USER MOD reduce.3.24.130724 H: found=0, std=0, add=689, rem=0, adj=20 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 461 LYS NZ :NH3+ 176:sc= -0.406 (180deg=-0.151) USER MOD Set 1.2: A 493 MET CE :methyl 147:sc= -1.2 (180deg=-3.1!) USER MOD Set 2.1: A 483 THR OG1 : rot -11:sc= -0.0662 USER MOD Set 2.2: A 486 THR OG1 : rot -174:sc= 1.17 USER MOD Set 3.1: A 433 LYS NZ :NH3+ 142:sc= 0.412 (180deg=-0.051) USER MOD Set 3.2: A 453 TYR OH : rot 180:sc= 0.382 USER MOD Single : A 423 SER OG : rot 180:sc= 0 USER MOD Single : A 424 SER OG : rot 180:sc= -0.0492 USER MOD Single : A 426 SER OG : rot 180:sc= 0 USER MOD Single : A 427 SER OG : rot -125:sc= 0.868 USER MOD Single : A 432 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 438 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 440 TYR OH : rot -146:sc= 0.0578 USER MOD Single : A 442 THR OG1 : rot -28:sc= 0.299 USER MOD Single : A 450 ASN : amide:sc= 0 K(o=0,f=-0.73) USER MOD Single : A 454 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 463 TYR OH : rot 180:sc= 0 USER MOD Single : A 464 HIS : no HD1:sc= -2.75 K(o=-2.8,f=-2) USER MOD Single : A 465 THR OG1 : rot -33:sc= 0.13 USER MOD Single : A 466 THR OG1 : rot 180:sc= 0 USER MOD Single : A 468 ASN : amide:sc= -0.0471 X(o=-0.047,f=-0.49) USER MOD Single : A 471 ASN : amide:sc= 0.313 K(o=0.31,f=-0.26) USER MOD Single : A 476 MET CE :methyl 149:sc= -0.488 (180deg=-3.06!) USER MOD Single : A 478 SER OG : rot 60:sc= 0.22 USER MOD Single : A 492 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 506 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 512 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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 15.325 -16.750 7.962 1.00 0.00 N ATOM 2 CA GLY A 422 16.066 -16.749 6.714 1.00 0.00 C ATOM 3 C GLY A 422 17.542 -17.033 6.917 1.00 0.00 C ATOM 4 O GLY A 422 18.202 -16.377 7.721 1.00 0.00 O ATOM 0 HA2 GLY A 422 15.644 -17.497 6.043 1.00 0.00 H new ATOM 0 HA3 GLY A 422 15.949 -15.781 6.226 1.00 0.00 H new ATOM 8 N SER A 423 18.059 -18.016 6.186 1.00 0.00 N ATOM 9 CA SER A 423 19.465 -18.389 6.293 1.00 0.00 C ATOM 10 C SER A 423 20.142 -18.355 4.927 1.00 0.00 C ATOM 11 O SER A 423 21.252 -17.842 4.784 1.00 0.00 O ATOM 12 CB SER A 423 19.598 -19.784 6.907 1.00 0.00 C ATOM 13 OG SER A 423 18.801 -20.726 6.209 1.00 0.00 O ATOM 0 H SER A 423 17.526 -18.568 5.514 1.00 0.00 H new ATOM 0 HA SER A 423 19.959 -17.665 6.941 1.00 0.00 H new ATOM 0 HB2 SER A 423 20.642 -20.097 6.883 1.00 0.00 H new ATOM 0 HB3 SER A 423 19.298 -19.754 7.954 1.00 0.00 H new ATOM 0 HG SER A 423 18.905 -21.610 6.619 1.00 0.00 H new ATOM 19 N SER A 424 19.465 -18.905 3.924 1.00 0.00 N ATOM 20 CA SER A 424 20.001 -18.942 2.569 1.00 0.00 C ATOM 21 C SER A 424 20.115 -17.534 1.991 1.00 0.00 C ATOM 22 O SER A 424 21.208 -17.066 1.677 1.00 0.00 O ATOM 23 CB SER A 424 19.114 -19.805 1.669 1.00 0.00 C ATOM 24 OG SER A 424 17.768 -19.363 1.706 1.00 0.00 O ATOM 0 H SER A 424 18.544 -19.331 4.025 1.00 0.00 H new ATOM 0 HA SER A 424 20.998 -19.381 2.612 1.00 0.00 H new ATOM 0 HB2 SER A 424 19.484 -19.768 0.645 1.00 0.00 H new ATOM 0 HB3 SER A 424 19.168 -20.845 1.990 1.00 0.00 H new ATOM 0 HG SER A 424 17.222 -19.929 1.122 1.00 0.00 H new ATOM 30 N GLY A 425 18.974 -16.864 1.854 1.00 0.00 N ATOM 31 CA GLY A 425 18.966 -15.517 1.314 1.00 0.00 C ATOM 32 C GLY A 425 19.044 -15.498 -0.200 1.00 0.00 C ATOM 33 O GLY A 425 18.295 -14.776 -0.858 1.00 0.00 O ATOM 0 H GLY A 425 18.056 -17.230 2.107 1.00 0.00 H new ATOM 0 HA2 GLY A 425 18.058 -15.006 1.634 1.00 0.00 H new ATOM 0 HA3 GLY A 425 19.807 -14.959 1.725 1.00 0.00 H new ATOM 37 N SER A 426 19.953 -16.293 -0.754 1.00 0.00 N ATOM 38 CA SER A 426 20.130 -16.361 -2.200 1.00 0.00 C ATOM 39 C SER A 426 18.836 -16.791 -2.886 1.00 0.00 C ATOM 40 O SER A 426 17.980 -17.431 -2.275 1.00 0.00 O ATOM 41 CB SER A 426 21.255 -17.336 -2.552 1.00 0.00 C ATOM 42 OG SER A 426 21.583 -17.260 -3.929 1.00 0.00 O ATOM 0 H SER A 426 20.579 -16.899 -0.224 1.00 0.00 H new ATOM 0 HA SER A 426 20.397 -15.366 -2.556 1.00 0.00 H new ATOM 0 HB2 SER A 426 22.137 -17.111 -1.952 1.00 0.00 H new ATOM 0 HB3 SER A 426 20.951 -18.353 -2.303 1.00 0.00 H new ATOM 0 HG SER A 426 22.306 -17.891 -4.128 1.00 0.00 H new ATOM 48 N SER A 427 18.702 -16.433 -4.159 1.00 0.00 N ATOM 49 CA SER A 427 17.511 -16.777 -4.928 1.00 0.00 C ATOM 50 C SER A 427 17.864 -17.030 -6.390 1.00 0.00 C ATOM 51 O SER A 427 18.233 -16.111 -7.120 1.00 0.00 O ATOM 52 CB SER A 427 16.473 -15.658 -4.828 1.00 0.00 C ATOM 53 OG SER A 427 17.025 -14.413 -5.222 1.00 0.00 O ATOM 0 H SER A 427 19.403 -15.905 -4.680 1.00 0.00 H new ATOM 0 HA SER A 427 17.090 -17.691 -4.510 1.00 0.00 H new ATOM 0 HB2 SER A 427 15.616 -15.895 -5.459 1.00 0.00 H new ATOM 0 HB3 SER A 427 16.106 -15.589 -3.804 1.00 0.00 H new ATOM 0 HG SER A 427 16.893 -13.756 -4.507 1.00 0.00 H new ATOM 59 N GLY A 428 17.748 -18.286 -6.812 1.00 0.00 N ATOM 60 CA GLY A 428 18.058 -18.639 -8.185 1.00 0.00 C ATOM 61 C GLY A 428 17.654 -17.558 -9.167 1.00 0.00 C ATOM 62 O GLY A 428 16.606 -16.931 -9.012 1.00 0.00 O ATOM 0 H GLY A 428 17.445 -19.065 -6.227 1.00 0.00 H new ATOM 0 HA2 GLY A 428 19.128 -18.827 -8.276 1.00 0.00 H new ATOM 0 HA3 GLY A 428 17.549 -19.568 -8.442 1.00 0.00 H new ATOM 66 N GLU A 429 18.487 -17.339 -10.179 1.00 0.00 N ATOM 67 CA GLU A 429 18.211 -16.323 -11.189 1.00 0.00 C ATOM 68 C GLU A 429 17.197 -16.833 -12.210 1.00 0.00 C ATOM 69 O GLU A 429 17.519 -17.667 -13.058 1.00 0.00 O ATOM 70 CB GLU A 429 19.503 -15.912 -11.898 1.00 0.00 C ATOM 71 CG GLU A 429 20.435 -15.083 -11.031 1.00 0.00 C ATOM 72 CD GLU A 429 20.653 -15.693 -9.660 1.00 0.00 C ATOM 73 OE1 GLU A 429 20.947 -16.905 -9.589 1.00 0.00 O ATOM 74 OE2 GLU A 429 20.529 -14.959 -8.657 1.00 0.00 O ATOM 0 H GLU A 429 19.358 -17.851 -10.322 1.00 0.00 H new ATOM 0 HA GLU A 429 17.789 -15.453 -10.686 1.00 0.00 H new ATOM 0 HB2 GLU A 429 20.028 -16.809 -12.227 1.00 0.00 H new ATOM 0 HB3 GLU A 429 19.251 -15.343 -12.793 1.00 0.00 H new ATOM 0 HG2 GLU A 429 21.396 -14.978 -11.535 1.00 0.00 H new ATOM 0 HG3 GLU A 429 20.023 -14.080 -10.917 1.00 0.00 H new ATOM 81 N LEU A 430 15.972 -16.327 -12.122 1.00 0.00 N ATOM 82 CA LEU A 430 14.910 -16.730 -13.037 1.00 0.00 C ATOM 83 C LEU A 430 14.077 -15.527 -13.468 1.00 0.00 C ATOM 84 O LEU A 430 14.065 -14.483 -12.816 1.00 0.00 O ATOM 85 CB LEU A 430 14.012 -17.778 -12.377 1.00 0.00 C ATOM 86 CG LEU A 430 14.454 -19.233 -12.531 1.00 0.00 C ATOM 87 CD1 LEU A 430 15.404 -19.624 -11.408 1.00 0.00 C ATOM 88 CD2 LEU A 430 13.246 -20.158 -12.556 1.00 0.00 C ATOM 0 H LEU A 430 15.689 -15.637 -11.426 1.00 0.00 H new ATOM 0 HA LEU A 430 15.373 -17.164 -13.924 1.00 0.00 H new ATOM 0 HB2 LEU A 430 13.944 -17.551 -11.313 1.00 0.00 H new ATOM 0 HB3 LEU A 430 13.008 -17.679 -12.789 1.00 0.00 H new ATOM 0 HG LEU A 430 14.983 -19.333 -13.479 1.00 0.00 H new ATOM 0 HD11 LEU A 430 15.708 -20.663 -11.534 1.00 0.00 H new ATOM 0 HD12 LEU A 430 16.285 -18.982 -11.436 1.00 0.00 H new ATOM 0 HD13 LEU A 430 14.901 -19.507 -10.448 1.00 0.00 H new ATOM 0 HD21 LEU A 430 13.580 -21.190 -12.666 1.00 0.00 H new ATOM 0 HD22 LEU A 430 12.689 -20.054 -11.625 1.00 0.00 H new ATOM 0 HD23 LEU A 430 12.602 -19.893 -13.395 1.00 0.00 H new ATOM 100 N PRO A 431 13.359 -15.676 -14.592 1.00 0.00 N ATOM 101 CA PRO A 431 12.507 -14.613 -15.133 1.00 0.00 C ATOM 102 C PRO A 431 11.279 -14.358 -14.266 1.00 0.00 C ATOM 103 O PRO A 431 10.183 -14.832 -14.568 1.00 0.00 O ATOM 104 CB PRO A 431 12.091 -15.155 -16.503 1.00 0.00 C ATOM 105 CG PRO A 431 12.188 -16.636 -16.370 1.00 0.00 C ATOM 106 CD PRO A 431 13.325 -16.893 -15.420 1.00 0.00 C ATOM 0 HA PRO A 431 13.027 -13.656 -15.178 1.00 0.00 H new ATOM 0 HB2 PRO A 431 11.078 -14.846 -16.760 1.00 0.00 H new ATOM 0 HB3 PRO A 431 12.747 -14.785 -17.291 1.00 0.00 H new ATOM 0 HG2 PRO A 431 11.257 -17.055 -15.987 1.00 0.00 H new ATOM 0 HG3 PRO A 431 12.374 -17.103 -17.337 1.00 0.00 H new ATOM 0 HD2 PRO A 431 13.151 -17.784 -14.817 1.00 0.00 H new ATOM 0 HD3 PRO A 431 14.265 -17.045 -15.950 1.00 0.00 H new ATOM 114 N LYS A 432 11.468 -13.605 -13.188 1.00 0.00 N ATOM 115 CA LYS A 432 10.375 -13.283 -12.278 1.00 0.00 C ATOM 116 C LYS A 432 10.555 -11.891 -11.681 1.00 0.00 C ATOM 117 O LYS A 432 11.591 -11.587 -11.089 1.00 0.00 O ATOM 118 CB LYS A 432 10.295 -14.323 -11.158 1.00 0.00 C ATOM 119 CG LYS A 432 9.876 -15.702 -11.637 1.00 0.00 C ATOM 120 CD LYS A 432 8.398 -15.746 -11.986 1.00 0.00 C ATOM 121 CE LYS A 432 7.880 -17.175 -12.041 1.00 0.00 C ATOM 122 NZ LYS A 432 8.029 -17.767 -13.399 1.00 0.00 N ATOM 0 H LYS A 432 12.368 -13.206 -12.923 1.00 0.00 H new ATOM 0 HA LYS A 432 9.445 -13.297 -12.847 1.00 0.00 H new ATOM 0 HB2 LYS A 432 11.268 -14.397 -10.672 1.00 0.00 H new ATOM 0 HB3 LYS A 432 9.587 -13.979 -10.404 1.00 0.00 H new ATOM 0 HG2 LYS A 432 10.465 -15.979 -12.511 1.00 0.00 H new ATOM 0 HG3 LYS A 432 10.090 -16.438 -10.862 1.00 0.00 H new ATOM 0 HD2 LYS A 432 7.831 -15.181 -11.246 1.00 0.00 H new ATOM 0 HD3 LYS A 432 8.236 -15.262 -12.949 1.00 0.00 H new ATOM 0 HE2 LYS A 432 8.421 -17.785 -11.317 1.00 0.00 H new ATOM 0 HE3 LYS A 432 6.830 -17.192 -11.751 1.00 0.00 H new ATOM 0 HZ1 LYS A 432 7.665 -18.741 -13.395 1.00 0.00 H new ATOM 0 HZ2 LYS A 432 7.493 -17.199 -14.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 432 9.034 -17.775 -13.666 1.00 0.00 H new ATOM 136 N LYS A 433 9.540 -11.049 -11.839 1.00 0.00 N ATOM 137 CA LYS A 433 9.584 -9.689 -11.314 1.00 0.00 C ATOM 138 C LYS A 433 9.158 -9.657 -9.850 1.00 0.00 C ATOM 139 O LYS A 433 8.039 -10.042 -9.511 1.00 0.00 O ATOM 140 CB LYS A 433 8.679 -8.772 -12.140 1.00 0.00 C ATOM 141 CG LYS A 433 9.035 -8.735 -13.616 1.00 0.00 C ATOM 142 CD LYS A 433 10.026 -7.625 -13.924 1.00 0.00 C ATOM 143 CE LYS A 433 10.041 -7.287 -15.407 1.00 0.00 C ATOM 144 NZ LYS A 433 8.842 -6.502 -15.809 1.00 0.00 N ATOM 0 H LYS A 433 8.676 -11.284 -12.327 1.00 0.00 H new ATOM 0 HA LYS A 433 10.612 -9.333 -11.383 1.00 0.00 H new ATOM 0 HB2 LYS A 433 7.646 -9.102 -12.032 1.00 0.00 H new ATOM 0 HB3 LYS A 433 8.734 -7.761 -11.736 1.00 0.00 H new ATOM 0 HG2 LYS A 433 9.458 -9.694 -13.913 1.00 0.00 H new ATOM 0 HG3 LYS A 433 8.130 -8.590 -14.206 1.00 0.00 H new ATOM 0 HD2 LYS A 433 9.768 -6.735 -13.350 1.00 0.00 H new ATOM 0 HD3 LYS A 433 11.024 -7.929 -13.609 1.00 0.00 H new ATOM 0 HE2 LYS A 433 10.942 -6.720 -15.641 1.00 0.00 H new ATOM 0 HE3 LYS A 433 10.084 -8.208 -15.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 433 9.116 -5.785 -16.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 433 8.133 -7.140 -16.224 1.00 0.00 H new ATOM 0 HZ3 LYS A 433 8.438 -6.032 -14.973 1.00 0.00 H new ATOM 158 N ARG A 434 10.057 -9.194 -8.987 1.00 0.00 N ATOM 159 CA ARG A 434 9.773 -9.112 -7.559 1.00 0.00 C ATOM 160 C ARG A 434 9.395 -7.688 -7.161 1.00 0.00 C ATOM 161 O ARG A 434 9.844 -7.181 -6.135 1.00 0.00 O ATOM 162 CB ARG A 434 10.986 -9.574 -6.749 1.00 0.00 C ATOM 163 CG ARG A 434 12.312 -9.348 -7.456 1.00 0.00 C ATOM 164 CD ARG A 434 12.651 -10.502 -8.387 1.00 0.00 C ATOM 165 NE ARG A 434 14.092 -10.643 -8.582 1.00 0.00 N ATOM 166 CZ ARG A 434 14.889 -11.281 -7.733 1.00 0.00 C ATOM 167 NH1 ARG A 434 14.389 -11.834 -6.637 1.00 0.00 N ATOM 168 NH2 ARG A 434 16.190 -11.366 -7.980 1.00 0.00 N ATOM 0 H ARG A 434 10.987 -8.870 -9.252 1.00 0.00 H new ATOM 0 HA ARG A 434 8.929 -9.768 -7.343 1.00 0.00 H new ATOM 0 HB2 ARG A 434 10.998 -9.046 -5.795 1.00 0.00 H new ATOM 0 HB3 ARG A 434 10.880 -10.635 -6.525 1.00 0.00 H new ATOM 0 HG2 ARG A 434 12.268 -8.420 -8.026 1.00 0.00 H new ATOM 0 HG3 ARG A 434 13.104 -9.231 -6.717 1.00 0.00 H new ATOM 0 HD2 ARG A 434 12.248 -11.428 -7.978 1.00 0.00 H new ATOM 0 HD3 ARG A 434 12.168 -10.343 -9.351 1.00 0.00 H new ATOM 0 HE ARG A 434 14.509 -10.229 -9.416 1.00 0.00 H new ATOM 0 HH11 ARG A 434 13.389 -11.770 -6.444 1.00 0.00 H new ATOM 0 HH12 ARG A 434 15.004 -12.323 -5.987 1.00 0.00 H new ATOM 0 HH21 ARG A 434 16.578 -10.941 -8.822 1.00 0.00 H new ATOM 0 HH22 ARG A 434 16.802 -11.856 -7.328 1.00 0.00 H new ATOM 182 N GLU A 435 8.566 -7.050 -7.982 1.00 0.00 N ATOM 183 CA GLU A 435 8.129 -5.685 -7.716 1.00 0.00 C ATOM 184 C GLU A 435 6.629 -5.637 -7.442 1.00 0.00 C ATOM 185 O GLU A 435 5.897 -6.574 -7.766 1.00 0.00 O ATOM 186 CB GLU A 435 8.473 -4.776 -8.898 1.00 0.00 C ATOM 187 CG GLU A 435 8.180 -3.307 -8.641 1.00 0.00 C ATOM 188 CD GLU A 435 9.029 -2.729 -7.526 1.00 0.00 C ATOM 189 OE1 GLU A 435 10.096 -3.307 -7.232 1.00 0.00 O ATOM 190 OE2 GLU A 435 8.625 -1.699 -6.947 1.00 0.00 O ATOM 0 H GLU A 435 8.184 -7.457 -8.836 1.00 0.00 H new ATOM 0 HA GLU A 435 8.654 -5.329 -6.829 1.00 0.00 H new ATOM 0 HB2 GLU A 435 9.530 -4.890 -9.138 1.00 0.00 H new ATOM 0 HB3 GLU A 435 7.910 -5.103 -9.773 1.00 0.00 H new ATOM 0 HG2 GLU A 435 8.354 -2.740 -9.556 1.00 0.00 H new ATOM 0 HG3 GLU A 435 7.126 -3.189 -8.388 1.00 0.00 H new ATOM 197 N LEU A 436 6.177 -4.541 -6.844 1.00 0.00 N ATOM 198 CA LEU A 436 4.764 -4.370 -6.526 1.00 0.00 C ATOM 199 C LEU A 436 3.956 -4.060 -7.783 1.00 0.00 C ATOM 200 O LEU A 436 3.999 -2.944 -8.302 1.00 0.00 O ATOM 201 CB LEU A 436 4.583 -3.248 -5.501 1.00 0.00 C ATOM 202 CG LEU A 436 3.140 -2.852 -5.187 1.00 0.00 C ATOM 203 CD1 LEU A 436 2.465 -3.922 -4.343 1.00 0.00 C ATOM 204 CD2 LEU A 436 3.099 -1.506 -4.478 1.00 0.00 C ATOM 0 H LEU A 436 6.769 -3.757 -6.569 1.00 0.00 H new ATOM 0 HA LEU A 436 4.397 -5.305 -6.102 1.00 0.00 H new ATOM 0 HB2 LEU A 436 5.066 -3.551 -4.572 1.00 0.00 H new ATOM 0 HB3 LEU A 436 5.111 -2.365 -5.862 1.00 0.00 H new ATOM 0 HG LEU A 436 2.595 -2.762 -6.127 1.00 0.00 H new ATOM 0 HD11 LEU A 436 1.439 -3.623 -4.129 1.00 0.00 H new ATOM 0 HD12 LEU A 436 2.462 -4.866 -4.887 1.00 0.00 H new ATOM 0 HD13 LEU A 436 3.010 -4.044 -3.407 1.00 0.00 H new ATOM 0 HD21 LEU A 436 2.064 -1.240 -4.262 1.00 0.00 H new ATOM 0 HD22 LEU A 436 3.660 -1.569 -3.545 1.00 0.00 H new ATOM 0 HD23 LEU A 436 3.544 -0.744 -5.118 1.00 0.00 H new ATOM 216 N CYS A 437 3.219 -5.054 -8.266 1.00 0.00 N ATOM 217 CA CYS A 437 2.400 -4.889 -9.460 1.00 0.00 C ATOM 218 C CYS A 437 1.676 -3.545 -9.442 1.00 0.00 C ATOM 219 O CYS A 437 1.118 -3.141 -8.422 1.00 0.00 O ATOM 220 CB CYS A 437 1.382 -6.027 -9.568 1.00 0.00 C ATOM 221 SG CYS A 437 0.478 -6.068 -11.148 1.00 0.00 S ATOM 0 H CYS A 437 3.172 -5.983 -7.848 1.00 0.00 H new ATOM 0 HA CYS A 437 3.059 -4.916 -10.328 1.00 0.00 H new ATOM 0 HB2 CYS A 437 1.899 -6.977 -9.433 1.00 0.00 H new ATOM 0 HB3 CYS A 437 0.664 -5.936 -8.753 1.00 0.00 H new ATOM 226 N LYS A 438 1.691 -2.857 -10.579 1.00 0.00 N ATOM 227 CA LYS A 438 1.036 -1.560 -10.696 1.00 0.00 C ATOM 228 C LYS A 438 -0.482 -1.713 -10.683 1.00 0.00 C ATOM 229 O LYS A 438 -1.216 -0.724 -10.667 1.00 0.00 O ATOM 230 CB LYS A 438 1.477 -0.857 -11.982 1.00 0.00 C ATOM 231 CG LYS A 438 2.818 -0.155 -11.862 1.00 0.00 C ATOM 232 CD LYS A 438 3.964 -1.072 -12.256 1.00 0.00 C ATOM 233 CE LYS A 438 4.523 -1.815 -11.052 1.00 0.00 C ATOM 234 NZ LYS A 438 5.635 -1.065 -10.405 1.00 0.00 N ATOM 0 H LYS A 438 2.150 -3.176 -11.432 1.00 0.00 H new ATOM 0 HA LYS A 438 1.330 -0.954 -9.839 1.00 0.00 H new ATOM 0 HB2 LYS A 438 1.531 -1.590 -12.787 1.00 0.00 H new ATOM 0 HB3 LYS A 438 0.719 -0.127 -12.266 1.00 0.00 H new ATOM 0 HG2 LYS A 438 2.824 0.731 -12.497 1.00 0.00 H new ATOM 0 HG3 LYS A 438 2.960 0.187 -10.837 1.00 0.00 H new ATOM 0 HD2 LYS A 438 3.618 -1.790 -12.999 1.00 0.00 H new ATOM 0 HD3 LYS A 438 4.756 -0.486 -12.723 1.00 0.00 H new ATOM 0 HE2 LYS A 438 3.727 -1.982 -10.326 1.00 0.00 H new ATOM 0 HE3 LYS A 438 4.880 -2.796 -11.364 1.00 0.00 H new ATOM 0 HZ1 LYS A 438 5.989 -1.604 -9.589 1.00 0.00 H new ATOM 0 HZ2 LYS A 438 6.406 -0.928 -11.090 1.00 0.00 H new ATOM 0 HZ3 LYS A 438 5.288 -0.139 -10.084 1.00 0.00 H new ATOM 248 N PHE A 439 -0.946 -2.958 -10.688 1.00 0.00 N ATOM 249 CA PHE A 439 -2.377 -3.240 -10.676 1.00 0.00 C ATOM 250 C PHE A 439 -2.823 -3.729 -9.301 1.00 0.00 C ATOM 251 O PHE A 439 -3.801 -3.232 -8.741 1.00 0.00 O ATOM 252 CB PHE A 439 -2.721 -4.287 -11.738 1.00 0.00 C ATOM 253 CG PHE A 439 -2.394 -3.850 -13.137 1.00 0.00 C ATOM 254 CD1 PHE A 439 -3.094 -2.815 -13.735 1.00 0.00 C ATOM 255 CD2 PHE A 439 -1.388 -4.476 -13.855 1.00 0.00 C ATOM 256 CE1 PHE A 439 -2.796 -2.411 -15.023 1.00 0.00 C ATOM 257 CE2 PHE A 439 -1.085 -4.076 -15.143 1.00 0.00 C ATOM 258 CZ PHE A 439 -1.790 -3.043 -15.728 1.00 0.00 C ATOM 0 H PHE A 439 -0.353 -3.787 -10.700 1.00 0.00 H new ATOM 0 HA PHE A 439 -2.906 -2.315 -10.903 1.00 0.00 H new ATOM 0 HB2 PHE A 439 -2.181 -5.208 -11.518 1.00 0.00 H new ATOM 0 HB3 PHE A 439 -3.784 -4.519 -11.677 1.00 0.00 H new ATOM 0 HD1 PHE A 439 -3.882 -2.318 -13.189 1.00 0.00 H new ATOM 0 HD2 PHE A 439 -0.834 -5.286 -13.403 1.00 0.00 H new ATOM 0 HE1 PHE A 439 -3.349 -1.602 -15.478 1.00 0.00 H new ATOM 0 HE2 PHE A 439 -0.297 -4.571 -15.691 1.00 0.00 H new ATOM 0 HZ PHE A 439 -1.555 -2.730 -16.735 1.00 0.00 H new ATOM 268 N TYR A 440 -2.100 -4.705 -8.763 1.00 0.00 N ATOM 269 CA TYR A 440 -2.423 -5.263 -7.455 1.00 0.00 C ATOM 270 C TYR A 440 -2.770 -4.159 -6.462 1.00 0.00 C ATOM 271 O TYR A 440 -3.633 -4.332 -5.601 1.00 0.00 O ATOM 272 CB TYR A 440 -1.249 -6.089 -6.927 1.00 0.00 C ATOM 273 CG TYR A 440 -1.595 -6.928 -5.717 1.00 0.00 C ATOM 274 CD1 TYR A 440 -2.483 -7.991 -5.815 1.00 0.00 C ATOM 275 CD2 TYR A 440 -1.034 -6.656 -4.475 1.00 0.00 C ATOM 276 CE1 TYR A 440 -2.803 -8.759 -4.712 1.00 0.00 C ATOM 277 CE2 TYR A 440 -1.346 -7.419 -3.368 1.00 0.00 C ATOM 278 CZ TYR A 440 -2.231 -8.470 -3.491 1.00 0.00 C ATOM 279 OH TYR A 440 -2.546 -9.232 -2.390 1.00 0.00 O ATOM 0 H TYR A 440 -1.287 -5.126 -9.212 1.00 0.00 H new ATOM 0 HA TYR A 440 -3.293 -5.910 -7.569 1.00 0.00 H new ATOM 0 HB2 TYR A 440 -0.889 -6.743 -7.721 1.00 0.00 H new ATOM 0 HB3 TYR A 440 -0.429 -5.418 -6.671 1.00 0.00 H new ATOM 0 HD1 TYR A 440 -2.931 -8.221 -6.770 1.00 0.00 H new ATOM 0 HD2 TYR A 440 -0.342 -5.833 -4.374 1.00 0.00 H new ATOM 0 HE1 TYR A 440 -3.497 -9.581 -4.806 1.00 0.00 H new ATOM 0 HE2 TYR A 440 -0.900 -7.194 -2.411 1.00 0.00 H new ATOM 0 HH TYR A 440 -2.544 -8.667 -1.590 1.00 0.00 H new ATOM 289 N ILE A 441 -2.092 -3.023 -6.589 1.00 0.00 N ATOM 290 CA ILE A 441 -2.330 -1.889 -5.704 1.00 0.00 C ATOM 291 C ILE A 441 -3.822 -1.656 -5.498 1.00 0.00 C ATOM 292 O ILE A 441 -4.265 -1.335 -4.395 1.00 0.00 O ATOM 293 CB ILE A 441 -1.692 -0.601 -6.257 1.00 0.00 C ATOM 294 CG1 ILE A 441 -0.184 -0.789 -6.438 1.00 0.00 C ATOM 295 CG2 ILE A 441 -1.978 0.571 -5.331 1.00 0.00 C ATOM 296 CD1 ILE A 441 0.477 0.336 -7.203 1.00 0.00 C ATOM 0 H ILE A 441 -1.374 -2.863 -7.296 1.00 0.00 H new ATOM 0 HA ILE A 441 -1.868 -2.132 -4.747 1.00 0.00 H new ATOM 0 HB ILE A 441 -2.131 -0.385 -7.231 1.00 0.00 H new ATOM 0 HG12 ILE A 441 0.284 -0.875 -5.457 1.00 0.00 H new ATOM 0 HG13 ILE A 441 -0.003 -1.728 -6.960 1.00 0.00 H new ATOM 0 HG21 ILE A 441 -1.521 1.474 -5.735 1.00 0.00 H new ATOM 0 HG22 ILE A 441 -3.055 0.715 -5.249 1.00 0.00 H new ATOM 0 HG23 ILE A 441 -1.563 0.365 -4.344 1.00 0.00 H new ATOM 0 HD11 ILE A 441 1.545 0.136 -7.293 1.00 0.00 H new ATOM 0 HD12 ILE A 441 0.036 0.408 -8.197 1.00 0.00 H new ATOM 0 HD13 ILE A 441 0.327 1.275 -6.671 1.00 0.00 H new ATOM 308 N THR A 442 -4.595 -1.822 -6.567 1.00 0.00 N ATOM 309 CA THR A 442 -6.039 -1.631 -6.503 1.00 0.00 C ATOM 310 C THR A 442 -6.766 -2.966 -6.398 1.00 0.00 C ATOM 311 O THR A 442 -7.767 -3.086 -5.692 1.00 0.00 O ATOM 312 CB THR A 442 -6.560 -0.871 -7.737 1.00 0.00 C ATOM 313 OG1 THR A 442 -6.309 -1.632 -8.924 1.00 0.00 O ATOM 314 CG2 THR A 442 -5.894 0.493 -7.854 1.00 0.00 C ATOM 0 H THR A 442 -4.245 -2.088 -7.487 1.00 0.00 H new ATOM 0 HA THR A 442 -6.240 -1.040 -5.610 1.00 0.00 H new ATOM 0 HB THR A 442 -7.634 -0.725 -7.619 1.00 0.00 H new ATOM 0 HG1 THR A 442 -5.521 -2.199 -8.789 1.00 0.00 H new ATOM 0 HG21 THR A 442 -6.278 1.011 -8.733 1.00 0.00 H new ATOM 0 HG22 THR A 442 -6.111 1.081 -6.962 1.00 0.00 H new ATOM 0 HG23 THR A 442 -4.816 0.364 -7.951 1.00 0.00 H new ATOM 322 N GLY A 443 -6.256 -3.970 -7.106 1.00 0.00 N ATOM 323 CA GLY A 443 -6.871 -5.284 -7.078 1.00 0.00 C ATOM 324 C GLY A 443 -7.393 -5.709 -8.436 1.00 0.00 C ATOM 325 O GLY A 443 -7.871 -6.832 -8.602 1.00 0.00 O ATOM 0 H GLY A 443 -5.429 -3.896 -7.698 1.00 0.00 H new ATOM 0 HA2 GLY A 443 -6.143 -6.015 -6.727 1.00 0.00 H new ATOM 0 HA3 GLY A 443 -7.692 -5.282 -6.361 1.00 0.00 H new ATOM 329 N PHE A 444 -7.304 -4.810 -9.410 1.00 0.00 N ATOM 330 CA PHE A 444 -7.774 -5.096 -10.761 1.00 0.00 C ATOM 331 C PHE A 444 -6.611 -5.479 -11.672 1.00 0.00 C ATOM 332 O PHE A 444 -6.146 -4.671 -12.476 1.00 0.00 O ATOM 333 CB PHE A 444 -8.509 -3.884 -11.336 1.00 0.00 C ATOM 334 CG PHE A 444 -8.664 -3.929 -12.829 1.00 0.00 C ATOM 335 CD1 PHE A 444 -9.259 -5.018 -13.445 1.00 0.00 C ATOM 336 CD2 PHE A 444 -8.213 -2.882 -13.617 1.00 0.00 C ATOM 337 CE1 PHE A 444 -9.403 -5.063 -14.819 1.00 0.00 C ATOM 338 CE2 PHE A 444 -8.354 -2.921 -14.991 1.00 0.00 C ATOM 339 CZ PHE A 444 -8.949 -4.013 -15.593 1.00 0.00 C ATOM 0 H PHE A 444 -6.911 -3.877 -9.289 1.00 0.00 H new ATOM 0 HA PHE A 444 -8.464 -5.938 -10.708 1.00 0.00 H new ATOM 0 HB2 PHE A 444 -9.496 -3.817 -10.878 1.00 0.00 H new ATOM 0 HB3 PHE A 444 -7.968 -2.978 -11.062 1.00 0.00 H new ATOM 0 HD1 PHE A 444 -9.615 -5.842 -12.844 1.00 0.00 H new ATOM 0 HD2 PHE A 444 -7.746 -2.026 -13.152 1.00 0.00 H new ATOM 0 HE1 PHE A 444 -9.870 -5.918 -15.286 1.00 0.00 H new ATOM 0 HE2 PHE A 444 -7.999 -2.098 -15.594 1.00 0.00 H new ATOM 0 HZ PHE A 444 -9.059 -4.046 -16.667 1.00 0.00 H new ATOM 349 N CYS A 445 -6.147 -6.717 -11.539 1.00 0.00 N ATOM 350 CA CYS A 445 -5.038 -7.209 -12.348 1.00 0.00 C ATOM 351 C CYS A 445 -5.499 -8.323 -13.283 1.00 0.00 C ATOM 352 O CYS A 445 -5.768 -9.442 -12.846 1.00 0.00 O ATOM 353 CB CYS A 445 -3.909 -7.716 -11.449 1.00 0.00 C ATOM 354 SG CYS A 445 -2.506 -8.444 -12.356 1.00 0.00 S ATOM 0 H CYS A 445 -6.522 -7.398 -10.879 1.00 0.00 H new ATOM 0 HA CYS A 445 -4.667 -6.382 -12.953 1.00 0.00 H new ATOM 0 HB2 CYS A 445 -3.544 -6.889 -10.840 1.00 0.00 H new ATOM 0 HB3 CYS A 445 -4.312 -8.462 -10.764 1.00 0.00 H new ATOM 359 N ALA A 446 -5.587 -8.009 -14.571 1.00 0.00 N ATOM 360 CA ALA A 446 -6.013 -8.984 -15.568 1.00 0.00 C ATOM 361 C ALA A 446 -5.407 -10.355 -15.289 1.00 0.00 C ATOM 362 O ALA A 446 -6.127 -11.335 -15.098 1.00 0.00 O ATOM 363 CB ALA A 446 -5.634 -8.511 -16.964 1.00 0.00 C ATOM 0 H ALA A 446 -5.369 -7.087 -14.949 1.00 0.00 H new ATOM 0 HA ALA A 446 -7.097 -9.077 -15.510 1.00 0.00 H new ATOM 0 HB1 ALA A 446 -5.958 -9.248 -17.698 1.00 0.00 H new ATOM 0 HB2 ALA A 446 -6.120 -7.557 -17.169 1.00 0.00 H new ATOM 0 HB3 ALA A 446 -4.553 -8.388 -17.026 1.00 0.00 H new ATOM 369 N ARG A 447 -4.079 -10.417 -15.267 1.00 0.00 N ATOM 370 CA ARG A 447 -3.377 -11.669 -15.013 1.00 0.00 C ATOM 371 C ARG A 447 -3.239 -11.921 -13.515 1.00 0.00 C ATOM 372 O ARG A 447 -2.506 -11.216 -12.822 1.00 0.00 O ATOM 373 CB ARG A 447 -1.994 -11.644 -15.667 1.00 0.00 C ATOM 374 CG ARG A 447 -2.025 -11.888 -17.167 1.00 0.00 C ATOM 375 CD ARG A 447 -0.623 -11.921 -17.755 1.00 0.00 C ATOM 376 NE ARG A 447 -0.641 -12.105 -19.203 1.00 0.00 N ATOM 377 CZ ARG A 447 -0.746 -11.104 -20.070 1.00 0.00 C ATOM 378 NH1 ARG A 447 -0.841 -9.855 -19.636 1.00 0.00 N ATOM 379 NH2 ARG A 447 -0.755 -11.351 -21.374 1.00 0.00 N ATOM 0 H ARG A 447 -3.468 -9.615 -15.422 1.00 0.00 H new ATOM 0 HA ARG A 447 -3.962 -12.479 -15.447 1.00 0.00 H new ATOM 0 HB2 ARG A 447 -1.528 -10.678 -15.474 1.00 0.00 H new ATOM 0 HB3 ARG A 447 -1.366 -12.401 -15.197 1.00 0.00 H new ATOM 0 HG2 ARG A 447 -2.529 -12.832 -17.373 1.00 0.00 H new ATOM 0 HG3 ARG A 447 -2.606 -11.104 -17.652 1.00 0.00 H new ATOM 0 HD2 ARG A 447 -0.107 -10.992 -17.514 1.00 0.00 H new ATOM 0 HD3 ARG A 447 -0.056 -12.729 -17.294 1.00 0.00 H new ATOM 0 HE ARG A 447 -0.569 -13.054 -19.569 1.00 0.00 H new ATOM 0 HH11 ARG A 447 -0.834 -9.661 -18.635 1.00 0.00 H new ATOM 0 HH12 ARG A 447 -0.922 -9.088 -20.303 1.00 0.00 H new ATOM 0 HH21 ARG A 447 -0.681 -12.311 -21.712 1.00 0.00 H new ATOM 0 HH22 ARG A 447 -0.836 -10.581 -22.038 1.00 0.00 H new ATOM 393 N ALA A 448 -3.949 -12.930 -13.021 1.00 0.00 N ATOM 394 CA ALA A 448 -3.905 -13.275 -11.606 1.00 0.00 C ATOM 395 C ALA A 448 -2.674 -14.117 -11.285 1.00 0.00 C ATOM 396 O ALA A 448 -1.698 -13.617 -10.729 1.00 0.00 O ATOM 397 CB ALA A 448 -5.172 -14.014 -11.203 1.00 0.00 C ATOM 0 H ALA A 448 -4.562 -13.523 -13.581 1.00 0.00 H new ATOM 0 HA ALA A 448 -3.840 -12.350 -11.033 1.00 0.00 H new ATOM 0 HB1 ALA A 448 -5.125 -14.265 -10.143 1.00 0.00 H new ATOM 0 HB2 ALA A 448 -6.038 -13.378 -11.387 1.00 0.00 H new ATOM 0 HB3 ALA A 448 -5.262 -14.929 -11.789 1.00 0.00 H new ATOM 403 N GLU A 449 -2.730 -15.397 -11.639 1.00 0.00 N ATOM 404 CA GLU A 449 -1.620 -16.308 -11.386 1.00 0.00 C ATOM 405 C GLU A 449 -0.546 -16.168 -12.461 1.00 0.00 C ATOM 406 O GLU A 449 0.516 -16.783 -12.375 1.00 0.00 O ATOM 407 CB GLU A 449 -2.119 -17.754 -11.333 1.00 0.00 C ATOM 408 CG GLU A 449 -1.100 -18.729 -10.768 1.00 0.00 C ATOM 409 CD GLU A 449 -1.073 -18.732 -9.252 1.00 0.00 C ATOM 410 OE1 GLU A 449 -1.004 -17.635 -8.659 1.00 0.00 O ATOM 411 OE2 GLU A 449 -1.121 -19.830 -8.659 1.00 0.00 O ATOM 0 H GLU A 449 -3.531 -15.826 -12.101 1.00 0.00 H new ATOM 0 HA GLU A 449 -1.182 -16.047 -10.423 1.00 0.00 H new ATOM 0 HB2 GLU A 449 -3.024 -17.795 -10.727 1.00 0.00 H new ATOM 0 HB3 GLU A 449 -2.394 -18.072 -12.339 1.00 0.00 H new ATOM 0 HG2 GLU A 449 -1.327 -19.733 -11.125 1.00 0.00 H new ATOM 0 HG3 GLU A 449 -0.110 -18.473 -11.145 1.00 0.00 H new ATOM 418 N ASN A 450 -0.832 -15.355 -13.472 1.00 0.00 N ATOM 419 CA ASN A 450 0.108 -15.135 -14.565 1.00 0.00 C ATOM 420 C ASN A 450 0.875 -13.831 -14.368 1.00 0.00 C ATOM 421 O ASN A 450 1.627 -13.402 -15.244 1.00 0.00 O ATOM 422 CB ASN A 450 -0.631 -15.107 -15.904 1.00 0.00 C ATOM 423 CG ASN A 450 -1.436 -16.370 -16.146 1.00 0.00 C ATOM 424 OD1 ASN A 450 -1.152 -17.420 -15.572 1.00 0.00 O ATOM 425 ND2 ASN A 450 -2.448 -16.271 -17.001 1.00 0.00 N ATOM 0 H ASN A 450 -1.707 -14.838 -13.557 1.00 0.00 H new ATOM 0 HA ASN A 450 0.821 -15.959 -14.569 1.00 0.00 H new ATOM 0 HB2 ASN A 450 -1.297 -14.244 -15.931 1.00 0.00 H new ATOM 0 HB3 ASN A 450 0.090 -14.978 -16.711 1.00 0.00 H new ATOM 0 HD21 ASN A 450 -3.026 -17.087 -17.204 1.00 0.00 H new ATOM 0 HD22 ASN A 450 -2.647 -15.379 -17.454 1.00 0.00 H new ATOM 432 N CYS A 451 0.680 -13.205 -13.212 1.00 0.00 N ATOM 433 CA CYS A 451 1.353 -11.950 -12.898 1.00 0.00 C ATOM 434 C CYS A 451 2.784 -12.202 -12.432 1.00 0.00 C ATOM 435 O CYS A 451 3.026 -12.749 -11.356 1.00 0.00 O ATOM 436 CB CYS A 451 0.580 -11.189 -11.820 1.00 0.00 C ATOM 437 SG CYS A 451 1.217 -9.515 -11.490 1.00 0.00 S ATOM 0 H CYS A 451 0.061 -13.547 -12.477 1.00 0.00 H new ATOM 0 HA CYS A 451 1.386 -11.347 -13.805 1.00 0.00 H new ATOM 0 HB2 CYS A 451 -0.465 -11.116 -12.121 1.00 0.00 H new ATOM 0 HB3 CYS A 451 0.606 -11.765 -10.895 1.00 0.00 H new ATOM 442 N PRO A 452 3.757 -11.794 -13.261 1.00 0.00 N ATOM 443 CA PRO A 452 5.180 -11.963 -12.955 1.00 0.00 C ATOM 444 C PRO A 452 5.639 -11.062 -11.814 1.00 0.00 C ATOM 445 O PRO A 452 6.814 -11.058 -11.447 1.00 0.00 O ATOM 446 CB PRO A 452 5.873 -11.567 -14.261 1.00 0.00 C ATOM 447 CG PRO A 452 4.914 -10.649 -14.935 1.00 0.00 C ATOM 448 CD PRO A 452 3.541 -11.134 -14.560 1.00 0.00 C ATOM 0 HA PRO A 452 5.408 -12.977 -12.626 1.00 0.00 H new ATOM 0 HB2 PRO A 452 6.826 -11.073 -14.070 1.00 0.00 H new ATOM 0 HB3 PRO A 452 6.085 -12.441 -14.878 1.00 0.00 H new ATOM 0 HG2 PRO A 452 5.066 -9.620 -14.611 1.00 0.00 H new ATOM 0 HG3 PRO A 452 5.052 -10.666 -16.016 1.00 0.00 H new ATOM 0 HD2 PRO A 452 2.832 -10.310 -14.480 1.00 0.00 H new ATOM 0 HD3 PRO A 452 3.143 -11.826 -15.302 1.00 0.00 H new ATOM 456 N TYR A 453 4.705 -10.299 -11.256 1.00 0.00 N ATOM 457 CA TYR A 453 5.015 -9.391 -10.158 1.00 0.00 C ATOM 458 C TYR A 453 4.566 -9.979 -8.823 1.00 0.00 C ATOM 459 O TYR A 453 4.015 -11.078 -8.770 1.00 0.00 O ATOM 460 CB TYR A 453 4.342 -8.036 -10.383 1.00 0.00 C ATOM 461 CG TYR A 453 5.043 -7.175 -11.409 1.00 0.00 C ATOM 462 CD1 TYR A 453 4.801 -7.344 -12.767 1.00 0.00 C ATOM 463 CD2 TYR A 453 5.948 -6.195 -11.022 1.00 0.00 C ATOM 464 CE1 TYR A 453 5.440 -6.560 -13.709 1.00 0.00 C ATOM 465 CE2 TYR A 453 6.590 -5.406 -11.956 1.00 0.00 C ATOM 466 CZ TYR A 453 6.333 -5.592 -13.299 1.00 0.00 C ATOM 467 OH TYR A 453 6.972 -4.809 -14.233 1.00 0.00 O ATOM 0 H TYR A 453 3.727 -10.291 -11.546 1.00 0.00 H new ATOM 0 HA TYR A 453 6.096 -9.252 -10.129 1.00 0.00 H new ATOM 0 HB2 TYR A 453 3.312 -8.200 -10.701 1.00 0.00 H new ATOM 0 HB3 TYR A 453 4.302 -7.498 -9.436 1.00 0.00 H new ATOM 0 HD1 TYR A 453 4.102 -8.101 -13.092 1.00 0.00 H new ATOM 0 HD2 TYR A 453 6.153 -6.047 -9.972 1.00 0.00 H new ATOM 0 HE1 TYR A 453 5.241 -6.705 -14.761 1.00 0.00 H new ATOM 0 HE2 TYR A 453 7.289 -4.647 -11.637 1.00 0.00 H new ATOM 0 HH TYR A 453 7.566 -4.177 -13.778 1.00 0.00 H new ATOM 477 N MET A 454 4.807 -9.237 -7.747 1.00 0.00 N ATOM 478 CA MET A 454 4.426 -9.682 -6.412 1.00 0.00 C ATOM 479 C MET A 454 3.072 -9.105 -6.011 1.00 0.00 C ATOM 480 O MET A 454 2.751 -7.963 -6.342 1.00 0.00 O ATOM 481 CB MET A 454 5.490 -9.273 -5.392 1.00 0.00 C ATOM 482 CG MET A 454 6.806 -10.016 -5.555 1.00 0.00 C ATOM 483 SD MET A 454 6.774 -11.658 -4.811 1.00 0.00 S ATOM 484 CE MET A 454 7.769 -11.386 -3.346 1.00 0.00 C ATOM 0 H MET A 454 5.264 -8.326 -7.774 1.00 0.00 H new ATOM 0 HA MET A 454 4.347 -10.769 -6.428 1.00 0.00 H new ATOM 0 HB2 MET A 454 5.673 -8.202 -5.480 1.00 0.00 H new ATOM 0 HB3 MET A 454 5.105 -9.449 -4.387 1.00 0.00 H new ATOM 0 HG2 MET A 454 7.038 -10.107 -6.616 1.00 0.00 H new ATOM 0 HG3 MET A 454 7.607 -9.432 -5.102 1.00 0.00 H new ATOM 0 HE1 MET A 454 7.842 -12.314 -2.779 1.00 0.00 H new ATOM 0 HE2 MET A 454 8.767 -11.060 -3.639 1.00 0.00 H new ATOM 0 HE3 MET A 454 7.304 -10.618 -2.728 1.00 0.00 H new ATOM 494 N HIS A 455 2.282 -9.901 -5.297 1.00 0.00 N ATOM 495 CA HIS A 455 0.963 -9.467 -4.851 1.00 0.00 C ATOM 496 C HIS A 455 0.863 -9.508 -3.329 1.00 0.00 C ATOM 497 O HIS A 455 0.949 -8.477 -2.664 1.00 0.00 O ATOM 498 CB HIS A 455 -0.123 -10.350 -5.469 1.00 0.00 C ATOM 499 CG HIS A 455 -0.479 -9.966 -6.872 1.00 0.00 C ATOM 500 ND1 HIS A 455 -1.581 -10.468 -7.532 1.00 0.00 N ATOM 501 CD2 HIS A 455 0.126 -9.123 -7.741 1.00 0.00 C ATOM 502 CE1 HIS A 455 -1.636 -9.952 -8.747 1.00 0.00 C ATOM 503 NE2 HIS A 455 -0.612 -9.132 -8.898 1.00 0.00 N ATOM 0 H HIS A 455 2.532 -10.849 -5.015 1.00 0.00 H new ATOM 0 HA HIS A 455 0.816 -8.438 -5.179 1.00 0.00 H new ATOM 0 HB2 HIS A 455 0.214 -11.387 -5.459 1.00 0.00 H new ATOM 0 HB3 HIS A 455 -1.018 -10.299 -4.849 1.00 0.00 H new ATOM 0 HD1 HIS A 455 -2.249 -11.133 -7.143 1.00 0.00 H new ATOM 0 HD2 HIS A 455 1.023 -8.550 -7.558 1.00 0.00 H new ATOM 0 HE1 HIS A 455 -2.390 -10.165 -9.490 1.00 0.00 H new ATOM 511 N GLY A 456 0.680 -10.708 -2.785 1.00 0.00 N ATOM 512 CA GLY A 456 0.571 -10.860 -1.346 1.00 0.00 C ATOM 513 C GLY A 456 1.923 -10.879 -0.660 1.00 0.00 C ATOM 514 O GLY A 456 2.231 -9.998 0.144 1.00 0.00 O ATOM 0 H GLY A 456 0.605 -11.576 -3.315 1.00 0.00 H new ATOM 0 HA2 GLY A 456 -0.026 -10.043 -0.942 1.00 0.00 H new ATOM 0 HA3 GLY A 456 0.040 -11.785 -1.121 1.00 0.00 H new ATOM 518 N ASP A 457 2.731 -11.884 -0.977 1.00 0.00 N ATOM 519 CA ASP A 457 4.057 -12.015 -0.385 1.00 0.00 C ATOM 520 C ASP A 457 4.676 -10.643 -0.131 1.00 0.00 C ATOM 521 O ASP A 457 5.215 -10.384 0.946 1.00 0.00 O ATOM 522 CB ASP A 457 4.968 -12.837 -1.298 1.00 0.00 C ATOM 523 CG ASP A 457 4.702 -14.326 -1.191 1.00 0.00 C ATOM 524 OD1 ASP A 457 3.567 -14.701 -0.830 1.00 0.00 O ATOM 525 OD2 ASP A 457 5.629 -15.116 -1.468 1.00 0.00 O ATOM 0 H ASP A 457 2.491 -12.620 -1.641 1.00 0.00 H new ATOM 0 HA ASP A 457 3.952 -12.530 0.570 1.00 0.00 H new ATOM 0 HB2 ASP A 457 4.826 -12.519 -2.331 1.00 0.00 H new ATOM 0 HB3 ASP A 457 6.009 -12.637 -1.043 1.00 0.00 H new ATOM 530 N PHE A 458 4.596 -9.770 -1.129 1.00 0.00 N ATOM 531 CA PHE A 458 5.149 -8.425 -1.014 1.00 0.00 C ATOM 532 C PHE A 458 4.819 -7.815 0.345 1.00 0.00 C ATOM 533 O PHE A 458 3.669 -7.804 0.785 1.00 0.00 O ATOM 534 CB PHE A 458 4.610 -7.532 -2.133 1.00 0.00 C ATOM 535 CG PHE A 458 5.402 -6.270 -2.327 1.00 0.00 C ATOM 536 CD1 PHE A 458 6.598 -6.289 -3.027 1.00 0.00 C ATOM 537 CD2 PHE A 458 4.951 -5.067 -1.811 1.00 0.00 C ATOM 538 CE1 PHE A 458 7.329 -5.130 -3.207 1.00 0.00 C ATOM 539 CE2 PHE A 458 5.678 -3.904 -1.988 1.00 0.00 C ATOM 540 CZ PHE A 458 6.868 -3.936 -2.688 1.00 0.00 C ATOM 0 H PHE A 458 4.154 -9.969 -2.026 1.00 0.00 H new ATOM 0 HA PHE A 458 6.233 -8.495 -1.106 1.00 0.00 H new ATOM 0 HB2 PHE A 458 4.605 -8.095 -3.066 1.00 0.00 H new ATOM 0 HB3 PHE A 458 3.575 -7.272 -1.912 1.00 0.00 H new ATOM 0 HD1 PHE A 458 6.963 -7.220 -3.436 1.00 0.00 H new ATOM 0 HD2 PHE A 458 4.020 -5.036 -1.264 1.00 0.00 H new ATOM 0 HE1 PHE A 458 8.260 -5.158 -3.753 1.00 0.00 H new ATOM 0 HE2 PHE A 458 5.316 -2.972 -1.579 1.00 0.00 H new ATOM 0 HZ PHE A 458 7.437 -3.029 -2.829 1.00 0.00 H new ATOM 550 N PRO A 459 5.851 -7.295 1.026 1.00 0.00 N ATOM 551 CA PRO A 459 5.696 -6.673 2.344 1.00 0.00 C ATOM 552 C PRO A 459 4.946 -5.347 2.275 1.00 0.00 C ATOM 553 O PRO A 459 5.071 -4.601 1.303 1.00 0.00 O ATOM 554 CB PRO A 459 7.139 -6.448 2.802 1.00 0.00 C ATOM 555 CG PRO A 459 7.927 -6.356 1.541 1.00 0.00 C ATOM 556 CD PRO A 459 7.248 -7.273 0.561 1.00 0.00 C ATOM 0 HA PRO A 459 5.111 -7.295 3.022 1.00 0.00 H new ATOM 0 HB2 PRO A 459 7.229 -5.536 3.393 1.00 0.00 H new ATOM 0 HB3 PRO A 459 7.488 -7.269 3.428 1.00 0.00 H new ATOM 0 HG2 PRO A 459 7.948 -5.332 1.168 1.00 0.00 H new ATOM 0 HG3 PRO A 459 8.962 -6.657 1.705 1.00 0.00 H new ATOM 0 HD2 PRO A 459 7.326 -6.899 -0.460 1.00 0.00 H new ATOM 0 HD3 PRO A 459 7.690 -8.269 0.570 1.00 0.00 H new ATOM 564 N CYS A 460 4.167 -5.058 3.312 1.00 0.00 N ATOM 565 CA CYS A 460 3.397 -3.821 3.370 1.00 0.00 C ATOM 566 C CYS A 460 4.317 -2.615 3.534 1.00 0.00 C ATOM 567 O CYS A 460 5.349 -2.693 4.200 1.00 0.00 O ATOM 568 CB CYS A 460 2.395 -3.874 4.525 1.00 0.00 C ATOM 569 SG CYS A 460 1.124 -2.571 4.466 1.00 0.00 S ATOM 0 H CYS A 460 4.052 -5.664 4.124 1.00 0.00 H new ATOM 0 HA CYS A 460 2.854 -3.715 2.431 1.00 0.00 H new ATOM 0 HB2 CYS A 460 1.903 -4.847 4.521 1.00 0.00 H new ATOM 0 HB3 CYS A 460 2.938 -3.795 5.467 1.00 0.00 H new ATOM 574 N LYS A 461 3.934 -1.499 2.923 1.00 0.00 N ATOM 575 CA LYS A 461 4.722 -0.274 3.001 1.00 0.00 C ATOM 576 C LYS A 461 4.469 0.452 4.319 1.00 0.00 C ATOM 577 O LYS A 461 5.366 0.575 5.154 1.00 0.00 O ATOM 578 CB LYS A 461 4.387 0.648 1.826 1.00 0.00 C ATOM 579 CG LYS A 461 5.160 1.955 1.840 1.00 0.00 C ATOM 580 CD LYS A 461 4.604 2.942 0.828 1.00 0.00 C ATOM 581 CE LYS A 461 5.428 4.220 0.784 1.00 0.00 C ATOM 582 NZ LYS A 461 6.529 4.136 -0.214 1.00 0.00 N ATOM 0 H LYS A 461 3.082 -1.417 2.368 1.00 0.00 H new ATOM 0 HA LYS A 461 5.776 -0.546 2.952 1.00 0.00 H new ATOM 0 HB2 LYS A 461 4.593 0.123 0.893 1.00 0.00 H new ATOM 0 HB3 LYS A 461 3.319 0.867 1.839 1.00 0.00 H new ATOM 0 HG2 LYS A 461 5.118 2.393 2.837 1.00 0.00 H new ATOM 0 HG3 LYS A 461 6.210 1.760 1.621 1.00 0.00 H new ATOM 0 HD2 LYS A 461 4.591 2.482 -0.160 1.00 0.00 H new ATOM 0 HD3 LYS A 461 3.572 3.182 1.082 1.00 0.00 H new ATOM 0 HE2 LYS A 461 4.780 5.062 0.540 1.00 0.00 H new ATOM 0 HE3 LYS A 461 5.847 4.416 1.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 461 7.024 5.049 -0.262 1.00 0.00 H new ATOM 0 HZ2 LYS A 461 7.199 3.393 0.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 461 6.134 3.907 -1.148 1.00 0.00 H new ATOM 596 N LEU A 462 3.243 0.930 4.499 1.00 0.00 N ATOM 597 CA LEU A 462 2.871 1.643 5.717 1.00 0.00 C ATOM 598 C LEU A 462 3.395 0.919 6.953 1.00 0.00 C ATOM 599 O LEU A 462 4.155 1.483 7.740 1.00 0.00 O ATOM 600 CB LEU A 462 1.351 1.788 5.803 1.00 0.00 C ATOM 601 CG LEU A 462 0.732 2.888 4.940 1.00 0.00 C ATOM 602 CD1 LEU A 462 -0.781 2.900 5.093 1.00 0.00 C ATOM 603 CD2 LEU A 462 1.318 4.245 5.304 1.00 0.00 C ATOM 0 H LEU A 462 2.490 0.837 3.818 1.00 0.00 H new ATOM 0 HA LEU A 462 3.323 2.634 5.680 1.00 0.00 H new ATOM 0 HB2 LEU A 462 0.899 0.837 5.523 1.00 0.00 H new ATOM 0 HB3 LEU A 462 1.082 1.975 6.843 1.00 0.00 H new ATOM 0 HG LEU A 462 0.969 2.680 3.896 1.00 0.00 H new ATOM 0 HD11 LEU A 462 -1.203 3.689 4.471 1.00 0.00 H new ATOM 0 HD12 LEU A 462 -1.186 1.937 4.782 1.00 0.00 H new ATOM 0 HD13 LEU A 462 -1.040 3.082 6.136 1.00 0.00 H new ATOM 0 HD21 LEU A 462 0.866 5.016 4.680 1.00 0.00 H new ATOM 0 HD22 LEU A 462 1.113 4.461 6.353 1.00 0.00 H new ATOM 0 HD23 LEU A 462 2.396 4.232 5.141 1.00 0.00 H new ATOM 615 N TYR A 463 2.984 -0.334 7.117 1.00 0.00 N ATOM 616 CA TYR A 463 3.412 -1.136 8.257 1.00 0.00 C ATOM 617 C TYR A 463 4.883 -0.889 8.576 1.00 0.00 C ATOM 618 O TYR A 463 5.324 -1.076 9.710 1.00 0.00 O ATOM 619 CB TYR A 463 3.181 -2.622 7.977 1.00 0.00 C ATOM 620 CG TYR A 463 3.677 -3.530 9.081 1.00 0.00 C ATOM 621 CD1 TYR A 463 2.934 -3.716 10.240 1.00 0.00 C ATOM 622 CD2 TYR A 463 4.887 -4.201 8.963 1.00 0.00 C ATOM 623 CE1 TYR A 463 3.383 -4.544 11.250 1.00 0.00 C ATOM 624 CE2 TYR A 463 5.344 -5.032 9.968 1.00 0.00 C ATOM 625 CZ TYR A 463 4.588 -5.200 11.110 1.00 0.00 C ATOM 626 OH TYR A 463 5.038 -6.026 12.114 1.00 0.00 O ATOM 0 H TYR A 463 2.355 -0.816 6.475 1.00 0.00 H new ATOM 0 HA TYR A 463 2.818 -0.839 9.121 1.00 0.00 H new ATOM 0 HB2 TYR A 463 2.115 -2.794 7.828 1.00 0.00 H new ATOM 0 HB3 TYR A 463 3.680 -2.890 7.046 1.00 0.00 H new ATOM 0 HD1 TYR A 463 1.990 -3.205 10.353 1.00 0.00 H new ATOM 0 HD2 TYR A 463 5.481 -4.071 8.070 1.00 0.00 H new ATOM 0 HE1 TYR A 463 2.793 -4.677 12.145 1.00 0.00 H new ATOM 0 HE2 TYR A 463 6.287 -5.547 9.860 1.00 0.00 H new ATOM 0 HH TYR A 463 5.902 -6.412 11.858 1.00 0.00 H new ATOM 636 N HIS A 464 5.638 -0.466 7.567 1.00 0.00 N ATOM 637 CA HIS A 464 7.060 -0.191 7.738 1.00 0.00 C ATOM 638 C HIS A 464 7.309 1.306 7.891 1.00 0.00 C ATOM 639 O HIS A 464 7.959 1.745 8.840 1.00 0.00 O ATOM 640 CB HIS A 464 7.853 -0.734 6.549 1.00 0.00 C ATOM 641 CG HIS A 464 7.945 -2.228 6.522 1.00 0.00 C ATOM 642 ND1 HIS A 464 8.248 -2.983 7.636 1.00 0.00 N ATOM 643 CD2 HIS A 464 7.771 -3.109 5.509 1.00 0.00 C ATOM 644 CE1 HIS A 464 8.258 -4.263 7.308 1.00 0.00 C ATOM 645 NE2 HIS A 464 7.972 -4.366 6.023 1.00 0.00 N ATOM 0 H HIS A 464 5.288 -0.306 6.622 1.00 0.00 H new ATOM 0 HA HIS A 464 7.395 -0.691 8.646 1.00 0.00 H new ATOM 0 HB2 HIS A 464 7.388 -0.390 5.625 1.00 0.00 H new ATOM 0 HB3 HIS A 464 8.860 -0.317 6.573 1.00 0.00 H new ATOM 0 HD2 HIS A 464 7.521 -2.868 4.486 1.00 0.00 H new ATOM 0 HE1 HIS A 464 8.465 -5.085 7.977 1.00 0.00 H new ATOM 0 HE2 HIS A 464 7.910 -5.238 5.498 1.00 0.00 H new ATOM 653 N THR A 465 6.789 2.087 6.949 1.00 0.00 N ATOM 654 CA THR A 465 6.956 3.534 6.977 1.00 0.00 C ATOM 655 C THR A 465 7.035 4.051 8.409 1.00 0.00 C ATOM 656 O THR A 465 7.892 4.872 8.738 1.00 0.00 O ATOM 657 CB THR A 465 5.802 4.248 6.249 1.00 0.00 C ATOM 658 OG1 THR A 465 4.567 4.005 6.932 1.00 0.00 O ATOM 659 CG2 THR A 465 5.693 3.771 4.809 1.00 0.00 C ATOM 0 H THR A 465 6.248 1.741 6.157 1.00 0.00 H new ATOM 0 HA THR A 465 7.891 3.753 6.462 1.00 0.00 H new ATOM 0 HB THR A 465 6.011 5.318 6.246 1.00 0.00 H new ATOM 0 HG1 THR A 465 4.586 3.112 7.335 1.00 0.00 H new ATOM 0 HG21 THR A 465 4.871 4.289 4.315 1.00 0.00 H new ATOM 0 HG22 THR A 465 6.624 3.984 4.284 1.00 0.00 H new ATOM 0 HG23 THR A 465 5.506 2.697 4.795 1.00 0.00 H new ATOM 667 N THR A 466 6.137 3.564 9.260 1.00 0.00 N ATOM 668 CA THR A 466 6.105 3.976 10.657 1.00 0.00 C ATOM 669 C THR A 466 6.160 2.771 11.588 1.00 0.00 C ATOM 670 O THR A 466 6.750 2.832 12.666 1.00 0.00 O ATOM 671 CB THR A 466 4.839 4.796 10.971 1.00 0.00 C ATOM 672 OG1 THR A 466 3.670 4.012 10.711 1.00 0.00 O ATOM 673 CG2 THR A 466 4.798 6.069 10.139 1.00 0.00 C ATOM 0 H THR A 466 5.422 2.883 9.005 1.00 0.00 H new ATOM 0 HA THR A 466 6.984 4.599 10.823 1.00 0.00 H new ATOM 0 HB THR A 466 4.864 5.071 12.025 1.00 0.00 H new ATOM 0 HG1 THR A 466 2.870 4.540 10.915 1.00 0.00 H new ATOM 0 HG21 THR A 466 3.895 6.631 10.378 1.00 0.00 H new ATOM 0 HG22 THR A 466 5.674 6.678 10.362 1.00 0.00 H new ATOM 0 HG23 THR A 466 4.795 5.811 9.080 1.00 0.00 H new ATOM 681 N GLY A 467 5.540 1.673 11.164 1.00 0.00 N ATOM 682 CA GLY A 467 5.531 0.467 11.972 1.00 0.00 C ATOM 683 C GLY A 467 4.150 -0.147 12.082 1.00 0.00 C ATOM 684 O GLY A 467 4.004 -1.368 12.080 1.00 0.00 O ATOM 0 H GLY A 467 5.044 1.597 10.276 1.00 0.00 H new ATOM 0 HA2 GLY A 467 6.216 -0.262 11.539 1.00 0.00 H new ATOM 0 HA3 GLY A 467 5.902 0.699 12.970 1.00 0.00 H new ATOM 688 N ASN A 468 3.133 0.703 12.180 1.00 0.00 N ATOM 689 CA ASN A 468 1.755 0.236 12.294 1.00 0.00 C ATOM 690 C ASN A 468 0.981 0.508 11.008 1.00 0.00 C ATOM 691 O ASN A 468 1.144 1.555 10.381 1.00 0.00 O ATOM 692 CB ASN A 468 1.060 0.917 13.475 1.00 0.00 C ATOM 693 CG ASN A 468 1.970 1.054 14.681 1.00 0.00 C ATOM 694 OD1 ASN A 468 2.842 1.922 14.720 1.00 0.00 O ATOM 695 ND2 ASN A 468 1.770 0.194 15.673 1.00 0.00 N ATOM 0 H ASN A 468 3.236 1.718 12.183 1.00 0.00 H new ATOM 0 HA ASN A 468 1.775 -0.840 12.464 1.00 0.00 H new ATOM 0 HB2 ASN A 468 0.715 1.905 13.170 1.00 0.00 H new ATOM 0 HB3 ASN A 468 0.176 0.343 13.753 1.00 0.00 H new ATOM 0 HD21 ASN A 468 2.351 0.237 16.510 1.00 0.00 H new ATOM 0 HD22 ASN A 468 1.035 -0.509 15.598 1.00 0.00 H new ATOM 702 N CYS A 469 0.136 -0.442 10.621 1.00 0.00 N ATOM 703 CA CYS A 469 -0.664 -0.306 9.410 1.00 0.00 C ATOM 704 C CYS A 469 -2.091 0.117 9.746 1.00 0.00 C ATOM 705 O CYS A 469 -2.708 -0.420 10.667 1.00 0.00 O ATOM 706 CB CYS A 469 -0.681 -1.625 8.634 1.00 0.00 C ATOM 707 SG CYS A 469 -1.506 -1.524 7.013 1.00 0.00 S ATOM 0 H CYS A 469 -0.012 -1.314 11.129 1.00 0.00 H new ATOM 0 HA CYS A 469 -0.211 0.467 8.790 1.00 0.00 H new ATOM 0 HB2 CYS A 469 0.346 -1.961 8.487 1.00 0.00 H new ATOM 0 HB3 CYS A 469 -1.181 -2.383 9.237 1.00 0.00 H new ATOM 712 N ILE A 470 -2.609 1.082 8.994 1.00 0.00 N ATOM 713 CA ILE A 470 -3.963 1.576 9.211 1.00 0.00 C ATOM 714 C ILE A 470 -4.991 0.467 9.017 1.00 0.00 C ATOM 715 O ILE A 470 -5.942 0.346 9.788 1.00 0.00 O ATOM 716 CB ILE A 470 -4.296 2.741 8.260 1.00 0.00 C ATOM 717 CG1 ILE A 470 -5.707 3.265 8.536 1.00 0.00 C ATOM 718 CG2 ILE A 470 -4.164 2.296 6.811 1.00 0.00 C ATOM 719 CD1 ILE A 470 -5.804 4.110 9.787 1.00 0.00 C ATOM 0 H ILE A 470 -2.111 1.537 8.229 1.00 0.00 H new ATOM 0 HA ILE A 470 -4.007 1.933 10.240 1.00 0.00 H new ATOM 0 HB ILE A 470 -3.587 3.550 8.437 1.00 0.00 H new ATOM 0 HG12 ILE A 470 -6.040 3.855 7.682 1.00 0.00 H new ATOM 0 HG13 ILE A 470 -6.389 2.419 8.625 1.00 0.00 H new ATOM 0 HG21 ILE A 470 -4.402 3.130 6.151 1.00 0.00 H new ATOM 0 HG22 ILE A 470 -3.142 1.966 6.623 1.00 0.00 H new ATOM 0 HG23 ILE A 470 -4.852 1.473 6.619 1.00 0.00 H new ATOM 0 HD11 ILE A 470 -6.832 4.447 9.920 1.00 0.00 H new ATOM 0 HD12 ILE A 470 -5.502 3.517 10.651 1.00 0.00 H new ATOM 0 HD13 ILE A 470 -5.148 4.975 9.693 1.00 0.00 H new ATOM 731 N ASN A 471 -4.791 -0.344 7.983 1.00 0.00 N ATOM 732 CA ASN A 471 -5.700 -1.445 7.688 1.00 0.00 C ATOM 733 C ASN A 471 -5.922 -2.313 8.924 1.00 0.00 C ATOM 734 O ASN A 471 -7.054 -2.497 9.370 1.00 0.00 O ATOM 735 CB ASN A 471 -5.146 -2.299 6.545 1.00 0.00 C ATOM 736 CG ASN A 471 -5.546 -1.769 5.182 1.00 0.00 C ATOM 737 OD1 ASN A 471 -6.720 -1.497 4.929 1.00 0.00 O ATOM 738 ND2 ASN A 471 -4.568 -1.619 4.296 1.00 0.00 N ATOM 0 H ASN A 471 -4.007 -0.259 7.336 1.00 0.00 H new ATOM 0 HA ASN A 471 -6.658 -1.022 7.386 1.00 0.00 H new ATOM 0 HB2 ASN A 471 -4.059 -2.333 6.614 1.00 0.00 H new ATOM 0 HB3 ASN A 471 -5.504 -3.323 6.653 1.00 0.00 H new ATOM 0 HD21 ASN A 471 -4.776 -1.266 3.362 1.00 0.00 H new ATOM 0 HD22 ASN A 471 -3.609 -1.857 4.550 1.00 0.00 H new ATOM 745 N GLY A 472 -4.833 -2.842 9.472 1.00 0.00 N ATOM 746 CA GLY A 472 -4.930 -3.683 10.651 1.00 0.00 C ATOM 747 C GLY A 472 -4.480 -5.106 10.387 1.00 0.00 C ATOM 748 O GLY A 472 -3.605 -5.343 9.554 1.00 0.00 O ATOM 0 H GLY A 472 -3.885 -2.704 9.121 1.00 0.00 H new ATOM 0 HA2 GLY A 472 -4.323 -3.256 11.449 1.00 0.00 H new ATOM 0 HA3 GLY A 472 -5.961 -3.691 11.004 1.00 0.00 H new ATOM 752 N ASP A 473 -5.077 -6.055 11.099 1.00 0.00 N ATOM 753 CA ASP A 473 -4.732 -7.463 10.938 1.00 0.00 C ATOM 754 C ASP A 473 -5.335 -8.027 9.655 1.00 0.00 C ATOM 755 O ASP A 473 -4.933 -9.091 9.184 1.00 0.00 O ATOM 756 CB ASP A 473 -5.218 -8.271 12.142 1.00 0.00 C ATOM 757 CG ASP A 473 -4.687 -7.729 13.455 1.00 0.00 C ATOM 758 OD1 ASP A 473 -3.497 -7.353 13.504 1.00 0.00 O ATOM 759 OD2 ASP A 473 -5.462 -7.680 14.433 1.00 0.00 O ATOM 0 H ASP A 473 -5.802 -5.875 11.793 1.00 0.00 H new ATOM 0 HA ASP A 473 -3.647 -7.540 10.873 1.00 0.00 H new ATOM 0 HB2 ASP A 473 -6.308 -8.265 12.164 1.00 0.00 H new ATOM 0 HB3 ASP A 473 -4.907 -9.310 12.029 1.00 0.00 H new ATOM 764 N ASP A 474 -6.301 -7.307 9.095 1.00 0.00 N ATOM 765 CA ASP A 474 -6.960 -7.736 7.867 1.00 0.00 C ATOM 766 C ASP A 474 -6.464 -6.925 6.673 1.00 0.00 C ATOM 767 O ASP A 474 -7.254 -6.482 5.839 1.00 0.00 O ATOM 768 CB ASP A 474 -8.477 -7.594 8.001 1.00 0.00 C ATOM 769 CG ASP A 474 -8.890 -6.212 8.467 1.00 0.00 C ATOM 770 OD1 ASP A 474 -9.052 -5.320 7.608 1.00 0.00 O ATOM 771 OD2 ASP A 474 -9.052 -6.022 9.691 1.00 0.00 O ATOM 0 H ASP A 474 -6.645 -6.424 9.472 1.00 0.00 H new ATOM 0 HA ASP A 474 -6.715 -8.785 7.699 1.00 0.00 H new ATOM 0 HB2 ASP A 474 -8.945 -7.805 7.040 1.00 0.00 H new ATOM 0 HB3 ASP A 474 -8.848 -8.338 8.706 1.00 0.00 H new ATOM 776 N CYS A 475 -5.151 -6.733 6.599 1.00 0.00 N ATOM 777 CA CYS A 475 -4.549 -5.975 5.509 1.00 0.00 C ATOM 778 C CYS A 475 -4.430 -6.831 4.252 1.00 0.00 C ATOM 779 O CYS A 475 -4.242 -8.044 4.330 1.00 0.00 O ATOM 780 CB CYS A 475 -3.168 -5.460 5.921 1.00 0.00 C ATOM 781 SG CYS A 475 -2.560 -4.073 4.908 1.00 0.00 S ATOM 0 H CYS A 475 -4.484 -7.092 7.281 1.00 0.00 H new ATOM 0 HA CYS A 475 -5.196 -5.126 5.289 1.00 0.00 H new ATOM 0 HB2 CYS A 475 -3.205 -5.145 6.964 1.00 0.00 H new ATOM 0 HB3 CYS A 475 -2.453 -6.281 5.861 1.00 0.00 H new ATOM 786 N MET A 476 -4.542 -6.189 3.093 1.00 0.00 N ATOM 787 CA MET A 476 -4.446 -6.891 1.819 1.00 0.00 C ATOM 788 C MET A 476 -2.995 -7.235 1.495 1.00 0.00 C ATOM 789 O MET A 476 -2.720 -8.001 0.572 1.00 0.00 O ATOM 790 CB MET A 476 -5.043 -6.040 0.697 1.00 0.00 C ATOM 791 CG MET A 476 -4.231 -4.794 0.382 1.00 0.00 C ATOM 792 SD MET A 476 -2.769 -5.150 -0.612 1.00 0.00 S ATOM 793 CE MET A 476 -3.482 -5.209 -2.254 1.00 0.00 C ATOM 0 H MET A 476 -4.699 -5.185 3.011 1.00 0.00 H new ATOM 0 HA MET A 476 -5.011 -7.819 1.901 1.00 0.00 H new ATOM 0 HB2 MET A 476 -5.125 -6.648 -0.204 1.00 0.00 H new ATOM 0 HB3 MET A 476 -6.054 -5.744 0.975 1.00 0.00 H new ATOM 0 HG2 MET A 476 -4.861 -4.079 -0.148 1.00 0.00 H new ATOM 0 HG3 MET A 476 -3.925 -4.319 1.314 1.00 0.00 H new ATOM 0 HE1 MET A 476 -2.744 -4.874 -2.983 1.00 0.00 H new ATOM 0 HE2 MET A 476 -3.781 -6.232 -2.484 1.00 0.00 H new ATOM 0 HE3 MET A 476 -4.355 -4.558 -2.295 1.00 0.00 H new ATOM 803 N PHE A 477 -2.072 -6.663 2.261 1.00 0.00 N ATOM 804 CA PHE A 477 -0.649 -6.907 2.054 1.00 0.00 C ATOM 805 C PHE A 477 -0.081 -7.783 3.167 1.00 0.00 C ATOM 806 O PHE A 477 -0.665 -7.892 4.245 1.00 0.00 O ATOM 807 CB PHE A 477 0.114 -5.583 1.992 1.00 0.00 C ATOM 808 CG PHE A 477 -0.046 -4.859 0.686 1.00 0.00 C ATOM 809 CD1 PHE A 477 0.334 -5.457 -0.504 1.00 0.00 C ATOM 810 CD2 PHE A 477 -0.577 -3.579 0.649 1.00 0.00 C ATOM 811 CE1 PHE A 477 0.187 -4.794 -1.708 1.00 0.00 C ATOM 812 CE2 PHE A 477 -0.726 -2.911 -0.552 1.00 0.00 C ATOM 813 CZ PHE A 477 -0.343 -3.519 -1.731 1.00 0.00 C ATOM 0 H PHE A 477 -2.284 -6.028 3.030 1.00 0.00 H new ATOM 0 HA PHE A 477 -0.530 -7.431 1.106 1.00 0.00 H new ATOM 0 HB2 PHE A 477 -0.229 -4.937 2.800 1.00 0.00 H new ATOM 0 HB3 PHE A 477 1.173 -5.775 2.164 1.00 0.00 H new ATOM 0 HD1 PHE A 477 0.750 -6.453 -0.491 1.00 0.00 H new ATOM 0 HD2 PHE A 477 -0.878 -3.099 1.568 1.00 0.00 H new ATOM 0 HE1 PHE A 477 0.486 -5.272 -2.629 1.00 0.00 H new ATOM 0 HE2 PHE A 477 -1.142 -1.914 -0.568 1.00 0.00 H new ATOM 0 HZ PHE A 477 -0.458 -2.998 -2.670 1.00 0.00 H new ATOM 823 N SER A 478 1.062 -8.406 2.897 1.00 0.00 N ATOM 824 CA SER A 478 1.707 -9.277 3.872 1.00 0.00 C ATOM 825 C SER A 478 2.436 -8.457 4.933 1.00 0.00 C ATOM 826 O SER A 478 3.012 -7.409 4.637 1.00 0.00 O ATOM 827 CB SER A 478 2.690 -10.219 3.175 1.00 0.00 C ATOM 828 OG SER A 478 2.013 -11.113 2.310 1.00 0.00 O ATOM 0 H SER A 478 1.560 -8.323 2.011 1.00 0.00 H new ATOM 0 HA SER A 478 0.934 -9.869 4.362 1.00 0.00 H new ATOM 0 HB2 SER A 478 3.415 -9.637 2.606 1.00 0.00 H new ATOM 0 HB3 SER A 478 3.249 -10.783 3.921 1.00 0.00 H new ATOM 0 HG SER A 478 1.522 -10.603 1.632 1.00 0.00 H new ATOM 834 N HIS A 479 2.407 -8.942 6.170 1.00 0.00 N ATOM 835 CA HIS A 479 3.064 -8.255 7.276 1.00 0.00 C ATOM 836 C HIS A 479 4.216 -9.091 7.827 1.00 0.00 C ATOM 837 O HIS A 479 4.517 -9.042 9.020 1.00 0.00 O ATOM 838 CB HIS A 479 2.059 -7.955 8.389 1.00 0.00 C ATOM 839 CG HIS A 479 1.167 -6.790 8.091 1.00 0.00 C ATOM 840 ND1 HIS A 479 0.378 -6.183 9.045 1.00 0.00 N ATOM 841 CD2 HIS A 479 0.942 -6.119 6.937 1.00 0.00 C ATOM 842 CE1 HIS A 479 -0.294 -5.190 8.491 1.00 0.00 C ATOM 843 NE2 HIS A 479 0.030 -5.129 7.212 1.00 0.00 N ATOM 0 H HIS A 479 1.936 -9.808 6.432 1.00 0.00 H new ATOM 0 HA HIS A 479 3.467 -7.315 6.899 1.00 0.00 H new ATOM 0 HB2 HIS A 479 1.444 -8.839 8.560 1.00 0.00 H new ATOM 0 HB3 HIS A 479 2.601 -7.760 9.314 1.00 0.00 H new ATOM 0 HD1 HIS A 479 0.322 -6.458 10.026 1.00 0.00 H new ATOM 0 HD2 HIS A 479 1.395 -6.324 5.978 1.00 0.00 H new ATOM 0 HE1 HIS A 479 -0.990 -4.538 8.998 1.00 0.00 H new ATOM 851 N ASP A 480 4.855 -9.859 6.951 1.00 0.00 N ATOM 852 CA ASP A 480 5.973 -10.706 7.349 1.00 0.00 C ATOM 853 C ASP A 480 7.216 -9.868 7.631 1.00 0.00 C ATOM 854 O ASP A 480 7.342 -8.729 7.181 1.00 0.00 O ATOM 855 CB ASP A 480 6.274 -11.736 6.260 1.00 0.00 C ATOM 856 CG ASP A 480 5.497 -13.024 6.451 1.00 0.00 C ATOM 857 OD1 ASP A 480 5.510 -13.563 7.576 1.00 0.00 O ATOM 858 OD2 ASP A 480 4.876 -13.493 5.474 1.00 0.00 O ATOM 0 H ASP A 480 4.618 -9.912 5.960 1.00 0.00 H new ATOM 0 HA ASP A 480 5.693 -11.228 8.264 1.00 0.00 H new ATOM 0 HB2 ASP A 480 6.033 -11.311 5.285 1.00 0.00 H new ATOM 0 HB3 ASP A 480 7.342 -11.956 6.257 1.00 0.00 H new ATOM 863 N PRO A 481 8.157 -10.442 8.395 1.00 0.00 N ATOM 864 CA PRO A 481 9.407 -9.765 8.754 1.00 0.00 C ATOM 865 C PRO A 481 10.340 -9.598 7.560 1.00 0.00 C ATOM 866 O PRO A 481 10.744 -10.578 6.933 1.00 0.00 O ATOM 867 CB PRO A 481 10.031 -10.701 9.793 1.00 0.00 C ATOM 868 CG PRO A 481 9.464 -12.043 9.482 1.00 0.00 C ATOM 869 CD PRO A 481 8.074 -11.797 8.966 1.00 0.00 C ATOM 0 HA PRO A 481 9.232 -8.754 9.121 1.00 0.00 H new ATOM 0 HB2 PRO A 481 11.119 -10.704 9.721 1.00 0.00 H new ATOM 0 HB3 PRO A 481 9.780 -10.390 10.807 1.00 0.00 H new ATOM 0 HG2 PRO A 481 10.070 -12.560 8.738 1.00 0.00 H new ATOM 0 HG3 PRO A 481 9.444 -12.674 10.371 1.00 0.00 H new ATOM 0 HD2 PRO A 481 7.788 -12.533 8.214 1.00 0.00 H new ATOM 0 HD3 PRO A 481 7.333 -11.852 9.764 1.00 0.00 H new ATOM 877 N LEU A 482 10.679 -8.351 7.250 1.00 0.00 N ATOM 878 CA LEU A 482 11.566 -8.055 6.130 1.00 0.00 C ATOM 879 C LEU A 482 12.743 -9.025 6.097 1.00 0.00 C ATOM 880 O LEU A 482 13.202 -9.498 7.137 1.00 0.00 O ATOM 881 CB LEU A 482 12.077 -6.617 6.226 1.00 0.00 C ATOM 882 CG LEU A 482 11.076 -5.522 5.855 1.00 0.00 C ATOM 883 CD1 LEU A 482 11.744 -4.156 5.885 1.00 0.00 C ATOM 884 CD2 LEU A 482 10.473 -5.793 4.485 1.00 0.00 C ATOM 0 H LEU A 482 10.353 -7.529 7.758 1.00 0.00 H new ATOM 0 HA LEU A 482 10.998 -8.171 5.207 1.00 0.00 H new ATOM 0 HB2 LEU A 482 12.416 -6.441 7.247 1.00 0.00 H new ATOM 0 HB3 LEU A 482 12.949 -6.519 5.579 1.00 0.00 H new ATOM 0 HG LEU A 482 10.272 -5.527 6.591 1.00 0.00 H new ATOM 0 HD11 LEU A 482 11.017 -3.389 5.618 1.00 0.00 H new ATOM 0 HD12 LEU A 482 12.127 -3.960 6.887 1.00 0.00 H new ATOM 0 HD13 LEU A 482 12.568 -4.138 5.172 1.00 0.00 H new ATOM 0 HD21 LEU A 482 9.763 -5.004 4.237 1.00 0.00 H new ATOM 0 HD22 LEU A 482 11.265 -5.816 3.737 1.00 0.00 H new ATOM 0 HD23 LEU A 482 9.958 -6.754 4.498 1.00 0.00 H new ATOM 896 N THR A 483 13.229 -9.316 4.894 1.00 0.00 N ATOM 897 CA THR A 483 14.353 -10.228 4.724 1.00 0.00 C ATOM 898 C THR A 483 15.415 -9.628 3.809 1.00 0.00 C ATOM 899 O THR A 483 15.116 -8.777 2.972 1.00 0.00 O ATOM 900 CB THR A 483 13.897 -11.580 4.145 1.00 0.00 C ATOM 901 OG1 THR A 483 13.085 -11.367 2.985 1.00 0.00 O ATOM 902 CG2 THR A 483 13.115 -12.376 5.179 1.00 0.00 C ATOM 0 H THR A 483 12.861 -8.933 4.023 1.00 0.00 H new ATOM 0 HA THR A 483 14.780 -10.391 5.714 1.00 0.00 H new ATOM 0 HB THR A 483 14.784 -12.149 3.867 1.00 0.00 H new ATOM 0 HG1 THR A 483 12.850 -10.418 2.920 1.00 0.00 H new ATOM 0 HG21 THR A 483 12.804 -13.327 4.747 1.00 0.00 H new ATOM 0 HG22 THR A 483 13.746 -12.562 6.048 1.00 0.00 H new ATOM 0 HG23 THR A 483 12.235 -11.810 5.484 1.00 0.00 H new ATOM 910 N GLU A 484 16.655 -10.077 3.975 1.00 0.00 N ATOM 911 CA GLU A 484 17.760 -9.583 3.163 1.00 0.00 C ATOM 912 C GLU A 484 17.328 -9.398 1.711 1.00 0.00 C ATOM 913 O GLU A 484 17.831 -8.519 1.011 1.00 0.00 O ATOM 914 CB GLU A 484 18.946 -10.548 3.235 1.00 0.00 C ATOM 915 CG GLU A 484 20.120 -10.135 2.363 1.00 0.00 C ATOM 916 CD GLU A 484 21.132 -11.250 2.181 1.00 0.00 C ATOM 917 OE1 GLU A 484 21.607 -11.792 3.201 1.00 0.00 O ATOM 918 OE2 GLU A 484 21.449 -11.579 1.019 1.00 0.00 O ATOM 0 H GLU A 484 16.919 -10.781 4.664 1.00 0.00 H new ATOM 0 HA GLU A 484 18.064 -8.614 3.560 1.00 0.00 H new ATOM 0 HB2 GLU A 484 19.281 -10.622 4.270 1.00 0.00 H new ATOM 0 HB3 GLU A 484 18.614 -11.542 2.936 1.00 0.00 H new ATOM 0 HG2 GLU A 484 19.750 -9.822 1.387 1.00 0.00 H new ATOM 0 HG3 GLU A 484 20.613 -9.271 2.809 1.00 0.00 H new ATOM 925 N GLU A 485 16.394 -10.233 1.266 1.00 0.00 N ATOM 926 CA GLU A 485 15.896 -10.162 -0.102 1.00 0.00 C ATOM 927 C GLU A 485 14.864 -9.048 -0.248 1.00 0.00 C ATOM 928 O GLU A 485 15.144 -7.997 -0.825 1.00 0.00 O ATOM 929 CB GLU A 485 15.280 -11.501 -0.514 1.00 0.00 C ATOM 930 CG GLU A 485 16.285 -12.638 -0.584 1.00 0.00 C ATOM 931 CD GLU A 485 17.085 -12.631 -1.873 1.00 0.00 C ATOM 932 OE1 GLU A 485 16.473 -12.781 -2.951 1.00 0.00 O ATOM 933 OE2 GLU A 485 18.322 -12.476 -1.803 1.00 0.00 O ATOM 0 H GLU A 485 15.968 -10.966 1.833 1.00 0.00 H new ATOM 0 HA GLU A 485 16.738 -9.941 -0.757 1.00 0.00 H new ATOM 0 HB2 GLU A 485 14.496 -11.764 0.196 1.00 0.00 H new ATOM 0 HB3 GLU A 485 14.804 -11.388 -1.488 1.00 0.00 H new ATOM 0 HG2 GLU A 485 16.967 -12.568 0.263 1.00 0.00 H new ATOM 0 HG3 GLU A 485 15.760 -13.589 -0.492 1.00 0.00 H new ATOM 940 N THR A 486 13.666 -9.286 0.278 1.00 0.00 N ATOM 941 CA THR A 486 12.591 -8.305 0.206 1.00 0.00 C ATOM 942 C THR A 486 13.106 -6.901 0.501 1.00 0.00 C ATOM 943 O THR A 486 12.791 -5.951 -0.216 1.00 0.00 O ATOM 944 CB THR A 486 11.456 -8.641 1.192 1.00 0.00 C ATOM 945 OG1 THR A 486 11.943 -8.580 2.537 1.00 0.00 O ATOM 946 CG2 THR A 486 10.890 -10.025 0.914 1.00 0.00 C ATOM 0 H THR A 486 13.416 -10.150 0.759 1.00 0.00 H new ATOM 0 HA THR A 486 12.201 -8.339 -0.811 1.00 0.00 H new ATOM 0 HB THR A 486 10.660 -7.908 1.060 1.00 0.00 H new ATOM 0 HG1 THR A 486 11.244 -8.886 3.152 1.00 0.00 H new ATOM 0 HG21 THR A 486 10.090 -10.240 1.623 1.00 0.00 H new ATOM 0 HG22 THR A 486 10.494 -10.059 -0.101 1.00 0.00 H new ATOM 0 HG23 THR A 486 11.679 -10.769 1.021 1.00 0.00 H new ATOM 954 N ARG A 487 13.901 -6.778 1.559 1.00 0.00 N ATOM 955 CA ARG A 487 14.460 -5.489 1.949 1.00 0.00 C ATOM 956 C ARG A 487 14.916 -4.701 0.724 1.00 0.00 C ATOM 957 O ARG A 487 14.625 -3.513 0.595 1.00 0.00 O ATOM 958 CB ARG A 487 15.635 -5.687 2.908 1.00 0.00 C ATOM 959 CG ARG A 487 15.801 -4.557 3.910 1.00 0.00 C ATOM 960 CD ARG A 487 16.178 -3.254 3.222 1.00 0.00 C ATOM 961 NE ARG A 487 16.668 -2.257 4.170 1.00 0.00 N ATOM 962 CZ ARG A 487 15.873 -1.480 4.896 1.00 0.00 C ATOM 963 NH1 ARG A 487 14.556 -1.585 4.785 1.00 0.00 N ATOM 964 NH2 ARG A 487 16.394 -0.596 5.737 1.00 0.00 N ATOM 0 H ARG A 487 14.172 -7.555 2.161 1.00 0.00 H new ATOM 0 HA ARG A 487 13.679 -4.921 2.455 1.00 0.00 H new ATOM 0 HB2 ARG A 487 15.498 -6.623 3.449 1.00 0.00 H new ATOM 0 HB3 ARG A 487 16.553 -5.785 2.329 1.00 0.00 H new ATOM 0 HG2 ARG A 487 14.872 -4.422 4.465 1.00 0.00 H new ATOM 0 HG3 ARG A 487 16.570 -4.822 4.636 1.00 0.00 H new ATOM 0 HD2 ARG A 487 16.945 -3.449 2.472 1.00 0.00 H new ATOM 0 HD3 ARG A 487 15.310 -2.858 2.695 1.00 0.00 H new ATOM 0 HE ARG A 487 17.677 -2.152 4.280 1.00 0.00 H new ATOM 0 HH11 ARG A 487 14.151 -2.264 4.141 1.00 0.00 H new ATOM 0 HH12 ARG A 487 13.948 -0.987 5.344 1.00 0.00 H new ATOM 0 HH21 ARG A 487 17.407 -0.513 5.827 1.00 0.00 H new ATOM 0 HH22 ARG A 487 15.782 0.000 6.294 1.00 0.00 H new ATOM 978 N GLU A 488 15.633 -5.373 -0.172 1.00 0.00 N ATOM 979 CA GLU A 488 16.131 -4.735 -1.385 1.00 0.00 C ATOM 980 C GLU A 488 14.987 -4.111 -2.179 1.00 0.00 C ATOM 981 O GLU A 488 15.133 -3.032 -2.755 1.00 0.00 O ATOM 982 CB GLU A 488 16.875 -5.752 -2.253 1.00 0.00 C ATOM 983 CG GLU A 488 18.217 -6.175 -1.680 1.00 0.00 C ATOM 984 CD GLU A 488 19.132 -4.997 -1.405 1.00 0.00 C ATOM 985 OE1 GLU A 488 19.693 -4.444 -2.374 1.00 0.00 O ATOM 986 OE2 GLU A 488 19.286 -4.629 -0.222 1.00 0.00 O ATOM 0 H GLU A 488 15.882 -6.358 -0.081 1.00 0.00 H new ATOM 0 HA GLU A 488 16.821 -3.944 -1.093 1.00 0.00 H new ATOM 0 HB2 GLU A 488 16.249 -6.635 -2.380 1.00 0.00 H new ATOM 0 HB3 GLU A 488 17.031 -5.326 -3.244 1.00 0.00 H new ATOM 0 HG2 GLU A 488 18.055 -6.728 -0.755 1.00 0.00 H new ATOM 0 HG3 GLU A 488 18.707 -6.856 -2.376 1.00 0.00 H new ATOM 993 N LEU A 489 13.850 -4.797 -2.207 1.00 0.00 N ATOM 994 CA LEU A 489 12.681 -4.312 -2.931 1.00 0.00 C ATOM 995 C LEU A 489 12.330 -2.889 -2.508 1.00 0.00 C ATOM 996 O LEU A 489 12.428 -1.952 -3.301 1.00 0.00 O ATOM 997 CB LEU A 489 11.486 -5.236 -2.690 1.00 0.00 C ATOM 998 CG LEU A 489 11.669 -6.693 -3.116 1.00 0.00 C ATOM 999 CD1 LEU A 489 10.345 -7.439 -3.051 1.00 0.00 C ATOM 1000 CD2 LEU A 489 12.257 -6.769 -4.518 1.00 0.00 C ATOM 0 H LEU A 489 13.713 -5.691 -1.736 1.00 0.00 H new ATOM 0 HA LEU A 489 12.920 -4.308 -3.994 1.00 0.00 H new ATOM 0 HB2 LEU A 489 11.245 -5.216 -1.627 1.00 0.00 H new ATOM 0 HB3 LEU A 489 10.625 -4.829 -3.219 1.00 0.00 H new ATOM 0 HG LEU A 489 12.365 -7.168 -2.425 1.00 0.00 H new ATOM 0 HD11 LEU A 489 10.495 -8.474 -3.358 1.00 0.00 H new ATOM 0 HD12 LEU A 489 9.963 -7.415 -2.030 1.00 0.00 H new ATOM 0 HD13 LEU A 489 9.626 -6.963 -3.718 1.00 0.00 H new ATOM 0 HD21 LEU A 489 12.380 -7.813 -4.805 1.00 0.00 H new ATOM 0 HD22 LEU A 489 11.586 -6.277 -5.221 1.00 0.00 H new ATOM 0 HD23 LEU A 489 13.227 -6.272 -4.533 1.00 0.00 H new ATOM 1012 N LEU A 490 11.924 -2.734 -1.253 1.00 0.00 N ATOM 1013 CA LEU A 490 11.561 -1.424 -0.722 1.00 0.00 C ATOM 1014 C LEU A 490 12.526 -0.351 -1.214 1.00 0.00 C ATOM 1015 O LEU A 490 12.115 0.637 -1.823 1.00 0.00 O ATOM 1016 CB LEU A 490 11.551 -1.456 0.807 1.00 0.00 C ATOM 1017 CG LEU A 490 10.497 -2.356 1.453 1.00 0.00 C ATOM 1018 CD1 LEU A 490 10.761 -2.502 2.944 1.00 0.00 C ATOM 1019 CD2 LEU A 490 9.101 -1.803 1.208 1.00 0.00 C ATOM 0 H LEU A 490 11.838 -3.499 -0.584 1.00 0.00 H new ATOM 0 HA LEU A 490 10.561 -1.179 -1.080 1.00 0.00 H new ATOM 0 HB2 LEU A 490 12.534 -1.778 1.150 1.00 0.00 H new ATOM 0 HB3 LEU A 490 11.404 -0.439 1.171 1.00 0.00 H new ATOM 0 HG LEU A 490 10.560 -3.343 0.996 1.00 0.00 H new ATOM 0 HD11 LEU A 490 10.001 -3.146 3.387 1.00 0.00 H new ATOM 0 HD12 LEU A 490 11.745 -2.944 3.098 1.00 0.00 H new ATOM 0 HD13 LEU A 490 10.726 -1.521 3.417 1.00 0.00 H new ATOM 0 HD21 LEU A 490 8.364 -2.456 1.675 1.00 0.00 H new ATOM 0 HD22 LEU A 490 9.025 -0.804 1.638 1.00 0.00 H new ATOM 0 HD23 LEU A 490 8.913 -1.752 0.136 1.00 0.00 H new ATOM 1031 N ASP A 491 13.812 -0.552 -0.948 1.00 0.00 N ATOM 1032 CA ASP A 491 14.838 0.396 -1.366 1.00 0.00 C ATOM 1033 C ASP A 491 14.545 0.932 -2.764 1.00 0.00 C ATOM 1034 O ASP A 491 14.675 2.129 -3.022 1.00 0.00 O ATOM 1035 CB ASP A 491 16.216 -0.265 -1.338 1.00 0.00 C ATOM 1036 CG ASP A 491 16.656 -0.628 0.067 1.00 0.00 C ATOM 1037 OD1 ASP A 491 16.099 -0.059 1.029 1.00 0.00 O ATOM 1038 OD2 ASP A 491 17.556 -1.482 0.204 1.00 0.00 O ATOM 0 H ASP A 491 14.169 -1.364 -0.444 1.00 0.00 H new ATOM 0 HA ASP A 491 14.831 1.232 -0.667 1.00 0.00 H new ATOM 0 HB2 ASP A 491 16.197 -1.165 -1.953 1.00 0.00 H new ATOM 0 HB3 ASP A 491 16.948 0.409 -1.782 1.00 0.00 H new ATOM 1043 N LYS A 492 14.150 0.038 -3.664 1.00 0.00 N ATOM 1044 CA LYS A 492 13.838 0.419 -5.036 1.00 0.00 C ATOM 1045 C LYS A 492 12.448 1.038 -5.126 1.00 0.00 C ATOM 1046 O LYS A 492 12.296 2.189 -5.536 1.00 0.00 O ATOM 1047 CB LYS A 492 13.926 -0.800 -5.958 1.00 0.00 C ATOM 1048 CG LYS A 492 14.058 -0.442 -7.428 1.00 0.00 C ATOM 1049 CD LYS A 492 15.509 -0.210 -7.817 1.00 0.00 C ATOM 1050 CE LYS A 492 16.201 -1.512 -8.190 1.00 0.00 C ATOM 1051 NZ LYS A 492 17.676 -1.428 -8.009 1.00 0.00 N ATOM 0 H LYS A 492 14.038 -0.957 -3.467 1.00 0.00 H new ATOM 0 HA LYS A 492 14.569 1.162 -5.355 1.00 0.00 H new ATOM 0 HB2 LYS A 492 14.781 -1.408 -5.662 1.00 0.00 H new ATOM 0 HB3 LYS A 492 13.036 -1.414 -5.821 1.00 0.00 H new ATOM 0 HG2 LYS A 492 13.641 -1.243 -8.038 1.00 0.00 H new ATOM 0 HG3 LYS A 492 13.476 0.455 -7.639 1.00 0.00 H new ATOM 0 HD2 LYS A 492 15.555 0.482 -8.658 1.00 0.00 H new ATOM 0 HD3 LYS A 492 16.038 0.260 -6.988 1.00 0.00 H new ATOM 0 HE2 LYS A 492 15.806 -2.322 -7.577 1.00 0.00 H new ATOM 0 HE3 LYS A 492 15.976 -1.758 -9.228 1.00 0.00 H new ATOM 0 HZ1 LYS A 492 18.110 -2.335 -8.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 492 18.057 -0.672 -8.613 1.00 0.00 H new ATOM 0 HZ3 LYS A 492 17.892 -1.218 -7.014 1.00 0.00 H new ATOM 1065 N MET A 493 11.435 0.269 -4.740 1.00 0.00 N ATOM 1066 CA MET A 493 10.057 0.745 -4.775 1.00 0.00 C ATOM 1067 C MET A 493 9.968 2.187 -4.288 1.00 0.00 C ATOM 1068 O MET A 493 9.522 3.073 -5.018 1.00 0.00 O ATOM 1069 CB MET A 493 9.164 -0.152 -3.916 1.00 0.00 C ATOM 1070 CG MET A 493 7.681 0.003 -4.214 1.00 0.00 C ATOM 1071 SD MET A 493 6.974 1.483 -3.465 1.00 0.00 S ATOM 1072 CE MET A 493 6.641 0.897 -1.805 1.00 0.00 C ATOM 0 H MET A 493 11.543 -0.686 -4.399 1.00 0.00 H new ATOM 0 HA MET A 493 9.711 0.707 -5.808 1.00 0.00 H new ATOM 0 HB2 MET A 493 9.451 -1.192 -4.071 1.00 0.00 H new ATOM 0 HB3 MET A 493 9.341 0.074 -2.864 1.00 0.00 H new ATOM 0 HG2 MET A 493 7.533 0.040 -5.293 1.00 0.00 H new ATOM 0 HG3 MET A 493 7.147 -0.875 -3.849 1.00 0.00 H new ATOM 0 HE1 MET A 493 6.771 1.716 -1.097 1.00 0.00 H new ATOM 0 HE2 MET A 493 5.617 0.527 -1.748 1.00 0.00 H new ATOM 0 HE3 MET A 493 7.332 0.091 -1.558 1.00 0.00 H new ATOM 1082 N LEU A 494 10.394 2.417 -3.051 1.00 0.00 N ATOM 1083 CA LEU A 494 10.362 3.753 -2.466 1.00 0.00 C ATOM 1084 C LEU A 494 11.143 4.742 -3.325 1.00 0.00 C ATOM 1085 O LEU A 494 10.582 5.706 -3.846 1.00 0.00 O ATOM 1086 CB LEU A 494 10.937 3.725 -1.049 1.00 0.00 C ATOM 1087 CG LEU A 494 9.993 3.234 0.049 1.00 0.00 C ATOM 1088 CD1 LEU A 494 9.472 1.843 -0.279 1.00 0.00 C ATOM 1089 CD2 LEU A 494 10.697 3.237 1.398 1.00 0.00 C ATOM 0 H LEU A 494 10.766 1.695 -2.433 1.00 0.00 H new ATOM 0 HA LEU A 494 9.323 4.079 -2.423 1.00 0.00 H new ATOM 0 HB2 LEU A 494 11.822 3.089 -1.050 1.00 0.00 H new ATOM 0 HB3 LEU A 494 11.268 4.731 -0.793 1.00 0.00 H new ATOM 0 HG LEU A 494 9.144 3.915 0.103 1.00 0.00 H new ATOM 0 HD11 LEU A 494 8.802 1.509 0.513 1.00 0.00 H new ATOM 0 HD12 LEU A 494 8.931 1.871 -1.225 1.00 0.00 H new ATOM 0 HD13 LEU A 494 10.310 1.151 -0.361 1.00 0.00 H new ATOM 0 HD21 LEU A 494 10.010 2.885 2.168 1.00 0.00 H new ATOM 0 HD22 LEU A 494 11.565 2.579 1.357 1.00 0.00 H new ATOM 0 HD23 LEU A 494 11.021 4.250 1.637 1.00 0.00 H new ATOM 1101 N ALA A 495 12.441 4.496 -3.470 1.00 0.00 N ATOM 1102 CA ALA A 495 13.299 5.363 -4.269 1.00 0.00 C ATOM 1103 C ALA A 495 12.592 5.810 -5.544 1.00 0.00 C ATOM 1104 O ALA A 495 12.634 6.985 -5.909 1.00 0.00 O ATOM 1105 CB ALA A 495 14.600 4.651 -4.607 1.00 0.00 C ATOM 0 H ALA A 495 12.922 3.703 -3.045 1.00 0.00 H new ATOM 0 HA ALA A 495 13.526 6.251 -3.680 1.00 0.00 H new ATOM 0 HB1 ALA A 495 15.231 5.310 -5.204 1.00 0.00 H new ATOM 0 HB2 ALA A 495 15.120 4.387 -3.686 1.00 0.00 H new ATOM 0 HB3 ALA A 495 14.383 3.746 -5.174 1.00 0.00 H new ATOM 1111 N ASP A 496 11.943 4.866 -6.217 1.00 0.00 N ATOM 1112 CA ASP A 496 11.226 5.164 -7.452 1.00 0.00 C ATOM 1113 C ASP A 496 10.095 6.155 -7.198 1.00 0.00 C ATOM 1114 O ASP A 496 10.055 7.233 -7.791 1.00 0.00 O ATOM 1115 CB ASP A 496 10.668 3.879 -8.065 1.00 0.00 C ATOM 1116 CG ASP A 496 10.056 4.108 -9.433 1.00 0.00 C ATOM 1117 OD1 ASP A 496 9.590 5.237 -9.692 1.00 0.00 O ATOM 1118 OD2 ASP A 496 10.042 3.158 -10.244 1.00 0.00 O ATOM 0 H ASP A 496 11.899 3.889 -5.929 1.00 0.00 H new ATOM 0 HA ASP A 496 11.929 5.615 -8.152 1.00 0.00 H new ATOM 0 HB2 ASP A 496 11.467 3.142 -8.146 1.00 0.00 H new ATOM 0 HB3 ASP A 496 9.914 3.460 -7.399 1.00 0.00 H new ATOM 1123 N ASP A 497 9.176 5.782 -6.314 1.00 0.00 N ATOM 1124 CA ASP A 497 8.043 6.637 -5.982 1.00 0.00 C ATOM 1125 C ASP A 497 8.516 7.955 -5.377 1.00 0.00 C ATOM 1126 O ASP A 497 8.321 9.022 -5.958 1.00 0.00 O ATOM 1127 CB ASP A 497 7.105 5.922 -5.007 1.00 0.00 C ATOM 1128 CG ASP A 497 6.568 4.621 -5.571 1.00 0.00 C ATOM 1129 OD1 ASP A 497 7.383 3.780 -6.002 1.00 0.00 O ATOM 1130 OD2 ASP A 497 5.331 4.445 -5.580 1.00 0.00 O ATOM 0 H ASP A 497 9.194 4.893 -5.814 1.00 0.00 H new ATOM 0 HA ASP A 497 7.501 6.854 -6.903 1.00 0.00 H new ATOM 0 HB2 ASP A 497 7.637 5.720 -4.077 1.00 0.00 H new ATOM 0 HB3 ASP A 497 6.271 6.580 -4.761 1.00 0.00 H new ATOM 1135 N ALA A 498 9.139 7.873 -4.205 1.00 0.00 N ATOM 1136 CA ALA A 498 9.641 9.058 -3.522 1.00 0.00 C ATOM 1137 C ALA A 498 10.250 10.046 -4.512 1.00 0.00 C ATOM 1138 O ALA A 498 9.768 11.168 -4.658 1.00 0.00 O ATOM 1139 CB ALA A 498 10.665 8.666 -2.467 1.00 0.00 C ATOM 0 H ALA A 498 9.308 6.998 -3.709 1.00 0.00 H new ATOM 0 HA ALA A 498 8.800 9.547 -3.031 1.00 0.00 H new ATOM 0 HB1 ALA A 498 11.031 9.562 -1.965 1.00 0.00 H new ATOM 0 HB2 ALA A 498 10.199 8.005 -1.736 1.00 0.00 H new ATOM 0 HB3 ALA A 498 11.499 8.150 -2.943 1.00 0.00 H new ATOM 1145 N GLU A 499 11.313 9.620 -5.188 1.00 0.00 N ATOM 1146 CA GLU A 499 11.988 10.469 -6.162 1.00 0.00 C ATOM 1147 C GLU A 499 10.993 11.035 -7.172 1.00 0.00 C ATOM 1148 O GLU A 499 10.918 12.247 -7.372 1.00 0.00 O ATOM 1149 CB GLU A 499 13.077 9.679 -6.891 1.00 0.00 C ATOM 1150 CG GLU A 499 14.175 10.553 -7.475 1.00 0.00 C ATOM 1151 CD GLU A 499 15.116 11.093 -6.416 1.00 0.00 C ATOM 1152 OE1 GLU A 499 15.305 10.410 -5.387 1.00 0.00 O ATOM 1153 OE2 GLU A 499 15.665 12.197 -6.615 1.00 0.00 O ATOM 0 H GLU A 499 11.724 8.693 -5.079 1.00 0.00 H new ATOM 0 HA GLU A 499 12.448 11.299 -5.626 1.00 0.00 H new ATOM 0 HB2 GLU A 499 13.522 8.965 -6.198 1.00 0.00 H new ATOM 0 HB3 GLU A 499 12.619 9.101 -7.693 1.00 0.00 H new ATOM 0 HG2 GLU A 499 14.746 9.976 -8.202 1.00 0.00 H new ATOM 0 HG3 GLU A 499 13.723 11.386 -8.013 1.00 0.00 H new ATOM 1160 N ALA A 500 10.232 10.149 -7.805 1.00 0.00 N ATOM 1161 CA ALA A 500 9.242 10.559 -8.792 1.00 0.00 C ATOM 1162 C ALA A 500 7.906 10.878 -8.130 1.00 0.00 C ATOM 1163 O ALA A 500 7.051 10.006 -7.983 1.00 0.00 O ATOM 1164 CB ALA A 500 9.065 9.475 -9.845 1.00 0.00 C ATOM 0 H ALA A 500 10.282 9.142 -7.652 1.00 0.00 H new ATOM 0 HA ALA A 500 9.604 11.466 -9.277 1.00 0.00 H new ATOM 0 HB1 ALA A 500 8.322 9.795 -10.576 1.00 0.00 H new ATOM 0 HB2 ALA A 500 10.016 9.297 -10.348 1.00 0.00 H new ATOM 0 HB3 ALA A 500 8.730 8.555 -9.367 1.00 0.00 H new ATOM 1170 N GLY A 501 7.733 12.135 -7.731 1.00 0.00 N ATOM 1171 CA GLY A 501 6.499 12.546 -7.087 1.00 0.00 C ATOM 1172 C GLY A 501 5.693 13.506 -7.940 1.00 0.00 C ATOM 1173 O GLY A 501 6.253 14.381 -8.599 1.00 0.00 O ATOM 0 H GLY A 501 8.425 12.876 -7.842 1.00 0.00 H new ATOM 0 HA2 GLY A 501 5.896 11.665 -6.868 1.00 0.00 H new ATOM 0 HA3 GLY A 501 6.731 13.019 -6.133 1.00 0.00 H new ATOM 1177 N ALA A 502 4.374 13.342 -7.927 1.00 0.00 N ATOM 1178 CA ALA A 502 3.490 14.201 -8.704 1.00 0.00 C ATOM 1179 C ALA A 502 2.633 15.074 -7.794 1.00 0.00 C ATOM 1180 O ALA A 502 2.251 14.658 -6.701 1.00 0.00 O ATOM 1181 CB ALA A 502 2.608 13.363 -9.618 1.00 0.00 C ATOM 0 H ALA A 502 3.895 12.622 -7.387 1.00 0.00 H new ATOM 0 HA ALA A 502 4.109 14.857 -9.316 1.00 0.00 H new ATOM 0 HB1 ALA A 502 1.953 14.018 -10.192 1.00 0.00 H new ATOM 0 HB2 ALA A 502 3.234 12.787 -10.300 1.00 0.00 H new ATOM 0 HB3 ALA A 502 2.005 12.682 -9.017 1.00 0.00 H new ATOM 1187 N GLU A 503 2.336 16.286 -8.251 1.00 0.00 N ATOM 1188 CA GLU A 503 1.525 17.218 -7.476 1.00 0.00 C ATOM 1189 C GLU A 503 0.047 16.847 -7.553 1.00 0.00 C ATOM 1190 O GLU A 503 -0.438 16.397 -8.592 1.00 0.00 O ATOM 1191 CB GLU A 503 1.731 18.648 -7.978 1.00 0.00 C ATOM 1192 CG GLU A 503 1.331 19.711 -6.969 1.00 0.00 C ATOM 1193 CD GLU A 503 1.885 21.080 -7.313 1.00 0.00 C ATOM 1194 OE1 GLU A 503 3.046 21.359 -6.947 1.00 0.00 O ATOM 1195 OE2 GLU A 503 1.158 21.872 -7.948 1.00 0.00 O ATOM 0 H GLU A 503 2.645 16.646 -9.154 1.00 0.00 H new ATOM 0 HA GLU A 503 1.843 17.158 -6.435 1.00 0.00 H new ATOM 0 HB2 GLU A 503 2.780 18.784 -8.240 1.00 0.00 H new ATOM 0 HB3 GLU A 503 1.153 18.790 -8.891 1.00 0.00 H new ATOM 0 HG2 GLU A 503 0.244 19.766 -6.917 1.00 0.00 H new ATOM 0 HG3 GLU A 503 1.683 19.419 -5.980 1.00 0.00 H new ATOM 1202 N ASP A 504 -0.664 17.039 -6.448 1.00 0.00 N ATOM 1203 CA ASP A 504 -2.087 16.725 -6.389 1.00 0.00 C ATOM 1204 C ASP A 504 -2.832 17.742 -5.530 1.00 0.00 C ATOM 1205 O ASP A 504 -2.457 17.996 -4.386 1.00 0.00 O ATOM 1206 CB ASP A 504 -2.298 15.317 -5.833 1.00 0.00 C ATOM 1207 CG ASP A 504 -1.760 14.242 -6.757 1.00 0.00 C ATOM 1208 OD1 ASP A 504 -0.565 13.899 -6.635 1.00 0.00 O ATOM 1209 OD2 ASP A 504 -2.533 13.744 -7.600 1.00 0.00 O ATOM 0 H ASP A 504 -0.278 17.411 -5.580 1.00 0.00 H new ATOM 0 HA ASP A 504 -2.486 16.770 -7.402 1.00 0.00 H new ATOM 0 HB2 ASP A 504 -1.809 15.236 -4.862 1.00 0.00 H new ATOM 0 HB3 ASP A 504 -3.363 15.151 -5.668 1.00 0.00 H new ATOM 1214 N GLU A 505 -3.889 18.322 -6.091 1.00 0.00 N ATOM 1215 CA GLU A 505 -4.685 19.313 -5.377 1.00 0.00 C ATOM 1216 C GLU A 505 -5.056 18.811 -3.984 1.00 0.00 C ATOM 1217 O GLU A 505 -5.020 17.610 -3.714 1.00 0.00 O ATOM 1218 CB GLU A 505 -5.954 19.645 -6.165 1.00 0.00 C ATOM 1219 CG GLU A 505 -6.833 18.437 -6.441 1.00 0.00 C ATOM 1220 CD GLU A 505 -8.073 18.789 -7.240 1.00 0.00 C ATOM 1221 OE1 GLU A 505 -7.993 19.701 -8.090 1.00 0.00 O ATOM 1222 OE2 GLU A 505 -9.123 18.151 -7.016 1.00 0.00 O ATOM 0 H GLU A 505 -4.213 18.122 -7.037 1.00 0.00 H new ATOM 0 HA GLU A 505 -4.084 20.216 -5.272 1.00 0.00 H new ATOM 0 HB2 GLU A 505 -6.532 20.385 -5.612 1.00 0.00 H new ATOM 0 HB3 GLU A 505 -5.673 20.104 -7.113 1.00 0.00 H new ATOM 0 HG2 GLU A 505 -6.256 17.689 -6.984 1.00 0.00 H new ATOM 0 HG3 GLU A 505 -7.131 17.985 -5.495 1.00 0.00 H new ATOM 1229 N LYS A 506 -5.412 19.739 -3.102 1.00 0.00 N ATOM 1230 CA LYS A 506 -5.790 19.393 -1.737 1.00 0.00 C ATOM 1231 C LYS A 506 -6.475 20.569 -1.048 1.00 0.00 C ATOM 1232 O LYS A 506 -6.245 21.726 -1.401 1.00 0.00 O ATOM 1233 CB LYS A 506 -4.557 18.967 -0.937 1.00 0.00 C ATOM 1234 CG LYS A 506 -3.548 20.084 -0.733 1.00 0.00 C ATOM 1235 CD LYS A 506 -2.656 19.817 0.467 1.00 0.00 C ATOM 1236 CE LYS A 506 -1.439 18.990 0.084 1.00 0.00 C ATOM 1237 NZ LYS A 506 -0.380 19.822 -0.552 1.00 0.00 N ATOM 0 H LYS A 506 -5.447 20.737 -3.309 1.00 0.00 H new ATOM 0 HA LYS A 506 -6.492 18.561 -1.781 1.00 0.00 H new ATOM 0 HB2 LYS A 506 -4.877 18.595 0.037 1.00 0.00 H new ATOM 0 HB3 LYS A 506 -4.070 18.138 -1.450 1.00 0.00 H new ATOM 0 HG2 LYS A 506 -2.934 20.189 -1.628 1.00 0.00 H new ATOM 0 HG3 LYS A 506 -4.073 21.029 -0.594 1.00 0.00 H new ATOM 0 HD2 LYS A 506 -2.332 20.764 0.899 1.00 0.00 H new ATOM 0 HD3 LYS A 506 -3.225 19.294 1.236 1.00 0.00 H new ATOM 0 HE2 LYS A 506 -1.035 18.505 0.973 1.00 0.00 H new ATOM 0 HE3 LYS A 506 -1.739 18.198 -0.602 1.00 0.00 H new ATOM 0 HZ1 LYS A 506 0.432 19.221 -0.798 1.00 0.00 H new ATOM 0 HZ2 LYS A 506 -0.757 20.264 -1.414 1.00 0.00 H new ATOM 0 HZ3 LYS A 506 -0.075 20.562 0.112 1.00 0.00 H new ATOM 1251 N GLU A 507 -7.315 20.265 -0.064 1.00 0.00 N ATOM 1252 CA GLU A 507 -8.032 21.298 0.674 1.00 0.00 C ATOM 1253 C GLU A 507 -8.688 20.718 1.924 1.00 0.00 C ATOM 1254 O GLU A 507 -8.659 19.508 2.149 1.00 0.00 O ATOM 1255 CB GLU A 507 -9.093 21.949 -0.216 1.00 0.00 C ATOM 1256 CG GLU A 507 -10.092 20.961 -0.795 1.00 0.00 C ATOM 1257 CD GLU A 507 -10.881 21.539 -1.953 1.00 0.00 C ATOM 1258 OE1 GLU A 507 -10.991 22.781 -2.034 1.00 0.00 O ATOM 1259 OE2 GLU A 507 -11.388 20.751 -2.779 1.00 0.00 O ATOM 0 H GLU A 507 -7.516 19.312 0.240 1.00 0.00 H new ATOM 0 HA GLU A 507 -7.311 22.055 0.981 1.00 0.00 H new ATOM 0 HB2 GLU A 507 -9.631 22.699 0.364 1.00 0.00 H new ATOM 0 HB3 GLU A 507 -8.598 22.473 -1.033 1.00 0.00 H new ATOM 0 HG2 GLU A 507 -9.562 20.069 -1.130 1.00 0.00 H new ATOM 0 HG3 GLU A 507 -10.782 20.646 -0.012 1.00 0.00 H new ATOM 1266 N VAL A 508 -9.278 21.591 2.735 1.00 0.00 N ATOM 1267 CA VAL A 508 -9.941 21.167 3.962 1.00 0.00 C ATOM 1268 C VAL A 508 -11.457 21.185 3.802 1.00 0.00 C ATOM 1269 O VAL A 508 -12.083 22.243 3.846 1.00 0.00 O ATOM 1270 CB VAL A 508 -9.551 22.066 5.150 1.00 0.00 C ATOM 1271 CG1 VAL A 508 -10.285 21.634 6.410 1.00 0.00 C ATOM 1272 CG2 VAL A 508 -8.045 22.039 5.366 1.00 0.00 C ATOM 0 H VAL A 508 -9.310 22.596 2.564 1.00 0.00 H new ATOM 0 HA VAL A 508 -9.612 20.148 4.164 1.00 0.00 H new ATOM 0 HB VAL A 508 -9.845 23.090 4.920 1.00 0.00 H new ATOM 0 HG11 VAL A 508 -9.997 22.281 7.239 1.00 0.00 H new ATOM 0 HG12 VAL A 508 -11.360 21.709 6.248 1.00 0.00 H new ATOM 0 HG13 VAL A 508 -10.025 20.602 6.647 1.00 0.00 H new ATOM 0 HG21 VAL A 508 -7.787 22.680 6.209 1.00 0.00 H new ATOM 0 HG22 VAL A 508 -7.726 21.018 5.575 1.00 0.00 H new ATOM 0 HG23 VAL A 508 -7.542 22.400 4.469 1.00 0.00 H new ATOM 1282 N GLU A 509 -12.041 20.005 3.616 1.00 0.00 N ATOM 1283 CA GLU A 509 -13.485 19.886 3.449 1.00 0.00 C ATOM 1284 C GLU A 509 -14.224 20.645 4.547 1.00 0.00 C ATOM 1285 O GLU A 509 -13.769 20.703 5.689 1.00 0.00 O ATOM 1286 CB GLU A 509 -13.902 18.414 3.461 1.00 0.00 C ATOM 1287 CG GLU A 509 -13.698 17.734 4.805 1.00 0.00 C ATOM 1288 CD GLU A 509 -14.292 16.340 4.849 1.00 0.00 C ATOM 1289 OE1 GLU A 509 -15.355 16.128 4.229 1.00 0.00 O ATOM 1290 OE2 GLU A 509 -13.694 15.461 5.504 1.00 0.00 O ATOM 0 H GLU A 509 -11.537 19.119 3.577 1.00 0.00 H new ATOM 0 HA GLU A 509 -13.751 20.324 2.487 1.00 0.00 H new ATOM 0 HB2 GLU A 509 -14.953 18.341 3.182 1.00 0.00 H new ATOM 0 HB3 GLU A 509 -13.333 17.878 2.702 1.00 0.00 H new ATOM 0 HG2 GLU A 509 -12.631 17.677 5.021 1.00 0.00 H new ATOM 0 HG3 GLU A 509 -14.150 18.342 5.588 1.00 0.00 H new ATOM 1297 N GLU A 510 -15.366 21.224 4.192 1.00 0.00 N ATOM 1298 CA GLU A 510 -16.168 21.981 5.147 1.00 0.00 C ATOM 1299 C GLU A 510 -16.871 21.046 6.128 1.00 0.00 C ATOM 1300 O GLU A 510 -17.502 20.068 5.726 1.00 0.00 O ATOM 1301 CB GLU A 510 -17.200 22.839 4.413 1.00 0.00 C ATOM 1302 CG GLU A 510 -16.690 24.222 4.044 1.00 0.00 C ATOM 1303 CD GLU A 510 -17.499 24.864 2.933 1.00 0.00 C ATOM 1304 OE1 GLU A 510 -18.650 25.269 3.195 1.00 0.00 O ATOM 1305 OE2 GLU A 510 -16.978 24.962 1.802 1.00 0.00 O ATOM 0 H GLU A 510 -15.757 21.184 3.251 1.00 0.00 H new ATOM 0 HA GLU A 510 -15.499 22.633 5.709 1.00 0.00 H new ATOM 0 HB2 GLU A 510 -17.511 22.322 3.505 1.00 0.00 H new ATOM 0 HB3 GLU A 510 -18.086 22.943 5.040 1.00 0.00 H new ATOM 0 HG2 GLU A 510 -16.718 24.863 4.925 1.00 0.00 H new ATOM 0 HG3 GLU A 510 -15.647 24.150 3.735 1.00 0.00 H new ATOM 1312 N LEU A 511 -16.757 21.355 7.415 1.00 0.00 N ATOM 1313 CA LEU A 511 -17.381 20.544 8.454 1.00 0.00 C ATOM 1314 C LEU A 511 -18.899 20.695 8.425 1.00 0.00 C ATOM 1315 O LEU A 511 -19.634 19.713 8.531 1.00 0.00 O ATOM 1316 CB LEU A 511 -16.844 20.941 9.830 1.00 0.00 C ATOM 1317 CG LEU A 511 -15.541 20.267 10.261 1.00 0.00 C ATOM 1318 CD1 LEU A 511 -14.883 21.048 11.388 1.00 0.00 C ATOM 1319 CD2 LEU A 511 -15.799 18.829 10.687 1.00 0.00 C ATOM 0 H LEU A 511 -16.238 22.161 7.764 1.00 0.00 H new ATOM 0 HA LEU A 511 -17.134 19.500 8.262 1.00 0.00 H new ATOM 0 HB2 LEU A 511 -16.693 22.020 9.841 1.00 0.00 H new ATOM 0 HB3 LEU A 511 -17.608 20.719 10.574 1.00 0.00 H new ATOM 0 HG LEU A 511 -14.862 20.256 9.409 1.00 0.00 H new ATOM 0 HD11 LEU A 511 -13.957 20.553 11.681 1.00 0.00 H new ATOM 0 HD12 LEU A 511 -14.662 22.060 11.049 1.00 0.00 H new ATOM 0 HD13 LEU A 511 -15.558 21.091 12.243 1.00 0.00 H new ATOM 0 HD21 LEU A 511 -14.860 18.365 10.990 1.00 0.00 H new ATOM 0 HD22 LEU A 511 -16.497 18.817 11.524 1.00 0.00 H new ATOM 0 HD23 LEU A 511 -16.225 18.273 9.852 1.00 0.00 H new ATOM 1331 N LYS A 512 -19.362 21.932 8.279 1.00 0.00 N ATOM 1332 CA LYS A 512 -20.792 22.213 8.233 1.00 0.00 C ATOM 1333 C LYS A 512 -21.049 23.653 7.800 1.00 0.00 C ATOM 1334 O LYS A 512 -20.816 24.592 8.561 1.00 0.00 O ATOM 1335 CB LYS A 512 -21.427 21.960 9.602 1.00 0.00 C ATOM 1336 CG LYS A 512 -22.938 21.809 9.553 1.00 0.00 C ATOM 1337 CD LYS A 512 -23.637 23.151 9.693 1.00 0.00 C ATOM 1338 CE LYS A 512 -25.139 23.021 9.488 1.00 0.00 C ATOM 1339 NZ LYS A 512 -25.805 22.382 10.657 1.00 0.00 N ATOM 0 H LYS A 512 -18.767 22.756 8.190 1.00 0.00 H new ATOM 0 HA LYS A 512 -21.245 21.545 7.501 1.00 0.00 H new ATOM 0 HB2 LYS A 512 -20.994 21.057 10.033 1.00 0.00 H new ATOM 0 HB3 LYS A 512 -21.174 22.785 10.269 1.00 0.00 H new ATOM 0 HG2 LYS A 512 -23.228 21.343 8.611 1.00 0.00 H new ATOM 0 HG3 LYS A 512 -23.264 21.143 10.352 1.00 0.00 H new ATOM 0 HD2 LYS A 512 -23.438 23.565 10.682 1.00 0.00 H new ATOM 0 HD3 LYS A 512 -23.229 23.853 8.966 1.00 0.00 H new ATOM 0 HE2 LYS A 512 -25.569 24.008 9.320 1.00 0.00 H new ATOM 0 HE3 LYS A 512 -25.334 22.431 8.592 1.00 0.00 H new ATOM 0 HZ1 LYS A 512 -26.827 22.312 10.478 1.00 0.00 H new ATOM 0 HZ2 LYS A 512 -25.413 21.430 10.803 1.00 0.00 H new ATOM 0 HZ3 LYS A 512 -25.641 22.958 11.507 1.00 0.00 H new ATOM 1353 N LYS A 513 -21.533 23.820 6.574 1.00 0.00 N ATOM 1354 CA LYS A 513 -21.826 25.145 6.040 1.00 0.00 C ATOM 1355 C LYS A 513 -23.194 25.630 6.507 1.00 0.00 C ATOM 1356 O LYS A 513 -24.117 24.835 6.687 1.00 0.00 O ATOM 1357 CB LYS A 513 -21.775 25.123 4.510 1.00 0.00 C ATOM 1358 CG LYS A 513 -21.573 26.494 3.889 1.00 0.00 C ATOM 1359 CD LYS A 513 -21.996 26.513 2.430 1.00 0.00 C ATOM 1360 CE LYS A 513 -22.103 27.935 1.899 1.00 0.00 C ATOM 1361 NZ LYS A 513 -22.750 27.979 0.558 1.00 0.00 N ATOM 0 H LYS A 513 -21.731 23.053 5.931 1.00 0.00 H new ATOM 0 HA LYS A 513 -21.069 25.835 6.413 1.00 0.00 H new ATOM 0 HB2 LYS A 513 -20.966 24.466 4.191 1.00 0.00 H new ATOM 0 HB3 LYS A 513 -22.702 24.694 4.130 1.00 0.00 H new ATOM 0 HG2 LYS A 513 -22.148 27.235 4.445 1.00 0.00 H new ATOM 0 HG3 LYS A 513 -20.524 26.779 3.968 1.00 0.00 H new ATOM 0 HD2 LYS A 513 -21.275 25.954 1.834 1.00 0.00 H new ATOM 0 HD3 LYS A 513 -22.957 26.010 2.322 1.00 0.00 H new ATOM 0 HE2 LYS A 513 -22.677 28.542 2.599 1.00 0.00 H new ATOM 0 HE3 LYS A 513 -21.108 28.375 1.837 1.00 0.00 H new ATOM 0 HZ1 LYS A 513 -22.804 28.965 0.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 513 -22.189 27.421 -0.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 513 -23.709 27.582 0.622 1.00 0.00 H new ATOM 1375 N SER A 514 -23.319 26.939 6.700 1.00 0.00 N ATOM 1376 CA SER A 514 -24.574 27.529 7.149 1.00 0.00 C ATOM 1377 C SER A 514 -25.722 27.130 6.227 1.00 0.00 C ATOM 1378 O SER A 514 -25.548 27.013 5.014 1.00 0.00 O ATOM 1379 CB SER A 514 -24.455 29.054 7.202 1.00 0.00 C ATOM 1380 OG SER A 514 -24.324 29.601 5.902 1.00 0.00 O ATOM 0 H SER A 514 -22.566 27.611 6.552 1.00 0.00 H new ATOM 0 HA SER A 514 -24.786 27.153 8.150 1.00 0.00 H new ATOM 0 HB2 SER A 514 -25.335 29.474 7.689 1.00 0.00 H new ATOM 0 HB3 SER A 514 -23.592 29.334 7.806 1.00 0.00 H new ATOM 0 HG SER A 514 -24.251 30.576 5.963 1.00 0.00 H new ATOM 1386 N GLY A 515 -26.898 26.921 6.812 1.00 0.00 N ATOM 1387 CA GLY A 515 -28.058 26.537 6.029 1.00 0.00 C ATOM 1388 C GLY A 515 -29.273 27.389 6.337 1.00 0.00 C ATOM 1389 O GLY A 515 -29.418 27.930 7.433 1.00 0.00 O ATOM 0 H GLY A 515 -27.068 27.011 7.814 1.00 0.00 H new ATOM 0 HA2 GLY A 515 -27.820 26.619 4.968 1.00 0.00 H new ATOM 0 HA3 GLY A 515 -28.293 25.491 6.223 1.00 0.00 H new ATOM 1393 N PRO A 516 -30.173 27.520 5.351 1.00 0.00 N ATOM 1394 CA PRO A 516 -31.398 28.313 5.497 1.00 0.00 C ATOM 1395 C PRO A 516 -32.394 27.670 6.455 1.00 0.00 C ATOM 1396 O PRO A 516 -32.091 26.666 7.100 1.00 0.00 O ATOM 1397 CB PRO A 516 -31.968 28.351 4.077 1.00 0.00 C ATOM 1398 CG PRO A 516 -31.427 27.129 3.420 1.00 0.00 C ATOM 1399 CD PRO A 516 -30.066 26.904 4.018 1.00 0.00 C ATOM 0 HA PRO A 516 -31.198 29.299 5.916 1.00 0.00 H new ATOM 0 HB2 PRO A 516 -33.058 28.345 4.087 1.00 0.00 H new ATOM 0 HB3 PRO A 516 -31.659 29.254 3.550 1.00 0.00 H new ATOM 0 HG2 PRO A 516 -32.077 26.272 3.596 1.00 0.00 H new ATOM 0 HG3 PRO A 516 -31.361 27.263 2.340 1.00 0.00 H new ATOM 0 HD2 PRO A 516 -29.827 25.843 4.084 1.00 0.00 H new ATOM 0 HD3 PRO A 516 -29.283 27.371 3.421 1.00 0.00 H new ATOM 1407 N SER A 517 -33.586 28.253 6.542 1.00 0.00 N ATOM 1408 CA SER A 517 -34.626 27.737 7.424 1.00 0.00 C ATOM 1409 C SER A 517 -35.839 27.276 6.621 1.00 0.00 C ATOM 1410 O SER A 517 -36.020 27.668 5.468 1.00 0.00 O ATOM 1411 CB SER A 517 -35.046 28.808 8.433 1.00 0.00 C ATOM 1412 OG SER A 517 -35.491 28.221 9.644 1.00 0.00 O ATOM 0 H SER A 517 -33.855 29.082 6.013 1.00 0.00 H new ATOM 0 HA SER A 517 -34.220 26.880 7.962 1.00 0.00 H new ATOM 0 HB2 SER A 517 -34.205 29.472 8.634 1.00 0.00 H new ATOM 0 HB3 SER A 517 -35.841 29.420 8.008 1.00 0.00 H new ATOM 0 HG SER A 517 -35.752 28.926 10.273 1.00 0.00 H new ATOM 1418 N SER A 518 -36.667 26.440 7.240 1.00 0.00 N ATOM 1419 CA SER A 518 -37.861 25.921 6.583 1.00 0.00 C ATOM 1420 C SER A 518 -39.039 25.880 7.551 1.00 0.00 C ATOM 1421 O SER A 518 -38.910 25.417 8.684 1.00 0.00 O ATOM 1422 CB SER A 518 -37.595 24.522 6.026 1.00 0.00 C ATOM 1423 OG SER A 518 -38.379 24.274 4.872 1.00 0.00 O ATOM 0 H SER A 518 -36.533 26.108 8.195 1.00 0.00 H new ATOM 0 HA SER A 518 -38.113 26.590 5.760 1.00 0.00 H new ATOM 0 HB2 SER A 518 -36.538 24.420 5.780 1.00 0.00 H new ATOM 0 HB3 SER A 518 -37.818 23.775 6.788 1.00 0.00 H new ATOM 0 HG SER A 518 -38.189 23.374 4.535 1.00 0.00 H new ATOM 1429 N GLY A 519 -40.189 26.368 7.096 1.00 0.00 N ATOM 1430 CA GLY A 519 -41.374 26.378 7.933 1.00 0.00 C ATOM 1431 C GLY A 519 -42.634 26.040 7.160 1.00 0.00 C ATOM 1432 O GLY A 519 -42.534 25.620 6.008 1.00 0.00 O ATOM 0 H GLY A 519 -40.321 26.757 6.162 1.00 0.00 H new ATOM 0 HA2 GLY A 519 -41.247 25.662 8.745 1.00 0.00 H new ATOM 0 HA3 GLY A 519 -41.484 27.362 8.389 1.00 0.00 H new TER 1436 GLY A 519 HETATM 1437 ZN ZN A 622 -0.623 -8.157 -11.012 1.00 0.00 ZN HETATM 1438 ZN ZN A 822 -0.575 -3.326 5.866 1.00 0.00 ZN