USER MOD reduce.3.24.130724 H: found=0, std=0, add=785, rem=0, adj=34 USER MOD reduce.3.24.130724 removed 785 hydrogens (27 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 489 ASN : amide:sc= 0.461 K(o=0.98,f=-0.7) USER MOD Set 1.2: A 492 LYS NZ :NH3+ 158:sc= 0.516 (180deg=0) USER MOD Set 1.3: A 493 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 442 HIS : no HD1:sc= 0.825 K(o=4,f=-7.1!) USER MOD Set 2.2: A 444 THR OG1 : rot 180:sc= 0 USER MOD Set 2.3: A 500 GLN : amide:sc= 1.78 K(o=4,f=-6.8!) USER MOD Set 2.4: A 508 LYS NZ :NH3+ -177:sc= 1.41 (180deg=0.478) USER MOD Set 3.1: A 424 SER OG : rot -129:sc= 0.508 USER MOD Set 3.2: A 427 SER OG : rot -112:sc= 0.55 USER MOD Single : A 425 SER OG : rot 180:sc= 0 USER MOD Single : A 428 SER OG : rot 180:sc= 0 USER MOD Single : A 434 GLN : amide:sc= -0.0581 X(o=-0.058,f=-0.15) USER MOD Single : A 436 LYS NZ :NH3+ 160:sc= 0 (180deg=-0.0809) USER MOD Single : A 439 HIS : no HD1:sc= 0.355 K(o=0.36,f=-1.9!) USER MOD Single : A 447 LYS NZ :NH3+ 166:sc= 1.13 (180deg=0.999) USER MOD Single : A 450 LYS NZ :NH3+ 176:sc= 0.995 (180deg=0.982) USER MOD Single : A 451 THR OG1 : rot 180:sc= 0.0704 USER MOD Single : A 452 SER OG : rot 180:sc= 0.00883 USER MOD Single : A 455 TYR OH : rot 180:sc= 0 USER MOD Single : A 456 GLN : amide:sc= 0 X(o=0,f=-0.096) USER MOD Single : A 459 SER OG : rot 180:sc= 0 USER MOD Single : A 463 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 465 GLN : amide:sc= 0.321 K(o=0.32,f=-0.26) USER MOD Single : A 467 SER OG : rot 180:sc= 0 USER MOD Single : A 472 THR OG1 : rot 180:sc= 0 USER MOD Single : A 473 SER OG : rot 180:sc= 0 USER MOD Single : A 477 SER OG : rot 180:sc= 0 USER MOD Single : A 479 SER OG : rot 180:sc= 0 USER MOD Single : A 480 GLN : amide:sc= 0 X(o=0,f=-0.38) USER MOD Single : A 483 GLN : amide:sc= 0.111 K(o=0.11,f=-2.5) USER MOD Single : A 485 GLN : amide:sc= 0.805 K(o=0.81,f=-0.0034) USER MOD Single : A 490 THR OG1 : rot -78:sc= 0.701 USER MOD Single : A 491 SER OG : rot -54:sc= 0.0177 USER MOD Single : A 496 SER OG : rot 180:sc= 0 USER MOD Single : A 497 TYR OH : rot 180:sc= 0 USER MOD Single : A 501 THR OG1 : rot 180:sc= 0.347 USER MOD Single : A 502 TYR OH : rot 180:sc= 0 USER MOD Single : A 505 TYR OH : rot 180:sc= 0 USER MOD Single : A 509 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 510 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 511 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 GLN : amide:sc= 0 X(o=0,f=-0.002) USER MOD Single : A 516 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 517 SER OG : rot 180:sc= 0 USER MOD Single : A 520 SER OG : rot 180:sc= 0 USER MOD Single : A 521 SER OG : rot 180:sc= 0 USER MOD Single : A 523 7MG O2' : rot -24:sc= 0.0534 USER MOD Single : A 523 7MG O3' : rot 180:sc= 0.0682 USER MOD Single : A 524 GDP O2' : rot 180:sc= 0 USER MOD Single : A 524 GDP O3' : rot 141:sc= 0.0477 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 423 -19.847 -35.705 -12.262 1.00 0.00 N ATOM 2 CA GLY A 423 -18.901 -34.629 -12.624 1.00 0.00 C ATOM 3 C GLY A 423 -18.582 -33.737 -11.433 1.00 0.00 C ATOM 4 O GLY A 423 -19.416 -33.552 -10.543 1.00 0.00 O ATOM 0 HA2 GLY A 423 -17.980 -35.068 -13.007 1.00 0.00 H new ATOM 0 HA3 GLY A 423 -19.325 -34.026 -13.427 1.00 0.00 H new ATOM 10 N SER A 424 -17.367 -33.180 -11.401 1.00 0.00 N ATOM 11 CA SER A 424 -16.907 -32.217 -10.382 1.00 0.00 C ATOM 12 C SER A 424 -17.588 -30.836 -10.488 1.00 0.00 C ATOM 13 O SER A 424 -18.245 -30.520 -11.488 1.00 0.00 O ATOM 14 CB SER A 424 -15.382 -32.062 -10.483 1.00 0.00 C ATOM 15 OG SER A 424 -15.000 -31.581 -11.763 1.00 0.00 O ATOM 0 H SER A 424 -16.654 -33.389 -12.100 1.00 0.00 H new ATOM 0 HA SER A 424 -17.189 -32.621 -9.410 1.00 0.00 H new ATOM 0 HB2 SER A 424 -15.032 -31.374 -9.713 1.00 0.00 H new ATOM 0 HB3 SER A 424 -14.903 -33.023 -10.294 1.00 0.00 H new ATOM 0 HG SER A 424 -14.300 -32.158 -12.134 1.00 0.00 H new ATOM 21 N SER A 425 -17.396 -29.992 -9.464 1.00 0.00 N ATOM 22 CA SER A 425 -17.997 -28.643 -9.353 1.00 0.00 C ATOM 23 C SER A 425 -16.994 -27.535 -8.965 1.00 0.00 C ATOM 24 O SER A 425 -17.389 -26.382 -8.772 1.00 0.00 O ATOM 25 CB SER A 425 -19.160 -28.667 -8.344 1.00 0.00 C ATOM 26 OG SER A 425 -20.135 -29.648 -8.679 1.00 0.00 O ATOM 0 H SER A 425 -16.805 -30.229 -8.667 1.00 0.00 H new ATOM 0 HA SER A 425 -18.357 -28.392 -10.351 1.00 0.00 H new ATOM 0 HB2 SER A 425 -18.770 -28.869 -7.346 1.00 0.00 H new ATOM 0 HB3 SER A 425 -19.631 -27.685 -8.310 1.00 0.00 H new ATOM 0 HG SER A 425 -20.855 -29.633 -8.015 1.00 0.00 H new ATOM 32 N GLY A 426 -15.698 -27.857 -8.851 1.00 0.00 N ATOM 33 CA GLY A 426 -14.639 -26.911 -8.462 1.00 0.00 C ATOM 34 C GLY A 426 -13.222 -27.503 -8.402 1.00 0.00 C ATOM 35 O GLY A 426 -12.374 -26.998 -7.662 1.00 0.00 O ATOM 0 H GLY A 426 -15.349 -28.799 -9.029 1.00 0.00 H new ATOM 0 HA2 GLY A 426 -14.639 -26.080 -9.168 1.00 0.00 H new ATOM 0 HA3 GLY A 426 -14.885 -26.498 -7.484 1.00 0.00 H new ATOM 39 N SER A 427 -12.954 -28.587 -9.143 1.00 0.00 N ATOM 40 CA SER A 427 -11.686 -29.344 -9.110 1.00 0.00 C ATOM 41 C SER A 427 -10.447 -28.570 -9.598 1.00 0.00 C ATOM 42 O SER A 427 -9.317 -29.007 -9.359 1.00 0.00 O ATOM 43 CB SER A 427 -11.841 -30.653 -9.897 1.00 0.00 C ATOM 44 OG SER A 427 -12.335 -30.423 -11.209 1.00 0.00 O ATOM 0 H SER A 427 -13.629 -28.976 -9.801 1.00 0.00 H new ATOM 0 HA SER A 427 -11.494 -29.545 -8.056 1.00 0.00 H new ATOM 0 HB2 SER A 427 -10.877 -31.159 -9.955 1.00 0.00 H new ATOM 0 HB3 SER A 427 -12.520 -31.319 -9.364 1.00 0.00 H new ATOM 0 HG SER A 427 -13.243 -30.785 -11.285 1.00 0.00 H new ATOM 50 N SER A 428 -10.628 -27.411 -10.241 1.00 0.00 N ATOM 51 CA SER A 428 -9.548 -26.474 -10.592 1.00 0.00 C ATOM 52 C SER A 428 -8.846 -25.856 -9.372 1.00 0.00 C ATOM 53 O SER A 428 -7.682 -25.455 -9.468 1.00 0.00 O ATOM 54 CB SER A 428 -10.109 -25.343 -11.463 1.00 0.00 C ATOM 55 OG SER A 428 -11.087 -24.596 -10.750 1.00 0.00 O ATOM 0 H SER A 428 -11.549 -27.089 -10.540 1.00 0.00 H new ATOM 0 HA SER A 428 -8.802 -27.058 -11.131 1.00 0.00 H new ATOM 0 HB2 SER A 428 -9.300 -24.684 -11.778 1.00 0.00 H new ATOM 0 HB3 SER A 428 -10.551 -25.760 -12.368 1.00 0.00 H new ATOM 0 HG SER A 428 -11.431 -23.878 -11.322 1.00 0.00 H new ATOM 61 N GLY A 429 -9.537 -25.760 -8.227 1.00 0.00 N ATOM 62 CA GLY A 429 -9.065 -25.071 -7.018 1.00 0.00 C ATOM 63 C GLY A 429 -8.799 -23.565 -7.200 1.00 0.00 C ATOM 64 O GLY A 429 -8.068 -22.972 -6.401 1.00 0.00 O ATOM 0 H GLY A 429 -10.464 -26.170 -8.114 1.00 0.00 H new ATOM 0 HA2 GLY A 429 -9.805 -25.203 -6.228 1.00 0.00 H new ATOM 0 HA3 GLY A 429 -8.147 -25.550 -6.678 1.00 0.00 H new ATOM 68 N GLY A 430 -9.346 -22.947 -8.254 1.00 0.00 N ATOM 69 CA GLY A 430 -9.034 -21.570 -8.658 1.00 0.00 C ATOM 70 C GLY A 430 -9.836 -21.091 -9.877 1.00 0.00 C ATOM 71 O GLY A 430 -9.248 -20.927 -10.951 1.00 0.00 O ATOM 0 H GLY A 430 -10.030 -23.398 -8.861 1.00 0.00 H new ATOM 0 HA2 GLY A 430 -9.229 -20.901 -7.820 1.00 0.00 H new ATOM 0 HA3 GLY A 430 -7.970 -21.498 -8.883 1.00 0.00 H new ATOM 75 N PRO A 431 -11.166 -20.895 -9.757 1.00 0.00 N ATOM 76 CA PRO A 431 -12.016 -20.430 -10.859 1.00 0.00 C ATOM 77 C PRO A 431 -11.759 -18.964 -11.263 1.00 0.00 C ATOM 78 O PRO A 431 -12.016 -18.588 -12.410 1.00 0.00 O ATOM 79 CB PRO A 431 -13.453 -20.634 -10.366 1.00 0.00 C ATOM 80 CG PRO A 431 -13.335 -20.501 -8.848 1.00 0.00 C ATOM 81 CD PRO A 431 -11.962 -21.103 -8.553 1.00 0.00 C ATOM 0 HA PRO A 431 -11.801 -20.991 -11.768 1.00 0.00 H new ATOM 0 HB2 PRO A 431 -14.129 -19.888 -10.782 1.00 0.00 H new ATOM 0 HB3 PRO A 431 -13.841 -21.611 -10.654 1.00 0.00 H new ATOM 0 HG2 PRO A 431 -13.396 -19.461 -8.529 1.00 0.00 H new ATOM 0 HG3 PRO A 431 -14.130 -21.040 -8.333 1.00 0.00 H new ATOM 0 HD2 PRO A 431 -11.501 -20.620 -7.692 1.00 0.00 H new ATOM 0 HD3 PRO A 431 -12.043 -22.164 -8.317 1.00 0.00 H new ATOM 89 N ASP A 432 -11.239 -18.133 -10.354 1.00 0.00 N ATOM 90 CA ASP A 432 -10.771 -16.769 -10.647 1.00 0.00 C ATOM 91 C ASP A 432 -9.445 -16.780 -11.441 1.00 0.00 C ATOM 92 O ASP A 432 -8.547 -17.576 -11.159 1.00 0.00 O ATOM 93 CB ASP A 432 -10.608 -16.006 -9.321 1.00 0.00 C ATOM 94 CG ASP A 432 -10.116 -14.558 -9.509 1.00 0.00 C ATOM 95 OD1 ASP A 432 -10.483 -13.911 -10.520 1.00 0.00 O ATOM 96 OD2 ASP A 432 -9.363 -14.062 -8.637 1.00 0.00 O ATOM 0 H ASP A 432 -11.128 -18.392 -9.374 1.00 0.00 H new ATOM 0 HA ASP A 432 -11.510 -16.268 -11.273 1.00 0.00 H new ATOM 0 HB2 ASP A 432 -11.564 -15.993 -8.797 1.00 0.00 H new ATOM 0 HB3 ASP A 432 -9.904 -16.542 -8.685 1.00 0.00 H new ATOM 101 N LEU A 433 -9.312 -15.865 -12.410 1.00 0.00 N ATOM 102 CA LEU A 433 -8.169 -15.749 -13.331 1.00 0.00 C ATOM 103 C LEU A 433 -7.601 -14.312 -13.430 1.00 0.00 C ATOM 104 O LEU A 433 -6.678 -14.067 -14.213 1.00 0.00 O ATOM 105 CB LEU A 433 -8.587 -16.287 -14.719 1.00 0.00 C ATOM 106 CG LEU A 433 -8.955 -17.785 -14.771 1.00 0.00 C ATOM 107 CD1 LEU A 433 -9.478 -18.136 -16.165 1.00 0.00 C ATOM 108 CD2 LEU A 433 -7.758 -18.696 -14.478 1.00 0.00 C ATOM 0 H LEU A 433 -10.025 -15.156 -12.582 1.00 0.00 H new ATOM 0 HA LEU A 433 -7.354 -16.350 -12.928 1.00 0.00 H new ATOM 0 HB2 LEU A 433 -9.442 -15.709 -15.070 1.00 0.00 H new ATOM 0 HB3 LEU A 433 -7.771 -16.107 -15.419 1.00 0.00 H new ATOM 0 HG LEU A 433 -9.712 -17.949 -14.004 1.00 0.00 H new ATOM 0 HD11 LEU A 433 -9.738 -19.194 -16.200 1.00 0.00 H new ATOM 0 HD12 LEU A 433 -10.363 -17.538 -16.383 1.00 0.00 H new ATOM 0 HD13 LEU A 433 -8.707 -17.927 -16.906 1.00 0.00 H new ATOM 0 HD21 LEU A 433 -8.073 -19.738 -14.528 1.00 0.00 H new ATOM 0 HD22 LEU A 433 -6.976 -18.518 -15.216 1.00 0.00 H new ATOM 0 HD23 LEU A 433 -7.372 -18.481 -13.482 1.00 0.00 H new ATOM 120 N GLN A 434 -8.121 -13.360 -12.647 1.00 0.00 N ATOM 121 CA GLN A 434 -7.569 -11.999 -12.534 1.00 0.00 C ATOM 122 C GLN A 434 -6.173 -11.989 -11.860 1.00 0.00 C ATOM 123 O GLN A 434 -5.841 -12.936 -11.133 1.00 0.00 O ATOM 124 CB GLN A 434 -8.551 -11.114 -11.743 1.00 0.00 C ATOM 125 CG GLN A 434 -9.905 -10.905 -12.445 1.00 0.00 C ATOM 126 CD GLN A 434 -9.796 -10.220 -13.811 1.00 0.00 C ATOM 127 OE1 GLN A 434 -8.964 -9.353 -14.052 1.00 0.00 O ATOM 128 NE2 GLN A 434 -10.625 -10.585 -14.768 1.00 0.00 N ATOM 0 H GLN A 434 -8.946 -13.511 -12.066 1.00 0.00 H new ATOM 0 HA GLN A 434 -7.440 -11.603 -13.541 1.00 0.00 H new ATOM 0 HB2 GLN A 434 -8.725 -11.565 -10.766 1.00 0.00 H new ATOM 0 HB3 GLN A 434 -8.089 -10.142 -11.568 1.00 0.00 H new ATOM 0 HG2 GLN A 434 -10.390 -11.873 -12.572 1.00 0.00 H new ATOM 0 HG3 GLN A 434 -10.549 -10.307 -11.800 1.00 0.00 H new ATOM 0 HE21 GLN A 434 -11.325 -11.305 -14.589 1.00 0.00 H new ATOM 0 HE22 GLN A 434 -10.566 -10.148 -15.688 1.00 0.00 H new ATOM 137 N PRO A 435 -5.347 -10.936 -12.055 1.00 0.00 N ATOM 138 CA PRO A 435 -4.080 -10.750 -11.337 1.00 0.00 C ATOM 139 C PRO A 435 -4.218 -10.865 -9.808 1.00 0.00 C ATOM 140 O PRO A 435 -5.219 -10.434 -9.227 1.00 0.00 O ATOM 141 CB PRO A 435 -3.570 -9.361 -11.741 1.00 0.00 C ATOM 142 CG PRO A 435 -4.203 -9.131 -13.110 1.00 0.00 C ATOM 143 CD PRO A 435 -5.555 -9.832 -12.986 1.00 0.00 C ATOM 0 HA PRO A 435 -3.382 -11.542 -11.608 1.00 0.00 H new ATOM 0 HB2 PRO A 435 -3.875 -8.598 -11.025 1.00 0.00 H new ATOM 0 HB3 PRO A 435 -2.482 -9.333 -11.793 1.00 0.00 H new ATOM 0 HG2 PRO A 435 -4.317 -8.069 -13.328 1.00 0.00 H new ATOM 0 HG3 PRO A 435 -3.599 -9.558 -13.911 1.00 0.00 H new ATOM 0 HD2 PRO A 435 -6.318 -9.147 -12.616 1.00 0.00 H new ATOM 0 HD3 PRO A 435 -5.897 -10.197 -13.955 1.00 0.00 H new ATOM 151 N LYS A 436 -3.198 -11.431 -9.146 1.00 0.00 N ATOM 152 CA LYS A 436 -3.213 -11.680 -7.689 1.00 0.00 C ATOM 153 C LYS A 436 -2.834 -10.455 -6.854 1.00 0.00 C ATOM 154 O LYS A 436 -3.454 -10.198 -5.821 1.00 0.00 O ATOM 155 CB LYS A 436 -2.311 -12.883 -7.345 1.00 0.00 C ATOM 156 CG LYS A 436 -2.847 -14.194 -7.948 1.00 0.00 C ATOM 157 CD LYS A 436 -1.961 -15.427 -7.700 1.00 0.00 C ATOM 158 CE LYS A 436 -1.885 -15.875 -6.231 1.00 0.00 C ATOM 159 NZ LYS A 436 -0.721 -15.296 -5.510 1.00 0.00 N ATOM 0 H LYS A 436 -2.337 -11.731 -9.602 1.00 0.00 H new ATOM 0 HA LYS A 436 -4.244 -11.911 -7.423 1.00 0.00 H new ATOM 0 HB2 LYS A 436 -1.303 -12.698 -7.716 1.00 0.00 H new ATOM 0 HB3 LYS A 436 -2.239 -12.984 -6.262 1.00 0.00 H new ATOM 0 HG2 LYS A 436 -3.838 -14.388 -7.538 1.00 0.00 H new ATOM 0 HG3 LYS A 436 -2.967 -14.061 -9.023 1.00 0.00 H new ATOM 0 HD2 LYS A 436 -2.338 -16.255 -8.300 1.00 0.00 H new ATOM 0 HD3 LYS A 436 -0.953 -15.211 -8.053 1.00 0.00 H new ATOM 0 HE2 LYS A 436 -2.803 -15.586 -5.720 1.00 0.00 H new ATOM 0 HE3 LYS A 436 -1.827 -16.963 -6.190 1.00 0.00 H new ATOM 0 HZ1 LYS A 436 -0.891 -15.340 -4.485 1.00 0.00 H new ATOM 0 HZ2 LYS A 436 0.136 -15.838 -5.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 436 -0.593 -14.305 -5.797 1.00 0.00 H new ATOM 173 N ARG A 437 -1.823 -9.709 -7.304 1.00 0.00 N ATOM 174 CA ARG A 437 -1.181 -8.570 -6.597 1.00 0.00 C ATOM 175 C ARG A 437 -0.794 -7.385 -7.497 1.00 0.00 C ATOM 176 O ARG A 437 -0.473 -6.317 -6.983 1.00 0.00 O ATOM 177 CB ARG A 437 0.091 -9.064 -5.872 1.00 0.00 C ATOM 178 CG ARG A 437 -0.095 -10.058 -4.710 1.00 0.00 C ATOM 179 CD ARG A 437 -0.692 -9.438 -3.439 1.00 0.00 C ATOM 180 NE ARG A 437 -2.162 -9.376 -3.464 1.00 0.00 N ATOM 181 CZ ARG A 437 -2.952 -8.934 -2.507 1.00 0.00 C ATOM 182 NH1 ARG A 437 -2.487 -8.426 -1.403 1.00 0.00 N ATOM 183 NH2 ARG A 437 -4.243 -8.996 -2.658 1.00 0.00 N ATOM 0 H ARG A 437 -1.400 -9.882 -8.216 1.00 0.00 H new ATOM 0 HA ARG A 437 -1.935 -8.200 -5.903 1.00 0.00 H new ATOM 0 HB2 ARG A 437 0.741 -9.530 -6.613 1.00 0.00 H new ATOM 0 HB3 ARG A 437 0.620 -8.192 -5.487 1.00 0.00 H new ATOM 0 HG2 ARG A 437 -0.741 -10.871 -5.042 1.00 0.00 H new ATOM 0 HG3 ARG A 437 0.872 -10.499 -4.466 1.00 0.00 H new ATOM 0 HD2 ARG A 437 -0.373 -10.019 -2.574 1.00 0.00 H new ATOM 0 HD3 ARG A 437 -0.294 -8.431 -3.311 1.00 0.00 H new ATOM 0 HE ARG A 437 -2.618 -9.711 -4.313 1.00 0.00 H new ATOM 0 HH11 ARG A 437 -1.480 -8.360 -1.257 1.00 0.00 H new ATOM 0 HH12 ARG A 437 -3.130 -8.094 -0.684 1.00 0.00 H new ATOM 0 HH21 ARG A 437 -4.638 -9.385 -3.514 1.00 0.00 H new ATOM 0 HH22 ARG A 437 -4.860 -8.655 -1.920 1.00 0.00 H new ATOM 197 N ASP A 438 -0.816 -7.536 -8.824 1.00 0.00 N ATOM 198 CA ASP A 438 -0.335 -6.512 -9.774 1.00 0.00 C ATOM 199 C ASP A 438 -1.175 -5.212 -9.776 1.00 0.00 C ATOM 200 O ASP A 438 -0.715 -4.159 -10.218 1.00 0.00 O ATOM 201 CB ASP A 438 -0.276 -7.136 -11.176 1.00 0.00 C ATOM 202 CG ASP A 438 0.584 -6.325 -12.164 1.00 0.00 C ATOM 203 OD1 ASP A 438 1.755 -6.010 -11.838 1.00 0.00 O ATOM 204 OD2 ASP A 438 0.115 -6.060 -13.296 1.00 0.00 O ATOM 0 H ASP A 438 -1.170 -8.377 -9.280 1.00 0.00 H new ATOM 0 HA ASP A 438 0.658 -6.201 -9.450 1.00 0.00 H new ATOM 0 HB2 ASP A 438 0.124 -8.147 -11.100 1.00 0.00 H new ATOM 0 HB3 ASP A 438 -1.288 -7.223 -11.571 1.00 0.00 H new ATOM 209 N HIS A 439 -2.396 -5.280 -9.237 1.00 0.00 N ATOM 210 CA HIS A 439 -3.354 -4.181 -9.054 1.00 0.00 C ATOM 211 C HIS A 439 -3.375 -3.620 -7.614 1.00 0.00 C ATOM 212 O HIS A 439 -4.309 -2.901 -7.249 1.00 0.00 O ATOM 213 CB HIS A 439 -4.742 -4.702 -9.465 1.00 0.00 C ATOM 214 CG HIS A 439 -5.258 -5.789 -8.549 1.00 0.00 C ATOM 215 ND1 HIS A 439 -4.729 -7.080 -8.442 1.00 0.00 N ATOM 216 CD2 HIS A 439 -6.268 -5.651 -7.643 1.00 0.00 C ATOM 217 CE1 HIS A 439 -5.446 -7.692 -7.482 1.00 0.00 C ATOM 218 NE2 HIS A 439 -6.373 -6.856 -6.984 1.00 0.00 N ATOM 0 H HIS A 439 -2.769 -6.165 -8.893 1.00 0.00 H new ATOM 0 HA HIS A 439 -3.048 -3.342 -9.680 1.00 0.00 H new ATOM 0 HB2 HIS A 439 -5.449 -3.872 -9.470 1.00 0.00 H new ATOM 0 HB3 HIS A 439 -4.693 -5.086 -10.484 1.00 0.00 H new ATOM 0 HD2 HIS A 439 -6.868 -4.769 -7.475 1.00 0.00 H new ATOM 0 HE1 HIS A 439 -5.298 -8.711 -7.157 1.00 0.00 H new ATOM 0 HE2 HIS A 439 -7.040 -7.076 -6.245 1.00 0.00 H new ATOM 226 N VAL A 440 -2.371 -3.946 -6.787 1.00 0.00 N ATOM 227 CA VAL A 440 -2.347 -3.655 -5.340 1.00 0.00 C ATOM 228 C VAL A 440 -1.151 -2.777 -4.960 1.00 0.00 C ATOM 229 O VAL A 440 -0.005 -3.030 -5.341 1.00 0.00 O ATOM 230 CB VAL A 440 -2.354 -4.953 -4.501 1.00 0.00 C ATOM 231 CG1 VAL A 440 -2.508 -4.667 -2.997 1.00 0.00 C ATOM 232 CG2 VAL A 440 -3.503 -5.882 -4.913 1.00 0.00 C ATOM 0 H VAL A 440 -1.533 -4.430 -7.109 1.00 0.00 H new ATOM 0 HA VAL A 440 -3.257 -3.100 -5.113 1.00 0.00 H new ATOM 0 HB VAL A 440 -1.393 -5.431 -4.690 1.00 0.00 H new ATOM 0 HG11 VAL A 440 -2.508 -5.607 -2.446 1.00 0.00 H new ATOM 0 HG12 VAL A 440 -1.678 -4.047 -2.658 1.00 0.00 H new ATOM 0 HG13 VAL A 440 -3.447 -4.143 -2.821 1.00 0.00 H new ATOM 0 HG21 VAL A 440 -3.478 -6.785 -4.303 1.00 0.00 H new ATOM 0 HG22 VAL A 440 -4.455 -5.371 -4.766 1.00 0.00 H new ATOM 0 HG23 VAL A 440 -3.394 -6.151 -5.964 1.00 0.00 H new ATOM 242 N LEU A 441 -1.439 -1.749 -4.167 1.00 0.00 N ATOM 243 CA LEU A 441 -0.493 -0.805 -3.579 1.00 0.00 C ATOM 244 C LEU A 441 -0.255 -1.094 -2.092 1.00 0.00 C ATOM 245 O LEU A 441 -1.039 -1.778 -1.434 1.00 0.00 O ATOM 246 CB LEU A 441 -1.082 0.616 -3.690 1.00 0.00 C ATOM 247 CG LEU A 441 -1.304 1.141 -5.114 1.00 0.00 C ATOM 248 CD1 LEU A 441 -2.057 2.465 -5.028 1.00 0.00 C ATOM 249 CD2 LEU A 441 0.021 1.381 -5.835 1.00 0.00 C ATOM 0 H LEU A 441 -2.401 -1.539 -3.901 1.00 0.00 H new ATOM 0 HA LEU A 441 0.452 -0.898 -4.114 1.00 0.00 H new ATOM 0 HB2 LEU A 441 -2.036 0.635 -3.164 1.00 0.00 H new ATOM 0 HB3 LEU A 441 -0.417 1.305 -3.169 1.00 0.00 H new ATOM 0 HG LEU A 441 -1.870 0.396 -5.673 1.00 0.00 H new ATOM 0 HD11 LEU A 441 -2.224 2.854 -6.032 1.00 0.00 H new ATOM 0 HD12 LEU A 441 -3.017 2.307 -4.536 1.00 0.00 H new ATOM 0 HD13 LEU A 441 -1.469 3.181 -4.454 1.00 0.00 H new ATOM 0 HD21 LEU A 441 -0.174 1.753 -6.841 1.00 0.00 H new ATOM 0 HD22 LEU A 441 0.607 2.116 -5.284 1.00 0.00 H new ATOM 0 HD23 LEU A 441 0.577 0.445 -5.895 1.00 0.00 H new ATOM 261 N HIS A 442 0.786 -0.469 -1.553 1.00 0.00 N ATOM 262 CA HIS A 442 1.109 -0.347 -0.135 1.00 0.00 C ATOM 263 C HIS A 442 1.266 1.147 0.173 1.00 0.00 C ATOM 264 O HIS A 442 1.827 1.900 -0.631 1.00 0.00 O ATOM 265 CB HIS A 442 2.389 -1.129 0.184 1.00 0.00 C ATOM 266 CG HIS A 442 2.860 -0.908 1.601 1.00 0.00 C ATOM 267 ND1 HIS A 442 3.637 0.169 2.038 1.00 0.00 N ATOM 268 CD2 HIS A 442 2.520 -1.673 2.676 1.00 0.00 C ATOM 269 CE1 HIS A 442 3.735 0.032 3.374 1.00 0.00 C ATOM 270 NE2 HIS A 442 3.080 -1.069 3.779 1.00 0.00 N ATOM 0 H HIS A 442 1.477 0.000 -2.138 1.00 0.00 H new ATOM 0 HA HIS A 442 0.318 -0.768 0.487 1.00 0.00 H new ATOM 0 HB2 HIS A 442 2.211 -2.193 0.025 1.00 0.00 H new ATOM 0 HB3 HIS A 442 3.176 -0.830 -0.508 1.00 0.00 H new ATOM 0 HD2 HIS A 442 1.928 -2.576 2.665 1.00 0.00 H new ATOM 0 HE1 HIS A 442 4.264 0.710 4.027 1.00 0.00 H new ATOM 0 HE2 HIS A 442 3.010 -1.401 4.741 1.00 0.00 H new ATOM 278 N VAL A 443 0.743 1.585 1.317 1.00 0.00 N ATOM 279 CA VAL A 443 0.610 2.998 1.691 1.00 0.00 C ATOM 280 C VAL A 443 1.050 3.176 3.143 1.00 0.00 C ATOM 281 O VAL A 443 0.699 2.366 4.007 1.00 0.00 O ATOM 282 CB VAL A 443 -0.845 3.491 1.518 1.00 0.00 C ATOM 283 CG1 VAL A 443 -0.930 5.025 1.556 1.00 0.00 C ATOM 284 CG2 VAL A 443 -1.474 3.036 0.193 1.00 0.00 C ATOM 0 H VAL A 443 0.389 0.950 2.033 1.00 0.00 H new ATOM 0 HA VAL A 443 1.244 3.592 1.033 1.00 0.00 H new ATOM 0 HB VAL A 443 -1.392 3.051 2.352 1.00 0.00 H new ATOM 0 HG11 VAL A 443 -1.967 5.335 1.431 1.00 0.00 H new ATOM 0 HG12 VAL A 443 -0.556 5.387 2.514 1.00 0.00 H new ATOM 0 HG13 VAL A 443 -0.327 5.443 0.750 1.00 0.00 H new ATOM 0 HG21 VAL A 443 -2.495 3.412 0.127 1.00 0.00 H new ATOM 0 HG22 VAL A 443 -0.889 3.426 -0.640 1.00 0.00 H new ATOM 0 HG23 VAL A 443 -1.485 1.947 0.150 1.00 0.00 H new ATOM 294 N THR A 444 1.785 4.256 3.412 1.00 0.00 N ATOM 295 CA THR A 444 2.317 4.604 4.740 1.00 0.00 C ATOM 296 C THR A 444 1.896 6.030 5.093 1.00 0.00 C ATOM 297 O THR A 444 2.042 6.942 4.274 1.00 0.00 O ATOM 298 CB THR A 444 3.852 4.484 4.788 1.00 0.00 C ATOM 299 OG1 THR A 444 4.306 3.293 4.177 1.00 0.00 O ATOM 300 CG2 THR A 444 4.373 4.453 6.224 1.00 0.00 C ATOM 0 H THR A 444 2.037 4.936 2.694 1.00 0.00 H new ATOM 0 HA THR A 444 1.909 3.901 5.466 1.00 0.00 H new ATOM 0 HB THR A 444 4.225 5.360 4.257 1.00 0.00 H new ATOM 0 HG1 THR A 444 5.284 3.253 4.225 1.00 0.00 H new ATOM 0 HG21 THR A 444 5.460 4.368 6.215 1.00 0.00 H new ATOM 0 HG22 THR A 444 4.085 5.372 6.735 1.00 0.00 H new ATOM 0 HG23 THR A 444 3.946 3.597 6.747 1.00 0.00 H new ATOM 308 N PHE A 445 1.359 6.225 6.299 1.00 0.00 N ATOM 309 CA PHE A 445 0.687 7.460 6.725 1.00 0.00 C ATOM 310 C PHE A 445 0.809 7.719 8.247 1.00 0.00 C ATOM 311 O PHE A 445 1.088 6.786 9.007 1.00 0.00 O ATOM 312 CB PHE A 445 -0.793 7.373 6.298 1.00 0.00 C ATOM 313 CG PHE A 445 -1.465 6.038 6.577 1.00 0.00 C ATOM 314 CD1 PHE A 445 -1.938 5.719 7.864 1.00 0.00 C ATOM 315 CD2 PHE A 445 -1.570 5.086 5.545 1.00 0.00 C ATOM 316 CE1 PHE A 445 -2.489 4.451 8.119 1.00 0.00 C ATOM 317 CE2 PHE A 445 -2.120 3.819 5.799 1.00 0.00 C ATOM 318 CZ PHE A 445 -2.573 3.499 7.088 1.00 0.00 C ATOM 0 H PHE A 445 1.379 5.511 7.027 1.00 0.00 H new ATOM 0 HA PHE A 445 1.177 8.306 6.243 1.00 0.00 H new ATOM 0 HB2 PHE A 445 -1.350 8.157 6.811 1.00 0.00 H new ATOM 0 HB3 PHE A 445 -0.860 7.580 5.230 1.00 0.00 H new ATOM 0 HD1 PHE A 445 -1.877 6.450 8.657 1.00 0.00 H new ATOM 0 HD2 PHE A 445 -1.225 5.332 4.551 1.00 0.00 H new ATOM 0 HE1 PHE A 445 -2.848 4.208 9.108 1.00 0.00 H new ATOM 0 HE2 PHE A 445 -2.194 3.092 5.004 1.00 0.00 H new ATOM 0 HZ PHE A 445 -2.986 2.521 7.288 1.00 0.00 H new ATOM 328 N PRO A 446 0.606 8.968 8.716 1.00 0.00 N ATOM 329 CA PRO A 446 0.633 9.341 10.134 1.00 0.00 C ATOM 330 C PRO A 446 -0.299 8.528 11.045 1.00 0.00 C ATOM 331 O PRO A 446 -1.348 8.037 10.621 1.00 0.00 O ATOM 332 CB PRO A 446 0.248 10.827 10.176 1.00 0.00 C ATOM 333 CG PRO A 446 0.691 11.350 8.814 1.00 0.00 C ATOM 334 CD PRO A 446 0.427 10.159 7.898 1.00 0.00 C ATOM 0 HA PRO A 446 1.628 9.132 10.528 1.00 0.00 H new ATOM 0 HB2 PRO A 446 -0.823 10.960 10.327 1.00 0.00 H new ATOM 0 HB3 PRO A 446 0.752 11.349 10.989 1.00 0.00 H new ATOM 0 HG2 PRO A 446 0.120 12.228 8.512 1.00 0.00 H new ATOM 0 HG3 PRO A 446 1.742 11.637 8.813 1.00 0.00 H new ATOM 0 HD2 PRO A 446 -0.582 10.201 7.487 1.00 0.00 H new ATOM 0 HD3 PRO A 446 1.116 10.158 7.053 1.00 0.00 H new ATOM 342 N LYS A 447 0.034 8.488 12.341 1.00 0.00 N ATOM 343 CA LYS A 447 -0.751 7.865 13.431 1.00 0.00 C ATOM 344 C LYS A 447 -2.184 8.398 13.618 1.00 0.00 C ATOM 345 O LYS A 447 -2.985 7.787 14.324 1.00 0.00 O ATOM 346 CB LYS A 447 0.054 7.950 14.741 1.00 0.00 C ATOM 347 CG LYS A 447 0.352 9.388 15.212 1.00 0.00 C ATOM 348 CD LYS A 447 1.190 9.365 16.497 1.00 0.00 C ATOM 349 CE LYS A 447 1.640 10.762 16.949 1.00 0.00 C ATOM 350 NZ LYS A 447 0.530 11.576 17.509 1.00 0.00 N ATOM 0 H LYS A 447 0.899 8.908 12.682 1.00 0.00 H new ATOM 0 HA LYS A 447 -0.906 6.828 13.133 1.00 0.00 H new ATOM 0 HB2 LYS A 447 -0.496 7.430 15.526 1.00 0.00 H new ATOM 0 HB3 LYS A 447 0.998 7.421 14.609 1.00 0.00 H new ATOM 0 HG2 LYS A 447 0.886 9.930 14.431 1.00 0.00 H new ATOM 0 HG3 LYS A 447 -0.582 9.921 15.389 1.00 0.00 H new ATOM 0 HD2 LYS A 447 0.609 8.902 17.294 1.00 0.00 H new ATOM 0 HD3 LYS A 447 2.069 8.740 16.339 1.00 0.00 H new ATOM 0 HE2 LYS A 447 2.423 10.660 17.700 1.00 0.00 H new ATOM 0 HE3 LYS A 447 2.078 11.289 16.101 1.00 0.00 H new ATOM 0 HZ1 LYS A 447 0.921 12.400 18.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 447 -0.087 11.900 16.737 1.00 0.00 H new ATOM 0 HZ3 LYS A 447 -0.023 10.998 18.174 1.00 0.00 H new ATOM 364 N GLU A 448 -2.517 9.524 12.984 1.00 0.00 N ATOM 365 CA GLU A 448 -3.818 10.210 13.072 1.00 0.00 C ATOM 366 C GLU A 448 -4.573 10.292 11.727 1.00 0.00 C ATOM 367 O GLU A 448 -5.700 10.795 11.690 1.00 0.00 O ATOM 368 CB GLU A 448 -3.597 11.603 13.692 1.00 0.00 C ATOM 369 CG GLU A 448 -3.386 11.513 15.211 1.00 0.00 C ATOM 370 CD GLU A 448 -2.746 12.796 15.766 1.00 0.00 C ATOM 371 OE1 GLU A 448 -3.452 13.823 15.925 1.00 0.00 O ATOM 372 OE2 GLU A 448 -1.525 12.774 16.063 1.00 0.00 O ATOM 0 H GLU A 448 -1.863 10.007 12.368 1.00 0.00 H new ATOM 0 HA GLU A 448 -4.469 9.614 13.712 1.00 0.00 H new ATOM 0 HB2 GLU A 448 -2.730 12.075 13.230 1.00 0.00 H new ATOM 0 HB3 GLU A 448 -4.457 12.238 13.480 1.00 0.00 H new ATOM 0 HG2 GLU A 448 -4.343 11.340 15.703 1.00 0.00 H new ATOM 0 HG3 GLU A 448 -2.750 10.658 15.441 1.00 0.00 H new ATOM 379 N TRP A 449 -4.005 9.776 10.626 1.00 0.00 N ATOM 380 CA TRP A 449 -4.731 9.599 9.356 1.00 0.00 C ATOM 381 C TRP A 449 -5.839 8.543 9.473 1.00 0.00 C ATOM 382 O TRP A 449 -5.744 7.606 10.278 1.00 0.00 O ATOM 383 CB TRP A 449 -3.763 9.216 8.226 1.00 0.00 C ATOM 384 CG TRP A 449 -3.287 10.338 7.356 1.00 0.00 C ATOM 385 CD1 TRP A 449 -2.899 11.567 7.767 1.00 0.00 C ATOM 386 CD2 TRP A 449 -3.150 10.343 5.901 1.00 0.00 C ATOM 387 NE1 TRP A 449 -2.522 12.324 6.674 1.00 0.00 N ATOM 388 CE2 TRP A 449 -2.653 11.618 5.496 1.00 0.00 C ATOM 389 CE3 TRP A 449 -3.396 9.395 4.882 1.00 0.00 C ATOM 390 CZ2 TRP A 449 -2.408 11.937 4.152 1.00 0.00 C ATOM 391 CZ3 TRP A 449 -3.159 9.706 3.530 1.00 0.00 C ATOM 392 CH2 TRP A 449 -2.665 10.971 3.163 1.00 0.00 C ATOM 0 H TRP A 449 -3.033 9.470 10.589 1.00 0.00 H new ATOM 0 HA TRP A 449 -5.200 10.554 9.119 1.00 0.00 H new ATOM 0 HB2 TRP A 449 -2.892 8.733 8.669 1.00 0.00 H new ATOM 0 HB3 TRP A 449 -4.251 8.475 7.593 1.00 0.00 H new ATOM 0 HD1 TRP A 449 -2.886 11.905 8.793 1.00 0.00 H new ATOM 0 HE1 TRP A 449 -2.188 13.286 6.731 1.00 0.00 H new ATOM 0 HE3 TRP A 449 -3.772 8.417 5.145 1.00 0.00 H new ATOM 0 HZ2 TRP A 449 -2.027 12.911 3.881 1.00 0.00 H new ATOM 0 HZ3 TRP A 449 -3.358 8.967 2.768 1.00 0.00 H new ATOM 0 HH2 TRP A 449 -2.483 11.200 2.123 1.00 0.00 H new ATOM 403 N LYS A 450 -6.867 8.660 8.625 1.00 0.00 N ATOM 404 CA LYS A 450 -8.079 7.825 8.644 1.00 0.00 C ATOM 405 C LYS A 450 -8.425 7.229 7.276 1.00 0.00 C ATOM 406 O LYS A 450 -7.948 7.679 6.231 1.00 0.00 O ATOM 407 CB LYS A 450 -9.261 8.660 9.187 1.00 0.00 C ATOM 408 CG LYS A 450 -9.098 9.213 10.615 1.00 0.00 C ATOM 409 CD LYS A 450 -8.995 8.118 11.686 1.00 0.00 C ATOM 410 CE LYS A 450 -8.946 8.739 13.085 1.00 0.00 C ATOM 411 NZ LYS A 450 -8.854 7.690 14.132 1.00 0.00 N ATOM 0 H LYS A 450 -6.881 9.359 7.883 1.00 0.00 H new ATOM 0 HA LYS A 450 -7.882 6.977 9.299 1.00 0.00 H new ATOM 0 HB2 LYS A 450 -9.428 9.499 8.511 1.00 0.00 H new ATOM 0 HB3 LYS A 450 -10.159 8.043 9.158 1.00 0.00 H new ATOM 0 HG2 LYS A 450 -8.204 9.835 10.656 1.00 0.00 H new ATOM 0 HG3 LYS A 450 -9.946 9.858 10.846 1.00 0.00 H new ATOM 0 HD2 LYS A 450 -9.849 7.445 11.610 1.00 0.00 H new ATOM 0 HD3 LYS A 450 -8.101 7.518 11.516 1.00 0.00 H new ATOM 0 HE2 LYS A 450 -8.089 9.408 13.160 1.00 0.00 H new ATOM 0 HE3 LYS A 450 -9.838 9.344 13.249 1.00 0.00 H new ATOM 0 HZ1 LYS A 450 -8.754 8.139 15.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 450 -9.716 7.109 14.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 450 -8.027 7.087 13.947 1.00 0.00 H new ATOM 425 N THR A 451 -9.333 6.251 7.278 1.00 0.00 N ATOM 426 CA THR A 451 -9.971 5.661 6.087 1.00 0.00 C ATOM 427 C THR A 451 -10.483 6.716 5.102 1.00 0.00 C ATOM 428 O THR A 451 -10.443 6.518 3.891 1.00 0.00 O ATOM 429 CB THR A 451 -11.175 4.791 6.489 1.00 0.00 C ATOM 430 OG1 THR A 451 -10.974 4.140 7.724 1.00 0.00 O ATOM 431 CG2 THR A 451 -11.478 3.730 5.436 1.00 0.00 C ATOM 0 H THR A 451 -9.662 5.826 8.145 1.00 0.00 H new ATOM 0 HA THR A 451 -9.195 5.067 5.604 1.00 0.00 H new ATOM 0 HB THR A 451 -12.017 5.477 6.577 1.00 0.00 H new ATOM 0 HG1 THR A 451 -11.763 3.600 7.941 1.00 0.00 H new ATOM 0 HG21 THR A 451 -12.334 3.135 5.755 1.00 0.00 H new ATOM 0 HG22 THR A 451 -11.706 4.214 4.486 1.00 0.00 H new ATOM 0 HG23 THR A 451 -10.611 3.081 5.313 1.00 0.00 H new ATOM 439 N SER A 452 -10.940 7.863 5.603 1.00 0.00 N ATOM 440 CA SER A 452 -11.406 8.985 4.787 1.00 0.00 C ATOM 441 C SER A 452 -10.293 9.753 4.079 1.00 0.00 C ATOM 442 O SER A 452 -10.437 10.070 2.898 1.00 0.00 O ATOM 443 CB SER A 452 -12.174 9.952 5.667 1.00 0.00 C ATOM 444 OG SER A 452 -11.452 10.295 6.842 1.00 0.00 O ATOM 0 H SER A 452 -10.998 8.042 6.605 1.00 0.00 H new ATOM 0 HA SER A 452 -12.032 8.552 4.007 1.00 0.00 H new ATOM 0 HB2 SER A 452 -12.397 10.857 5.102 1.00 0.00 H new ATOM 0 HB3 SER A 452 -13.129 9.507 5.946 1.00 0.00 H new ATOM 0 HG SER A 452 -11.981 10.921 7.380 1.00 0.00 H new ATOM 450 N ASP A 453 -9.163 10.000 4.747 1.00 0.00 N ATOM 451 CA ASP A 453 -7.951 10.515 4.094 1.00 0.00 C ATOM 452 C ASP A 453 -7.465 9.531 3.018 1.00 0.00 C ATOM 453 O ASP A 453 -6.882 9.940 2.013 1.00 0.00 O ATOM 454 CB ASP A 453 -6.818 10.743 5.108 1.00 0.00 C ATOM 455 CG ASP A 453 -7.193 11.712 6.234 1.00 0.00 C ATOM 456 OD1 ASP A 453 -7.426 12.913 5.956 1.00 0.00 O ATOM 457 OD2 ASP A 453 -7.235 11.270 7.408 1.00 0.00 O ATOM 0 H ASP A 453 -9.060 9.850 5.751 1.00 0.00 H new ATOM 0 HA ASP A 453 -8.210 11.470 3.636 1.00 0.00 H new ATOM 0 HB2 ASP A 453 -6.532 9.785 5.543 1.00 0.00 H new ATOM 0 HB3 ASP A 453 -5.944 11.128 4.584 1.00 0.00 H new ATOM 462 N LEU A 454 -7.757 8.236 3.205 1.00 0.00 N ATOM 463 CA LEU A 454 -7.373 7.192 2.244 1.00 0.00 C ATOM 464 C LEU A 454 -8.315 7.162 1.026 1.00 0.00 C ATOM 465 O LEU A 454 -7.846 7.192 -0.114 1.00 0.00 O ATOM 466 CB LEU A 454 -7.266 5.826 2.949 1.00 0.00 C ATOM 467 CG LEU A 454 -6.051 5.688 3.886 1.00 0.00 C ATOM 468 CD1 LEU A 454 -6.174 4.385 4.675 1.00 0.00 C ATOM 469 CD2 LEU A 454 -4.720 5.655 3.128 1.00 0.00 C ATOM 0 H LEU A 454 -8.261 7.885 4.019 1.00 0.00 H new ATOM 0 HA LEU A 454 -6.386 7.433 1.850 1.00 0.00 H new ATOM 0 HB2 LEU A 454 -8.175 5.656 3.525 1.00 0.00 H new ATOM 0 HB3 LEU A 454 -7.217 5.043 2.192 1.00 0.00 H new ATOM 0 HG LEU A 454 -6.051 6.561 4.539 1.00 0.00 H new ATOM 0 HD11 LEU A 454 -5.317 4.280 5.341 1.00 0.00 H new ATOM 0 HD12 LEU A 454 -7.091 4.401 5.264 1.00 0.00 H new ATOM 0 HD13 LEU A 454 -6.202 3.542 3.984 1.00 0.00 H new ATOM 0 HD21 LEU A 454 -3.899 5.557 3.838 1.00 0.00 H new ATOM 0 HD22 LEU A 454 -4.712 4.806 2.444 1.00 0.00 H new ATOM 0 HD23 LEU A 454 -4.601 6.579 2.562 1.00 0.00 H new ATOM 481 N TYR A 455 -9.635 7.211 1.230 1.00 0.00 N ATOM 482 CA TYR A 455 -10.594 7.410 0.135 1.00 0.00 C ATOM 483 C TYR A 455 -10.332 8.718 -0.629 1.00 0.00 C ATOM 484 O TYR A 455 -10.381 8.719 -1.857 1.00 0.00 O ATOM 485 CB TYR A 455 -12.042 7.356 0.653 1.00 0.00 C ATOM 486 CG TYR A 455 -12.592 5.953 0.853 1.00 0.00 C ATOM 487 CD1 TYR A 455 -12.756 5.103 -0.260 1.00 0.00 C ATOM 488 CD2 TYR A 455 -12.980 5.509 2.132 1.00 0.00 C ATOM 489 CE1 TYR A 455 -13.276 3.805 -0.091 1.00 0.00 C ATOM 490 CE2 TYR A 455 -13.508 4.213 2.305 1.00 0.00 C ATOM 491 CZ TYR A 455 -13.649 3.353 1.193 1.00 0.00 C ATOM 492 OH TYR A 455 -14.151 2.097 1.348 1.00 0.00 O ATOM 0 H TYR A 455 -10.067 7.115 2.149 1.00 0.00 H new ATOM 0 HA TYR A 455 -10.452 6.591 -0.570 1.00 0.00 H new ATOM 0 HB2 TYR A 455 -12.095 7.891 1.601 1.00 0.00 H new ATOM 0 HB3 TYR A 455 -12.685 7.887 -0.049 1.00 0.00 H new ATOM 0 HD1 TYR A 455 -12.482 5.449 -1.246 1.00 0.00 H new ATOM 0 HD2 TYR A 455 -12.873 6.164 2.984 1.00 0.00 H new ATOM 0 HE1 TYR A 455 -13.390 3.154 -0.946 1.00 0.00 H new ATOM 0 HE2 TYR A 455 -13.805 3.878 3.288 1.00 0.00 H new ATOM 0 HH TYR A 455 -14.357 1.941 2.293 1.00 0.00 H new ATOM 502 N GLN A 456 -9.981 9.814 0.055 1.00 0.00 N ATOM 503 CA GLN A 456 -9.599 11.083 -0.579 1.00 0.00 C ATOM 504 C GLN A 456 -8.305 10.971 -1.414 1.00 0.00 C ATOM 505 O GLN A 456 -8.191 11.611 -2.462 1.00 0.00 O ATOM 506 CB GLN A 456 -9.485 12.163 0.511 1.00 0.00 C ATOM 507 CG GLN A 456 -9.291 13.579 -0.057 1.00 0.00 C ATOM 508 CD GLN A 456 -9.270 14.656 1.032 1.00 0.00 C ATOM 509 OE1 GLN A 456 -10.075 14.677 1.956 1.00 0.00 O ATOM 510 NE2 GLN A 456 -8.353 15.601 0.969 1.00 0.00 N ATOM 0 H GLN A 456 -9.954 9.846 1.074 1.00 0.00 H new ATOM 0 HA GLN A 456 -10.375 11.362 -1.292 1.00 0.00 H new ATOM 0 HB2 GLN A 456 -10.385 12.145 1.126 1.00 0.00 H new ATOM 0 HB3 GLN A 456 -8.647 11.923 1.165 1.00 0.00 H new ATOM 0 HG2 GLN A 456 -8.357 13.616 -0.617 1.00 0.00 H new ATOM 0 HG3 GLN A 456 -10.094 13.796 -0.762 1.00 0.00 H new ATOM 0 HE21 GLN A 456 -7.673 15.602 0.208 1.00 0.00 H new ATOM 0 HE22 GLN A 456 -8.323 16.331 1.681 1.00 0.00 H new ATOM 519 N LEU A 457 -7.341 10.144 -0.988 1.00 0.00 N ATOM 520 CA LEU A 457 -6.086 9.900 -1.709 1.00 0.00 C ATOM 521 C LEU A 457 -6.277 9.066 -2.995 1.00 0.00 C ATOM 522 O LEU A 457 -5.525 9.256 -3.955 1.00 0.00 O ATOM 523 CB LEU A 457 -5.084 9.246 -0.735 1.00 0.00 C ATOM 524 CG LEU A 457 -3.670 8.992 -1.292 1.00 0.00 C ATOM 525 CD1 LEU A 457 -3.005 10.273 -1.802 1.00 0.00 C ATOM 526 CD2 LEU A 457 -2.789 8.412 -0.182 1.00 0.00 C ATOM 0 H LEU A 457 -7.413 9.617 -0.118 1.00 0.00 H new ATOM 0 HA LEU A 457 -5.692 10.855 -2.056 1.00 0.00 H new ATOM 0 HB2 LEU A 457 -4.997 9.881 0.147 1.00 0.00 H new ATOM 0 HB3 LEU A 457 -5.499 8.294 -0.403 1.00 0.00 H new ATOM 0 HG LEU A 457 -3.772 8.300 -2.128 1.00 0.00 H new ATOM 0 HD11 LEU A 457 -2.011 10.040 -2.184 1.00 0.00 H new ATOM 0 HD12 LEU A 457 -3.609 10.703 -2.601 1.00 0.00 H new ATOM 0 HD13 LEU A 457 -2.921 10.989 -0.985 1.00 0.00 H new ATOM 0 HD21 LEU A 457 -1.787 8.230 -0.570 1.00 0.00 H new ATOM 0 HD22 LEU A 457 -2.734 9.119 0.646 1.00 0.00 H new ATOM 0 HD23 LEU A 457 -3.218 7.474 0.170 1.00 0.00 H new ATOM 538 N PHE A 458 -7.290 8.190 -3.048 1.00 0.00 N ATOM 539 CA PHE A 458 -7.474 7.222 -4.150 1.00 0.00 C ATOM 540 C PHE A 458 -8.814 7.316 -4.914 1.00 0.00 C ATOM 541 O PHE A 458 -9.048 6.531 -5.837 1.00 0.00 O ATOM 542 CB PHE A 458 -7.211 5.804 -3.619 1.00 0.00 C ATOM 543 CG PHE A 458 -5.809 5.578 -3.087 1.00 0.00 C ATOM 544 CD1 PHE A 458 -4.726 5.544 -3.983 1.00 0.00 C ATOM 545 CD2 PHE A 458 -5.578 5.403 -1.710 1.00 0.00 C ATOM 546 CE1 PHE A 458 -3.417 5.364 -3.507 1.00 0.00 C ATOM 547 CE2 PHE A 458 -4.268 5.235 -1.231 1.00 0.00 C ATOM 548 CZ PHE A 458 -3.186 5.220 -2.129 1.00 0.00 C ATOM 0 H PHE A 458 -8.010 8.129 -2.328 1.00 0.00 H new ATOM 0 HA PHE A 458 -6.743 7.487 -4.914 1.00 0.00 H new ATOM 0 HB2 PHE A 458 -7.926 5.590 -2.824 1.00 0.00 H new ATOM 0 HB3 PHE A 458 -7.401 5.089 -4.420 1.00 0.00 H new ATOM 0 HD1 PHE A 458 -4.902 5.657 -5.043 1.00 0.00 H new ATOM 0 HD2 PHE A 458 -6.409 5.398 -1.020 1.00 0.00 H new ATOM 0 HE1 PHE A 458 -2.589 5.336 -4.200 1.00 0.00 H new ATOM 0 HE2 PHE A 458 -4.092 5.117 -0.172 1.00 0.00 H new ATOM 0 HZ PHE A 458 -2.179 5.098 -1.760 1.00 0.00 H new ATOM 558 N SER A 459 -9.682 8.286 -4.607 1.00 0.00 N ATOM 559 CA SER A 459 -10.964 8.523 -5.306 1.00 0.00 C ATOM 560 C SER A 459 -10.833 8.754 -6.820 1.00 0.00 C ATOM 561 O SER A 459 -11.762 8.450 -7.573 1.00 0.00 O ATOM 562 CB SER A 459 -11.714 9.710 -4.684 1.00 0.00 C ATOM 563 OG SER A 459 -10.925 10.892 -4.732 1.00 0.00 O ATOM 0 H SER A 459 -9.515 8.947 -3.849 1.00 0.00 H new ATOM 0 HA SER A 459 -11.526 7.598 -5.176 1.00 0.00 H new ATOM 0 HB2 SER A 459 -12.651 9.872 -5.216 1.00 0.00 H new ATOM 0 HB3 SER A 459 -11.970 9.481 -3.650 1.00 0.00 H new ATOM 0 HG SER A 459 -11.424 11.635 -4.332 1.00 0.00 H new ATOM 569 N ALA A 460 -9.666 9.216 -7.286 1.00 0.00 N ATOM 570 CA ALA A 460 -9.312 9.367 -8.702 1.00 0.00 C ATOM 571 C ALA A 460 -9.388 8.060 -9.529 1.00 0.00 C ATOM 572 O ALA A 460 -9.413 8.114 -10.761 1.00 0.00 O ATOM 573 CB ALA A 460 -7.904 9.975 -8.769 1.00 0.00 C ATOM 0 H ALA A 460 -8.913 9.506 -6.662 1.00 0.00 H new ATOM 0 HA ALA A 460 -10.055 10.020 -9.161 1.00 0.00 H new ATOM 0 HB1 ALA A 460 -7.611 10.100 -9.811 1.00 0.00 H new ATOM 0 HB2 ALA A 460 -7.903 10.945 -8.273 1.00 0.00 H new ATOM 0 HB3 ALA A 460 -7.197 9.312 -8.271 1.00 0.00 H new ATOM 579 N PHE A 461 -9.454 6.895 -8.870 1.00 0.00 N ATOM 580 CA PHE A 461 -9.481 5.565 -9.495 1.00 0.00 C ATOM 581 C PHE A 461 -10.866 4.883 -9.453 1.00 0.00 C ATOM 582 O PHE A 461 -11.017 3.752 -9.923 1.00 0.00 O ATOM 583 CB PHE A 461 -8.360 4.723 -8.861 1.00 0.00 C ATOM 584 CG PHE A 461 -6.977 5.349 -8.991 1.00 0.00 C ATOM 585 CD1 PHE A 461 -6.503 5.772 -10.251 1.00 0.00 C ATOM 586 CD2 PHE A 461 -6.172 5.543 -7.852 1.00 0.00 C ATOM 587 CE1 PHE A 461 -5.238 6.371 -10.371 1.00 0.00 C ATOM 588 CE2 PHE A 461 -4.905 6.145 -7.974 1.00 0.00 C ATOM 589 CZ PHE A 461 -4.436 6.556 -9.233 1.00 0.00 C ATOM 0 H PHE A 461 -9.491 6.851 -7.852 1.00 0.00 H new ATOM 0 HA PHE A 461 -9.296 5.669 -10.564 1.00 0.00 H new ATOM 0 HB2 PHE A 461 -8.583 4.573 -7.805 1.00 0.00 H new ATOM 0 HB3 PHE A 461 -8.349 3.738 -9.328 1.00 0.00 H new ATOM 0 HD1 PHE A 461 -7.117 5.634 -11.129 1.00 0.00 H new ATOM 0 HD2 PHE A 461 -6.528 5.229 -6.882 1.00 0.00 H new ATOM 0 HE1 PHE A 461 -4.882 6.690 -11.339 1.00 0.00 H new ATOM 0 HE2 PHE A 461 -4.292 6.291 -7.097 1.00 0.00 H new ATOM 0 HZ PHE A 461 -3.462 7.013 -9.325 1.00 0.00 H new ATOM 599 N GLY A 462 -11.892 5.571 -8.938 1.00 0.00 N ATOM 600 CA GLY A 462 -13.310 5.189 -9.013 1.00 0.00 C ATOM 601 C GLY A 462 -13.779 4.175 -7.962 1.00 0.00 C ATOM 602 O GLY A 462 -14.820 4.379 -7.334 1.00 0.00 O ATOM 0 H GLY A 462 -11.752 6.448 -8.435 1.00 0.00 H new ATOM 0 HA2 GLY A 462 -13.916 6.090 -8.919 1.00 0.00 H new ATOM 0 HA3 GLY A 462 -13.505 4.776 -10.003 1.00 0.00 H new ATOM 606 N ASN A 463 -13.010 3.107 -7.734 1.00 0.00 N ATOM 607 CA ASN A 463 -13.282 2.075 -6.726 1.00 0.00 C ATOM 608 C ASN A 463 -11.974 1.441 -6.213 1.00 0.00 C ATOM 609 O ASN A 463 -11.021 1.256 -6.977 1.00 0.00 O ATOM 610 CB ASN A 463 -14.220 1.019 -7.343 1.00 0.00 C ATOM 611 CG ASN A 463 -14.606 -0.065 -6.350 1.00 0.00 C ATOM 612 OD1 ASN A 463 -14.064 -1.161 -6.343 1.00 0.00 O ATOM 613 ND2 ASN A 463 -15.535 0.214 -5.463 1.00 0.00 N ATOM 0 H ASN A 463 -12.155 2.930 -8.261 1.00 0.00 H new ATOM 0 HA ASN A 463 -13.769 2.526 -5.862 1.00 0.00 H new ATOM 0 HB2 ASN A 463 -15.122 1.509 -7.711 1.00 0.00 H new ATOM 0 HB3 ASN A 463 -13.732 0.562 -8.204 1.00 0.00 H new ATOM 0 HD21 ASN A 463 -15.804 -0.484 -4.769 1.00 0.00 H new ATOM 0 HD22 ASN A 463 -15.987 1.128 -5.469 1.00 0.00 H new ATOM 620 N ILE A 464 -11.937 1.106 -4.918 1.00 0.00 N ATOM 621 CA ILE A 464 -10.758 0.576 -4.211 1.00 0.00 C ATOM 622 C ILE A 464 -11.143 -0.459 -3.140 1.00 0.00 C ATOM 623 O ILE A 464 -12.318 -0.601 -2.789 1.00 0.00 O ATOM 624 CB ILE A 464 -9.935 1.723 -3.558 1.00 0.00 C ATOM 625 CG1 ILE A 464 -10.655 2.387 -2.357 1.00 0.00 C ATOM 626 CG2 ILE A 464 -9.509 2.777 -4.592 1.00 0.00 C ATOM 627 CD1 ILE A 464 -9.827 3.469 -1.652 1.00 0.00 C ATOM 0 H ILE A 464 -12.751 1.198 -4.311 1.00 0.00 H new ATOM 0 HA ILE A 464 -10.144 0.076 -4.960 1.00 0.00 H new ATOM 0 HB ILE A 464 -9.037 1.251 -3.160 1.00 0.00 H new ATOM 0 HG12 ILE A 464 -11.589 2.828 -2.705 1.00 0.00 H new ATOM 0 HG13 ILE A 464 -10.918 1.616 -1.633 1.00 0.00 H new ATOM 0 HG21 ILE A 464 -8.936 3.561 -4.097 1.00 0.00 H new ATOM 0 HG22 ILE A 464 -8.893 2.307 -5.358 1.00 0.00 H new ATOM 0 HG23 ILE A 464 -10.395 3.212 -5.055 1.00 0.00 H new ATOM 0 HD11 ILE A 464 -10.401 3.884 -0.824 1.00 0.00 H new ATOM 0 HD12 ILE A 464 -8.905 3.031 -1.271 1.00 0.00 H new ATOM 0 HD13 ILE A 464 -9.586 4.262 -2.360 1.00 0.00 H new ATOM 639 N GLN A 465 -10.140 -1.130 -2.564 1.00 0.00 N ATOM 640 CA GLN A 465 -10.281 -1.947 -1.353 1.00 0.00 C ATOM 641 C GLN A 465 -9.078 -1.711 -0.433 1.00 0.00 C ATOM 642 O GLN A 465 -7.972 -2.178 -0.709 1.00 0.00 O ATOM 643 CB GLN A 465 -10.467 -3.444 -1.679 1.00 0.00 C ATOM 644 CG GLN A 465 -10.790 -4.296 -0.436 1.00 0.00 C ATOM 645 CD GLN A 465 -12.019 -3.817 0.338 1.00 0.00 C ATOM 646 OE1 GLN A 465 -13.150 -3.900 -0.123 1.00 0.00 O ATOM 647 NE2 GLN A 465 -11.852 -3.288 1.535 1.00 0.00 N ATOM 0 H GLN A 465 -9.189 -1.121 -2.933 1.00 0.00 H new ATOM 0 HA GLN A 465 -11.188 -1.638 -0.833 1.00 0.00 H new ATOM 0 HB2 GLN A 465 -11.271 -3.554 -2.407 1.00 0.00 H new ATOM 0 HB3 GLN A 465 -9.559 -3.824 -2.147 1.00 0.00 H new ATOM 0 HG2 GLN A 465 -10.947 -5.329 -0.746 1.00 0.00 H new ATOM 0 HG3 GLN A 465 -9.928 -4.291 0.231 1.00 0.00 H new ATOM 0 HE21 GLN A 465 -10.916 -3.212 1.933 1.00 0.00 H new ATOM 0 HE22 GLN A 465 -12.659 -2.955 2.063 1.00 0.00 H new ATOM 656 N ILE A 466 -9.298 -0.966 0.654 1.00 0.00 N ATOM 657 CA ILE A 466 -8.318 -0.772 1.732 1.00 0.00 C ATOM 658 C ILE A 466 -8.252 -2.063 2.570 1.00 0.00 C ATOM 659 O ILE A 466 -9.289 -2.644 2.910 1.00 0.00 O ATOM 660 CB ILE A 466 -8.704 0.457 2.596 1.00 0.00 C ATOM 661 CG1 ILE A 466 -8.754 1.753 1.743 1.00 0.00 C ATOM 662 CG2 ILE A 466 -7.715 0.639 3.765 1.00 0.00 C ATOM 663 CD1 ILE A 466 -9.451 2.932 2.435 1.00 0.00 C ATOM 0 H ILE A 466 -10.176 -0.472 0.814 1.00 0.00 H new ATOM 0 HA ILE A 466 -7.331 -0.571 1.316 1.00 0.00 H new ATOM 0 HB ILE A 466 -9.699 0.271 3.000 1.00 0.00 H new ATOM 0 HG12 ILE A 466 -7.736 2.046 1.487 1.00 0.00 H new ATOM 0 HG13 ILE A 466 -9.269 1.539 0.807 1.00 0.00 H new ATOM 0 HG21 ILE A 466 -8.006 1.507 4.356 1.00 0.00 H new ATOM 0 HG22 ILE A 466 -7.729 -0.250 4.395 1.00 0.00 H new ATOM 0 HG23 ILE A 466 -6.710 0.789 3.371 1.00 0.00 H new ATOM 0 HD11 ILE A 466 -9.444 3.798 1.773 1.00 0.00 H new ATOM 0 HD12 ILE A 466 -10.481 2.661 2.666 1.00 0.00 H new ATOM 0 HD13 ILE A 466 -8.924 3.176 3.357 1.00 0.00 H new ATOM 675 N SER A 467 -7.037 -2.499 2.906 1.00 0.00 N ATOM 676 CA SER A 467 -6.727 -3.700 3.683 1.00 0.00 C ATOM 677 C SER A 467 -5.592 -3.394 4.669 1.00 0.00 C ATOM 678 O SER A 467 -4.416 -3.373 4.301 1.00 0.00 O ATOM 679 CB SER A 467 -6.329 -4.842 2.740 1.00 0.00 C ATOM 680 OG SER A 467 -7.439 -5.303 1.980 1.00 0.00 O ATOM 0 H SER A 467 -6.195 -1.995 2.627 1.00 0.00 H new ATOM 0 HA SER A 467 -7.608 -4.008 4.246 1.00 0.00 H new ATOM 0 HB2 SER A 467 -5.542 -4.501 2.067 1.00 0.00 H new ATOM 0 HB3 SER A 467 -5.917 -5.667 3.321 1.00 0.00 H new ATOM 0 HG SER A 467 -7.151 -6.029 1.388 1.00 0.00 H new ATOM 686 N TRP A 468 -5.949 -3.083 5.917 1.00 0.00 N ATOM 687 CA TRP A 468 -5.025 -2.629 6.964 1.00 0.00 C ATOM 688 C TRP A 468 -3.881 -3.607 7.280 1.00 0.00 C ATOM 689 O TRP A 468 -4.005 -4.823 7.102 1.00 0.00 O ATOM 690 CB TRP A 468 -5.821 -2.338 8.239 1.00 0.00 C ATOM 691 CG TRP A 468 -6.876 -1.288 8.079 1.00 0.00 C ATOM 692 CD1 TRP A 468 -8.196 -1.515 7.916 1.00 0.00 C ATOM 693 CD2 TRP A 468 -6.715 0.162 8.065 1.00 0.00 C ATOM 694 NE1 TRP A 468 -8.854 -0.315 7.724 1.00 0.00 N ATOM 695 CE2 TRP A 468 -7.982 0.751 7.774 1.00 0.00 C ATOM 696 CE3 TRP A 468 -5.631 1.038 8.288 1.00 0.00 C ATOM 697 CZ2 TRP A 468 -8.146 2.134 7.628 1.00 0.00 C ATOM 698 CZ3 TRP A 468 -5.796 2.433 8.168 1.00 0.00 C ATOM 699 CH2 TRP A 468 -7.041 2.980 7.819 1.00 0.00 C ATOM 0 H TRP A 468 -6.915 -3.141 6.238 1.00 0.00 H new ATOM 0 HA TRP A 468 -4.543 -1.731 6.577 1.00 0.00 H new ATOM 0 HB2 TRP A 468 -6.292 -3.261 8.578 1.00 0.00 H new ATOM 0 HB3 TRP A 468 -5.130 -2.026 9.022 1.00 0.00 H new ATOM 0 HD1 TRP A 468 -8.667 -2.487 7.933 1.00 0.00 H new ATOM 0 HE1 TRP A 468 -9.858 -0.229 7.565 1.00 0.00 H new ATOM 0 HE3 TRP A 468 -4.665 0.635 8.553 1.00 0.00 H new ATOM 0 HZ2 TRP A 468 -9.111 2.545 7.371 1.00 0.00 H new ATOM 0 HZ3 TRP A 468 -4.956 3.088 8.346 1.00 0.00 H new ATOM 0 HH2 TRP A 468 -7.149 4.048 7.698 1.00 0.00 H new ATOM 710 N ILE A 469 -2.785 -3.061 7.818 1.00 0.00 N ATOM 711 CA ILE A 469 -1.598 -3.808 8.267 1.00 0.00 C ATOM 712 C ILE A 469 -1.188 -3.349 9.679 1.00 0.00 C ATOM 713 O ILE A 469 -0.866 -4.178 10.532 1.00 0.00 O ATOM 714 CB ILE A 469 -0.408 -3.626 7.287 1.00 0.00 C ATOM 715 CG1 ILE A 469 -0.766 -3.717 5.785 1.00 0.00 C ATOM 716 CG2 ILE A 469 0.663 -4.695 7.567 1.00 0.00 C ATOM 717 CD1 ILE A 469 0.303 -3.070 4.896 1.00 0.00 C ATOM 0 H ILE A 469 -2.694 -2.055 7.959 1.00 0.00 H new ATOM 0 HA ILE A 469 -1.858 -4.866 8.289 1.00 0.00 H new ATOM 0 HB ILE A 469 -0.056 -2.611 7.471 1.00 0.00 H new ATOM 0 HG12 ILE A 469 -0.885 -4.763 5.504 1.00 0.00 H new ATOM 0 HG13 ILE A 469 -1.725 -3.229 5.611 1.00 0.00 H new ATOM 0 HG21 ILE A 469 1.497 -4.564 6.877 1.00 0.00 H new ATOM 0 HG22 ILE A 469 1.020 -4.592 8.592 1.00 0.00 H new ATOM 0 HG23 ILE A 469 0.232 -5.687 7.431 1.00 0.00 H new ATOM 0 HD11 ILE A 469 0.009 -3.158 3.850 1.00 0.00 H new ATOM 0 HD12 ILE A 469 0.404 -2.017 5.157 1.00 0.00 H new ATOM 0 HD13 ILE A 469 1.257 -3.575 5.048 1.00 0.00 H new ATOM 729 N ASP A 470 -1.241 -2.039 9.947 1.00 0.00 N ATOM 730 CA ASP A 470 -0.910 -1.419 11.238 1.00 0.00 C ATOM 731 C ASP A 470 -1.605 -0.047 11.401 1.00 0.00 C ATOM 732 O ASP A 470 -2.286 0.444 10.497 1.00 0.00 O ATOM 733 CB ASP A 470 0.627 -1.276 11.329 1.00 0.00 C ATOM 734 CG ASP A 470 1.192 -1.074 12.750 1.00 0.00 C ATOM 735 OD1 ASP A 470 0.443 -1.194 13.748 1.00 0.00 O ATOM 736 OD2 ASP A 470 2.412 -0.804 12.873 1.00 0.00 O ATOM 0 H ASP A 470 -1.526 -1.355 9.246 1.00 0.00 H new ATOM 0 HA ASP A 470 -1.272 -2.052 12.048 1.00 0.00 H new ATOM 0 HB2 ASP A 470 1.083 -2.167 10.899 1.00 0.00 H new ATOM 0 HB3 ASP A 470 0.933 -0.431 10.712 1.00 0.00 H new ATOM 741 N ASP A 471 -1.378 0.608 12.539 1.00 0.00 N ATOM 742 CA ASP A 471 -1.822 1.974 12.871 1.00 0.00 C ATOM 743 C ASP A 471 -1.359 3.051 11.862 1.00 0.00 C ATOM 744 O ASP A 471 -1.962 4.123 11.777 1.00 0.00 O ATOM 745 CB ASP A 471 -1.297 2.285 14.283 1.00 0.00 C ATOM 746 CG ASP A 471 -1.652 3.694 14.785 1.00 0.00 C ATOM 747 OD1 ASP A 471 -2.849 3.952 15.055 1.00 0.00 O ATOM 748 OD2 ASP A 471 -0.725 4.517 14.974 1.00 0.00 O ATOM 0 H ASP A 471 -0.850 0.182 13.301 1.00 0.00 H new ATOM 0 HA ASP A 471 -2.911 2.006 12.824 1.00 0.00 H new ATOM 0 HB2 ASP A 471 -1.700 1.550 14.980 1.00 0.00 H new ATOM 0 HB3 ASP A 471 -0.213 2.170 14.290 1.00 0.00 H new ATOM 753 N THR A 472 -0.316 2.761 11.077 1.00 0.00 N ATOM 754 CA THR A 472 0.366 3.689 10.151 1.00 0.00 C ATOM 755 C THR A 472 0.577 3.114 8.741 1.00 0.00 C ATOM 756 O THR A 472 1.203 3.768 7.902 1.00 0.00 O ATOM 757 CB THR A 472 1.736 4.100 10.728 1.00 0.00 C ATOM 758 OG1 THR A 472 2.500 2.947 11.031 1.00 0.00 O ATOM 759 CG2 THR A 472 1.604 4.928 12.007 1.00 0.00 C ATOM 0 H THR A 472 0.100 1.830 11.065 1.00 0.00 H new ATOM 0 HA THR A 472 -0.295 4.550 10.053 1.00 0.00 H new ATOM 0 HB THR A 472 2.226 4.707 9.967 1.00 0.00 H new ATOM 0 HG1 THR A 472 3.369 3.217 11.395 1.00 0.00 H new ATOM 0 HG21 THR A 472 2.596 5.192 12.373 1.00 0.00 H new ATOM 0 HG22 THR A 472 1.041 5.837 11.795 1.00 0.00 H new ATOM 0 HG23 THR A 472 1.080 4.346 12.765 1.00 0.00 H new ATOM 767 N SER A 473 0.071 1.903 8.455 1.00 0.00 N ATOM 768 CA SER A 473 0.294 1.193 7.182 1.00 0.00 C ATOM 769 C SER A 473 -0.927 0.385 6.728 1.00 0.00 C ATOM 770 O SER A 473 -1.565 -0.304 7.532 1.00 0.00 O ATOM 771 CB SER A 473 1.482 0.226 7.303 1.00 0.00 C ATOM 772 OG SER A 473 2.707 0.899 7.544 1.00 0.00 O ATOM 0 H SER A 473 -0.512 1.382 9.109 1.00 0.00 H new ATOM 0 HA SER A 473 0.494 1.967 6.441 1.00 0.00 H new ATOM 0 HB2 SER A 473 1.292 -0.478 8.113 1.00 0.00 H new ATOM 0 HB3 SER A 473 1.566 -0.358 6.386 1.00 0.00 H new ATOM 0 HG SER A 473 3.432 0.243 7.615 1.00 0.00 H new ATOM 778 N ALA A 474 -1.217 0.412 5.425 1.00 0.00 N ATOM 779 CA ALA A 474 -2.283 -0.369 4.792 1.00 0.00 C ATOM 780 C ALA A 474 -1.952 -0.731 3.331 1.00 0.00 C ATOM 781 O ALA A 474 -1.241 0.004 2.640 1.00 0.00 O ATOM 782 CB ALA A 474 -3.597 0.427 4.852 1.00 0.00 C ATOM 0 H ALA A 474 -0.703 0.993 4.763 1.00 0.00 H new ATOM 0 HA ALA A 474 -2.384 -1.306 5.340 1.00 0.00 H new ATOM 0 HB1 ALA A 474 -4.394 -0.150 4.382 1.00 0.00 H new ATOM 0 HB2 ALA A 474 -3.856 0.623 5.892 1.00 0.00 H new ATOM 0 HB3 ALA A 474 -3.474 1.373 4.324 1.00 0.00 H new ATOM 788 N PHE A 475 -2.496 -1.848 2.847 1.00 0.00 N ATOM 789 CA PHE A 475 -2.511 -2.198 1.424 1.00 0.00 C ATOM 790 C PHE A 475 -3.785 -1.615 0.783 1.00 0.00 C ATOM 791 O PHE A 475 -4.807 -1.463 1.459 1.00 0.00 O ATOM 792 CB PHE A 475 -2.471 -3.726 1.244 1.00 0.00 C ATOM 793 CG PHE A 475 -1.171 -4.403 1.652 1.00 0.00 C ATOM 794 CD1 PHE A 475 -0.001 -4.179 0.900 1.00 0.00 C ATOM 795 CD2 PHE A 475 -1.127 -5.288 2.749 1.00 0.00 C ATOM 796 CE1 PHE A 475 1.201 -4.826 1.240 1.00 0.00 C ATOM 797 CE2 PHE A 475 0.071 -5.950 3.077 1.00 0.00 C ATOM 798 CZ PHE A 475 1.235 -5.718 2.326 1.00 0.00 C ATOM 0 H PHE A 475 -2.945 -2.546 3.440 1.00 0.00 H new ATOM 0 HA PHE A 475 -1.631 -1.780 0.936 1.00 0.00 H new ATOM 0 HB2 PHE A 475 -3.285 -4.163 1.823 1.00 0.00 H new ATOM 0 HB3 PHE A 475 -2.666 -3.956 0.196 1.00 0.00 H new ATOM 0 HD1 PHE A 475 -0.027 -3.506 0.056 1.00 0.00 H new ATOM 0 HD2 PHE A 475 -2.015 -5.458 3.339 1.00 0.00 H new ATOM 0 HE1 PHE A 475 2.097 -4.638 0.667 1.00 0.00 H new ATOM 0 HE2 PHE A 475 0.095 -6.638 3.909 1.00 0.00 H new ATOM 0 HZ PHE A 475 2.154 -6.224 2.582 1.00 0.00 H new ATOM 808 N VAL A 476 -3.751 -1.301 -0.515 1.00 0.00 N ATOM 809 CA VAL A 476 -4.898 -0.739 -1.256 1.00 0.00 C ATOM 810 C VAL A 476 -4.982 -1.345 -2.657 1.00 0.00 C ATOM 811 O VAL A 476 -4.137 -1.087 -3.513 1.00 0.00 O ATOM 812 CB VAL A 476 -4.851 0.807 -1.329 1.00 0.00 C ATOM 813 CG1 VAL A 476 -6.086 1.368 -2.051 1.00 0.00 C ATOM 814 CG2 VAL A 476 -4.821 1.454 0.064 1.00 0.00 C ATOM 0 H VAL A 476 -2.920 -1.429 -1.093 1.00 0.00 H new ATOM 0 HA VAL A 476 -5.799 -1.004 -0.703 1.00 0.00 H new ATOM 0 HB VAL A 476 -3.937 1.045 -1.872 1.00 0.00 H new ATOM 0 HG11 VAL A 476 -6.024 2.456 -2.086 1.00 0.00 H new ATOM 0 HG12 VAL A 476 -6.124 0.974 -3.066 1.00 0.00 H new ATOM 0 HG13 VAL A 476 -6.987 1.073 -1.513 1.00 0.00 H new ATOM 0 HG21 VAL A 476 -4.788 2.539 -0.039 1.00 0.00 H new ATOM 0 HG22 VAL A 476 -5.716 1.169 0.617 1.00 0.00 H new ATOM 0 HG23 VAL A 476 -3.937 1.114 0.604 1.00 0.00 H new ATOM 824 N SER A 477 -6.011 -2.156 -2.901 1.00 0.00 N ATOM 825 CA SER A 477 -6.370 -2.642 -4.243 1.00 0.00 C ATOM 826 C SER A 477 -7.015 -1.524 -5.067 1.00 0.00 C ATOM 827 O SER A 477 -7.819 -0.757 -4.531 1.00 0.00 O ATOM 828 CB SER A 477 -7.398 -3.772 -4.131 1.00 0.00 C ATOM 829 OG SER A 477 -6.842 -4.921 -3.513 1.00 0.00 O ATOM 0 H SER A 477 -6.629 -2.501 -2.167 1.00 0.00 H new ATOM 0 HA SER A 477 -5.456 -2.990 -4.724 1.00 0.00 H new ATOM 0 HB2 SER A 477 -8.257 -3.428 -3.555 1.00 0.00 H new ATOM 0 HB3 SER A 477 -7.763 -4.033 -5.124 1.00 0.00 H new ATOM 0 HG SER A 477 -7.523 -5.623 -3.455 1.00 0.00 H new ATOM 835 N LEU A 478 -6.739 -1.486 -6.372 1.00 0.00 N ATOM 836 CA LEU A 478 -7.381 -0.605 -7.360 1.00 0.00 C ATOM 837 C LEU A 478 -8.105 -1.439 -8.439 1.00 0.00 C ATOM 838 O LEU A 478 -7.856 -2.642 -8.573 1.00 0.00 O ATOM 839 CB LEU A 478 -6.322 0.314 -8.002 1.00 0.00 C ATOM 840 CG LEU A 478 -5.493 1.192 -7.042 1.00 0.00 C ATOM 841 CD1 LEU A 478 -4.567 2.082 -7.866 1.00 0.00 C ATOM 842 CD2 LEU A 478 -6.350 2.111 -6.173 1.00 0.00 C ATOM 0 H LEU A 478 -6.033 -2.092 -6.791 1.00 0.00 H new ATOM 0 HA LEU A 478 -8.125 0.012 -6.856 1.00 0.00 H new ATOM 0 HB2 LEU A 478 -5.634 -0.308 -8.574 1.00 0.00 H new ATOM 0 HB3 LEU A 478 -6.826 0.969 -8.713 1.00 0.00 H new ATOM 0 HG LEU A 478 -4.950 0.512 -6.386 1.00 0.00 H new ATOM 0 HD11 LEU A 478 -3.975 2.708 -7.198 1.00 0.00 H new ATOM 0 HD12 LEU A 478 -3.902 1.460 -8.465 1.00 0.00 H new ATOM 0 HD13 LEU A 478 -5.162 2.715 -8.525 1.00 0.00 H new ATOM 0 HD21 LEU A 478 -5.705 2.701 -5.521 1.00 0.00 H new ATOM 0 HD22 LEU A 478 -6.929 2.779 -6.811 1.00 0.00 H new ATOM 0 HD23 LEU A 478 -7.027 1.510 -5.566 1.00 0.00 H new ATOM 854 N SER A 479 -8.992 -0.821 -9.226 1.00 0.00 N ATOM 855 CA SER A 479 -9.767 -1.510 -10.277 1.00 0.00 C ATOM 856 C SER A 479 -8.910 -2.116 -11.401 1.00 0.00 C ATOM 857 O SER A 479 -9.316 -3.116 -11.998 1.00 0.00 O ATOM 858 CB SER A 479 -10.792 -0.566 -10.917 1.00 0.00 C ATOM 859 OG SER A 479 -11.727 -0.099 -9.959 1.00 0.00 O ATOM 0 H SER A 479 -9.197 0.176 -9.156 1.00 0.00 H new ATOM 0 HA SER A 479 -10.260 -2.331 -9.757 1.00 0.00 H new ATOM 0 HB2 SER A 479 -10.277 0.281 -11.370 1.00 0.00 H new ATOM 0 HB3 SER A 479 -11.317 -1.085 -11.719 1.00 0.00 H new ATOM 0 HG SER A 479 -12.368 0.502 -10.393 1.00 0.00 H new ATOM 865 N GLN A 480 -7.737 -1.539 -11.697 1.00 0.00 N ATOM 866 CA GLN A 480 -6.833 -1.981 -12.772 1.00 0.00 C ATOM 867 C GLN A 480 -5.345 -1.818 -12.392 1.00 0.00 C ATOM 868 O GLN A 480 -5.000 -0.897 -11.646 1.00 0.00 O ATOM 869 CB GLN A 480 -7.110 -1.164 -14.053 1.00 0.00 C ATOM 870 CG GLN A 480 -8.510 -1.379 -14.655 1.00 0.00 C ATOM 871 CD GLN A 480 -8.722 -0.649 -15.984 1.00 0.00 C ATOM 872 OE1 GLN A 480 -7.926 0.169 -16.434 1.00 0.00 O ATOM 873 NE2 GLN A 480 -9.811 -0.916 -16.674 1.00 0.00 N ATOM 0 H GLN A 480 -7.381 -0.733 -11.184 1.00 0.00 H new ATOM 0 HA GLN A 480 -7.026 -3.041 -12.938 1.00 0.00 H new ATOM 0 HB2 GLN A 480 -6.983 -0.105 -13.828 1.00 0.00 H new ATOM 0 HB3 GLN A 480 -6.362 -1.422 -14.803 1.00 0.00 H new ATOM 0 HG2 GLN A 480 -8.672 -2.446 -14.806 1.00 0.00 H new ATOM 0 HG3 GLN A 480 -9.260 -1.041 -13.940 1.00 0.00 H new ATOM 0 HE21 GLN A 480 -10.487 -1.593 -16.319 1.00 0.00 H new ATOM 0 HE22 GLN A 480 -9.979 -0.446 -17.564 1.00 0.00 H new ATOM 882 N PRO A 481 -4.430 -2.634 -12.958 1.00 0.00 N ATOM 883 CA PRO A 481 -2.983 -2.476 -12.776 1.00 0.00 C ATOM 884 C PRO A 481 -2.396 -1.249 -13.498 1.00 0.00 C ATOM 885 O PRO A 481 -1.302 -0.801 -13.161 1.00 0.00 O ATOM 886 CB PRO A 481 -2.373 -3.780 -13.294 1.00 0.00 C ATOM 887 CG PRO A 481 -3.358 -4.233 -14.369 1.00 0.00 C ATOM 888 CD PRO A 481 -4.705 -3.794 -13.801 1.00 0.00 C ATOM 0 HA PRO A 481 -2.750 -2.292 -11.727 1.00 0.00 H new ATOM 0 HB2 PRO A 481 -1.376 -3.621 -13.705 1.00 0.00 H new ATOM 0 HB3 PRO A 481 -2.277 -4.521 -12.500 1.00 0.00 H new ATOM 0 HG2 PRO A 481 -3.152 -3.763 -15.330 1.00 0.00 H new ATOM 0 HG3 PRO A 481 -3.317 -5.311 -14.526 1.00 0.00 H new ATOM 0 HD2 PRO A 481 -5.401 -3.539 -14.600 1.00 0.00 H new ATOM 0 HD3 PRO A 481 -5.164 -4.596 -13.223 1.00 0.00 H new ATOM 896 N GLU A 482 -3.115 -0.658 -14.459 1.00 0.00 N ATOM 897 CA GLU A 482 -2.749 0.634 -15.066 1.00 0.00 C ATOM 898 C GLU A 482 -2.824 1.788 -14.046 1.00 0.00 C ATOM 899 O GLU A 482 -1.954 2.659 -14.014 1.00 0.00 O ATOM 900 CB GLU A 482 -3.666 0.897 -16.273 1.00 0.00 C ATOM 901 CG GLU A 482 -3.240 2.135 -17.075 1.00 0.00 C ATOM 902 CD GLU A 482 -4.089 2.292 -18.352 1.00 0.00 C ATOM 903 OE1 GLU A 482 -3.765 1.656 -19.386 1.00 0.00 O ATOM 904 OE2 GLU A 482 -5.078 3.068 -18.342 1.00 0.00 O ATOM 0 H GLU A 482 -3.971 -1.061 -14.841 1.00 0.00 H new ATOM 0 HA GLU A 482 -1.713 0.585 -15.401 1.00 0.00 H new ATOM 0 HB2 GLU A 482 -3.660 0.025 -16.927 1.00 0.00 H new ATOM 0 HB3 GLU A 482 -4.691 1.028 -15.925 1.00 0.00 H new ATOM 0 HG2 GLU A 482 -3.343 3.026 -16.455 1.00 0.00 H new ATOM 0 HG3 GLU A 482 -2.187 2.053 -17.343 1.00 0.00 H new ATOM 911 N GLN A 483 -3.827 1.766 -13.161 1.00 0.00 N ATOM 912 CA GLN A 483 -4.029 2.777 -12.115 1.00 0.00 C ATOM 913 C GLN A 483 -2.918 2.747 -11.050 1.00 0.00 C ATOM 914 O GLN A 483 -2.533 3.791 -10.523 1.00 0.00 O ATOM 915 CB GLN A 483 -5.402 2.564 -11.463 1.00 0.00 C ATOM 916 CG GLN A 483 -6.574 2.738 -12.446 1.00 0.00 C ATOM 917 CD GLN A 483 -7.919 2.419 -11.796 1.00 0.00 C ATOM 918 OE1 GLN A 483 -8.061 1.482 -11.023 1.00 0.00 O ATOM 919 NE2 GLN A 483 -8.957 3.178 -12.074 1.00 0.00 N ATOM 0 H GLN A 483 -4.535 1.032 -13.151 1.00 0.00 H new ATOM 0 HA GLN A 483 -3.988 3.760 -12.585 1.00 0.00 H new ATOM 0 HB2 GLN A 483 -5.442 1.563 -11.034 1.00 0.00 H new ATOM 0 HB3 GLN A 483 -5.519 3.269 -10.640 1.00 0.00 H new ATOM 0 HG2 GLN A 483 -6.585 3.762 -12.819 1.00 0.00 H new ATOM 0 HG3 GLN A 483 -6.424 2.087 -13.307 1.00 0.00 H new ATOM 0 HE21 GLN A 483 -8.857 3.964 -12.717 1.00 0.00 H new ATOM 0 HE22 GLN A 483 -9.862 2.981 -11.647 1.00 0.00 H new ATOM 928 N VAL A 484 -2.340 1.567 -10.786 1.00 0.00 N ATOM 929 CA VAL A 484 -1.144 1.406 -9.937 1.00 0.00 C ATOM 930 C VAL A 484 0.036 2.216 -10.480 1.00 0.00 C ATOM 931 O VAL A 484 0.737 2.867 -9.706 1.00 0.00 O ATOM 932 CB VAL A 484 -0.786 -0.089 -9.786 1.00 0.00 C ATOM 933 CG1 VAL A 484 0.597 -0.356 -9.181 1.00 0.00 C ATOM 934 CG2 VAL A 484 -1.831 -0.792 -8.914 1.00 0.00 C ATOM 0 H VAL A 484 -2.691 0.685 -11.159 1.00 0.00 H new ATOM 0 HA VAL A 484 -1.373 1.798 -8.946 1.00 0.00 H new ATOM 0 HB VAL A 484 -0.772 -0.482 -10.803 1.00 0.00 H new ATOM 0 HG11 VAL A 484 0.763 -1.431 -9.113 1.00 0.00 H new ATOM 0 HG12 VAL A 484 1.364 0.090 -9.815 1.00 0.00 H new ATOM 0 HG13 VAL A 484 0.649 0.083 -8.185 1.00 0.00 H new ATOM 0 HG21 VAL A 484 -1.571 -1.846 -8.813 1.00 0.00 H new ATOM 0 HG22 VAL A 484 -1.854 -0.328 -7.928 1.00 0.00 H new ATOM 0 HG23 VAL A 484 -2.812 -0.704 -9.380 1.00 0.00 H new ATOM 944 N GLN A 485 0.232 2.252 -11.803 1.00 0.00 N ATOM 945 CA GLN A 485 1.315 3.031 -12.422 1.00 0.00 C ATOM 946 C GLN A 485 1.115 4.542 -12.220 1.00 0.00 C ATOM 947 O GLN A 485 2.074 5.266 -11.945 1.00 0.00 O ATOM 948 CB GLN A 485 1.454 2.712 -13.925 1.00 0.00 C ATOM 949 CG GLN A 485 1.349 1.226 -14.310 1.00 0.00 C ATOM 950 CD GLN A 485 2.194 0.291 -13.445 1.00 0.00 C ATOM 951 OE1 GLN A 485 3.398 0.454 -13.284 1.00 0.00 O ATOM 952 NE2 GLN A 485 1.596 -0.722 -12.851 1.00 0.00 N ATOM 0 H GLN A 485 -0.350 1.747 -12.472 1.00 0.00 H new ATOM 0 HA GLN A 485 2.238 2.738 -11.921 1.00 0.00 H new ATOM 0 HB2 GLN A 485 0.684 3.263 -14.466 1.00 0.00 H new ATOM 0 HB3 GLN A 485 2.417 3.089 -14.269 1.00 0.00 H new ATOM 0 HG2 GLN A 485 0.305 0.919 -14.244 1.00 0.00 H new ATOM 0 HG3 GLN A 485 1.650 1.110 -15.351 1.00 0.00 H new ATOM 0 HE21 GLN A 485 0.594 -0.868 -12.977 1.00 0.00 H new ATOM 0 HE22 GLN A 485 2.135 -1.360 -12.265 1.00 0.00 H new ATOM 961 N ILE A 486 -0.135 5.017 -12.297 1.00 0.00 N ATOM 962 CA ILE A 486 -0.506 6.420 -12.041 1.00 0.00 C ATOM 963 C ILE A 486 -0.251 6.789 -10.571 1.00 0.00 C ATOM 964 O ILE A 486 0.343 7.832 -10.297 1.00 0.00 O ATOM 965 CB ILE A 486 -1.976 6.687 -12.456 1.00 0.00 C ATOM 966 CG1 ILE A 486 -2.199 6.358 -13.953 1.00 0.00 C ATOM 967 CG2 ILE A 486 -2.364 8.153 -12.172 1.00 0.00 C ATOM 968 CD1 ILE A 486 -3.663 6.430 -14.410 1.00 0.00 C ATOM 0 H ILE A 486 -0.932 4.430 -12.543 1.00 0.00 H new ATOM 0 HA ILE A 486 0.125 7.063 -12.654 1.00 0.00 H new ATOM 0 HB ILE A 486 -2.614 6.034 -11.861 1.00 0.00 H new ATOM 0 HG12 ILE A 486 -1.609 7.049 -14.555 1.00 0.00 H new ATOM 0 HG13 ILE A 486 -1.818 5.356 -14.152 1.00 0.00 H new ATOM 0 HG21 ILE A 486 -3.399 8.320 -12.470 1.00 0.00 H new ATOM 0 HG22 ILE A 486 -2.256 8.358 -11.107 1.00 0.00 H new ATOM 0 HG23 ILE A 486 -1.712 8.818 -12.738 1.00 0.00 H new ATOM 0 HD11 ILE A 486 -3.726 6.185 -15.470 1.00 0.00 H new ATOM 0 HD12 ILE A 486 -4.258 5.719 -13.838 1.00 0.00 H new ATOM 0 HD13 ILE A 486 -4.046 7.437 -14.247 1.00 0.00 H new ATOM 980 N ALA A 487 -0.629 5.934 -9.617 1.00 0.00 N ATOM 981 CA ALA A 487 -0.363 6.152 -8.191 1.00 0.00 C ATOM 982 C ALA A 487 1.146 6.180 -7.859 1.00 0.00 C ATOM 983 O ALA A 487 1.599 7.036 -7.098 1.00 0.00 O ATOM 984 CB ALA A 487 -1.086 5.059 -7.398 1.00 0.00 C ATOM 0 H ALA A 487 -1.130 5.067 -9.812 1.00 0.00 H new ATOM 0 HA ALA A 487 -0.740 7.136 -7.912 1.00 0.00 H new ATOM 0 HB1 ALA A 487 -0.903 5.201 -6.333 1.00 0.00 H new ATOM 0 HB2 ALA A 487 -2.157 5.116 -7.593 1.00 0.00 H new ATOM 0 HB3 ALA A 487 -0.714 4.081 -7.703 1.00 0.00 H new ATOM 990 N VAL A 488 1.940 5.286 -8.463 1.00 0.00 N ATOM 991 CA VAL A 488 3.410 5.257 -8.326 1.00 0.00 C ATOM 992 C VAL A 488 4.082 6.479 -8.979 1.00 0.00 C ATOM 993 O VAL A 488 5.100 6.961 -8.478 1.00 0.00 O ATOM 994 CB VAL A 488 3.963 3.925 -8.881 1.00 0.00 C ATOM 995 CG1 VAL A 488 5.493 3.878 -8.992 1.00 0.00 C ATOM 996 CG2 VAL A 488 3.555 2.762 -7.964 1.00 0.00 C ATOM 0 H VAL A 488 1.578 4.550 -9.070 1.00 0.00 H new ATOM 0 HA VAL A 488 3.654 5.316 -7.265 1.00 0.00 H new ATOM 0 HB VAL A 488 3.540 3.841 -9.882 1.00 0.00 H new ATOM 0 HG11 VAL A 488 5.799 2.910 -9.389 1.00 0.00 H new ATOM 0 HG12 VAL A 488 5.834 4.669 -9.660 1.00 0.00 H new ATOM 0 HG13 VAL A 488 5.934 4.021 -8.006 1.00 0.00 H new ATOM 0 HG21 VAL A 488 3.949 1.828 -8.364 1.00 0.00 H new ATOM 0 HG22 VAL A 488 3.958 2.928 -6.965 1.00 0.00 H new ATOM 0 HG23 VAL A 488 2.468 2.704 -7.912 1.00 0.00 H new ATOM 1006 N ASN A 489 3.514 7.034 -10.057 1.00 0.00 N ATOM 1007 CA ASN A 489 3.969 8.304 -10.633 1.00 0.00 C ATOM 1008 C ASN A 489 3.650 9.499 -9.712 1.00 0.00 C ATOM 1009 O ASN A 489 4.516 10.319 -9.415 1.00 0.00 O ATOM 1010 CB ASN A 489 3.321 8.492 -12.018 1.00 0.00 C ATOM 1011 CG ASN A 489 3.823 9.744 -12.723 1.00 0.00 C ATOM 1012 OD1 ASN A 489 5.018 9.977 -12.862 1.00 0.00 O ATOM 1013 ND2 ASN A 489 2.938 10.600 -13.182 1.00 0.00 N ATOM 0 H ASN A 489 2.727 6.615 -10.553 1.00 0.00 H new ATOM 0 HA ASN A 489 5.053 8.268 -10.738 1.00 0.00 H new ATOM 0 HB2 ASN A 489 3.531 7.620 -12.637 1.00 0.00 H new ATOM 0 HB3 ASN A 489 2.238 8.550 -11.906 1.00 0.00 H new ATOM 0 HD21 ASN A 489 3.247 11.452 -13.650 1.00 0.00 H new ATOM 0 HD22 ASN A 489 1.942 10.413 -13.070 1.00 0.00 H new ATOM 1020 N THR A 490 2.404 9.599 -9.247 1.00 0.00 N ATOM 1021 CA THR A 490 1.908 10.743 -8.460 1.00 0.00 C ATOM 1022 C THR A 490 2.470 10.810 -7.034 1.00 0.00 C ATOM 1023 O THR A 490 2.587 11.903 -6.473 1.00 0.00 O ATOM 1024 CB THR A 490 0.369 10.779 -8.430 1.00 0.00 C ATOM 1025 OG1 THR A 490 -0.189 9.539 -8.076 1.00 0.00 O ATOM 1026 CG2 THR A 490 -0.196 11.163 -9.800 1.00 0.00 C ATOM 0 H THR A 490 1.697 8.881 -9.405 1.00 0.00 H new ATOM 0 HA THR A 490 2.278 11.628 -8.978 1.00 0.00 H new ATOM 0 HB THR A 490 0.104 11.522 -7.678 1.00 0.00 H new ATOM 0 HG1 THR A 490 -0.173 8.940 -8.851 1.00 0.00 H new ATOM 0 HG21 THR A 490 -1.285 11.181 -9.752 1.00 0.00 H new ATOM 0 HG22 THR A 490 0.172 12.150 -10.082 1.00 0.00 H new ATOM 0 HG23 THR A 490 0.122 10.432 -10.543 1.00 0.00 H new ATOM 1034 N SER A 491 2.903 9.685 -6.455 1.00 0.00 N ATOM 1035 CA SER A 491 3.526 9.634 -5.121 1.00 0.00 C ATOM 1036 C SER A 491 4.899 10.319 -5.018 1.00 0.00 C ATOM 1037 O SER A 491 5.347 10.615 -3.906 1.00 0.00 O ATOM 1038 CB SER A 491 3.625 8.187 -4.645 1.00 0.00 C ATOM 1039 OG SER A 491 4.614 7.467 -5.358 1.00 0.00 O ATOM 0 H SER A 491 2.831 8.771 -6.902 1.00 0.00 H new ATOM 0 HA SER A 491 2.867 10.211 -4.472 1.00 0.00 H new ATOM 0 HB2 SER A 491 3.859 8.169 -3.581 1.00 0.00 H new ATOM 0 HB3 SER A 491 2.659 7.697 -4.767 1.00 0.00 H new ATOM 0 HG SER A 491 4.447 7.547 -6.320 1.00 0.00 H new ATOM 1045 N LYS A 492 5.550 10.638 -6.149 1.00 0.00 N ATOM 1046 CA LYS A 492 6.763 11.484 -6.216 1.00 0.00 C ATOM 1047 C LYS A 492 6.558 12.905 -5.664 1.00 0.00 C ATOM 1048 O LYS A 492 7.538 13.593 -5.369 1.00 0.00 O ATOM 1049 CB LYS A 492 7.260 11.576 -7.670 1.00 0.00 C ATOM 1050 CG LYS A 492 7.836 10.250 -8.197 1.00 0.00 C ATOM 1051 CD LYS A 492 8.384 10.382 -9.627 1.00 0.00 C ATOM 1052 CE LYS A 492 7.248 10.608 -10.631 1.00 0.00 C ATOM 1053 NZ LYS A 492 7.730 10.715 -12.029 1.00 0.00 N ATOM 0 H LYS A 492 5.244 10.310 -7.065 1.00 0.00 H new ATOM 0 HA LYS A 492 7.504 10.999 -5.580 1.00 0.00 H new ATOM 0 HB2 LYS A 492 6.435 11.887 -8.311 1.00 0.00 H new ATOM 0 HB3 LYS A 492 8.025 12.350 -7.738 1.00 0.00 H new ATOM 0 HG2 LYS A 492 8.633 9.913 -7.534 1.00 0.00 H new ATOM 0 HG3 LYS A 492 7.060 9.485 -8.176 1.00 0.00 H new ATOM 0 HD2 LYS A 492 9.088 11.213 -9.675 1.00 0.00 H new ATOM 0 HD3 LYS A 492 8.936 9.481 -9.894 1.00 0.00 H new ATOM 0 HE2 LYS A 492 6.536 9.786 -10.559 1.00 0.00 H new ATOM 0 HE3 LYS A 492 6.711 11.519 -10.366 1.00 0.00 H new ATOM 0 HZ1 LYS A 492 6.951 10.495 -12.682 1.00 0.00 H new ATOM 0 HZ2 LYS A 492 8.068 11.682 -12.207 1.00 0.00 H new ATOM 0 HZ3 LYS A 492 8.509 10.043 -12.180 1.00 0.00 H new ATOM 1067 N TYR A 493 5.303 13.334 -5.505 1.00 0.00 N ATOM 1068 CA TYR A 493 4.905 14.703 -5.150 1.00 0.00 C ATOM 1069 C TYR A 493 4.126 14.773 -3.817 1.00 0.00 C ATOM 1070 O TYR A 493 3.558 15.814 -3.476 1.00 0.00 O ATOM 1071 CB TYR A 493 4.128 15.307 -6.334 1.00 0.00 C ATOM 1072 CG TYR A 493 4.770 15.043 -7.691 1.00 0.00 C ATOM 1073 CD1 TYR A 493 6.018 15.618 -8.009 1.00 0.00 C ATOM 1074 CD2 TYR A 493 4.161 14.153 -8.597 1.00 0.00 C ATOM 1075 CE1 TYR A 493 6.661 15.291 -9.218 1.00 0.00 C ATOM 1076 CE2 TYR A 493 4.803 13.819 -9.806 1.00 0.00 C ATOM 1077 CZ TYR A 493 6.060 14.382 -10.117 1.00 0.00 C ATOM 1078 OH TYR A 493 6.690 14.035 -11.275 1.00 0.00 O ATOM 0 H TYR A 493 4.502 12.713 -5.624 1.00 0.00 H new ATOM 0 HA TYR A 493 5.798 15.301 -4.971 1.00 0.00 H new ATOM 0 HB2 TYR A 493 3.116 14.902 -6.337 1.00 0.00 H new ATOM 0 HB3 TYR A 493 4.040 16.384 -6.187 1.00 0.00 H new ATOM 0 HD1 TYR A 493 6.482 16.311 -7.323 1.00 0.00 H new ATOM 0 HD2 TYR A 493 3.197 13.725 -8.364 1.00 0.00 H new ATOM 0 HE1 TYR A 493 7.615 15.736 -9.459 1.00 0.00 H new ATOM 0 HE2 TYR A 493 4.334 13.132 -10.495 1.00 0.00 H new ATOM 0 HH TYR A 493 6.134 13.399 -11.772 1.00 0.00 H new ATOM 1088 N ALA A 494 4.103 13.672 -3.053 1.00 0.00 N ATOM 1089 CA ALA A 494 3.599 13.614 -1.680 1.00 0.00 C ATOM 1090 C ALA A 494 4.423 14.489 -0.705 1.00 0.00 C ATOM 1091 O ALA A 494 5.559 14.880 -0.996 1.00 0.00 O ATOM 1092 CB ALA A 494 3.604 12.144 -1.238 1.00 0.00 C ATOM 0 H ALA A 494 4.446 12.771 -3.387 1.00 0.00 H new ATOM 0 HA ALA A 494 2.587 14.019 -1.657 1.00 0.00 H new ATOM 0 HB1 ALA A 494 3.232 12.070 -0.216 1.00 0.00 H new ATOM 0 HB2 ALA A 494 2.962 11.563 -1.900 1.00 0.00 H new ATOM 0 HB3 ALA A 494 4.621 11.754 -1.283 1.00 0.00 H new ATOM 1098 N GLU A 495 3.867 14.762 0.479 1.00 0.00 N ATOM 1099 CA GLU A 495 4.479 15.629 1.507 1.00 0.00 C ATOM 1100 C GLU A 495 4.378 15.069 2.944 1.00 0.00 C ATOM 1101 O GLU A 495 5.269 15.320 3.761 1.00 0.00 O ATOM 1102 CB GLU A 495 3.836 17.024 1.399 1.00 0.00 C ATOM 1103 CG GLU A 495 4.548 18.088 2.243 1.00 0.00 C ATOM 1104 CD GLU A 495 3.991 19.494 1.951 1.00 0.00 C ATOM 1105 OE1 GLU A 495 2.975 19.897 2.570 1.00 0.00 O ATOM 1106 OE2 GLU A 495 4.570 20.219 1.102 1.00 0.00 O ATOM 0 H GLU A 495 2.963 14.383 0.761 1.00 0.00 H new ATOM 0 HA GLU A 495 5.550 15.681 1.311 1.00 0.00 H new ATOM 0 HB2 GLU A 495 3.838 17.337 0.355 1.00 0.00 H new ATOM 0 HB3 GLU A 495 2.793 16.961 1.711 1.00 0.00 H new ATOM 0 HG2 GLU A 495 4.426 17.858 3.301 1.00 0.00 H new ATOM 0 HG3 GLU A 495 5.617 18.067 2.033 1.00 0.00 H new ATOM 1113 N SER A 496 3.351 14.262 3.240 1.00 0.00 N ATOM 1114 CA SER A 496 3.058 13.733 4.591 1.00 0.00 C ATOM 1115 C SER A 496 2.751 12.224 4.616 1.00 0.00 C ATOM 1116 O SER A 496 2.388 11.684 5.659 1.00 0.00 O ATOM 1117 CB SER A 496 1.880 14.505 5.210 1.00 0.00 C ATOM 1118 OG SER A 496 2.146 15.901 5.271 1.00 0.00 O ATOM 0 H SER A 496 2.683 13.948 2.536 1.00 0.00 H new ATOM 0 HA SER A 496 3.966 13.876 5.176 1.00 0.00 H new ATOM 0 HB2 SER A 496 0.980 14.331 4.621 1.00 0.00 H new ATOM 0 HB3 SER A 496 1.683 14.127 6.213 1.00 0.00 H new ATOM 0 HG SER A 496 1.378 16.363 5.667 1.00 0.00 H new ATOM 1124 N TYR A 497 2.889 11.536 3.480 1.00 0.00 N ATOM 1125 CA TYR A 497 2.576 10.114 3.273 1.00 0.00 C ATOM 1126 C TYR A 497 3.488 9.514 2.183 1.00 0.00 C ATOM 1127 O TYR A 497 4.267 10.236 1.547 1.00 0.00 O ATOM 1128 CB TYR A 497 1.086 9.974 2.892 1.00 0.00 C ATOM 1129 CG TYR A 497 0.719 10.603 1.558 1.00 0.00 C ATOM 1130 CD1 TYR A 497 0.390 11.973 1.494 1.00 0.00 C ATOM 1131 CD2 TYR A 497 0.747 9.832 0.378 1.00 0.00 C ATOM 1132 CE1 TYR A 497 0.118 12.580 0.252 1.00 0.00 C ATOM 1133 CE2 TYR A 497 0.504 10.443 -0.867 1.00 0.00 C ATOM 1134 CZ TYR A 497 0.185 11.817 -0.935 1.00 0.00 C ATOM 1135 OH TYR A 497 -0.049 12.398 -2.143 1.00 0.00 O ATOM 0 H TYR A 497 3.241 11.978 2.631 1.00 0.00 H new ATOM 0 HA TYR A 497 2.758 9.561 4.195 1.00 0.00 H new ATOM 0 HB2 TYR A 497 0.828 8.915 2.864 1.00 0.00 H new ATOM 0 HB3 TYR A 497 0.479 10.429 3.674 1.00 0.00 H new ATOM 0 HD1 TYR A 497 0.346 12.559 2.400 1.00 0.00 H new ATOM 0 HD2 TYR A 497 0.955 8.773 0.429 1.00 0.00 H new ATOM 0 HE1 TYR A 497 -0.141 13.627 0.207 1.00 0.00 H new ATOM 0 HE2 TYR A 497 0.562 9.859 -1.773 1.00 0.00 H new ATOM 0 HH TYR A 497 0.040 11.727 -2.852 1.00 0.00 H new ATOM 1145 N ARG A 498 3.380 8.202 1.932 1.00 0.00 N ATOM 1146 CA ARG A 498 4.069 7.501 0.831 1.00 0.00 C ATOM 1147 C ARG A 498 3.195 6.386 0.244 1.00 0.00 C ATOM 1148 O ARG A 498 2.389 5.790 0.959 1.00 0.00 O ATOM 1149 CB ARG A 498 5.422 6.967 1.360 1.00 0.00 C ATOM 1150 CG ARG A 498 6.333 6.290 0.320 1.00 0.00 C ATOM 1151 CD ARG A 498 6.782 7.228 -0.811 1.00 0.00 C ATOM 1152 NE ARG A 498 7.451 6.473 -1.889 1.00 0.00 N ATOM 1153 CZ ARG A 498 7.540 6.819 -3.162 1.00 0.00 C ATOM 1154 NH1 ARG A 498 7.132 7.973 -3.607 1.00 0.00 N ATOM 1155 NH2 ARG A 498 8.055 5.997 -4.030 1.00 0.00 N ATOM 0 H ARG A 498 2.800 7.583 2.498 1.00 0.00 H new ATOM 0 HA ARG A 498 4.258 8.195 0.012 1.00 0.00 H new ATOM 0 HB2 ARG A 498 5.968 7.798 1.806 1.00 0.00 H new ATOM 0 HB3 ARG A 498 5.221 6.252 2.158 1.00 0.00 H new ATOM 0 HG2 ARG A 498 7.215 5.895 0.825 1.00 0.00 H new ATOM 0 HG3 ARG A 498 5.806 5.440 -0.113 1.00 0.00 H new ATOM 0 HD2 ARG A 498 5.918 7.757 -1.214 1.00 0.00 H new ATOM 0 HD3 ARG A 498 7.461 7.983 -0.415 1.00 0.00 H new ATOM 0 HE ARG A 498 7.891 5.592 -1.624 1.00 0.00 H new ATOM 0 HH11 ARG A 498 6.724 8.652 -2.964 1.00 0.00 H new ATOM 0 HH12 ARG A 498 7.220 8.198 -4.598 1.00 0.00 H new ATOM 0 HH21 ARG A 498 8.392 5.082 -3.729 1.00 0.00 H new ATOM 0 HH22 ARG A 498 8.122 6.267 -5.011 1.00 0.00 H new ATOM 1169 N ILE A 499 3.385 6.096 -1.046 1.00 0.00 N ATOM 1170 CA ILE A 499 2.705 5.038 -1.812 1.00 0.00 C ATOM 1171 C ILE A 499 3.759 4.270 -2.627 1.00 0.00 C ATOM 1172 O ILE A 499 4.665 4.877 -3.205 1.00 0.00 O ATOM 1173 CB ILE A 499 1.638 5.612 -2.774 1.00 0.00 C ATOM 1174 CG1 ILE A 499 0.667 6.606 -2.101 1.00 0.00 C ATOM 1175 CG2 ILE A 499 0.851 4.467 -3.442 1.00 0.00 C ATOM 1176 CD1 ILE A 499 -0.172 7.392 -3.110 1.00 0.00 C ATOM 0 H ILE A 499 4.050 6.617 -1.617 1.00 0.00 H new ATOM 0 HA ILE A 499 2.195 4.380 -1.108 1.00 0.00 H new ATOM 0 HB ILE A 499 2.182 6.180 -3.529 1.00 0.00 H new ATOM 0 HG12 ILE A 499 0.003 6.060 -1.430 1.00 0.00 H new ATOM 0 HG13 ILE A 499 1.237 7.304 -1.487 1.00 0.00 H new ATOM 0 HG21 ILE A 499 0.103 4.884 -4.116 1.00 0.00 H new ATOM 0 HG22 ILE A 499 1.537 3.835 -4.007 1.00 0.00 H new ATOM 0 HG23 ILE A 499 0.356 3.871 -2.676 1.00 0.00 H new ATOM 0 HD11 ILE A 499 -0.835 8.074 -2.578 1.00 0.00 H new ATOM 0 HD12 ILE A 499 0.487 7.963 -3.765 1.00 0.00 H new ATOM 0 HD13 ILE A 499 -0.766 6.700 -3.707 1.00 0.00 H new ATOM 1188 N GLN A 500 3.617 2.949 -2.704 1.00 0.00 N ATOM 1189 CA GLN A 500 4.432 2.037 -3.517 1.00 0.00 C ATOM 1190 C GLN A 500 3.595 0.819 -3.957 1.00 0.00 C ATOM 1191 O GLN A 500 2.463 0.655 -3.502 1.00 0.00 O ATOM 1192 CB GLN A 500 5.680 1.638 -2.709 1.00 0.00 C ATOM 1193 CG GLN A 500 5.368 0.810 -1.448 1.00 0.00 C ATOM 1194 CD GLN A 500 6.565 0.671 -0.515 1.00 0.00 C ATOM 1195 OE1 GLN A 500 7.721 0.680 -0.920 1.00 0.00 O ATOM 1196 NE2 GLN A 500 6.340 0.554 0.775 1.00 0.00 N ATOM 0 H GLN A 500 2.896 2.457 -2.177 1.00 0.00 H new ATOM 0 HA GLN A 500 4.763 2.530 -4.431 1.00 0.00 H new ATOM 0 HB2 GLN A 500 6.349 1.066 -3.351 1.00 0.00 H new ATOM 0 HB3 GLN A 500 6.215 2.541 -2.416 1.00 0.00 H new ATOM 0 HG2 GLN A 500 4.545 1.278 -0.907 1.00 0.00 H new ATOM 0 HG3 GLN A 500 5.030 -0.182 -1.746 1.00 0.00 H new ATOM 0 HE21 GLN A 500 5.383 0.545 1.127 1.00 0.00 H new ATOM 0 HE22 GLN A 500 7.123 0.472 1.424 1.00 0.00 H new ATOM 1205 N THR A 501 4.112 -0.050 -4.830 1.00 0.00 N ATOM 1206 CA THR A 501 3.438 -1.326 -5.158 1.00 0.00 C ATOM 1207 C THR A 501 3.533 -2.338 -4.007 1.00 0.00 C ATOM 1208 O THR A 501 4.395 -2.229 -3.129 1.00 0.00 O ATOM 1209 CB THR A 501 4.003 -1.973 -6.434 1.00 0.00 C ATOM 1210 OG1 THR A 501 5.314 -2.437 -6.214 1.00 0.00 O ATOM 1211 CG2 THR A 501 4.045 -1.012 -7.621 1.00 0.00 C ATOM 0 H THR A 501 4.991 0.099 -5.325 1.00 0.00 H new ATOM 0 HA THR A 501 2.392 -1.069 -5.325 1.00 0.00 H new ATOM 0 HB THR A 501 3.328 -2.795 -6.672 1.00 0.00 H new ATOM 0 HG1 THR A 501 5.658 -2.847 -7.035 1.00 0.00 H new ATOM 0 HG21 THR A 501 4.453 -1.526 -8.491 1.00 0.00 H new ATOM 0 HG22 THR A 501 3.036 -0.665 -7.844 1.00 0.00 H new ATOM 0 HG23 THR A 501 4.676 -0.158 -7.375 1.00 0.00 H new ATOM 1219 N TYR A 502 2.691 -3.377 -4.028 1.00 0.00 N ATOM 1220 CA TYR A 502 2.827 -4.532 -3.129 1.00 0.00 C ATOM 1221 C TYR A 502 4.231 -5.170 -3.221 1.00 0.00 C ATOM 1222 O TYR A 502 4.848 -5.492 -2.202 1.00 0.00 O ATOM 1223 CB TYR A 502 1.727 -5.550 -3.475 1.00 0.00 C ATOM 1224 CG TYR A 502 1.707 -6.775 -2.580 1.00 0.00 C ATOM 1225 CD1 TYR A 502 2.488 -7.904 -2.898 1.00 0.00 C ATOM 1226 CD2 TYR A 502 0.902 -6.784 -1.425 1.00 0.00 C ATOM 1227 CE1 TYR A 502 2.482 -9.030 -2.050 1.00 0.00 C ATOM 1228 CE2 TYR A 502 0.902 -7.902 -0.568 1.00 0.00 C ATOM 1229 CZ TYR A 502 1.697 -9.027 -0.876 1.00 0.00 C ATOM 1230 OH TYR A 502 1.684 -10.108 -0.049 1.00 0.00 O ATOM 0 H TYR A 502 1.898 -3.443 -4.666 1.00 0.00 H new ATOM 0 HA TYR A 502 2.711 -4.199 -2.098 1.00 0.00 H new ATOM 0 HB2 TYR A 502 0.758 -5.055 -3.415 1.00 0.00 H new ATOM 0 HB3 TYR A 502 1.857 -5.871 -4.508 1.00 0.00 H new ATOM 0 HD1 TYR A 502 3.092 -7.907 -3.793 1.00 0.00 H new ATOM 0 HD2 TYR A 502 0.282 -5.930 -1.195 1.00 0.00 H new ATOM 0 HE1 TYR A 502 3.078 -9.896 -2.298 1.00 0.00 H new ATOM 0 HE2 TYR A 502 0.294 -7.898 0.325 1.00 0.00 H new ATOM 0 HH TYR A 502 1.091 -9.932 0.711 1.00 0.00 H new ATOM 1240 N ALA A 503 4.770 -5.297 -4.440 1.00 0.00 N ATOM 1241 CA ALA A 503 6.094 -5.866 -4.696 1.00 0.00 C ATOM 1242 C ALA A 503 7.254 -5.008 -4.146 1.00 0.00 C ATOM 1243 O ALA A 503 8.236 -5.560 -3.653 1.00 0.00 O ATOM 1244 CB ALA A 503 6.237 -6.088 -6.206 1.00 0.00 C ATOM 0 H ALA A 503 4.288 -5.001 -5.289 1.00 0.00 H new ATOM 0 HA ALA A 503 6.165 -6.812 -4.159 1.00 0.00 H new ATOM 0 HB1 ALA A 503 7.218 -6.512 -6.420 1.00 0.00 H new ATOM 0 HB2 ALA A 503 5.462 -6.774 -6.548 1.00 0.00 H new ATOM 0 HB3 ALA A 503 6.132 -5.135 -6.725 1.00 0.00 H new ATOM 1250 N GLU A 504 7.155 -3.675 -4.175 1.00 0.00 N ATOM 1251 CA GLU A 504 8.170 -2.774 -3.597 1.00 0.00 C ATOM 1252 C GLU A 504 8.223 -2.838 -2.060 1.00 0.00 C ATOM 1253 O GLU A 504 9.306 -2.725 -1.475 1.00 0.00 O ATOM 1254 CB GLU A 504 7.909 -1.329 -4.052 1.00 0.00 C ATOM 1255 CG GLU A 504 8.335 -1.055 -5.502 1.00 0.00 C ATOM 1256 CD GLU A 504 9.869 -1.036 -5.657 1.00 0.00 C ATOM 1257 OE1 GLU A 504 10.503 0.000 -5.342 1.00 0.00 O ATOM 1258 OE2 GLU A 504 10.455 -2.056 -6.099 1.00 0.00 O ATOM 0 H GLU A 504 6.368 -3.184 -4.600 1.00 0.00 H new ATOM 0 HA GLU A 504 9.139 -3.113 -3.963 1.00 0.00 H new ATOM 0 HB2 GLU A 504 6.846 -1.110 -3.947 1.00 0.00 H new ATOM 0 HB3 GLU A 504 8.442 -0.647 -3.390 1.00 0.00 H new ATOM 0 HG2 GLU A 504 7.914 -1.820 -6.155 1.00 0.00 H new ATOM 0 HG3 GLU A 504 7.926 -0.098 -5.826 1.00 0.00 H new ATOM 1265 N TYR A 505 7.083 -3.064 -1.394 1.00 0.00 N ATOM 1266 CA TYR A 505 7.039 -3.347 0.046 1.00 0.00 C ATOM 1267 C TYR A 505 7.688 -4.703 0.383 1.00 0.00 C ATOM 1268 O TYR A 505 8.543 -4.783 1.269 1.00 0.00 O ATOM 1269 CB TYR A 505 5.584 -3.290 0.532 1.00 0.00 C ATOM 1270 CG TYR A 505 5.415 -3.692 1.986 1.00 0.00 C ATOM 1271 CD1 TYR A 505 5.831 -2.818 3.008 1.00 0.00 C ATOM 1272 CD2 TYR A 505 4.879 -4.954 2.313 1.00 0.00 C ATOM 1273 CE1 TYR A 505 5.699 -3.197 4.359 1.00 0.00 C ATOM 1274 CE2 TYR A 505 4.748 -5.338 3.663 1.00 0.00 C ATOM 1275 CZ TYR A 505 5.153 -4.457 4.691 1.00 0.00 C ATOM 1276 OH TYR A 505 5.025 -4.814 5.998 1.00 0.00 O ATOM 0 H TYR A 505 6.165 -3.056 -1.839 1.00 0.00 H new ATOM 0 HA TYR A 505 7.620 -2.586 0.567 1.00 0.00 H new ATOM 0 HB2 TYR A 505 5.203 -2.278 0.397 1.00 0.00 H new ATOM 0 HB3 TYR A 505 4.975 -3.945 -0.091 1.00 0.00 H new ATOM 0 HD1 TYR A 505 6.252 -1.856 2.757 1.00 0.00 H new ATOM 0 HD2 TYR A 505 4.568 -5.628 1.528 1.00 0.00 H new ATOM 0 HE1 TYR A 505 6.016 -2.523 5.142 1.00 0.00 H new ATOM 0 HE2 TYR A 505 4.338 -6.306 3.912 1.00 0.00 H new ATOM 0 HH TYR A 505 4.632 -5.710 6.055 1.00 0.00 H new ATOM 1286 N VAL A 506 7.346 -5.760 -0.365 1.00 0.00 N ATOM 1287 CA VAL A 506 7.956 -7.100 -0.244 1.00 0.00 C ATOM 1288 C VAL A 506 9.468 -7.078 -0.499 1.00 0.00 C ATOM 1289 O VAL A 506 10.226 -7.728 0.221 1.00 0.00 O ATOM 1290 CB VAL A 506 7.258 -8.076 -1.218 1.00 0.00 C ATOM 1291 CG1 VAL A 506 8.039 -9.372 -1.471 1.00 0.00 C ATOM 1292 CG2 VAL A 506 5.867 -8.448 -0.692 1.00 0.00 C ATOM 0 H VAL A 506 6.625 -5.712 -1.085 1.00 0.00 H new ATOM 0 HA VAL A 506 7.814 -7.439 0.782 1.00 0.00 H new ATOM 0 HB VAL A 506 7.195 -7.541 -2.166 1.00 0.00 H new ATOM 0 HG11 VAL A 506 7.483 -10.003 -2.164 1.00 0.00 H new ATOM 0 HG12 VAL A 506 9.012 -9.133 -1.899 1.00 0.00 H new ATOM 0 HG13 VAL A 506 8.178 -9.903 -0.529 1.00 0.00 H new ATOM 0 HG21 VAL A 506 5.387 -9.136 -1.388 1.00 0.00 H new ATOM 0 HG22 VAL A 506 5.963 -8.926 0.283 1.00 0.00 H new ATOM 0 HG23 VAL A 506 5.261 -7.547 -0.596 1.00 0.00 H new ATOM 1302 N GLY A 507 9.931 -6.327 -1.500 1.00 0.00 N ATOM 1303 CA GLY A 507 11.329 -6.341 -1.934 1.00 0.00 C ATOM 1304 C GLY A 507 12.309 -5.780 -0.896 1.00 0.00 C ATOM 1305 O GLY A 507 13.381 -6.356 -0.692 1.00 0.00 O ATOM 0 H GLY A 507 9.343 -5.688 -2.035 1.00 0.00 H new ATOM 0 HA2 GLY A 507 11.615 -7.366 -2.172 1.00 0.00 H new ATOM 0 HA3 GLY A 507 11.419 -5.763 -2.854 1.00 0.00 H new ATOM 1309 N LYS A 508 11.931 -4.711 -0.174 1.00 0.00 N ATOM 1310 CA LYS A 508 12.742 -4.162 0.935 1.00 0.00 C ATOM 1311 C LYS A 508 12.643 -4.964 2.240 1.00 0.00 C ATOM 1312 O LYS A 508 13.511 -4.824 3.102 1.00 0.00 O ATOM 1313 CB LYS A 508 12.447 -2.666 1.153 1.00 0.00 C ATOM 1314 CG LYS A 508 11.134 -2.374 1.900 1.00 0.00 C ATOM 1315 CD LYS A 508 10.935 -0.867 2.134 1.00 0.00 C ATOM 1316 CE LYS A 508 9.894 -0.235 1.201 1.00 0.00 C ATOM 1317 NZ LYS A 508 10.264 -0.307 -0.235 1.00 0.00 N ATOM 0 H LYS A 508 11.061 -4.204 -0.338 1.00 0.00 H new ATOM 0 HA LYS A 508 13.781 -4.262 0.622 1.00 0.00 H new ATOM 0 HB2 LYS A 508 13.273 -2.224 1.710 1.00 0.00 H new ATOM 0 HB3 LYS A 508 12.416 -2.170 0.183 1.00 0.00 H new ATOM 0 HG2 LYS A 508 10.294 -2.767 1.327 1.00 0.00 H new ATOM 0 HG3 LYS A 508 11.137 -2.894 2.858 1.00 0.00 H new ATOM 0 HD2 LYS A 508 10.630 -0.705 3.168 1.00 0.00 H new ATOM 0 HD3 LYS A 508 11.889 -0.357 1.999 1.00 0.00 H new ATOM 0 HE2 LYS A 508 8.936 -0.735 1.347 1.00 0.00 H new ATOM 0 HE3 LYS A 508 9.754 0.809 1.480 1.00 0.00 H new ATOM 0 HZ1 LYS A 508 9.544 0.182 -0.804 1.00 0.00 H new ATOM 0 HZ2 LYS A 508 11.187 0.149 -0.379 1.00 0.00 H new ATOM 0 HZ3 LYS A 508 10.320 -1.303 -0.529 1.00 0.00 H new ATOM 1331 N LYS A 509 11.631 -5.830 2.393 1.00 0.00 N ATOM 1332 CA LYS A 509 11.407 -6.684 3.581 1.00 0.00 C ATOM 1333 C LYS A 509 12.610 -7.581 3.921 1.00 0.00 C ATOM 1334 O LYS A 509 12.855 -7.876 5.091 1.00 0.00 O ATOM 1335 CB LYS A 509 10.127 -7.512 3.357 1.00 0.00 C ATOM 1336 CG LYS A 509 9.518 -8.050 4.658 1.00 0.00 C ATOM 1337 CD LYS A 509 8.271 -8.896 4.375 1.00 0.00 C ATOM 1338 CE LYS A 509 7.694 -9.432 5.691 1.00 0.00 C ATOM 1339 NZ LYS A 509 6.511 -10.298 5.458 1.00 0.00 N ATOM 0 H LYS A 509 10.920 -5.964 1.674 1.00 0.00 H new ATOM 0 HA LYS A 509 11.285 -6.036 4.449 1.00 0.00 H new ATOM 0 HB2 LYS A 509 9.388 -6.895 2.846 1.00 0.00 H new ATOM 0 HB3 LYS A 509 10.355 -8.349 2.697 1.00 0.00 H new ATOM 0 HG2 LYS A 509 10.257 -8.651 5.188 1.00 0.00 H new ATOM 0 HG3 LYS A 509 9.256 -7.218 5.312 1.00 0.00 H new ATOM 0 HD2 LYS A 509 7.523 -8.295 3.858 1.00 0.00 H new ATOM 0 HD3 LYS A 509 8.526 -9.725 3.715 1.00 0.00 H new ATOM 0 HE2 LYS A 509 8.460 -9.997 6.221 1.00 0.00 H new ATOM 0 HE3 LYS A 509 7.413 -8.597 6.332 1.00 0.00 H new ATOM 0 HZ1 LYS A 509 6.148 -10.642 6.370 1.00 0.00 H new ATOM 0 HZ2 LYS A 509 5.770 -9.751 4.974 1.00 0.00 H new ATOM 0 HZ3 LYS A 509 6.785 -11.108 4.867 1.00 0.00 H new ATOM 1353 N GLN A 510 13.399 -7.955 2.909 1.00 0.00 N ATOM 1354 CA GLN A 510 14.655 -8.711 3.037 1.00 0.00 C ATOM 1355 C GLN A 510 15.813 -7.925 3.698 1.00 0.00 C ATOM 1356 O GLN A 510 16.824 -8.531 4.068 1.00 0.00 O ATOM 1357 CB GLN A 510 15.090 -9.208 1.646 1.00 0.00 C ATOM 1358 CG GLN A 510 14.078 -10.176 1.011 1.00 0.00 C ATOM 1359 CD GLN A 510 14.602 -10.758 -0.301 1.00 0.00 C ATOM 1360 OE1 GLN A 510 14.580 -10.126 -1.351 1.00 0.00 O ATOM 1361 NE2 GLN A 510 15.099 -11.979 -0.303 1.00 0.00 N ATOM 0 H GLN A 510 13.174 -7.732 1.939 1.00 0.00 H new ATOM 0 HA GLN A 510 14.444 -9.544 3.708 1.00 0.00 H new ATOM 0 HB2 GLN A 510 15.228 -8.351 0.987 1.00 0.00 H new ATOM 0 HB3 GLN A 510 16.057 -9.705 1.729 1.00 0.00 H new ATOM 0 HG2 GLN A 510 13.862 -10.986 1.708 1.00 0.00 H new ATOM 0 HG3 GLN A 510 13.139 -9.653 0.828 1.00 0.00 H new ATOM 0 HE21 GLN A 510 15.126 -12.520 0.561 1.00 0.00 H new ATOM 0 HE22 GLN A 510 15.457 -12.383 -1.169 1.00 0.00 H new ATOM 1370 N LYS A 511 15.685 -6.597 3.861 1.00 0.00 N ATOM 1371 CA LYS A 511 16.729 -5.688 4.382 1.00 0.00 C ATOM 1372 C LYS A 511 16.258 -4.811 5.553 1.00 0.00 C ATOM 1373 O LYS A 511 17.066 -4.496 6.430 1.00 0.00 O ATOM 1374 CB LYS A 511 17.267 -4.804 3.239 1.00 0.00 C ATOM 1375 CG LYS A 511 17.962 -5.612 2.129 1.00 0.00 C ATOM 1376 CD LYS A 511 18.514 -4.733 0.995 1.00 0.00 C ATOM 1377 CE LYS A 511 19.664 -3.828 1.462 1.00 0.00 C ATOM 1378 NZ LYS A 511 20.237 -3.051 0.333 1.00 0.00 N ATOM 0 H LYS A 511 14.822 -6.106 3.626 1.00 0.00 H new ATOM 0 HA LYS A 511 17.523 -6.321 4.779 1.00 0.00 H new ATOM 0 HB2 LYS A 511 16.442 -4.238 2.806 1.00 0.00 H new ATOM 0 HB3 LYS A 511 17.971 -4.079 3.648 1.00 0.00 H new ATOM 0 HG2 LYS A 511 18.779 -6.187 2.565 1.00 0.00 H new ATOM 0 HG3 LYS A 511 17.254 -6.329 1.713 1.00 0.00 H new ATOM 0 HD2 LYS A 511 18.864 -5.370 0.183 1.00 0.00 H new ATOM 0 HD3 LYS A 511 17.710 -4.116 0.593 1.00 0.00 H new ATOM 0 HE2 LYS A 511 19.302 -3.144 2.229 1.00 0.00 H new ATOM 0 HE3 LYS A 511 20.444 -4.436 1.920 1.00 0.00 H new ATOM 0 HZ1 LYS A 511 21.011 -2.450 0.682 1.00 0.00 H new ATOM 0 HZ2 LYS A 511 20.604 -3.705 -0.387 1.00 0.00 H new ATOM 0 HZ3 LYS A 511 19.497 -2.453 -0.087 1.00 0.00 H new ATOM 1392 N GLY A 512 14.972 -4.450 5.601 1.00 0.00 N ATOM 1393 CA GLY A 512 14.338 -3.721 6.710 1.00 0.00 C ATOM 1394 C GLY A 512 13.943 -2.276 6.371 1.00 0.00 C ATOM 1395 O GLY A 512 13.972 -1.855 5.209 1.00 0.00 O ATOM 0 H GLY A 512 14.320 -4.663 4.846 1.00 0.00 H new ATOM 0 HA2 GLY A 512 13.447 -4.265 7.025 1.00 0.00 H new ATOM 0 HA3 GLY A 512 15.021 -3.709 7.559 1.00 0.00 H new ATOM 1399 N LYS A 513 13.566 -1.512 7.405 1.00 0.00 N ATOM 1400 CA LYS A 513 13.269 -0.066 7.328 1.00 0.00 C ATOM 1401 C LYS A 513 14.481 0.758 6.859 1.00 0.00 C ATOM 1402 O LYS A 513 15.631 0.330 6.997 1.00 0.00 O ATOM 1403 CB LYS A 513 12.787 0.442 8.705 1.00 0.00 C ATOM 1404 CG LYS A 513 11.515 -0.233 9.251 1.00 0.00 C ATOM 1405 CD LYS A 513 10.279 -0.015 8.366 1.00 0.00 C ATOM 1406 CE LYS A 513 9.042 -0.613 9.048 1.00 0.00 C ATOM 1407 NZ LYS A 513 7.816 -0.406 8.236 1.00 0.00 N ATOM 0 H LYS A 513 13.455 -1.888 8.346 1.00 0.00 H new ATOM 0 HA LYS A 513 12.482 0.066 6.585 1.00 0.00 H new ATOM 0 HB2 LYS A 513 13.591 0.301 9.427 1.00 0.00 H new ATOM 0 HB3 LYS A 513 12.607 1.515 8.635 1.00 0.00 H new ATOM 0 HG2 LYS A 513 11.696 -1.303 9.352 1.00 0.00 H new ATOM 0 HG3 LYS A 513 11.309 0.151 10.250 1.00 0.00 H new ATOM 0 HD2 LYS A 513 10.130 1.050 8.190 1.00 0.00 H new ATOM 0 HD3 LYS A 513 10.430 -0.481 7.392 1.00 0.00 H new ATOM 0 HE2 LYS A 513 9.196 -1.680 9.211 1.00 0.00 H new ATOM 0 HE3 LYS A 513 8.911 -0.157 10.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 513 7.000 -0.823 8.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 513 7.656 0.613 8.102 1.00 0.00 H new ATOM 0 HZ3 LYS A 513 7.932 -0.863 7.309 1.00 0.00 H new ATOM 1421 N GLN A 514 14.216 1.964 6.351 1.00 0.00 N ATOM 1422 CA GLN A 514 15.227 2.876 5.780 1.00 0.00 C ATOM 1423 C GLN A 514 15.209 4.295 6.392 1.00 0.00 C ATOM 1424 O GLN A 514 16.108 5.096 6.121 1.00 0.00 O ATOM 1425 CB GLN A 514 15.057 2.932 4.249 1.00 0.00 C ATOM 1426 CG GLN A 514 15.278 1.571 3.566 1.00 0.00 C ATOM 1427 CD GLN A 514 15.158 1.675 2.047 1.00 0.00 C ATOM 1428 OE1 GLN A 514 14.087 1.530 1.467 1.00 0.00 O ATOM 1429 NE2 GLN A 514 16.239 1.932 1.338 1.00 0.00 N ATOM 0 H GLN A 514 13.272 2.349 6.322 1.00 0.00 H new ATOM 0 HA GLN A 514 16.205 2.468 6.035 1.00 0.00 H new ATOM 0 HB2 GLN A 514 14.055 3.291 4.014 1.00 0.00 H new ATOM 0 HB3 GLN A 514 15.760 3.656 3.838 1.00 0.00 H new ATOM 0 HG2 GLN A 514 16.265 1.188 3.828 1.00 0.00 H new ATOM 0 HG3 GLN A 514 14.548 0.853 3.940 1.00 0.00 H new ATOM 0 HE21 GLN A 514 17.138 2.055 1.805 1.00 0.00 H new ATOM 0 HE22 GLN A 514 16.177 2.008 0.323 1.00 0.00 H new ATOM 1438 N VAL A 515 14.226 4.610 7.245 1.00 0.00 N ATOM 1439 CA VAL A 515 14.126 5.895 7.978 1.00 0.00 C ATOM 1440 C VAL A 515 15.051 5.979 9.207 1.00 0.00 C ATOM 1441 O VAL A 515 15.283 7.071 9.734 1.00 0.00 O ATOM 1442 CB VAL A 515 12.671 6.195 8.400 1.00 0.00 C ATOM 1443 CG1 VAL A 515 11.761 6.338 7.172 1.00 0.00 C ATOM 1444 CG2 VAL A 515 12.070 5.137 9.336 1.00 0.00 C ATOM 0 H VAL A 515 13.459 3.971 7.455 1.00 0.00 H new ATOM 0 HA VAL A 515 14.462 6.653 7.271 1.00 0.00 H new ATOM 0 HB VAL A 515 12.721 7.134 8.951 1.00 0.00 H new ATOM 0 HG11 VAL A 515 10.742 6.549 7.497 1.00 0.00 H new ATOM 0 HG12 VAL A 515 12.119 7.156 6.547 1.00 0.00 H new ATOM 0 HG13 VAL A 515 11.775 5.411 6.599 1.00 0.00 H new ATOM 0 HG21 VAL A 515 11.047 5.415 9.590 1.00 0.00 H new ATOM 0 HG22 VAL A 515 12.070 4.168 8.837 1.00 0.00 H new ATOM 0 HG23 VAL A 515 12.666 5.076 10.247 1.00 0.00 H new ATOM 1454 N LYS A 516 15.583 4.836 9.660 1.00 0.00 N ATOM 1455 CA LYS A 516 16.486 4.676 10.817 1.00 0.00 C ATOM 1456 C LYS A 516 17.387 3.439 10.663 1.00 0.00 C ATOM 1457 O LYS A 516 17.174 2.622 9.761 1.00 0.00 O ATOM 1458 CB LYS A 516 15.652 4.619 12.117 1.00 0.00 C ATOM 1459 CG LYS A 516 14.729 3.388 12.220 1.00 0.00 C ATOM 1460 CD LYS A 516 13.928 3.345 13.530 1.00 0.00 C ATOM 1461 CE LYS A 516 12.911 4.490 13.635 1.00 0.00 C ATOM 1462 NZ LYS A 516 12.118 4.400 14.888 1.00 0.00 N ATOM 0 H LYS A 516 15.386 3.944 9.205 1.00 0.00 H new ATOM 0 HA LYS A 516 17.151 5.538 10.867 1.00 0.00 H new ATOM 0 HB2 LYS A 516 16.329 4.624 12.971 1.00 0.00 H new ATOM 0 HB3 LYS A 516 15.045 5.522 12.186 1.00 0.00 H new ATOM 0 HG2 LYS A 516 14.037 3.388 11.378 1.00 0.00 H new ATOM 0 HG3 LYS A 516 15.330 2.482 12.138 1.00 0.00 H new ATOM 0 HD2 LYS A 516 13.405 2.391 13.601 1.00 0.00 H new ATOM 0 HD3 LYS A 516 14.616 3.395 14.374 1.00 0.00 H new ATOM 0 HE2 LYS A 516 13.433 5.446 13.601 1.00 0.00 H new ATOM 0 HE3 LYS A 516 12.241 4.463 12.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 516 11.441 5.188 14.928 1.00 0.00 H new ATOM 0 HZ2 LYS A 516 11.601 3.498 14.908 1.00 0.00 H new ATOM 0 HZ3 LYS A 516 12.756 4.451 15.707 1.00 0.00 H new ATOM 1476 N SER A 517 18.362 3.280 11.559 1.00 0.00 N ATOM 1477 CA SER A 517 19.261 2.111 11.612 1.00 0.00 C ATOM 1478 C SER A 517 19.762 1.804 13.032 1.00 0.00 C ATOM 1479 O SER A 517 19.592 0.679 13.512 1.00 0.00 O ATOM 1480 CB SER A 517 20.453 2.313 10.661 1.00 0.00 C ATOM 1481 OG SER A 517 21.132 3.536 10.921 1.00 0.00 O ATOM 0 H SER A 517 18.558 3.969 12.285 1.00 0.00 H new ATOM 0 HA SER A 517 18.676 1.249 11.291 1.00 0.00 H new ATOM 0 HB2 SER A 517 21.149 1.481 10.768 1.00 0.00 H new ATOM 0 HB3 SER A 517 20.101 2.304 9.629 1.00 0.00 H new ATOM 0 HG SER A 517 21.884 3.631 10.300 1.00 0.00 H new ATOM 1487 N GLY A 518 20.315 2.802 13.735 1.00 0.00 N ATOM 1488 CA GLY A 518 20.851 2.665 15.098 1.00 0.00 C ATOM 1489 C GLY A 518 22.081 1.739 15.222 1.00 0.00 C ATOM 1490 O GLY A 518 22.628 1.282 14.207 1.00 0.00 O ATOM 0 H GLY A 518 20.404 3.748 13.364 1.00 0.00 H new ATOM 0 HA2 GLY A 518 21.120 3.654 15.468 1.00 0.00 H new ATOM 0 HA3 GLY A 518 20.062 2.286 15.747 1.00 0.00 H new ATOM 1494 N PRO A 519 22.548 1.463 16.457 1.00 0.00 N ATOM 1495 CA PRO A 519 23.631 0.512 16.725 1.00 0.00 C ATOM 1496 C PRO A 519 23.193 -0.953 16.518 1.00 0.00 C ATOM 1497 O PRO A 519 21.998 -1.264 16.474 1.00 0.00 O ATOM 1498 CB PRO A 519 24.038 0.783 18.179 1.00 0.00 C ATOM 1499 CG PRO A 519 22.736 1.251 18.827 1.00 0.00 C ATOM 1500 CD PRO A 519 22.046 2.026 17.704 1.00 0.00 C ATOM 0 HA PRO A 519 24.462 0.648 16.033 1.00 0.00 H new ATOM 0 HB2 PRO A 519 24.428 -0.113 18.661 1.00 0.00 H new ATOM 0 HB3 PRO A 519 24.816 1.544 18.244 1.00 0.00 H new ATOM 0 HG2 PRO A 519 22.131 0.411 19.167 1.00 0.00 H new ATOM 0 HG3 PRO A 519 22.923 1.882 19.696 1.00 0.00 H new ATOM 0 HD2 PRO A 519 20.963 1.925 17.769 1.00 0.00 H new ATOM 0 HD3 PRO A 519 22.271 3.090 17.770 1.00 0.00 H new ATOM 1508 N SER A 520 24.171 -1.864 16.449 1.00 0.00 N ATOM 1509 CA SER A 520 23.973 -3.309 16.230 1.00 0.00 C ATOM 1510 C SER A 520 24.932 -4.153 17.081 1.00 0.00 C ATOM 1511 O SER A 520 26.062 -3.741 17.361 1.00 0.00 O ATOM 1512 CB SER A 520 24.195 -3.663 14.749 1.00 0.00 C ATOM 1513 OG SER A 520 23.262 -3.000 13.907 1.00 0.00 O ATOM 0 H SER A 520 25.154 -1.612 16.547 1.00 0.00 H new ATOM 0 HA SER A 520 22.948 -3.536 16.524 1.00 0.00 H new ATOM 0 HB2 SER A 520 25.209 -3.389 14.457 1.00 0.00 H new ATOM 0 HB3 SER A 520 24.105 -4.741 14.615 1.00 0.00 H new ATOM 0 HG SER A 520 23.432 -3.245 12.974 1.00 0.00 H new ATOM 1519 N SER A 521 24.494 -5.354 17.475 1.00 0.00 N ATOM 1520 CA SER A 521 25.255 -6.288 18.331 1.00 0.00 C ATOM 1521 C SER A 521 26.456 -6.961 17.641 1.00 0.00 C ATOM 1522 O SER A 521 27.325 -7.516 18.321 1.00 0.00 O ATOM 1523 CB SER A 521 24.321 -7.386 18.862 1.00 0.00 C ATOM 1524 OG SER A 521 23.201 -6.819 19.533 1.00 0.00 O ATOM 0 H SER A 521 23.580 -5.717 17.204 1.00 0.00 H new ATOM 0 HA SER A 521 25.660 -5.674 19.136 1.00 0.00 H new ATOM 0 HB2 SER A 521 23.978 -8.008 18.036 1.00 0.00 H new ATOM 0 HB3 SER A 521 24.868 -8.036 19.545 1.00 0.00 H new ATOM 0 HG SER A 521 22.619 -7.536 19.861 1.00 0.00 H new ATOM 1530 N GLY A 522 26.522 -6.921 16.302 1.00 0.00 N ATOM 1531 CA GLY A 522 27.575 -7.533 15.474 1.00 0.00 C ATOM 1532 C GLY A 522 27.408 -7.240 13.982 1.00 0.00 C ATOM 1533 O GLY A 522 26.272 -7.362 13.472 1.00 0.00 O ATOM 1534 OXT GLY A 522 28.417 -6.887 13.331 1.00 0.00 O ATOM 0 H GLY A 522 25.816 -6.443 15.743 1.00 0.00 H new ATOM 0 HA2 GLY A 522 28.547 -7.167 15.804 1.00 0.00 H new ATOM 0 HA3 GLY A 522 27.571 -8.612 15.629 1.00 0.00 H new TER 1538 GLY A 522 HETATM 1539 P 7MG A 523 -8.943 -5.042 10.755 1.00 0.00 P HETATM 1540 OP1 7MG A 523 -9.291 -4.482 9.428 1.00 0.00 O HETATM 1541 OP2 7MG A 523 -8.497 -6.457 10.835 1.00 0.00 O HETATM 1542 O5' 7MG A 523 -7.763 -4.145 11.397 1.00 0.00 O HETATM 1543 C5' 7MG A 523 -7.969 -2.776 11.717 1.00 0.00 C HETATM 1544 C4' 7MG A 523 -6.639 -2.080 12.062 1.00 0.00 C HETATM 1545 O4' 7MG A 523 -6.271 -1.126 11.075 1.00 0.00 O HETATM 1546 C3' 7MG A 523 -6.661 -1.339 13.408 1.00 0.00 C HETATM 1547 O3' 7MG A 523 -6.356 -2.155 14.539 1.00 0.00 O HETATM 1548 C2' 7MG A 523 -5.591 -0.269 13.169 1.00 0.00 C HETATM 1549 O2' 7MG A 523 -4.264 -0.772 13.331 1.00 0.00 O HETATM 1550 C1' 7MG A 523 -5.837 0.077 11.699 1.00 0.00 C HETATM 1551 N9 7MG A 523 -6.900 1.096 11.514 1.00 0.00 N HETATM 1552 C8 7MG A 523 -8.251 0.885 11.311 1.00 0.00 C HETATM 1553 N7 7MG A 523 -8.858 2.114 10.972 1.00 0.00 N HETATM 1554 C5 7MG A 523 -7.854 3.039 11.035 1.00 0.00 C HETATM 1555 C6 7MG A 523 -7.884 4.419 10.769 1.00 0.00 C HETATM 1556 O6 7MG A 523 -8.829 5.117 10.433 1.00 0.00 O HETATM 1557 N1 7MG A 523 -6.680 5.012 10.887 1.00 0.00 N HETATM 1558 C2 7MG A 523 -5.590 4.370 11.240 1.00 0.00 C HETATM 1559 N2 7MG A 523 -4.551 5.115 11.277 1.00 0.00 N HETATM 1560 N3 7MG A 523 -5.481 3.091 11.513 1.00 0.00 N HETATM 1561 C4 7MG A 523 -6.671 2.454 11.375 1.00 0.00 C HETATM 1562 CM7 7MG A 523 -10.309 2.173 10.608 1.00 0.00 C HETATM 0 HO3' 7MG A 523 -6.389 -1.611 15.353 1.00 0.00 H new HETATM 0 HO2' 7MG A 523 -4.281 -1.555 13.920 1.00 0.00 H new HETATM 0 HN22 7MG A 523 -3.648 4.719 11.539 1.00 0.00 H new HETATM 0 HN21 7MG A 523 -4.625 6.105 11.044 1.00 0.00 H new HETATM 0 HM73 7MG A 523 -10.491 1.547 9.734 1.00 0.00 H new HETATM 0 HM72 7MG A 523 -10.909 1.812 11.444 1.00 0.00 H new HETATM 0 HM71 7MG A 523 -10.586 3.203 10.381 1.00 0.00 H new HETATM 0 H5'' 7MG A 523 -8.440 -2.270 10.875 1.00 0.00 H new HETATM 0 HN1 7MG A 523 -6.612 6.011 10.692 1.00 0.00 H new HETATM 0 H82 7MG A 523 -8.404 0.156 10.515 1.00 0.00 H new HETATM 0 H81 7MG A 523 -8.708 0.474 12.211 1.00 0.00 H new HETATM 0 H5' 7MG A 523 -8.654 -2.696 12.561 1.00 0.00 H new HETATM 0 H4' 7MG A 523 -5.919 -2.897 12.112 1.00 0.00 H new HETATM 0 H3' 7MG A 523 -7.650 -0.960 13.664 1.00 0.00 H new HETATM 0 H2' 7MG A 523 -5.662 0.564 13.868 1.00 0.00 H new HETATM 0 H1' 7MG A 523 -4.920 0.487 11.275 1.00 0.00 H new HETATM 1578 PB GDP A 524 -11.548 -4.232 11.651 1.00 0.00 P HETATM 1579 O1B GDP A 524 -12.109 -4.424 13.014 1.00 0.00 O HETATM 1580 O2B GDP A 524 -12.260 -4.852 10.501 1.00 0.00 O HETATM 1581 O3B GDP A 524 -10.143 -4.900 11.744 1.00 0.00 O HETATM 1582 O3A GDP A 524 -11.241 -2.736 11.439 1.00 0.00 O HETATM 1583 PA GDP A 524 -12.314 -1.747 10.937 1.00 0.00 P HETATM 1584 O1A GDP A 524 -13.696 -2.097 11.371 1.00 0.00 O HETATM 1585 O2A GDP A 524 -12.075 -1.454 9.497 1.00 0.00 O HETATM 1586 O5' GDP A 524 -11.921 -0.378 11.709 1.00 0.00 O HETATM 1587 C5' GDP A 524 -12.169 -0.176 13.101 1.00 0.00 C HETATM 1588 C4' GDP A 524 -11.125 -0.830 14.030 1.00 0.00 C HETATM 1589 O4' GDP A 524 -9.894 -0.119 13.923 1.00 0.00 O HETATM 1590 C3' GDP A 524 -11.559 -0.743 15.503 1.00 0.00 C HETATM 1591 O3' GDP A 524 -10.959 -1.795 16.262 1.00 0.00 O HETATM 1592 C2' GDP A 524 -11.009 0.636 15.892 1.00 0.00 C HETATM 1593 O2' GDP A 524 -10.805 0.809 17.294 1.00 0.00 O HETATM 1594 C1' GDP A 524 -9.704 0.673 15.089 1.00 0.00 C HETATM 1595 N9 GDP A 524 -9.291 2.044 14.716 1.00 0.00 N HETATM 1596 C8 GDP A 524 -10.019 3.025 14.094 1.00 0.00 C HETATM 1597 N7 GDP A 524 -9.359 4.137 13.880 1.00 0.00 N HETATM 1598 C5 GDP A 524 -8.085 3.864 14.400 1.00 0.00 C HETATM 1599 C6 GDP A 524 -6.880 4.653 14.442 1.00 0.00 C HETATM 1600 O6 GDP A 524 -6.698 5.802 14.035 1.00 0.00 O HETATM 1601 N1 GDP A 524 -5.808 3.987 15.003 1.00 0.00 N HETATM 1602 C2 GDP A 524 -5.891 2.738 15.525 1.00 0.00 C HETATM 1603 N2 GDP A 524 -4.794 2.228 16.006 1.00 0.00 N HETATM 1604 N3 GDP A 524 -6.982 1.978 15.521 1.00 0.00 N HETATM 1605 C4 GDP A 524 -8.048 2.591 14.928 1.00 0.00 C HETATM 0 HO3' GDP A 524 -10.687 -1.452 17.139 1.00 0.00 H new HETATM 0 HO2' GDP A 524 -10.453 1.707 17.465 1.00 0.00 H new HETATM 0 HN22 GDP A 524 -4.801 1.292 16.410 1.00 0.00 H new HETATM 0 HN21 GDP A 524 -3.927 2.765 15.979 1.00 0.00 H new HETATM 0 H5'' GDP A 524 -12.198 0.895 13.302 1.00 0.00 H new HETATM 0 HN1 GDP A 524 -4.905 4.460 15.026 1.00 0.00 H new HETATM 0 H8 GDP A 524 -11.061 2.891 13.802 1.00 0.00 H new HETATM 0 H5' GDP A 524 -13.155 -0.572 13.344 1.00 0.00 H new HETATM 0 H4' GDP A 524 -11.023 -1.873 13.731 1.00 0.00 H new HETATM 0 H3' GDP A 524 -12.630 -0.850 15.678 1.00 0.00 H new HETATM 0 H2' GDP A 524 -11.698 1.451 15.670 1.00 0.00 H new HETATM 0 H1' GDP A 524 -8.901 0.280 15.712 1.00 0.00 H new