 512 -23.511 10.753 -19.429 1.00 0.00 N ATOM 0 H LYS A 512 -18.670 8.390 -16.987 1.00 0.00 H new ATOM 0 HA LYS A 512 -20.736 9.240 -16.962 1.00 0.00 H new ATOM 0 HB2 LYS A 512 -20.424 8.032 -19.702 1.00 0.00 H new ATOM 0 HB3 LYS A 512 -21.978 8.713 -19.264 1.00 0.00 H new ATOM 0 HG2 LYS A 512 -20.399 10.764 -18.487 1.00 0.00 H new ATOM 0 HG3 LYS A 512 -19.362 10.081 -19.724 1.00 0.00 H new ATOM 0 HD2 LYS A 512 -20.613 11.461 -21.068 1.00 0.00 H new ATOM 0 HD3 LYS A 512 -21.649 10.049 -21.125 1.00 0.00 H new ATOM 0 HE2 LYS A 512 -22.008 12.181 -18.997 1.00 0.00 H new ATOM 0 HE3 LYS A 512 -22.733 12.349 -20.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 512 -24.362 11.335 -19.295 1.00 0.00 H new ATOM 0 HZ2 LYS A 512 -23.693 10.036 -20.160 1.00 0.00 H new ATOM 0 HZ3 LYS A 512 -23.270 10.282 -18.534 1.00 0.00 H new ATOM 1353 N LYS A 513 -21.496 6.673 -16.048 1.00 0.00 N ATOM 1354 CA LYS A 513 -22.445 5.702 -15.515 1.00 0.00 C ATOM 1355 C LYS A 513 -23.875 6.224 -15.623 1.00 0.00 C ATOM 1356 O LYS A 513 -24.111 7.431 -15.571 1.00 0.00 O ATOM 1357 CB LYS A 513 -22.116 5.385 -14.055 1.00 0.00 C ATOM 1358 CG LYS A 513 -22.426 6.524 -13.099 1.00 0.00 C ATOM 1359 CD LYS A 513 -22.107 6.149 -11.662 1.00 0.00 C ATOM 1360 CE LYS A 513 -22.766 7.103 -10.678 1.00 0.00 C ATOM 1361 NZ LYS A 513 -22.006 7.195 -9.400 1.00 0.00 N ATOM 0 H LYS A 513 -20.636 6.762 -15.507 1.00 0.00 H new ATOM 0 HA LYS A 513 -22.364 4.790 -16.106 1.00 0.00 H new ATOM 0 HB2 LYS A 513 -22.677 4.502 -13.749 1.00 0.00 H new ATOM 0 HB3 LYS A 513 -21.058 5.134 -13.976 1.00 0.00 H new ATOM 0 HG2 LYS A 513 -21.850 7.405 -13.382 1.00 0.00 H new ATOM 0 HG3 LYS A 513 -23.479 6.792 -13.181 1.00 0.00 H new ATOM 0 HD2 LYS A 513 -22.446 5.132 -11.467 1.00 0.00 H new ATOM 0 HD3 LYS A 513 -21.027 6.160 -11.513 1.00 0.00 H new ATOM 0 HE2 LYS A 513 -22.842 8.093 -11.127 1.00 0.00 H new ATOM 0 HE3 LYS A 513 -23.783 6.768 -10.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 513 -22.488 7.855 -8.756 1.00 0.00 H new ATOM 0 HZ2 LYS A 513 -21.955 6.255 -8.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 513 -21.044 7.539 -9.592 1.00 0.00 H new ATOM 1375 N SER A 514 -24.825 5.306 -15.772 1.00 0.00 N ATOM 1376 CA SER A 514 -26.231 5.674 -15.889 1.00 0.00 C ATOM 1377 C SER A 514 -27.122 4.635 -15.215 1.00 0.00 C ATOM 1378 O SER A 514 -26.642 3.617 -14.717 1.00 0.00 O ATOM 1379 CB SER A 514 -26.621 5.819 -17.361 1.00 0.00 C ATOM 1380 OG SER A 514 -26.265 4.663 -18.099 1.00 0.00 O ATOM 0 H SER A 514 -24.646 4.303 -15.815 1.00 0.00 H new ATOM 0 HA SER A 514 -26.374 6.631 -15.387 1.00 0.00 H new ATOM 0 HB2 SER A 514 -27.695 5.989 -17.441 1.00 0.00 H new ATOM 0 HB3 SER A 514 -26.127 6.693 -17.787 1.00 0.00 H new ATOM 0 HG SER A 514 -26.526 4.780 -19.036 1.00 0.00 H new ATOM 1386 N GLY A 515 -28.425 4.900 -15.203 1.00 0.00 N ATOM 1387 CA GLY A 515 -29.364 3.980 -14.588 1.00 0.00 C ATOM 1388 C GLY A 515 -30.804 4.417 -14.766 1.00 0.00 C ATOM 1389 O GLY A 515 -31.280 5.343 -14.110 1.00 0.00 O ATOM 0 H GLY A 515 -28.847 5.736 -15.608 1.00 0.00 H new ATOM 0 HA2 GLY A 515 -29.232 2.988 -15.020 1.00 0.00 H new ATOM 0 HA3 GLY A 515 -29.142 3.896 -13.524 1.00 0.00 H new ATOM 1393 N PRO A 516 -31.524 3.740 -15.674 1.00 0.00 N ATOM 1394 CA PRO A 516 -32.929 4.047 -15.958 1.00 0.00 C ATOM 1395 C PRO A 516 -33.850 3.670 -14.803 1.00 0.00 C ATOM 1396 O PRO A 516 -33.391 3.233 -13.747 1.00 0.00 O ATOM 1397 CB PRO A 516 -33.237 3.191 -17.189 1.00 0.00 C ATOM 1398 CG PRO A 516 -32.269 2.061 -17.116 1.00 0.00 C ATOM 1399 CD PRO A 516 -31.022 2.624 -16.492 1.00 0.00 C ATOM 0 HA PRO A 516 -33.090 5.114 -16.112 1.00 0.00 H new ATOM 0 HB2 PRO A 516 -34.266 2.832 -17.174 1.00 0.00 H new ATOM 0 HB3 PRO A 516 -33.111 3.761 -18.109 1.00 0.00 H new ATOM 0 HG2 PRO A 516 -32.669 1.242 -16.518 1.00 0.00 H new ATOM 0 HG3 PRO A 516 -32.062 1.660 -18.108 1.00 0.00 H new ATOM 0 HD2 PRO A 516 -30.506 1.881 -15.884 1.00 0.00 H new ATOM 0 HD3 PRO A 516 -30.314 2.966 -17.247 1.00 0.00 H new ATOM 1407 N SER A 517 -35.152 3.841 -15.009 1.00 0.00 N ATOM 1408 CA SER A 517 -36.137 3.521 -13.983 1.00 0.00 C ATOM 1409 C SER A 517 -37.501 3.242 -14.608 1.00 0.00 C ATOM 1410 O SER A 517 -37.673 3.348 -15.822 1.00 0.00 O ATOM 1411 CB SER A 517 -36.249 4.669 -12.978 1.00 0.00 C ATOM 1412 OG SER A 517 -36.948 5.769 -13.535 1.00 0.00 O ATOM 0 H SER A 517 -35.549 4.199 -15.877 1.00 0.00 H new ATOM 0 HA SER A 517 -35.805 2.623 -13.462 1.00 0.00 H new ATOM 0 HB2 SER A 517 -36.764 4.323 -12.082 1.00 0.00 H new ATOM 0 HB3 SER A 517 -35.252 4.986 -12.670 1.00 0.00 H new ATOM 0 HG SER A 517 -37.007 6.488 -12.872 1.00 0.00 H new ATOM 1418 N SER A 518 -38.467 2.885 -13.768 1.00 0.00 N ATOM 1419 CA SER A 518 -39.816 2.587 -14.236 1.00 0.00 C ATOM 1420 C SER A 518 -40.831 2.747 -13.109 1.00 0.00 C ATOM 1421 O SER A 518 -40.464 2.962 -11.954 1.00 0.00 O ATOM 1422 CB SER A 518 -39.880 1.165 -14.798 1.00 0.00 C ATOM 1423 OG SER A 518 -39.528 0.211 -13.812 1.00 0.00 O ATOM 0 H SER A 518 -38.341 2.795 -12.760 1.00 0.00 H new ATOM 0 HA SER A 518 -40.064 3.295 -15.027 1.00 0.00 H new ATOM 0 HB2 SER A 518 -40.886 0.960 -15.164 1.00 0.00 H new ATOM 0 HB3 SER A 518 -39.207 1.077 -15.651 1.00 0.00 H new ATOM 0 HG SER A 518 -39.578 -0.689 -14.195 1.00 0.00 H new ATOM 1429 N GLY A 519 -42.111 2.640 -13.453 1.00 0.00 N ATOM 1430 CA GLY A 519 -43.160 2.776 -12.460 1.00 0.00 C ATOM 1431 C GLY A 519 -44.439 3.344 -13.042 1.00 0.00 C ATOM 1432 O GLY A 519 -44.369 4.155 -13.964 1.00 0.00 O ATOM 0 H GLY A 519 -42.440 2.462 -14.402 1.00 0.00 H new ATOM 0 HA2 GLY A 519 -43.367 1.801 -12.019 1.00 0.00 H new ATOM 0 HA3 GLY A 519 -42.812 3.423 -11.655 1.00 0.00 H new TER 1436 GLY A 519 HETATM 1437 ZN ZN A 622 -0.846 -7.816 -10.942 1.00 0.00 ZN HETATM 1438 ZN ZN A 822 -0.718 -3.682 5.427 1.00 0.00 ZN