USER MOD reduce.3.24.130724 H: found=0, std=0, add=785, rem=0, adj=32 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 523 7MG O3' : rot -139:sc= 0.564 USER MOD Set 1.2: A 524 GDP O3' : rot 132:sc= 0.515 USER MOD Set 2.1: A 489 ASN : amide:sc= 0.838 K(o=1.8,f=-2.1) USER MOD Set 2.2: A 492 LYS NZ :NH3+ -154:sc= 0.965 (180deg=0) USER MOD Set 3.1: A 442 HIS : no HD1:sc=-0.000201 K(o=3.4,f=-7.4) USER MOD Set 3.2: A 444 THR OG1 : rot 180:sc= 0 USER MOD Set 3.3: A 473 SER OG : rot 180:sc= 0 USER MOD Set 3.4: A 500 GLN : amide:sc= 2.2 K(o=3.4,f=-5.3) USER MOD Set 3.5: A 508 LYS NZ :NH3+ -178:sc= 1.18 (180deg=-0.0373) USER MOD Single : A 424 SER OG : rot 180:sc= 0 USER MOD Single : A 425 SER OG : rot 180:sc= 0 USER MOD Single : A 427 SER OG : rot 180:sc= 0 USER MOD Single : A 428 SER OG : rot 180:sc= 0 USER MOD Single : A 434 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 436 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 439 HIS : no HD1:sc= 0.256 K(o=0.26,f=-1.6!) USER MOD Single : A 447 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 450 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 451 THR OG1 : rot 180:sc= 0.0364 USER MOD Single : A 452 SER OG : rot 180:sc= 0 USER MOD Single : A 455 TYR OH : rot 180:sc= 0 USER MOD Single : A 456 GLN : amide:sc= 0.379 X(o=0.38,f=-0.0092) 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= -0.225 K(o=-0.23,f=-2!) 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 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= 0.681 K(o=0.68,f=-0.026) USER MOD Single : A 483 GLN : amide:sc= 0.039 K(o=0.039,f=-0.85) USER MOD Single : A 485 GLN : amide:sc= 0.508 K(o=0.51,f=-0.015) USER MOD Single : A 490 THR OG1 : rot -75:sc= 0.92 USER MOD Single : A 491 SER OG : rot -63:sc= 0.0057 USER MOD Single : A 493 TYR OH : rot 180:sc= 0 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= 0.335 USER MOD Single : A 502 TYR OH : rot 180:sc= 0.351 USER MOD Single : A 505 TYR OH : rot 180:sc= 0 USER MOD Single : A 509 LYS NZ :NH3+ 170:sc= 0 (180deg=-0.0672) USER MOD Single : A 510 GLN : amide:sc= 0.974 K(o=0.97,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=-0.3) 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 -26:sc= 0.0475 USER MOD Single : A 524 GDP O2' : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 423 -1.280 -11.215 9.177 1.00 0.00 N ATOM 2 CA GLY A 423 0.197 -11.164 9.124 1.00 0.00 C ATOM 3 C GLY A 423 0.745 -12.103 8.058 1.00 0.00 C ATOM 4 O GLY A 423 0.215 -12.161 6.947 1.00 0.00 O ATOM 0 HA2 GLY A 423 0.521 -10.144 8.915 1.00 0.00 H new ATOM 0 HA3 GLY A 423 0.608 -11.435 10.097 1.00 0.00 H new ATOM 10 N SER A 424 1.810 -12.843 8.384 1.00 0.00 N ATOM 11 CA SER A 424 2.458 -13.836 7.504 1.00 0.00 C ATOM 12 C SER A 424 3.140 -14.952 8.319 1.00 0.00 C ATOM 13 O SER A 424 3.371 -14.800 9.523 1.00 0.00 O ATOM 14 CB SER A 424 3.491 -13.128 6.614 1.00 0.00 C ATOM 15 OG SER A 424 3.941 -13.980 5.571 1.00 0.00 O ATOM 0 H SER A 424 2.263 -12.769 9.295 1.00 0.00 H new ATOM 0 HA SER A 424 1.691 -14.300 6.885 1.00 0.00 H new ATOM 0 HB2 SER A 424 3.050 -12.227 6.187 1.00 0.00 H new ATOM 0 HB3 SER A 424 4.340 -12.811 7.220 1.00 0.00 H new ATOM 0 HG SER A 424 4.596 -13.504 5.019 1.00 0.00 H new ATOM 21 N SER A 425 3.483 -16.065 7.660 1.00 0.00 N ATOM 22 CA SER A 425 4.042 -17.283 8.282 1.00 0.00 C ATOM 23 C SER A 425 5.211 -17.916 7.500 1.00 0.00 C ATOM 24 O SER A 425 5.780 -18.914 7.951 1.00 0.00 O ATOM 25 CB SER A 425 2.934 -18.334 8.470 1.00 0.00 C ATOM 26 OG SER A 425 1.837 -17.828 9.224 1.00 0.00 O ATOM 0 H SER A 425 3.378 -16.151 6.649 1.00 0.00 H new ATOM 0 HA SER A 425 4.447 -16.963 9.242 1.00 0.00 H new ATOM 0 HB2 SER A 425 2.580 -18.665 7.494 1.00 0.00 H new ATOM 0 HB3 SER A 425 3.346 -19.209 8.973 1.00 0.00 H new ATOM 0 HG SER A 425 1.156 -18.526 9.319 1.00 0.00 H new ATOM 32 N GLY A 426 5.592 -17.359 6.343 1.00 0.00 N ATOM 33 CA GLY A 426 6.700 -17.853 5.511 1.00 0.00 C ATOM 34 C GLY A 426 6.700 -17.304 4.077 1.00 0.00 C ATOM 35 O GLY A 426 5.790 -16.573 3.674 1.00 0.00 O ATOM 0 H GLY A 426 5.131 -16.538 5.951 1.00 0.00 H new ATOM 0 HA2 GLY A 426 7.644 -17.591 5.989 1.00 0.00 H new ATOM 0 HA3 GLY A 426 6.654 -18.941 5.472 1.00 0.00 H new ATOM 39 N SER A 427 7.721 -17.677 3.301 1.00 0.00 N ATOM 40 CA SER A 427 7.943 -17.219 1.912 1.00 0.00 C ATOM 41 C SER A 427 8.472 -18.306 0.955 1.00 0.00 C ATOM 42 O SER A 427 8.674 -18.041 -0.236 1.00 0.00 O ATOM 43 CB SER A 427 8.896 -16.015 1.920 1.00 0.00 C ATOM 44 OG SER A 427 10.152 -16.364 2.491 1.00 0.00 O ATOM 0 H SER A 427 8.441 -18.324 3.623 1.00 0.00 H new ATOM 0 HA SER A 427 6.963 -16.941 1.523 1.00 0.00 H new ATOM 0 HB2 SER A 427 9.043 -15.656 0.901 1.00 0.00 H new ATOM 0 HB3 SER A 427 8.450 -15.197 2.486 1.00 0.00 H new ATOM 0 HG SER A 427 10.743 -15.582 2.484 1.00 0.00 H new ATOM 50 N SER A 428 8.684 -19.534 1.442 1.00 0.00 N ATOM 51 CA SER A 428 9.086 -20.705 0.643 1.00 0.00 C ATOM 52 C SER A 428 7.967 -21.225 -0.282 1.00 0.00 C ATOM 53 O SER A 428 6.788 -20.882 -0.127 1.00 0.00 O ATOM 54 CB SER A 428 9.568 -21.819 1.586 1.00 0.00 C ATOM 55 OG SER A 428 8.573 -22.151 2.546 1.00 0.00 O ATOM 0 H SER A 428 8.578 -19.750 2.433 1.00 0.00 H new ATOM 0 HA SER A 428 9.896 -20.389 -0.014 1.00 0.00 H new ATOM 0 HB2 SER A 428 9.825 -22.704 1.005 1.00 0.00 H new ATOM 0 HB3 SER A 428 10.476 -21.498 2.097 1.00 0.00 H new ATOM 0 HG SER A 428 8.907 -22.863 3.131 1.00 0.00 H new ATOM 61 N GLY A 429 8.332 -22.077 -1.249 1.00 0.00 N ATOM 62 CA GLY A 429 7.388 -22.753 -2.155 1.00 0.00 C ATOM 63 C GLY A 429 8.038 -23.413 -3.381 1.00 0.00 C ATOM 64 O GLY A 429 7.541 -24.430 -3.872 1.00 0.00 O ATOM 0 H GLY A 429 9.306 -22.321 -1.428 1.00 0.00 H new ATOM 0 HA2 GLY A 429 6.848 -23.515 -1.593 1.00 0.00 H new ATOM 0 HA3 GLY A 429 6.651 -22.027 -2.498 1.00 0.00 H new ATOM 68 N GLY A 430 9.166 -22.874 -3.857 1.00 0.00 N ATOM 69 CA GLY A 430 9.954 -23.423 -4.968 1.00 0.00 C ATOM 70 C GLY A 430 11.189 -22.575 -5.319 1.00 0.00 C ATOM 71 O GLY A 430 11.378 -21.497 -4.741 1.00 0.00 O ATOM 0 H GLY A 430 9.568 -22.020 -3.470 1.00 0.00 H new ATOM 0 HA2 GLY A 430 10.276 -24.432 -4.711 1.00 0.00 H new ATOM 0 HA3 GLY A 430 9.317 -23.506 -5.849 1.00 0.00 H new ATOM 75 N PRO A 431 12.037 -23.032 -6.263 1.00 0.00 N ATOM 76 CA PRO A 431 13.250 -22.320 -6.685 1.00 0.00 C ATOM 77 C PRO A 431 12.967 -21.063 -7.531 1.00 0.00 C ATOM 78 O PRO A 431 13.826 -20.185 -7.641 1.00 0.00 O ATOM 79 CB PRO A 431 14.058 -23.356 -7.477 1.00 0.00 C ATOM 80 CG PRO A 431 12.984 -24.268 -8.069 1.00 0.00 C ATOM 81 CD PRO A 431 11.916 -24.298 -6.977 1.00 0.00 C ATOM 0 HA PRO A 431 13.788 -21.936 -5.818 1.00 0.00 H new ATOM 0 HB2 PRO A 431 14.660 -22.886 -8.255 1.00 0.00 H new ATOM 0 HB3 PRO A 431 14.743 -23.908 -6.834 1.00 0.00 H new ATOM 0 HG2 PRO A 431 12.592 -23.873 -9.006 1.00 0.00 H new ATOM 0 HG3 PRO A 431 13.373 -25.264 -8.281 1.00 0.00 H new ATOM 0 HD2 PRO A 431 10.921 -24.410 -7.407 1.00 0.00 H new ATOM 0 HD3 PRO A 431 12.069 -25.142 -6.304 1.00 0.00 H new ATOM 89 N ASP A 432 11.766 -20.952 -8.110 1.00 0.00 N ATOM 90 CA ASP A 432 11.282 -19.794 -8.871 1.00 0.00 C ATOM 91 C ASP A 432 9.753 -19.659 -8.729 1.00 0.00 C ATOM 92 O ASP A 432 9.021 -20.646 -8.849 1.00 0.00 O ATOM 93 CB ASP A 432 11.683 -19.957 -10.346 1.00 0.00 C ATOM 94 CG ASP A 432 11.239 -18.754 -11.195 1.00 0.00 C ATOM 95 OD1 ASP A 432 11.761 -17.634 -10.974 1.00 0.00 O ATOM 96 OD2 ASP A 432 10.374 -18.923 -12.088 1.00 0.00 O ATOM 0 H ASP A 432 11.074 -21.700 -8.059 1.00 0.00 H new ATOM 0 HA ASP A 432 11.734 -18.884 -8.478 1.00 0.00 H new ATOM 0 HB2 ASP A 432 12.764 -20.073 -10.418 1.00 0.00 H new ATOM 0 HB3 ASP A 432 11.237 -20.868 -10.745 1.00 0.00 H new ATOM 101 N LEU A 433 9.278 -18.437 -8.462 1.00 0.00 N ATOM 102 CA LEU A 433 7.873 -18.074 -8.208 1.00 0.00 C ATOM 103 C LEU A 433 7.568 -16.668 -8.777 1.00 0.00 C ATOM 104 O LEU A 433 8.482 -15.944 -9.185 1.00 0.00 O ATOM 105 CB LEU A 433 7.604 -18.101 -6.682 1.00 0.00 C ATOM 106 CG LEU A 433 7.681 -19.479 -5.990 1.00 0.00 C ATOM 107 CD1 LEU A 433 7.527 -19.301 -4.479 1.00 0.00 C ATOM 108 CD2 LEU A 433 6.576 -20.431 -6.458 1.00 0.00 C ATOM 0 H LEU A 433 9.896 -17.627 -8.414 1.00 0.00 H new ATOM 0 HA LEU A 433 7.222 -18.794 -8.704 1.00 0.00 H new ATOM 0 HB2 LEU A 433 8.320 -17.437 -6.198 1.00 0.00 H new ATOM 0 HB3 LEU A 433 6.612 -17.685 -6.504 1.00 0.00 H new ATOM 0 HG LEU A 433 8.648 -19.909 -6.250 1.00 0.00 H new ATOM 0 HD11 LEU A 433 7.581 -20.274 -3.991 1.00 0.00 H new ATOM 0 HD12 LEU A 433 8.327 -18.662 -4.105 1.00 0.00 H new ATOM 0 HD13 LEU A 433 6.563 -18.840 -4.263 1.00 0.00 H new ATOM 0 HD21 LEU A 433 6.675 -21.386 -5.941 1.00 0.00 H new ATOM 0 HD22 LEU A 433 5.602 -19.996 -6.233 1.00 0.00 H new ATOM 0 HD23 LEU A 433 6.663 -20.590 -7.533 1.00 0.00 H new ATOM 120 N GLN A 434 6.294 -16.259 -8.771 1.00 0.00 N ATOM 121 CA GLN A 434 5.851 -14.921 -9.201 1.00 0.00 C ATOM 122 C GLN A 434 4.696 -14.363 -8.336 1.00 0.00 C ATOM 123 O GLN A 434 3.896 -15.148 -7.810 1.00 0.00 O ATOM 124 CB GLN A 434 5.455 -14.951 -10.692 1.00 0.00 C ATOM 125 CG GLN A 434 4.274 -15.881 -11.023 1.00 0.00 C ATOM 126 CD GLN A 434 3.862 -15.765 -12.488 1.00 0.00 C ATOM 127 OE1 GLN A 434 4.382 -16.440 -13.370 1.00 0.00 O ATOM 128 NE2 GLN A 434 2.916 -14.907 -12.811 1.00 0.00 N ATOM 0 H GLN A 434 5.527 -16.856 -8.463 1.00 0.00 H new ATOM 0 HA GLN A 434 6.693 -14.242 -9.063 1.00 0.00 H new ATOM 0 HB2 GLN A 434 5.203 -13.939 -11.008 1.00 0.00 H new ATOM 0 HB3 GLN A 434 6.320 -15.261 -11.278 1.00 0.00 H new ATOM 0 HG2 GLN A 434 4.549 -16.912 -10.802 1.00 0.00 H new ATOM 0 HG3 GLN A 434 3.425 -15.634 -10.385 1.00 0.00 H new ATOM 0 HE21 GLN A 434 2.474 -14.339 -12.088 1.00 0.00 H new ATOM 0 HE22 GLN A 434 2.625 -14.811 -13.784 1.00 0.00 H new ATOM 137 N PRO A 435 4.568 -13.025 -8.192 1.00 0.00 N ATOM 138 CA PRO A 435 3.401 -12.376 -7.583 1.00 0.00 C ATOM 139 C PRO A 435 2.065 -12.673 -8.292 1.00 0.00 C ATOM 140 O PRO A 435 2.028 -13.065 -9.464 1.00 0.00 O ATOM 141 CB PRO A 435 3.688 -10.867 -7.627 1.00 0.00 C ATOM 142 CG PRO A 435 5.206 -10.779 -7.739 1.00 0.00 C ATOM 143 CD PRO A 435 5.558 -12.018 -8.559 1.00 0.00 C ATOM 0 HA PRO A 435 3.272 -12.764 -6.573 1.00 0.00 H new ATOM 0 HB2 PRO A 435 3.198 -10.393 -8.477 1.00 0.00 H new ATOM 0 HB3 PRO A 435 3.325 -10.366 -6.730 1.00 0.00 H new ATOM 0 HG2 PRO A 435 5.522 -9.862 -8.236 1.00 0.00 H new ATOM 0 HG3 PRO A 435 5.685 -10.792 -6.760 1.00 0.00 H new ATOM 0 HD2 PRO A 435 5.522 -11.804 -9.627 1.00 0.00 H new ATOM 0 HD3 PRO A 435 6.568 -12.362 -8.336 1.00 0.00 H new ATOM 151 N LYS A 436 0.961 -12.387 -7.585 1.00 0.00 N ATOM 152 CA LYS A 436 -0.433 -12.385 -8.088 1.00 0.00 C ATOM 153 C LYS A 436 -1.220 -11.143 -7.606 1.00 0.00 C ATOM 154 O LYS A 436 -2.447 -11.174 -7.484 1.00 0.00 O ATOM 155 CB LYS A 436 -1.137 -13.707 -7.707 1.00 0.00 C ATOM 156 CG LYS A 436 -0.486 -14.950 -8.341 1.00 0.00 C ATOM 157 CD LYS A 436 -1.250 -16.253 -8.043 1.00 0.00 C ATOM 158 CE LYS A 436 -2.673 -16.317 -8.623 1.00 0.00 C ATOM 159 NZ LYS A 436 -2.681 -16.330 -10.111 1.00 0.00 N ATOM 0 H LYS A 436 1.012 -12.138 -6.597 1.00 0.00 H new ATOM 0 HA LYS A 436 -0.405 -12.319 -9.176 1.00 0.00 H new ATOM 0 HB2 LYS A 436 -1.129 -13.815 -6.622 1.00 0.00 H new ATOM 0 HB3 LYS A 436 -2.181 -13.656 -8.015 1.00 0.00 H new ATOM 0 HG2 LYS A 436 -0.426 -14.810 -9.420 1.00 0.00 H new ATOM 0 HG3 LYS A 436 0.536 -15.044 -7.974 1.00 0.00 H new ATOM 0 HD2 LYS A 436 -0.675 -17.092 -8.436 1.00 0.00 H new ATOM 0 HD3 LYS A 436 -1.308 -16.384 -6.962 1.00 0.00 H new ATOM 0 HE2 LYS A 436 -3.173 -17.212 -8.252 1.00 0.00 H new ATOM 0 HE3 LYS A 436 -3.246 -15.461 -8.267 1.00 0.00 H new ATOM 0 HZ1 LYS A 436 -3.662 -16.374 -10.453 1.00 0.00 H new ATOM 0 HZ2 LYS A 436 -2.228 -15.465 -10.468 1.00 0.00 H new ATOM 0 HZ3 LYS A 436 -2.158 -17.161 -10.454 1.00 0.00 H new ATOM 173 N ARG A 437 -0.499 -10.057 -7.286 1.00 0.00 N ATOM 174 CA ARG A 437 -0.982 -8.827 -6.612 1.00 0.00 C ATOM 175 C ARG A 437 -0.498 -7.541 -7.305 1.00 0.00 C ATOM 176 O ARG A 437 -0.330 -6.498 -6.677 1.00 0.00 O ATOM 177 CB ARG A 437 -0.630 -8.898 -5.111 1.00 0.00 C ATOM 178 CG ARG A 437 -1.611 -9.817 -4.369 1.00 0.00 C ATOM 179 CD ARG A 437 -1.267 -9.905 -2.882 1.00 0.00 C ATOM 180 NE ARG A 437 -2.292 -10.666 -2.144 1.00 0.00 N ATOM 181 CZ ARG A 437 -2.218 -11.121 -0.904 1.00 0.00 C ATOM 182 NH1 ARG A 437 -1.152 -10.998 -0.167 1.00 0.00 N ATOM 183 NH2 ARG A 437 -3.241 -11.725 -0.371 1.00 0.00 N ATOM 0 H ARG A 437 0.497 -10.004 -7.501 1.00 0.00 H new ATOM 0 HA ARG A 437 -2.068 -8.778 -6.697 1.00 0.00 H new ATOM 0 HB2 ARG A 437 0.388 -9.268 -4.988 1.00 0.00 H new ATOM 0 HB3 ARG A 437 -0.660 -7.899 -4.677 1.00 0.00 H new ATOM 0 HG2 ARG A 437 -2.627 -9.441 -4.489 1.00 0.00 H new ATOM 0 HG3 ARG A 437 -1.586 -10.813 -4.811 1.00 0.00 H new ATOM 0 HD2 ARG A 437 -0.295 -10.383 -2.758 1.00 0.00 H new ATOM 0 HD3 ARG A 437 -1.184 -8.901 -2.465 1.00 0.00 H new ATOM 0 HE ARG A 437 -3.157 -10.864 -2.647 1.00 0.00 H new ATOM 0 HH11 ARG A 437 -0.324 -10.534 -0.541 1.00 0.00 H new ATOM 0 HH12 ARG A 437 -1.144 -11.366 0.784 1.00 0.00 H new ATOM 0 HH21 ARG A 437 -4.099 -11.847 -0.909 1.00 0.00 H new ATOM 0 HH22 ARG A 437 -3.185 -12.076 0.585 1.00 0.00 H new ATOM 197 N ASP A 438 -0.279 -7.599 -8.618 1.00 0.00 N ATOM 198 CA ASP A 438 0.114 -6.450 -9.455 1.00 0.00 C ATOM 199 C ASP A 438 -0.909 -5.290 -9.442 1.00 0.00 C ATOM 200 O ASP A 438 -0.553 -4.140 -9.702 1.00 0.00 O ATOM 201 CB ASP A 438 0.342 -6.928 -10.897 1.00 0.00 C ATOM 202 CG ASP A 438 1.492 -7.941 -10.996 1.00 0.00 C ATOM 203 OD1 ASP A 438 2.659 -7.519 -11.186 1.00 0.00 O ATOM 204 OD2 ASP A 438 1.230 -9.164 -10.888 1.00 0.00 O ATOM 0 H ASP A 438 -0.370 -8.465 -9.149 1.00 0.00 H new ATOM 0 HA ASP A 438 1.033 -6.049 -9.027 1.00 0.00 H new ATOM 0 HB2 ASP A 438 -0.573 -7.382 -11.277 1.00 0.00 H new ATOM 0 HB3 ASP A 438 0.560 -6.070 -11.533 1.00 0.00 H new ATOM 209 N HIS A 439 -2.170 -5.578 -9.103 1.00 0.00 N ATOM 210 CA HIS A 439 -3.266 -4.615 -8.903 1.00 0.00 C ATOM 211 C HIS A 439 -3.286 -3.956 -7.505 1.00 0.00 C ATOM 212 O HIS A 439 -4.241 -3.248 -7.172 1.00 0.00 O ATOM 213 CB HIS A 439 -4.591 -5.338 -9.191 1.00 0.00 C ATOM 214 CG HIS A 439 -4.889 -6.479 -8.245 1.00 0.00 C ATOM 215 ND1 HIS A 439 -4.246 -7.723 -8.244 1.00 0.00 N ATOM 216 CD2 HIS A 439 -5.827 -6.468 -7.254 1.00 0.00 C ATOM 217 CE1 HIS A 439 -4.821 -8.434 -7.258 1.00 0.00 C ATOM 218 NE2 HIS A 439 -5.770 -7.704 -6.646 1.00 0.00 N ATOM 0 H HIS A 439 -2.473 -6.540 -8.952 1.00 0.00 H new ATOM 0 HA HIS A 439 -3.110 -3.786 -9.593 1.00 0.00 H new ATOM 0 HB2 HIS A 439 -5.406 -4.615 -9.140 1.00 0.00 H new ATOM 0 HB3 HIS A 439 -4.569 -5.722 -10.211 1.00 0.00 H new ATOM 0 HD2 HIS A 439 -6.485 -5.651 -6.996 1.00 0.00 H new ATOM 0 HE1 HIS A 439 -4.558 -9.448 -6.995 1.00 0.00 H new ATOM 0 HE2 HIS A 439 -6.349 -8.012 -5.865 1.00 0.00 H new ATOM 226 N VAL A 440 -2.258 -4.182 -6.676 1.00 0.00 N ATOM 227 CA VAL A 440 -2.215 -3.793 -5.253 1.00 0.00 C ATOM 228 C VAL A 440 -1.004 -2.901 -4.950 1.00 0.00 C ATOM 229 O VAL A 440 0.112 -3.117 -5.432 1.00 0.00 O ATOM 230 CB VAL A 440 -2.216 -5.035 -4.328 1.00 0.00 C ATOM 231 CG1 VAL A 440 -2.393 -4.660 -2.849 1.00 0.00 C ATOM 232 CG2 VAL A 440 -3.336 -6.024 -4.679 1.00 0.00 C ATOM 0 H VAL A 440 -1.407 -4.654 -6.982 1.00 0.00 H new ATOM 0 HA VAL A 440 -3.118 -3.217 -5.052 1.00 0.00 H new ATOM 0 HB VAL A 440 -1.242 -5.498 -4.486 1.00 0.00 H new ATOM 0 HG11 VAL A 440 -2.387 -5.565 -2.241 1.00 0.00 H new ATOM 0 HG12 VAL A 440 -1.576 -4.009 -2.538 1.00 0.00 H new ATOM 0 HG13 VAL A 440 -3.342 -4.140 -2.717 1.00 0.00 H new ATOM 0 HG21 VAL A 440 -3.294 -6.877 -4.002 1.00 0.00 H new ATOM 0 HG22 VAL A 440 -4.302 -5.530 -4.580 1.00 0.00 H new ATOM 0 HG23 VAL A 440 -3.209 -6.369 -5.705 1.00 0.00 H new ATOM 242 N LEU A 441 -1.241 -1.906 -4.100 1.00 0.00 N ATOM 243 CA LEU A 441 -0.282 -0.942 -3.568 1.00 0.00 C ATOM 244 C LEU A 441 -0.135 -1.112 -2.050 1.00 0.00 C ATOM 245 O LEU A 441 -0.994 -1.687 -1.379 1.00 0.00 O ATOM 246 CB LEU A 441 -0.809 0.478 -3.851 1.00 0.00 C ATOM 247 CG LEU A 441 -0.867 0.882 -5.333 1.00 0.00 C ATOM 248 CD1 LEU A 441 -1.684 2.163 -5.465 1.00 0.00 C ATOM 249 CD2 LEU A 441 0.528 1.145 -5.899 1.00 0.00 C ATOM 0 H LEU A 441 -2.180 -1.740 -3.738 1.00 0.00 H new ATOM 0 HA LEU A 441 0.687 -1.104 -4.041 1.00 0.00 H new ATOM 0 HB2 LEU A 441 -1.811 0.565 -3.430 1.00 0.00 H new ATOM 0 HB3 LEU A 441 -0.178 1.192 -3.323 1.00 0.00 H new ATOM 0 HG LEU A 441 -1.321 0.062 -5.888 1.00 0.00 H new ATOM 0 HD11 LEU A 441 -1.731 2.458 -6.513 1.00 0.00 H new ATOM 0 HD12 LEU A 441 -2.693 1.991 -5.091 1.00 0.00 H new ATOM 0 HD13 LEU A 441 -1.212 2.957 -4.885 1.00 0.00 H new ATOM 0 HD21 LEU A 441 0.447 1.428 -6.949 1.00 0.00 H new ATOM 0 HD22 LEU A 441 1.001 1.953 -5.341 1.00 0.00 H new ATOM 0 HD23 LEU A 441 1.132 0.242 -5.812 1.00 0.00 H new ATOM 261 N HIS A 442 0.922 -0.522 -1.504 1.00 0.00 N ATOM 262 CA HIS A 442 1.173 -0.334 -0.078 1.00 0.00 C ATOM 263 C HIS A 442 1.358 1.164 0.183 1.00 0.00 C ATOM 264 O HIS A 442 1.953 1.879 -0.630 1.00 0.00 O ATOM 265 CB HIS A 442 2.407 -1.147 0.334 1.00 0.00 C ATOM 266 CG HIS A 442 2.853 -0.861 1.746 1.00 0.00 C ATOM 267 ND1 HIS A 442 3.760 0.138 2.117 1.00 0.00 N ATOM 268 CD2 HIS A 442 2.387 -1.477 2.870 1.00 0.00 C ATOM 269 CE1 HIS A 442 3.821 0.098 3.459 1.00 0.00 C ATOM 270 NE2 HIS A 442 3.013 -0.865 3.933 1.00 0.00 N ATOM 0 H HIS A 442 1.672 -0.139 -2.079 1.00 0.00 H new ATOM 0 HA HIS A 442 0.334 -0.689 0.521 1.00 0.00 H new ATOM 0 HB2 HIS A 442 2.185 -2.210 0.237 1.00 0.00 H new ATOM 0 HB3 HIS A 442 3.226 -0.928 -0.352 1.00 0.00 H new ATOM 0 HD2 HIS A 442 1.670 -2.284 2.917 1.00 0.00 H new ATOM 0 HE1 HIS A 442 4.432 0.747 4.069 1.00 0.00 H new ATOM 0 HE2 HIS A 442 2.885 -1.103 4.916 1.00 0.00 H new ATOM 278 N VAL A 443 0.822 1.645 1.303 1.00 0.00 N ATOM 279 CA VAL A 443 0.715 3.072 1.635 1.00 0.00 C ATOM 280 C VAL A 443 1.179 3.289 3.072 1.00 0.00 C ATOM 281 O VAL A 443 0.816 2.516 3.960 1.00 0.00 O ATOM 282 CB VAL A 443 -0.737 3.578 1.481 1.00 0.00 C ATOM 283 CG1 VAL A 443 -0.807 5.112 1.477 1.00 0.00 C ATOM 284 CG2 VAL A 443 -1.399 3.101 0.185 1.00 0.00 C ATOM 0 H VAL A 443 0.438 1.039 2.028 1.00 0.00 H new ATOM 0 HA VAL A 443 1.345 3.634 0.945 1.00 0.00 H new ATOM 0 HB VAL A 443 -1.266 3.165 2.340 1.00 0.00 H new ATOM 0 HG11 VAL A 443 -1.844 5.429 1.367 1.00 0.00 H new ATOM 0 HG12 VAL A 443 -0.408 5.497 2.415 1.00 0.00 H new ATOM 0 HG13 VAL A 443 -0.219 5.501 0.646 1.00 0.00 H new ATOM 0 HG21 VAL A 443 -2.417 3.488 0.133 1.00 0.00 H new ATOM 0 HG22 VAL A 443 -0.828 3.464 -0.670 1.00 0.00 H new ATOM 0 HG23 VAL A 443 -1.424 2.011 0.169 1.00 0.00 H new ATOM 294 N THR A 444 1.941 4.357 3.303 1.00 0.00 N ATOM 295 CA THR A 444 2.496 4.735 4.614 1.00 0.00 C ATOM 296 C THR A 444 2.149 6.192 4.914 1.00 0.00 C ATOM 297 O THR A 444 2.208 7.042 4.023 1.00 0.00 O ATOM 298 CB THR A 444 4.023 4.541 4.650 1.00 0.00 C ATOM 299 OG1 THR A 444 4.393 3.279 4.136 1.00 0.00 O ATOM 300 CG2 THR A 444 4.590 4.595 6.068 1.00 0.00 C ATOM 0 H THR A 444 2.201 5.008 2.562 1.00 0.00 H new ATOM 0 HA THR A 444 2.057 4.088 5.373 1.00 0.00 H new ATOM 0 HB THR A 444 4.423 5.357 4.048 1.00 0.00 H new ATOM 0 HG1 THR A 444 5.368 3.185 4.170 1.00 0.00 H new ATOM 0 HG21 THR A 444 5.670 4.452 6.034 1.00 0.00 H new ATOM 0 HG22 THR A 444 4.366 5.565 6.513 1.00 0.00 H new ATOM 0 HG23 THR A 444 4.139 3.807 6.670 1.00 0.00 H new ATOM 308 N PHE A 445 1.759 6.491 6.153 1.00 0.00 N ATOM 309 CA PHE A 445 1.184 7.784 6.548 1.00 0.00 C ATOM 310 C PHE A 445 1.310 8.045 8.067 1.00 0.00 C ATOM 311 O PHE A 445 1.453 7.094 8.845 1.00 0.00 O ATOM 312 CB PHE A 445 -0.303 7.800 6.124 1.00 0.00 C ATOM 313 CG PHE A 445 -1.049 6.496 6.376 1.00 0.00 C ATOM 314 CD1 PHE A 445 -1.386 6.108 7.685 1.00 0.00 C ATOM 315 CD2 PHE A 445 -1.331 5.623 5.305 1.00 0.00 C ATOM 316 CE1 PHE A 445 -1.969 4.855 7.927 1.00 0.00 C ATOM 317 CE2 PHE A 445 -1.916 4.366 5.544 1.00 0.00 C ATOM 318 CZ PHE A 445 -2.230 3.980 6.858 1.00 0.00 C ATOM 0 H PHE A 445 1.834 5.831 6.927 1.00 0.00 H new ATOM 0 HA PHE A 445 1.738 8.579 6.050 1.00 0.00 H new ATOM 0 HB2 PHE A 445 -0.811 8.603 6.658 1.00 0.00 H new ATOM 0 HB3 PHE A 445 -0.362 8.037 5.062 1.00 0.00 H new ATOM 0 HD1 PHE A 445 -1.195 6.779 8.509 1.00 0.00 H new ATOM 0 HD2 PHE A 445 -1.096 5.922 4.294 1.00 0.00 H new ATOM 0 HE1 PHE A 445 -2.218 4.562 8.936 1.00 0.00 H new ATOM 0 HE2 PHE A 445 -2.123 3.700 4.720 1.00 0.00 H new ATOM 0 HZ PHE A 445 -2.671 3.012 7.047 1.00 0.00 H new ATOM 328 N PRO A 446 1.242 9.314 8.524 1.00 0.00 N ATOM 329 CA PRO A 446 1.107 9.651 9.945 1.00 0.00 C ATOM 330 C PRO A 446 -0.110 8.961 10.585 1.00 0.00 C ATOM 331 O PRO A 446 -1.171 8.876 9.964 1.00 0.00 O ATOM 332 CB PRO A 446 0.955 11.178 9.998 1.00 0.00 C ATOM 333 CG PRO A 446 1.586 11.659 8.693 1.00 0.00 C ATOM 334 CD PRO A 446 1.284 10.526 7.716 1.00 0.00 C ATOM 0 HA PRO A 446 1.974 9.307 10.508 1.00 0.00 H new ATOM 0 HB2 PRO A 446 -0.092 11.472 10.067 1.00 0.00 H new ATOM 0 HB3 PRO A 446 1.463 11.600 10.866 1.00 0.00 H new ATOM 0 HG2 PRO A 446 1.153 12.602 8.361 1.00 0.00 H new ATOM 0 HG3 PRO A 446 2.658 11.821 8.801 1.00 0.00 H new ATOM 0 HD2 PRO A 446 0.335 10.690 7.206 1.00 0.00 H new ATOM 0 HD3 PRO A 446 2.052 10.457 6.946 1.00 0.00 H new ATOM 342 N LYS A 447 0.006 8.514 11.844 1.00 0.00 N ATOM 343 CA LYS A 447 -1.058 7.778 12.568 1.00 0.00 C ATOM 344 C LYS A 447 -2.407 8.511 12.679 1.00 0.00 C ATOM 345 O LYS A 447 -3.441 7.871 12.867 1.00 0.00 O ATOM 346 CB LYS A 447 -0.545 7.321 13.947 1.00 0.00 C ATOM 347 CG LYS A 447 -0.233 8.476 14.916 1.00 0.00 C ATOM 348 CD LYS A 447 0.321 7.935 16.245 1.00 0.00 C ATOM 349 CE LYS A 447 0.739 9.054 17.211 1.00 0.00 C ATOM 350 NZ LYS A 447 -0.425 9.807 17.749 1.00 0.00 N ATOM 0 H LYS A 447 0.849 8.652 12.401 1.00 0.00 H new ATOM 0 HA LYS A 447 -1.282 6.908 11.951 1.00 0.00 H new ATOM 0 HB2 LYS A 447 -1.291 6.670 14.403 1.00 0.00 H new ATOM 0 HB3 LYS A 447 0.356 6.724 13.808 1.00 0.00 H new ATOM 0 HG2 LYS A 447 0.492 9.152 14.462 1.00 0.00 H new ATOM 0 HG3 LYS A 447 -1.137 9.056 15.102 1.00 0.00 H new ATOM 0 HD2 LYS A 447 -0.435 7.312 16.722 1.00 0.00 H new ATOM 0 HD3 LYS A 447 1.180 7.295 16.043 1.00 0.00 H new ATOM 0 HE2 LYS A 447 1.303 8.623 18.039 1.00 0.00 H new ATOM 0 HE3 LYS A 447 1.407 9.744 16.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 447 -0.089 10.550 18.395 1.00 0.00 H new ATOM 0 HZ2 LYS A 447 -0.950 10.242 16.964 1.00 0.00 H new ATOM 0 HZ3 LYS A 447 -1.051 9.156 18.265 1.00 0.00 H new ATOM 364 N GLU A 448 -2.406 9.836 12.534 1.00 0.00 N ATOM 365 CA GLU A 448 -3.609 10.683 12.504 1.00 0.00 C ATOM 366 C GLU A 448 -4.523 10.433 11.285 1.00 0.00 C ATOM 367 O GLU A 448 -5.712 10.762 11.337 1.00 0.00 O ATOM 368 CB GLU A 448 -3.195 12.164 12.539 1.00 0.00 C ATOM 369 CG GLU A 448 -2.464 12.545 13.835 1.00 0.00 C ATOM 370 CD GLU A 448 -2.159 14.056 13.873 1.00 0.00 C ATOM 371 OE1 GLU A 448 -1.085 14.477 13.376 1.00 0.00 O ATOM 372 OE2 GLU A 448 -2.986 14.836 14.408 1.00 0.00 O ATOM 0 H GLU A 448 -1.544 10.371 12.431 1.00 0.00 H new ATOM 0 HA GLU A 448 -4.193 10.417 13.385 1.00 0.00 H new ATOM 0 HB2 GLU A 448 -2.550 12.377 11.687 1.00 0.00 H new ATOM 0 HB3 GLU A 448 -4.082 12.788 12.430 1.00 0.00 H new ATOM 0 HG2 GLU A 448 -3.075 12.272 14.695 1.00 0.00 H new ATOM 0 HG3 GLU A 448 -1.535 11.981 13.912 1.00 0.00 H new ATOM 379 N TRP A 449 -4.006 9.844 10.197 1.00 0.00 N ATOM 380 CA TRP A 449 -4.805 9.424 9.036 1.00 0.00 C ATOM 381 C TRP A 449 -5.799 8.309 9.389 1.00 0.00 C ATOM 382 O TRP A 449 -5.539 7.475 10.263 1.00 0.00 O ATOM 383 CB TRP A 449 -3.887 8.944 7.901 1.00 0.00 C ATOM 384 CG TRP A 449 -3.263 10.017 7.060 1.00 0.00 C ATOM 385 CD1 TRP A 449 -2.491 11.035 7.504 1.00 0.00 C ATOM 386 CD2 TRP A 449 -3.367 10.198 5.613 1.00 0.00 C ATOM 387 NE1 TRP A 449 -2.130 11.843 6.442 1.00 0.00 N ATOM 388 CE2 TRP A 449 -2.654 11.380 5.253 1.00 0.00 C ATOM 389 CE3 TRP A 449 -4.005 9.489 4.570 1.00 0.00 C ATOM 390 CZ2 TRP A 449 -2.597 11.851 3.931 1.00 0.00 C ATOM 391 CZ3 TRP A 449 -3.955 9.951 3.242 1.00 0.00 C ATOM 392 CH2 TRP A 449 -3.256 11.130 2.920 1.00 0.00 C ATOM 0 H TRP A 449 -3.011 9.644 10.097 1.00 0.00 H new ATOM 0 HA TRP A 449 -5.375 10.295 8.711 1.00 0.00 H new ATOM 0 HB2 TRP A 449 -3.090 8.342 8.336 1.00 0.00 H new ATOM 0 HB3 TRP A 449 -4.463 8.288 7.248 1.00 0.00 H new ATOM 0 HD1 TRP A 449 -2.201 11.193 8.532 1.00 0.00 H new ATOM 0 HE1 TRP A 449 -1.549 12.677 6.527 1.00 0.00 H new ATOM 0 HE3 TRP A 449 -4.539 8.578 4.796 1.00 0.00 H new ATOM 0 HZ2 TRP A 449 -2.054 12.754 3.694 1.00 0.00 H new ATOM 0 HZ3 TRP A 449 -4.457 9.397 2.463 1.00 0.00 H new ATOM 0 HH2 TRP A 449 -3.226 11.480 1.899 1.00 0.00 H new ATOM 403 N LYS A 450 -6.915 8.257 8.652 1.00 0.00 N ATOM 404 CA LYS A 450 -7.982 7.248 8.770 1.00 0.00 C ATOM 405 C LYS A 450 -8.405 6.695 7.404 1.00 0.00 C ATOM 406 O LYS A 450 -8.026 7.231 6.360 1.00 0.00 O ATOM 407 CB LYS A 450 -9.180 7.837 9.534 1.00 0.00 C ATOM 408 CG LYS A 450 -8.780 8.438 10.893 1.00 0.00 C ATOM 409 CD LYS A 450 -9.938 8.340 11.883 1.00 0.00 C ATOM 410 CE LYS A 450 -9.634 9.168 13.135 1.00 0.00 C ATOM 411 NZ LYS A 450 -10.618 8.906 14.214 1.00 0.00 N ATOM 0 H LYS A 450 -7.110 8.945 7.925 1.00 0.00 H new ATOM 0 HA LYS A 450 -7.588 6.404 9.336 1.00 0.00 H new ATOM 0 HB2 LYS A 450 -9.651 8.608 8.925 1.00 0.00 H new ATOM 0 HB3 LYS A 450 -9.925 7.057 9.691 1.00 0.00 H new ATOM 0 HG2 LYS A 450 -7.911 7.912 11.288 1.00 0.00 H new ATOM 0 HG3 LYS A 450 -8.491 9.481 10.765 1.00 0.00 H new ATOM 0 HD2 LYS A 450 -10.856 8.696 11.416 1.00 0.00 H new ATOM 0 HD3 LYS A 450 -10.104 7.298 12.158 1.00 0.00 H new ATOM 0 HE2 LYS A 450 -8.631 8.935 13.492 1.00 0.00 H new ATOM 0 HE3 LYS A 450 -9.644 10.228 12.882 1.00 0.00 H new ATOM 0 HZ1 LYS A 450 -10.382 9.483 15.047 1.00 0.00 H new ATOM 0 HZ2 LYS A 450 -11.572 9.152 13.881 1.00 0.00 H new ATOM 0 HZ3 LYS A 450 -10.591 7.899 14.472 1.00 0.00 H new ATOM 425 N THR A 451 -9.244 5.659 7.400 1.00 0.00 N ATOM 426 CA THR A 451 -9.865 5.064 6.200 1.00 0.00 C ATOM 427 C THR A 451 -10.536 6.116 5.306 1.00 0.00 C ATOM 428 O THR A 451 -10.465 6.024 4.083 1.00 0.00 O ATOM 429 CB THR A 451 -10.908 4.003 6.600 1.00 0.00 C ATOM 430 OG1 THR A 451 -10.453 3.203 7.673 1.00 0.00 O ATOM 431 CG2 THR A 451 -11.253 3.054 5.454 1.00 0.00 C ATOM 0 H THR A 451 -9.525 5.188 8.260 1.00 0.00 H new ATOM 0 HA THR A 451 -9.060 4.600 5.631 1.00 0.00 H new ATOM 0 HB THR A 451 -11.792 4.573 6.887 1.00 0.00 H new ATOM 0 HG1 THR A 451 -11.139 2.542 7.902 1.00 0.00 H new ATOM 0 HG21 THR A 451 -11.992 2.328 5.793 1.00 0.00 H new ATOM 0 HG22 THR A 451 -11.661 3.624 4.619 1.00 0.00 H new ATOM 0 HG23 THR A 451 -10.353 2.531 5.131 1.00 0.00 H new ATOM 439 N SER A 452 -11.126 7.161 5.895 1.00 0.00 N ATOM 440 CA SER A 452 -11.708 8.297 5.168 1.00 0.00 C ATOM 441 C SER A 452 -10.680 9.114 4.374 1.00 0.00 C ATOM 442 O SER A 452 -10.917 9.437 3.210 1.00 0.00 O ATOM 443 CB SER A 452 -12.390 9.246 6.152 1.00 0.00 C ATOM 444 OG SER A 452 -13.462 8.604 6.829 1.00 0.00 O ATOM 0 H SER A 452 -11.215 7.244 6.908 1.00 0.00 H new ATOM 0 HA SER A 452 -12.414 7.864 4.460 1.00 0.00 H new ATOM 0 HB2 SER A 452 -11.661 9.605 6.879 1.00 0.00 H new ATOM 0 HB3 SER A 452 -12.765 10.119 5.618 1.00 0.00 H new ATOM 0 HG SER A 452 -13.879 9.234 7.453 1.00 0.00 H new ATOM 450 N ASP A 453 -9.523 9.427 4.968 1.00 0.00 N ATOM 451 CA ASP A 453 -8.423 10.122 4.281 1.00 0.00 C ATOM 452 C ASP A 453 -7.830 9.259 3.158 1.00 0.00 C ATOM 453 O ASP A 453 -7.396 9.774 2.128 1.00 0.00 O ATOM 454 CB ASP A 453 -7.306 10.486 5.270 1.00 0.00 C ATOM 455 CG ASP A 453 -7.801 11.342 6.441 1.00 0.00 C ATOM 456 OD1 ASP A 453 -8.125 12.536 6.234 1.00 0.00 O ATOM 457 OD2 ASP A 453 -7.859 10.810 7.575 1.00 0.00 O ATOM 0 H ASP A 453 -9.320 9.205 5.943 1.00 0.00 H new ATOM 0 HA ASP A 453 -8.840 11.031 3.848 1.00 0.00 H new ATOM 0 HB2 ASP A 453 -6.860 9.571 5.659 1.00 0.00 H new ATOM 0 HB3 ASP A 453 -6.520 11.024 4.740 1.00 0.00 H new ATOM 462 N LEU A 454 -7.861 7.936 3.338 1.00 0.00 N ATOM 463 CA LEU A 454 -7.411 6.967 2.337 1.00 0.00 C ATOM 464 C LEU A 454 -8.391 6.878 1.155 1.00 0.00 C ATOM 465 O LEU A 454 -7.971 6.984 0.002 1.00 0.00 O ATOM 466 CB LEU A 454 -7.178 5.604 3.018 1.00 0.00 C ATOM 467 CG LEU A 454 -5.948 5.561 3.943 1.00 0.00 C ATOM 468 CD1 LEU A 454 -5.942 4.247 4.727 1.00 0.00 C ATOM 469 CD2 LEU A 454 -4.635 5.656 3.159 1.00 0.00 C ATOM 0 H LEU A 454 -8.204 7.503 4.195 1.00 0.00 H new ATOM 0 HA LEU A 454 -6.465 7.301 1.911 1.00 0.00 H new ATOM 0 HB2 LEU A 454 -8.064 5.344 3.598 1.00 0.00 H new ATOM 0 HB3 LEU A 454 -7.066 4.841 2.248 1.00 0.00 H new ATOM 0 HG LEU A 454 -6.017 6.419 4.612 1.00 0.00 H new ATOM 0 HD11 LEU A 454 -5.071 4.218 5.381 1.00 0.00 H new ATOM 0 HD12 LEU A 454 -6.849 4.177 5.327 1.00 0.00 H new ATOM 0 HD13 LEU A 454 -5.902 3.409 4.032 1.00 0.00 H new ATOM 0 HD21 LEU A 454 -3.794 5.622 3.852 1.00 0.00 H new ATOM 0 HD22 LEU A 454 -4.566 4.820 2.463 1.00 0.00 H new ATOM 0 HD23 LEU A 454 -4.610 6.594 2.604 1.00 0.00 H new ATOM 481 N TYR A 455 -9.702 6.795 1.408 1.00 0.00 N ATOM 482 CA TYR A 455 -10.724 6.917 0.358 1.00 0.00 C ATOM 483 C TYR A 455 -10.653 8.263 -0.383 1.00 0.00 C ATOM 484 O TYR A 455 -10.841 8.292 -1.599 1.00 0.00 O ATOM 485 CB TYR A 455 -12.130 6.666 0.928 1.00 0.00 C ATOM 486 CG TYR A 455 -12.614 5.242 0.722 1.00 0.00 C ATOM 487 CD1 TYR A 455 -12.251 4.230 1.630 1.00 0.00 C ATOM 488 CD2 TYR A 455 -13.401 4.920 -0.403 1.00 0.00 C ATOM 489 CE1 TYR A 455 -12.672 2.901 1.420 1.00 0.00 C ATOM 490 CE2 TYR A 455 -13.826 3.594 -0.617 1.00 0.00 C ATOM 491 CZ TYR A 455 -13.459 2.579 0.294 1.00 0.00 C ATOM 492 OH TYR A 455 -13.854 1.292 0.094 1.00 0.00 O ATOM 0 H TYR A 455 -10.085 6.642 2.341 1.00 0.00 H new ATOM 0 HA TYR A 455 -10.512 6.145 -0.382 1.00 0.00 H new ATOM 0 HB2 TYR A 455 -12.128 6.891 1.994 1.00 0.00 H new ATOM 0 HB3 TYR A 455 -12.833 7.353 0.458 1.00 0.00 H new ATOM 0 HD1 TYR A 455 -11.647 4.473 2.492 1.00 0.00 H new ATOM 0 HD2 TYR A 455 -13.679 5.693 -1.104 1.00 0.00 H new ATOM 0 HE1 TYR A 455 -12.392 2.129 2.121 1.00 0.00 H new ATOM 0 HE2 TYR A 455 -14.432 3.354 -1.478 1.00 0.00 H new ATOM 0 HH TYR A 455 -14.390 1.238 -0.725 1.00 0.00 H new ATOM 502 N GLN A 456 -10.331 9.364 0.306 1.00 0.00 N ATOM 503 CA GLN A 456 -10.114 10.675 -0.318 1.00 0.00 C ATOM 504 C GLN A 456 -8.844 10.719 -1.193 1.00 0.00 C ATOM 505 O GLN A 456 -8.875 11.310 -2.275 1.00 0.00 O ATOM 506 CB GLN A 456 -10.089 11.755 0.781 1.00 0.00 C ATOM 507 CG GLN A 456 -9.901 13.194 0.268 1.00 0.00 C ATOM 508 CD GLN A 456 -11.017 13.660 -0.669 1.00 0.00 C ATOM 509 OE1 GLN A 456 -12.031 14.206 -0.253 1.00 0.00 O ATOM 510 NE2 GLN A 456 -10.877 13.466 -1.964 1.00 0.00 N ATOM 0 H GLN A 456 -10.213 9.371 1.319 1.00 0.00 H new ATOM 0 HA GLN A 456 -10.941 10.871 -1.001 1.00 0.00 H new ATOM 0 HB2 GLN A 456 -11.022 11.703 1.343 1.00 0.00 H new ATOM 0 HB3 GLN A 456 -9.284 11.525 1.479 1.00 0.00 H new ATOM 0 HG2 GLN A 456 -9.847 13.871 1.121 1.00 0.00 H new ATOM 0 HG3 GLN A 456 -8.947 13.263 -0.254 1.00 0.00 H new ATOM 0 HE21 GLN A 456 -10.037 13.012 -2.324 1.00 0.00 H new ATOM 0 HE22 GLN A 456 -11.608 13.769 -2.607 1.00 0.00 H new ATOM 519 N LEU A 457 -7.744 10.084 -0.767 1.00 0.00 N ATOM 520 CA LEU A 457 -6.467 10.041 -1.495 1.00 0.00 C ATOM 521 C LEU A 457 -6.583 9.266 -2.817 1.00 0.00 C ATOM 522 O LEU A 457 -6.061 9.702 -3.845 1.00 0.00 O ATOM 523 CB LEU A 457 -5.399 9.427 -0.563 1.00 0.00 C ATOM 524 CG LEU A 457 -4.029 9.145 -1.212 1.00 0.00 C ATOM 525 CD1 LEU A 457 -3.380 10.403 -1.787 1.00 0.00 C ATOM 526 CD2 LEU A 457 -3.071 8.550 -0.179 1.00 0.00 C ATOM 0 H LEU A 457 -7.716 9.573 0.115 1.00 0.00 H new ATOM 0 HA LEU A 457 -6.174 11.054 -1.771 1.00 0.00 H new ATOM 0 HB2 LEU A 457 -5.249 10.100 0.281 1.00 0.00 H new ATOM 0 HB3 LEU A 457 -5.789 8.492 -0.160 1.00 0.00 H new ATOM 0 HG LEU A 457 -4.213 8.446 -2.028 1.00 0.00 H new ATOM 0 HD11 LEU A 457 -2.418 10.146 -2.231 1.00 0.00 H new ATOM 0 HD12 LEU A 457 -4.030 10.831 -2.551 1.00 0.00 H new ATOM 0 HD13 LEU A 457 -3.228 11.131 -0.990 1.00 0.00 H new ATOM 0 HD21 LEU A 457 -2.106 8.355 -0.647 1.00 0.00 H new ATOM 0 HD22 LEU A 457 -2.939 9.254 0.643 1.00 0.00 H new ATOM 0 HD23 LEU A 457 -3.484 7.617 0.205 1.00 0.00 H new ATOM 538 N PHE A 458 -7.311 8.147 -2.803 1.00 0.00 N ATOM 539 CA PHE A 458 -7.489 7.266 -3.968 1.00 0.00 C ATOM 540 C PHE A 458 -8.831 7.484 -4.706 1.00 0.00 C ATOM 541 O PHE A 458 -9.171 6.732 -5.623 1.00 0.00 O ATOM 542 CB PHE A 458 -7.249 5.810 -3.538 1.00 0.00 C ATOM 543 CG PHE A 458 -5.817 5.510 -3.124 1.00 0.00 C ATOM 544 CD1 PHE A 458 -4.854 5.199 -4.103 1.00 0.00 C ATOM 545 CD2 PHE A 458 -5.435 5.539 -1.770 1.00 0.00 C ATOM 546 CE1 PHE A 458 -3.522 4.944 -3.738 1.00 0.00 C ATOM 547 CE2 PHE A 458 -4.102 5.288 -1.402 1.00 0.00 C ATOM 548 CZ PHE A 458 -3.145 4.993 -2.386 1.00 0.00 C ATOM 0 H PHE A 458 -7.802 7.819 -1.971 1.00 0.00 H new ATOM 0 HA PHE A 458 -6.743 7.528 -4.719 1.00 0.00 H new ATOM 0 HB2 PHE A 458 -7.913 5.575 -2.706 1.00 0.00 H new ATOM 0 HB3 PHE A 458 -7.523 5.150 -4.361 1.00 0.00 H new ATOM 0 HD1 PHE A 458 -5.142 5.156 -5.143 1.00 0.00 H new ATOM 0 HD2 PHE A 458 -6.170 5.755 -1.009 1.00 0.00 H new ATOM 0 HE1 PHE A 458 -2.789 4.711 -4.496 1.00 0.00 H new ATOM 0 HE2 PHE A 458 -3.814 5.322 -0.362 1.00 0.00 H new ATOM 0 HZ PHE A 458 -2.120 4.804 -2.104 1.00 0.00 H new ATOM 558 N SER A 459 -9.579 8.542 -4.360 1.00 0.00 N ATOM 559 CA SER A 459 -10.861 8.927 -4.986 1.00 0.00 C ATOM 560 C SER A 459 -10.773 9.103 -6.512 1.00 0.00 C ATOM 561 O SER A 459 -11.717 8.782 -7.240 1.00 0.00 O ATOM 562 CB SER A 459 -11.369 10.226 -4.343 1.00 0.00 C ATOM 563 OG SER A 459 -12.683 10.536 -4.779 1.00 0.00 O ATOM 0 H SER A 459 -9.302 9.177 -3.612 1.00 0.00 H new ATOM 0 HA SER A 459 -11.557 8.107 -4.811 1.00 0.00 H new ATOM 0 HB2 SER A 459 -11.358 10.126 -3.258 1.00 0.00 H new ATOM 0 HB3 SER A 459 -10.697 11.046 -4.595 1.00 0.00 H new ATOM 0 HG SER A 459 -12.982 11.366 -4.353 1.00 0.00 H new ATOM 569 N ALA A 460 -9.608 9.536 -7.016 1.00 0.00 N ATOM 570 CA ALA A 460 -9.302 9.697 -8.441 1.00 0.00 C ATOM 571 C ALA A 460 -9.438 8.410 -9.291 1.00 0.00 C ATOM 572 O ALA A 460 -9.483 8.491 -10.523 1.00 0.00 O ATOM 573 CB ALA A 460 -7.885 10.277 -8.550 1.00 0.00 C ATOM 0 H ALA A 460 -8.824 9.793 -6.417 1.00 0.00 H new ATOM 0 HA ALA A 460 -10.050 10.369 -8.861 1.00 0.00 H new ATOM 0 HB1 ALA A 460 -7.626 10.409 -9.600 1.00 0.00 H new ATOM 0 HB2 ALA A 460 -7.846 11.241 -8.042 1.00 0.00 H new ATOM 0 HB3 ALA A 460 -7.175 9.593 -8.085 1.00 0.00 H new ATOM 579 N PHE A 461 -9.531 7.235 -8.656 1.00 0.00 N ATOM 580 CA PHE A 461 -9.612 5.921 -9.310 1.00 0.00 C ATOM 581 C PHE A 461 -11.018 5.282 -9.252 1.00 0.00 C ATOM 582 O PHE A 461 -11.227 4.187 -9.780 1.00 0.00 O ATOM 583 CB PHE A 461 -8.517 5.027 -8.708 1.00 0.00 C ATOM 584 CG PHE A 461 -7.118 5.618 -8.808 1.00 0.00 C ATOM 585 CD1 PHE A 461 -6.581 5.981 -10.061 1.00 0.00 C ATOM 586 CD2 PHE A 461 -6.360 5.839 -7.644 1.00 0.00 C ATOM 587 CE1 PHE A 461 -5.290 6.532 -10.148 1.00 0.00 C ATOM 588 CE2 PHE A 461 -5.071 6.398 -7.730 1.00 0.00 C ATOM 589 CZ PHE A 461 -4.533 6.735 -8.983 1.00 0.00 C ATOM 0 H PHE A 461 -9.553 7.170 -7.638 1.00 0.00 H new ATOM 0 HA PHE A 461 -9.438 6.045 -10.379 1.00 0.00 H new ATOM 0 HB2 PHE A 461 -8.749 4.841 -7.659 1.00 0.00 H new ATOM 0 HB3 PHE A 461 -8.530 4.061 -9.214 1.00 0.00 H new ATOM 0 HD1 PHE A 461 -7.164 5.835 -10.958 1.00 0.00 H new ATOM 0 HD2 PHE A 461 -6.769 5.578 -6.679 1.00 0.00 H new ATOM 0 HE1 PHE A 461 -4.881 6.799 -11.111 1.00 0.00 H new ATOM 0 HE2 PHE A 461 -4.495 6.568 -6.832 1.00 0.00 H new ATOM 0 HZ PHE A 461 -3.538 7.150 -9.050 1.00 0.00 H new ATOM 599 N GLY A 462 -11.997 5.968 -8.648 1.00 0.00 N ATOM 600 CA GLY A 462 -13.431 5.641 -8.679 1.00 0.00 C ATOM 601 C GLY A 462 -13.885 4.532 -7.718 1.00 0.00 C ATOM 602 O GLY A 462 -14.867 4.716 -6.995 1.00 0.00 O ATOM 0 H GLY A 462 -11.803 6.805 -8.099 1.00 0.00 H new ATOM 0 HA2 GLY A 462 -13.996 6.545 -8.452 1.00 0.00 H new ATOM 0 HA3 GLY A 462 -13.695 5.346 -9.695 1.00 0.00 H new ATOM 606 N ASN A 463 -13.170 3.404 -7.676 1.00 0.00 N ATOM 607 CA ASN A 463 -13.458 2.244 -6.820 1.00 0.00 C ATOM 608 C ASN A 463 -12.151 1.592 -6.333 1.00 0.00 C ATOM 609 O ASN A 463 -11.201 1.435 -7.107 1.00 0.00 O ATOM 610 CB ASN A 463 -14.306 1.224 -7.605 1.00 0.00 C ATOM 611 CG ASN A 463 -15.737 1.685 -7.831 1.00 0.00 C ATOM 612 OD1 ASN A 463 -16.548 1.744 -6.915 1.00 0.00 O ATOM 613 ND2 ASN A 463 -16.105 2.010 -9.052 1.00 0.00 N ATOM 0 H ASN A 463 -12.344 3.266 -8.258 1.00 0.00 H new ATOM 0 HA ASN A 463 -14.016 2.578 -5.945 1.00 0.00 H new ATOM 0 HB2 ASN A 463 -13.835 1.035 -8.570 1.00 0.00 H new ATOM 0 HB3 ASN A 463 -14.317 0.277 -7.065 1.00 0.00 H new ATOM 0 HD21 ASN A 463 -17.063 2.310 -9.233 1.00 0.00 H new ATOM 0 HD22 ASN A 463 -15.432 1.962 -9.817 1.00 0.00 H new ATOM 620 N ILE A 464 -12.113 1.213 -5.050 1.00 0.00 N ATOM 621 CA ILE A 464 -10.919 0.711 -4.342 1.00 0.00 C ATOM 622 C ILE A 464 -11.283 -0.348 -3.283 1.00 0.00 C ATOM 623 O ILE A 464 -12.461 -0.582 -2.996 1.00 0.00 O ATOM 624 CB ILE A 464 -10.137 1.881 -3.676 1.00 0.00 C ATOM 625 CG1 ILE A 464 -10.873 2.490 -2.457 1.00 0.00 C ATOM 626 CG2 ILE A 464 -9.780 2.980 -4.690 1.00 0.00 C ATOM 627 CD1 ILE A 464 -10.075 3.579 -1.729 1.00 0.00 C ATOM 0 H ILE A 464 -12.938 1.247 -4.452 1.00 0.00 H new ATOM 0 HA ILE A 464 -10.282 0.236 -5.088 1.00 0.00 H new ATOM 0 HB ILE A 464 -9.213 1.439 -3.304 1.00 0.00 H new ATOM 0 HG12 ILE A 464 -11.822 2.910 -2.791 1.00 0.00 H new ATOM 0 HG13 ILE A 464 -11.108 1.693 -1.752 1.00 0.00 H new ATOM 0 HG21 ILE A 464 -9.235 3.778 -4.185 1.00 0.00 H new ATOM 0 HG22 ILE A 464 -9.158 2.559 -5.479 1.00 0.00 H new ATOM 0 HG23 ILE A 464 -10.694 3.384 -5.125 1.00 0.00 H new ATOM 0 HD11 ILE A 464 -10.657 3.956 -0.888 1.00 0.00 H new ATOM 0 HD12 ILE A 464 -9.138 3.160 -1.363 1.00 0.00 H new ATOM 0 HD13 ILE A 464 -9.862 4.396 -2.418 1.00 0.00 H new ATOM 639 N GLN A 465 -10.266 -0.946 -2.655 1.00 0.00 N ATOM 640 CA GLN A 465 -10.393 -1.778 -1.448 1.00 0.00 C ATOM 641 C GLN A 465 -9.171 -1.543 -0.545 1.00 0.00 C ATOM 642 O GLN A 465 -8.082 -1.283 -1.057 1.00 0.00 O ATOM 643 CB GLN A 465 -10.534 -3.264 -1.838 1.00 0.00 C ATOM 644 CG GLN A 465 -11.021 -4.180 -0.701 1.00 0.00 C ATOM 645 CD GLN A 465 -12.355 -3.743 -0.096 1.00 0.00 C ATOM 646 OE1 GLN A 465 -12.406 -2.980 0.861 1.00 0.00 O ATOM 647 NE2 GLN A 465 -13.475 -4.192 -0.623 1.00 0.00 N ATOM 0 H GLN A 465 -9.302 -0.864 -2.979 1.00 0.00 H new ATOM 0 HA GLN A 465 -11.291 -1.500 -0.896 1.00 0.00 H new ATOM 0 HB2 GLN A 465 -11.229 -3.343 -2.674 1.00 0.00 H new ATOM 0 HB3 GLN A 465 -9.569 -3.627 -2.191 1.00 0.00 H new ATOM 0 HG2 GLN A 465 -11.119 -5.197 -1.081 1.00 0.00 H new ATOM 0 HG3 GLN A 465 -10.265 -4.205 0.084 1.00 0.00 H new ATOM 0 HE21 GLN A 465 -13.445 -4.828 -1.420 1.00 0.00 H new ATOM 0 HE22 GLN A 465 -14.373 -3.904 -0.234 1.00 0.00 H new ATOM 656 N ILE A 466 -9.329 -1.632 0.778 1.00 0.00 N ATOM 657 CA ILE A 466 -8.285 -1.292 1.764 1.00 0.00 C ATOM 658 C ILE A 466 -8.142 -2.424 2.793 1.00 0.00 C ATOM 659 O ILE A 466 -9.140 -2.944 3.300 1.00 0.00 O ATOM 660 CB ILE A 466 -8.595 0.063 2.457 1.00 0.00 C ATOM 661 CG1 ILE A 466 -8.797 1.196 1.418 1.00 0.00 C ATOM 662 CG2 ILE A 466 -7.475 0.430 3.456 1.00 0.00 C ATOM 663 CD1 ILE A 466 -9.112 2.569 2.024 1.00 0.00 C ATOM 0 H ILE A 466 -10.199 -1.947 1.207 1.00 0.00 H new ATOM 0 HA ILE A 466 -7.335 -1.181 1.241 1.00 0.00 H new ATOM 0 HB ILE A 466 -9.528 -0.050 3.009 1.00 0.00 H new ATOM 0 HG12 ILE A 466 -7.895 1.280 0.811 1.00 0.00 H new ATOM 0 HG13 ILE A 466 -9.608 0.915 0.747 1.00 0.00 H new ATOM 0 HG21 ILE A 466 -7.709 1.382 3.932 1.00 0.00 H new ATOM 0 HG22 ILE A 466 -7.397 -0.347 4.217 1.00 0.00 H new ATOM 0 HG23 ILE A 466 -6.527 0.514 2.925 1.00 0.00 H new ATOM 0 HD11 ILE A 466 -9.237 3.299 1.225 1.00 0.00 H new ATOM 0 HD12 ILE A 466 -10.031 2.507 2.607 1.00 0.00 H new ATOM 0 HD13 ILE A 466 -8.292 2.878 2.672 1.00 0.00 H new ATOM 675 N SER A 467 -6.897 -2.784 3.121 1.00 0.00 N ATOM 676 CA SER A 467 -6.532 -3.803 4.113 1.00 0.00 C ATOM 677 C SER A 467 -5.398 -3.299 5.014 1.00 0.00 C ATOM 678 O SER A 467 -4.235 -3.259 4.606 1.00 0.00 O ATOM 679 CB SER A 467 -6.105 -5.095 3.404 1.00 0.00 C ATOM 680 OG SER A 467 -7.219 -5.762 2.827 1.00 0.00 O ATOM 0 H SER A 467 -6.081 -2.356 2.684 1.00 0.00 H new ATOM 0 HA SER A 467 -7.403 -4.008 4.736 1.00 0.00 H new ATOM 0 HB2 SER A 467 -5.376 -4.862 2.628 1.00 0.00 H new ATOM 0 HB3 SER A 467 -5.612 -5.757 4.116 1.00 0.00 H new ATOM 0 HG SER A 467 -6.915 -6.580 2.381 1.00 0.00 H new ATOM 686 N TRP A 468 -5.732 -2.888 6.240 1.00 0.00 N ATOM 687 CA TRP A 468 -4.763 -2.443 7.250 1.00 0.00 C ATOM 688 C TRP A 468 -3.725 -3.514 7.616 1.00 0.00 C ATOM 689 O TRP A 468 -4.033 -4.711 7.629 1.00 0.00 O ATOM 690 CB TRP A 468 -5.507 -2.044 8.527 1.00 0.00 C ATOM 691 CG TRP A 468 -6.385 -0.834 8.429 1.00 0.00 C ATOM 692 CD1 TRP A 468 -7.731 -0.836 8.319 1.00 0.00 C ATOM 693 CD2 TRP A 468 -5.998 0.569 8.521 1.00 0.00 C ATOM 694 NE1 TRP A 468 -8.194 0.466 8.245 1.00 0.00 N ATOM 695 CE2 TRP A 468 -7.166 1.376 8.375 1.00 0.00 C ATOM 696 CE3 TRP A 468 -4.781 1.238 8.762 1.00 0.00 C ATOM 697 CZ2 TRP A 468 -7.117 2.777 8.408 1.00 0.00 C ATOM 698 CZ3 TRP A 468 -4.733 2.642 8.832 1.00 0.00 C ATOM 699 CH2 TRP A 468 -5.887 3.416 8.627 1.00 0.00 C ATOM 0 H TRP A 468 -6.698 -2.854 6.566 1.00 0.00 H new ATOM 0 HA TRP A 468 -4.228 -1.601 6.812 1.00 0.00 H new ATOM 0 HB2 TRP A 468 -6.120 -2.888 8.844 1.00 0.00 H new ATOM 0 HB3 TRP A 468 -4.771 -1.871 9.313 1.00 0.00 H new ATOM 0 HD1 TRP A 468 -8.352 -1.719 8.293 1.00 0.00 H new ATOM 0 HE1 TRP A 468 -9.173 0.721 8.111 1.00 0.00 H new ATOM 0 HE3 TRP A 468 -3.875 0.666 8.894 1.00 0.00 H new ATOM 0 HZ2 TRP A 468 -8.016 3.358 8.266 1.00 0.00 H new ATOM 0 HZ3 TRP A 468 -3.795 3.132 9.047 1.00 0.00 H new ATOM 0 HH2 TRP A 468 -5.828 4.494 8.638 1.00 0.00 H new ATOM 710 N ILE A 469 -2.522 -3.072 8.004 1.00 0.00 N ATOM 711 CA ILE A 469 -1.464 -3.920 8.576 1.00 0.00 C ATOM 712 C ILE A 469 -0.776 -3.310 9.811 1.00 0.00 C ATOM 713 O ILE A 469 -0.212 -4.051 10.618 1.00 0.00 O ATOM 714 CB ILE A 469 -0.417 -4.290 7.506 1.00 0.00 C ATOM 715 CG1 ILE A 469 0.227 -3.066 6.822 1.00 0.00 C ATOM 716 CG2 ILE A 469 -1.024 -5.247 6.468 1.00 0.00 C ATOM 717 CD1 ILE A 469 1.461 -3.431 5.993 1.00 0.00 C ATOM 0 H ILE A 469 -2.249 -2.092 7.928 1.00 0.00 H new ATOM 0 HA ILE A 469 -1.966 -4.824 8.922 1.00 0.00 H new ATOM 0 HB ILE A 469 0.393 -4.797 8.030 1.00 0.00 H new ATOM 0 HG12 ILE A 469 -0.509 -2.587 6.177 1.00 0.00 H new ATOM 0 HG13 ILE A 469 0.508 -2.337 7.582 1.00 0.00 H new ATOM 0 HG21 ILE A 469 -0.271 -5.498 5.720 1.00 0.00 H new ATOM 0 HG22 ILE A 469 -1.359 -6.157 6.965 1.00 0.00 H new ATOM 0 HG23 ILE A 469 -1.872 -4.766 5.982 1.00 0.00 H new ATOM 0 HD11 ILE A 469 1.871 -2.531 5.536 1.00 0.00 H new ATOM 0 HD12 ILE A 469 2.212 -3.885 6.639 1.00 0.00 H new ATOM 0 HD13 ILE A 469 1.179 -4.138 5.213 1.00 0.00 H new ATOM 729 N ASP A 470 -0.846 -1.989 10.004 1.00 0.00 N ATOM 730 CA ASP A 470 -0.318 -1.286 11.184 1.00 0.00 C ATOM 731 C ASP A 470 -1.092 0.019 11.475 1.00 0.00 C ATOM 732 O ASP A 470 -1.989 0.417 10.728 1.00 0.00 O ATOM 733 CB ASP A 470 1.185 -0.998 10.982 1.00 0.00 C ATOM 734 CG ASP A 470 1.990 -1.121 12.287 1.00 0.00 C ATOM 735 OD1 ASP A 470 1.853 -0.243 13.172 1.00 0.00 O ATOM 736 OD2 ASP A 470 2.765 -2.096 12.438 1.00 0.00 O ATOM 0 H ASP A 470 -1.282 -1.361 9.329 1.00 0.00 H new ATOM 0 HA ASP A 470 -0.451 -1.932 12.052 1.00 0.00 H new ATOM 0 HB2 ASP A 470 1.588 -1.691 10.244 1.00 0.00 H new ATOM 0 HB3 ASP A 470 1.308 0.006 10.577 1.00 0.00 H new ATOM 741 N ASP A 471 -0.708 0.725 12.538 1.00 0.00 N ATOM 742 CA ASP A 471 -1.225 2.058 12.892 1.00 0.00 C ATOM 743 C ASP A 471 -0.797 3.161 11.899 1.00 0.00 C ATOM 744 O ASP A 471 -1.360 4.256 11.915 1.00 0.00 O ATOM 745 CB ASP A 471 -0.754 2.437 14.306 1.00 0.00 C ATOM 746 CG ASP A 471 -1.500 1.663 15.403 1.00 0.00 C ATOM 747 OD1 ASP A 471 -2.653 2.046 15.721 1.00 0.00 O ATOM 748 OD2 ASP A 471 -0.922 0.716 15.991 1.00 0.00 O ATOM 0 H ASP A 471 -0.010 0.381 13.198 1.00 0.00 H new ATOM 0 HA ASP A 471 -2.312 1.993 12.850 1.00 0.00 H new ATOM 0 HB2 ASP A 471 0.315 2.244 14.393 1.00 0.00 H new ATOM 0 HB3 ASP A 471 -0.898 3.507 14.459 1.00 0.00 H new ATOM 753 N THR A 472 0.186 2.888 11.034 1.00 0.00 N ATOM 754 CA THR A 472 0.823 3.859 10.120 1.00 0.00 C ATOM 755 C THR A 472 0.962 3.352 8.678 1.00 0.00 C ATOM 756 O THR A 472 1.523 4.057 7.836 1.00 0.00 O ATOM 757 CB THR A 472 2.211 4.273 10.644 1.00 0.00 C ATOM 758 OG1 THR A 472 3.005 3.124 10.888 1.00 0.00 O ATOM 759 CG2 THR A 472 2.123 5.073 11.944 1.00 0.00 C ATOM 0 H THR A 472 0.579 1.951 10.943 1.00 0.00 H new ATOM 0 HA THR A 472 0.153 4.718 10.097 1.00 0.00 H new ATOM 0 HB THR A 472 2.661 4.900 9.874 1.00 0.00 H new ATOM 0 HG1 THR A 472 3.885 3.399 11.219 1.00 0.00 H new ATOM 0 HG21 THR A 472 3.126 5.342 12.274 1.00 0.00 H new ATOM 0 HG22 THR A 472 1.541 5.979 11.775 1.00 0.00 H new ATOM 0 HG23 THR A 472 1.639 4.469 12.711 1.00 0.00 H new ATOM 767 N SER A 473 0.451 2.153 8.358 1.00 0.00 N ATOM 768 CA SER A 473 0.429 1.642 6.980 1.00 0.00 C ATOM 769 C SER A 473 -0.679 0.619 6.688 1.00 0.00 C ATOM 770 O SER A 473 -1.201 -0.060 7.581 1.00 0.00 O ATOM 771 CB SER A 473 1.798 1.067 6.583 1.00 0.00 C ATOM 772 OG SER A 473 2.163 -0.062 7.358 1.00 0.00 O ATOM 0 H SER A 473 0.044 1.515 9.042 1.00 0.00 H new ATOM 0 HA SER A 473 0.197 2.512 6.365 1.00 0.00 H new ATOM 0 HB2 SER A 473 1.779 0.788 5.529 1.00 0.00 H new ATOM 0 HB3 SER A 473 2.558 1.840 6.694 1.00 0.00 H new ATOM 0 HG SER A 473 3.039 -0.390 7.066 1.00 0.00 H new ATOM 778 N ALA A 474 -1.043 0.523 5.407 1.00 0.00 N ATOM 779 CA ALA A 474 -2.092 -0.347 4.873 1.00 0.00 C ATOM 780 C ALA A 474 -1.832 -0.710 3.396 1.00 0.00 C ATOM 781 O ALA A 474 -1.119 0.003 2.684 1.00 0.00 O ATOM 782 CB ALA A 474 -3.437 0.387 5.007 1.00 0.00 C ATOM 0 H ALA A 474 -0.592 1.077 4.679 1.00 0.00 H new ATOM 0 HA ALA A 474 -2.104 -1.280 5.437 1.00 0.00 H new ATOM 0 HB1 ALA A 474 -4.236 -0.243 4.615 1.00 0.00 H new ATOM 0 HB2 ALA A 474 -3.629 0.605 6.057 1.00 0.00 H new ATOM 0 HB3 ALA A 474 -3.400 1.319 4.444 1.00 0.00 H new ATOM 788 N PHE A 475 -2.446 -1.795 2.921 1.00 0.00 N ATOM 789 CA PHE A 475 -2.514 -2.132 1.497 1.00 0.00 C ATOM 790 C PHE A 475 -3.764 -1.504 0.860 1.00 0.00 C ATOM 791 O PHE A 475 -4.802 -1.371 1.520 1.00 0.00 O ATOM 792 CB PHE A 475 -2.561 -3.654 1.305 1.00 0.00 C ATOM 793 CG PHE A 475 -1.308 -4.408 1.704 1.00 0.00 C ATOM 794 CD1 PHE A 475 -0.096 -4.171 1.028 1.00 0.00 C ATOM 795 CD2 PHE A 475 -1.366 -5.397 2.705 1.00 0.00 C ATOM 796 CE1 PHE A 475 1.053 -4.914 1.352 1.00 0.00 C ATOM 797 CE2 PHE A 475 -0.222 -6.153 3.016 1.00 0.00 C ATOM 798 CZ PHE A 475 0.986 -5.912 2.340 1.00 0.00 C ATOM 0 H PHE A 475 -2.916 -2.473 3.521 1.00 0.00 H new ATOM 0 HA PHE A 475 -1.621 -1.737 1.013 1.00 0.00 H new ATOM 0 HB2 PHE A 475 -3.398 -4.048 1.881 1.00 0.00 H new ATOM 0 HB3 PHE A 475 -2.769 -3.863 0.256 1.00 0.00 H new ATOM 0 HD1 PHE A 475 -0.049 -3.416 0.258 1.00 0.00 H new ATOM 0 HD2 PHE A 475 -2.290 -5.575 3.234 1.00 0.00 H new ATOM 0 HE1 PHE A 475 1.985 -4.718 0.843 1.00 0.00 H new ATOM 0 HE2 PHE A 475 -0.272 -6.920 3.775 1.00 0.00 H new ATOM 0 HZ PHE A 475 1.864 -6.494 2.580 1.00 0.00 H new ATOM 808 N VAL A 476 -3.693 -1.176 -0.434 1.00 0.00 N ATOM 809 CA VAL A 476 -4.802 -0.606 -1.223 1.00 0.00 C ATOM 810 C VAL A 476 -4.858 -1.259 -2.606 1.00 0.00 C ATOM 811 O VAL A 476 -3.894 -1.207 -3.370 1.00 0.00 O ATOM 812 CB VAL A 476 -4.689 0.932 -1.349 1.00 0.00 C ATOM 813 CG1 VAL A 476 -5.849 1.520 -2.167 1.00 0.00 C ATOM 814 CG2 VAL A 476 -4.714 1.615 0.026 1.00 0.00 C ATOM 0 H VAL A 476 -2.841 -1.301 -0.981 1.00 0.00 H new ATOM 0 HA VAL A 476 -5.730 -0.819 -0.693 1.00 0.00 H new ATOM 0 HB VAL A 476 -3.739 1.119 -1.849 1.00 0.00 H new ATOM 0 HG11 VAL A 476 -5.735 2.602 -2.234 1.00 0.00 H new ATOM 0 HG12 VAL A 476 -5.841 1.092 -3.169 1.00 0.00 H new ATOM 0 HG13 VAL A 476 -6.795 1.284 -1.679 1.00 0.00 H new ATOM 0 HG21 VAL A 476 -4.633 2.694 -0.102 1.00 0.00 H new ATOM 0 HG22 VAL A 476 -5.650 1.379 0.532 1.00 0.00 H new ATOM 0 HG23 VAL A 476 -3.877 1.257 0.625 1.00 0.00 H new ATOM 824 N SER A 477 -5.991 -1.878 -2.936 1.00 0.00 N ATOM 825 CA SER A 477 -6.285 -2.444 -4.262 1.00 0.00 C ATOM 826 C SER A 477 -6.938 -1.399 -5.170 1.00 0.00 C ATOM 827 O SER A 477 -7.803 -0.645 -4.716 1.00 0.00 O ATOM 828 CB SER A 477 -7.272 -3.605 -4.118 1.00 0.00 C ATOM 829 OG SER A 477 -6.690 -4.688 -3.409 1.00 0.00 O ATOM 0 H SER A 477 -6.755 -2.006 -2.272 1.00 0.00 H new ATOM 0 HA SER A 477 -5.343 -2.778 -4.697 1.00 0.00 H new ATOM 0 HB2 SER A 477 -8.166 -3.263 -3.596 1.00 0.00 H new ATOM 0 HB3 SER A 477 -7.589 -3.941 -5.105 1.00 0.00 H new ATOM 0 HG SER A 477 -7.342 -5.415 -3.330 1.00 0.00 H new ATOM 835 N LEU A 478 -6.590 -1.410 -6.461 1.00 0.00 N ATOM 836 CA LEU A 478 -7.175 -0.559 -7.510 1.00 0.00 C ATOM 837 C LEU A 478 -7.698 -1.422 -8.677 1.00 0.00 C ATOM 838 O LEU A 478 -7.246 -2.552 -8.881 1.00 0.00 O ATOM 839 CB LEU A 478 -6.128 0.466 -7.999 1.00 0.00 C ATOM 840 CG LEU A 478 -5.556 1.418 -6.928 1.00 0.00 C ATOM 841 CD1 LEU A 478 -4.554 2.377 -7.569 1.00 0.00 C ATOM 842 CD2 LEU A 478 -6.626 2.277 -6.256 1.00 0.00 C ATOM 0 H LEU A 478 -5.867 -2.033 -6.820 1.00 0.00 H new ATOM 0 HA LEU A 478 -8.023 -0.013 -7.095 1.00 0.00 H new ATOM 0 HB2 LEU A 478 -5.299 -0.079 -8.451 1.00 0.00 H new ATOM 0 HB3 LEU A 478 -6.580 1.068 -8.787 1.00 0.00 H new ATOM 0 HG LEU A 478 -5.093 0.779 -6.176 1.00 0.00 H new ATOM 0 HD11 LEU A 478 -4.153 3.047 -6.808 1.00 0.00 H new ATOM 0 HD12 LEU A 478 -3.739 1.807 -8.016 1.00 0.00 H new ATOM 0 HD13 LEU A 478 -5.053 2.962 -8.341 1.00 0.00 H new ATOM 0 HD21 LEU A 478 -6.159 2.924 -5.513 1.00 0.00 H new ATOM 0 HD22 LEU A 478 -7.126 2.888 -7.007 1.00 0.00 H new ATOM 0 HD23 LEU A 478 -7.356 1.632 -5.768 1.00 0.00 H new ATOM 854 N SER A 479 -8.664 -0.905 -9.442 1.00 0.00 N ATOM 855 CA SER A 479 -9.392 -1.668 -10.474 1.00 0.00 C ATOM 856 C SER A 479 -8.556 -2.064 -11.701 1.00 0.00 C ATOM 857 O SER A 479 -8.901 -3.038 -12.375 1.00 0.00 O ATOM 858 CB SER A 479 -10.615 -0.881 -10.961 1.00 0.00 C ATOM 859 OG SER A 479 -11.525 -0.655 -9.894 1.00 0.00 O ATOM 0 H SER A 479 -8.970 0.065 -9.365 1.00 0.00 H new ATOM 0 HA SER A 479 -9.680 -2.593 -9.975 1.00 0.00 H new ATOM 0 HB2 SER A 479 -10.296 0.073 -11.381 1.00 0.00 H new ATOM 0 HB3 SER A 479 -11.113 -1.431 -11.760 1.00 0.00 H new ATOM 0 HG SER A 479 -12.297 -0.150 -10.224 1.00 0.00 H new ATOM 865 N GLN A 480 -7.474 -1.339 -12.010 1.00 0.00 N ATOM 866 CA GLN A 480 -6.607 -1.575 -13.178 1.00 0.00 C ATOM 867 C GLN A 480 -5.123 -1.275 -12.882 1.00 0.00 C ATOM 868 O GLN A 480 -4.821 -0.432 -12.030 1.00 0.00 O ATOM 869 CB GLN A 480 -7.084 -0.701 -14.360 1.00 0.00 C ATOM 870 CG GLN A 480 -8.346 -1.215 -15.071 1.00 0.00 C ATOM 871 CD GLN A 480 -8.137 -2.551 -15.785 1.00 0.00 C ATOM 872 OE1 GLN A 480 -7.675 -2.618 -16.919 1.00 0.00 O ATOM 873 NE2 GLN A 480 -8.460 -3.662 -15.159 1.00 0.00 N ATOM 0 H GLN A 480 -7.166 -0.550 -11.441 1.00 0.00 H new ATOM 0 HA GLN A 480 -6.682 -2.633 -13.431 1.00 0.00 H new ATOM 0 HB2 GLN A 480 -7.275 0.308 -13.994 1.00 0.00 H new ATOM 0 HB3 GLN A 480 -6.277 -0.628 -15.089 1.00 0.00 H new ATOM 0 HG2 GLN A 480 -9.148 -1.323 -14.340 1.00 0.00 H new ATOM 0 HG3 GLN A 480 -8.674 -0.471 -15.797 1.00 0.00 H new ATOM 0 HE21 GLN A 480 -8.845 -3.622 -14.215 1.00 0.00 H new ATOM 0 HE22 GLN A 480 -8.325 -4.563 -15.617 1.00 0.00 H new ATOM 882 N PRO A 481 -4.178 -1.901 -13.615 1.00 0.00 N ATOM 883 CA PRO A 481 -2.742 -1.678 -13.428 1.00 0.00 C ATOM 884 C PRO A 481 -2.280 -0.291 -13.913 1.00 0.00 C ATOM 885 O PRO A 481 -1.269 0.224 -13.438 1.00 0.00 O ATOM 886 CB PRO A 481 -2.057 -2.818 -14.187 1.00 0.00 C ATOM 887 CG PRO A 481 -3.044 -3.152 -15.306 1.00 0.00 C ATOM 888 CD PRO A 481 -4.410 -2.872 -14.680 1.00 0.00 C ATOM 0 HA PRO A 481 -2.479 -1.682 -12.370 1.00 0.00 H new ATOM 0 HB2 PRO A 481 -1.090 -2.510 -14.585 1.00 0.00 H new ATOM 0 HB3 PRO A 481 -1.877 -3.678 -13.542 1.00 0.00 H new ATOM 0 HG2 PRO A 481 -2.874 -2.534 -16.188 1.00 0.00 H new ATOM 0 HG3 PRO A 481 -2.954 -4.191 -15.622 1.00 0.00 H new ATOM 0 HD2 PRO A 481 -5.105 -2.478 -15.422 1.00 0.00 H new ATOM 0 HD3 PRO A 481 -4.852 -3.786 -14.284 1.00 0.00 H new ATOM 896 N GLU A 482 -3.037 0.360 -14.803 1.00 0.00 N ATOM 897 CA GLU A 482 -2.822 1.765 -15.178 1.00 0.00 C ATOM 898 C GLU A 482 -3.003 2.703 -13.969 1.00 0.00 C ATOM 899 O GLU A 482 -2.208 3.616 -13.757 1.00 0.00 O ATOM 900 CB GLU A 482 -3.799 2.130 -16.311 1.00 0.00 C ATOM 901 CG GLU A 482 -3.526 3.491 -16.969 1.00 0.00 C ATOM 902 CD GLU A 482 -2.262 3.463 -17.853 1.00 0.00 C ATOM 903 OE1 GLU A 482 -2.368 3.126 -19.058 1.00 0.00 O ATOM 904 OE2 GLU A 482 -1.155 3.782 -17.357 1.00 0.00 O ATOM 0 H GLU A 482 -3.822 -0.075 -15.288 1.00 0.00 H new ATOM 0 HA GLU A 482 -1.796 1.891 -15.525 1.00 0.00 H new ATOM 0 HB2 GLU A 482 -3.755 1.355 -17.076 1.00 0.00 H new ATOM 0 HB3 GLU A 482 -4.814 2.129 -15.914 1.00 0.00 H new ATOM 0 HG2 GLU A 482 -4.385 3.780 -17.574 1.00 0.00 H new ATOM 0 HG3 GLU A 482 -3.411 4.251 -16.196 1.00 0.00 H new ATOM 911 N GLN A 483 -4.008 2.446 -13.124 1.00 0.00 N ATOM 912 CA GLN A 483 -4.263 3.217 -11.900 1.00 0.00 C ATOM 913 C GLN A 483 -3.134 3.032 -10.870 1.00 0.00 C ATOM 914 O GLN A 483 -2.680 4.001 -10.259 1.00 0.00 O ATOM 915 CB GLN A 483 -5.620 2.809 -11.303 1.00 0.00 C ATOM 916 CG GLN A 483 -6.797 3.025 -12.272 1.00 0.00 C ATOM 917 CD GLN A 483 -8.143 2.688 -11.632 1.00 0.00 C ATOM 918 OE1 GLN A 483 -8.285 1.745 -10.865 1.00 0.00 O ATOM 919 NE2 GLN A 483 -9.181 3.448 -11.910 1.00 0.00 N ATOM 0 H GLN A 483 -4.675 1.689 -13.272 1.00 0.00 H new ATOM 0 HA GLN A 483 -4.291 4.275 -12.160 1.00 0.00 H new ATOM 0 HB2 GLN A 483 -5.582 1.758 -11.016 1.00 0.00 H new ATOM 0 HB3 GLN A 483 -5.797 3.382 -10.393 1.00 0.00 H new ATOM 0 HG2 GLN A 483 -6.805 4.063 -12.605 1.00 0.00 H new ATOM 0 HG3 GLN A 483 -6.653 2.407 -13.158 1.00 0.00 H new ATOM 0 HE21 GLN A 483 -9.079 4.238 -12.547 1.00 0.00 H new ATOM 0 HE22 GLN A 483 -10.088 3.247 -11.488 1.00 0.00 H new ATOM 928 N VAL A 484 -2.619 1.802 -10.737 1.00 0.00 N ATOM 929 CA VAL A 484 -1.416 1.481 -9.941 1.00 0.00 C ATOM 930 C VAL A 484 -0.199 2.261 -10.453 1.00 0.00 C ATOM 931 O VAL A 484 0.489 2.911 -9.664 1.00 0.00 O ATOM 932 CB VAL A 484 -1.156 -0.042 -9.945 1.00 0.00 C ATOM 933 CG1 VAL A 484 0.134 -0.460 -9.230 1.00 0.00 C ATOM 934 CG2 VAL A 484 -2.313 -0.789 -9.268 1.00 0.00 C ATOM 0 H VAL A 484 -3.031 0.984 -11.186 1.00 0.00 H new ATOM 0 HA VAL A 484 -1.590 1.787 -8.910 1.00 0.00 H new ATOM 0 HB VAL A 484 -1.063 -0.304 -10.999 1.00 0.00 H new ATOM 0 HG11 VAL A 484 0.242 -1.544 -9.278 1.00 0.00 H new ATOM 0 HG12 VAL A 484 0.988 0.012 -9.716 1.00 0.00 H new ATOM 0 HG13 VAL A 484 0.090 -0.146 -8.187 1.00 0.00 H new ATOM 0 HG21 VAL A 484 -2.111 -1.860 -9.281 1.00 0.00 H new ATOM 0 HG22 VAL A 484 -2.411 -0.450 -8.237 1.00 0.00 H new ATOM 0 HG23 VAL A 484 -3.240 -0.588 -9.805 1.00 0.00 H new ATOM 944 N GLN A 485 0.044 2.270 -11.768 1.00 0.00 N ATOM 945 CA GLN A 485 1.140 3.023 -12.383 1.00 0.00 C ATOM 946 C GLN A 485 1.012 4.544 -12.172 1.00 0.00 C ATOM 947 O GLN A 485 2.019 5.201 -11.899 1.00 0.00 O ATOM 948 CB GLN A 485 1.227 2.650 -13.874 1.00 0.00 C ATOM 949 CG GLN A 485 2.346 3.363 -14.650 1.00 0.00 C ATOM 950 CD GLN A 485 3.749 3.054 -14.128 1.00 0.00 C ATOM 951 OE1 GLN A 485 4.422 2.132 -14.575 1.00 0.00 O ATOM 952 NE2 GLN A 485 4.250 3.805 -13.170 1.00 0.00 N ATOM 0 H GLN A 485 -0.520 1.750 -12.440 1.00 0.00 H new ATOM 0 HA GLN A 485 2.071 2.746 -11.888 1.00 0.00 H new ATOM 0 HB2 GLN A 485 1.375 1.573 -13.957 1.00 0.00 H new ATOM 0 HB3 GLN A 485 0.272 2.878 -14.348 1.00 0.00 H new ATOM 0 HG2 GLN A 485 2.287 3.076 -15.700 1.00 0.00 H new ATOM 0 HG3 GLN A 485 2.179 4.439 -14.603 1.00 0.00 H new ATOM 0 HE21 GLN A 485 3.703 4.576 -12.787 1.00 0.00 H new ATOM 0 HE22 GLN A 485 5.186 3.616 -12.810 1.00 0.00 H new ATOM 961 N ILE A 486 -0.199 5.110 -12.251 1.00 0.00 N ATOM 962 CA ILE A 486 -0.460 6.530 -11.956 1.00 0.00 C ATOM 963 C ILE A 486 -0.140 6.856 -10.489 1.00 0.00 C ATOM 964 O ILE A 486 0.562 7.832 -10.226 1.00 0.00 O ATOM 965 CB ILE A 486 -1.911 6.908 -12.344 1.00 0.00 C ATOM 966 CG1 ILE A 486 -2.064 6.907 -13.885 1.00 0.00 C ATOM 967 CG2 ILE A 486 -2.316 8.294 -11.800 1.00 0.00 C ATOM 968 CD1 ILE A 486 -3.522 6.868 -14.364 1.00 0.00 C ATOM 0 H ILE A 486 -1.035 4.593 -12.524 1.00 0.00 H new ATOM 0 HA ILE A 486 0.206 7.142 -12.564 1.00 0.00 H new ATOM 0 HB ILE A 486 -2.568 6.162 -11.897 1.00 0.00 H new ATOM 0 HG12 ILE A 486 -1.583 7.798 -14.289 1.00 0.00 H new ATOM 0 HG13 ILE A 486 -1.535 6.046 -14.293 1.00 0.00 H new ATOM 0 HG21 ILE A 486 -3.341 8.516 -12.097 1.00 0.00 H new ATOM 0 HG22 ILE A 486 -2.246 8.293 -10.712 1.00 0.00 H new ATOM 0 HG23 ILE A 486 -1.648 9.054 -12.206 1.00 0.00 H new ATOM 0 HD11 ILE A 486 -3.547 6.870 -15.454 1.00 0.00 H new ATOM 0 HD12 ILE A 486 -4.003 5.964 -13.991 1.00 0.00 H new ATOM 0 HD13 ILE A 486 -4.052 7.743 -13.988 1.00 0.00 H new ATOM 980 N ALA A 487 -0.578 6.035 -9.530 1.00 0.00 N ATOM 981 CA ALA A 487 -0.267 6.231 -8.108 1.00 0.00 C ATOM 982 C ALA A 487 1.246 6.148 -7.807 1.00 0.00 C ATOM 983 O ALA A 487 1.771 6.944 -7.025 1.00 0.00 O ATOM 984 CB ALA A 487 -1.056 5.198 -7.301 1.00 0.00 C ATOM 0 H ALA A 487 -1.158 5.216 -9.716 1.00 0.00 H new ATOM 0 HA ALA A 487 -0.562 7.240 -7.820 1.00 0.00 H new ATOM 0 HB1 ALA A 487 -0.841 5.324 -6.240 1.00 0.00 H new ATOM 0 HB2 ALA A 487 -2.123 5.339 -7.474 1.00 0.00 H new ATOM 0 HB3 ALA A 487 -0.767 4.194 -7.613 1.00 0.00 H new ATOM 990 N VAL A 488 1.972 5.234 -8.465 1.00 0.00 N ATOM 991 CA VAL A 488 3.445 5.137 -8.396 1.00 0.00 C ATOM 992 C VAL A 488 4.136 6.356 -9.034 1.00 0.00 C ATOM 993 O VAL A 488 5.141 6.838 -8.510 1.00 0.00 O ATOM 994 CB VAL A 488 3.918 3.814 -9.036 1.00 0.00 C ATOM 995 CG1 VAL A 488 5.439 3.718 -9.221 1.00 0.00 C ATOM 996 CG2 VAL A 488 3.501 2.620 -8.164 1.00 0.00 C ATOM 0 H VAL A 488 1.551 4.529 -9.070 1.00 0.00 H new ATOM 0 HA VAL A 488 3.735 5.136 -7.345 1.00 0.00 H new ATOM 0 HB VAL A 488 3.447 3.794 -10.019 1.00 0.00 H new ATOM 0 HG11 VAL A 488 5.690 2.760 -9.676 1.00 0.00 H new ATOM 0 HG12 VAL A 488 5.779 4.527 -9.868 1.00 0.00 H new ATOM 0 HG13 VAL A 488 5.929 3.799 -8.251 1.00 0.00 H new ATOM 0 HG21 VAL A 488 3.841 1.694 -8.628 1.00 0.00 H new ATOM 0 HG22 VAL A 488 3.950 2.717 -7.176 1.00 0.00 H new ATOM 0 HG23 VAL A 488 2.415 2.600 -8.069 1.00 0.00 H new ATOM 1006 N ASN A 489 3.598 6.899 -10.132 1.00 0.00 N ATOM 1007 CA ASN A 489 4.128 8.107 -10.779 1.00 0.00 C ATOM 1008 C ASN A 489 3.879 9.394 -9.965 1.00 0.00 C ATOM 1009 O ASN A 489 4.679 10.326 -10.021 1.00 0.00 O ATOM 1010 CB ASN A 489 3.506 8.227 -12.184 1.00 0.00 C ATOM 1011 CG ASN A 489 4.133 9.339 -13.014 1.00 0.00 C ATOM 1012 OD1 ASN A 489 5.334 9.583 -12.986 1.00 0.00 O ATOM 1013 ND2 ASN A 489 3.345 10.056 -13.783 1.00 0.00 N ATOM 0 H ASN A 489 2.779 6.512 -10.600 1.00 0.00 H new ATOM 0 HA ASN A 489 5.211 8.002 -10.845 1.00 0.00 H new ATOM 0 HB2 ASN A 489 3.621 7.279 -12.709 1.00 0.00 H new ATOM 0 HB3 ASN A 489 2.436 8.411 -12.088 1.00 0.00 H new ATOM 0 HD21 ASN A 489 3.734 10.809 -14.351 1.00 0.00 H new ATOM 0 HD22 ASN A 489 2.345 9.860 -13.812 1.00 0.00 H new ATOM 1020 N THR A 490 2.783 9.458 -9.206 1.00 0.00 N ATOM 1021 CA THR A 490 2.354 10.658 -8.457 1.00 0.00 C ATOM 1022 C THR A 490 2.885 10.718 -7.020 1.00 0.00 C ATOM 1023 O THR A 490 2.949 11.801 -6.434 1.00 0.00 O ATOM 1024 CB THR A 490 0.820 10.788 -8.450 1.00 0.00 C ATOM 1025 OG1 THR A 490 0.191 9.591 -8.065 1.00 0.00 O ATOM 1026 CG2 THR A 490 0.275 11.165 -9.829 1.00 0.00 C ATOM 0 H THR A 490 2.151 8.666 -9.087 1.00 0.00 H new ATOM 0 HA THR A 490 2.795 11.501 -8.990 1.00 0.00 H new ATOM 0 HB THR A 490 0.600 11.575 -7.729 1.00 0.00 H new ATOM 0 HG1 THR A 490 0.227 8.950 -8.805 1.00 0.00 H new ATOM 0 HG21 THR A 490 -0.811 11.247 -9.781 1.00 0.00 H new ATOM 0 HG22 THR A 490 0.698 12.121 -10.138 1.00 0.00 H new ATOM 0 HG23 THR A 490 0.549 10.396 -10.551 1.00 0.00 H new ATOM 1034 N SER A 491 3.327 9.597 -6.440 1.00 0.00 N ATOM 1035 CA SER A 491 3.863 9.550 -5.068 1.00 0.00 C ATOM 1036 C SER A 491 5.197 10.290 -4.875 1.00 0.00 C ATOM 1037 O SER A 491 5.512 10.712 -3.759 1.00 0.00 O ATOM 1038 CB SER A 491 3.999 8.099 -4.608 1.00 0.00 C ATOM 1039 OG SER A 491 5.052 7.428 -5.279 1.00 0.00 O ATOM 0 H SER A 491 3.325 8.691 -6.908 1.00 0.00 H new ATOM 0 HA SER A 491 3.139 10.083 -4.452 1.00 0.00 H new ATOM 0 HB2 SER A 491 4.179 8.074 -3.533 1.00 0.00 H new ATOM 0 HB3 SER A 491 3.061 7.572 -4.786 1.00 0.00 H new ATOM 0 HG SER A 491 4.855 7.388 -6.238 1.00 0.00 H new ATOM 1045 N LYS A 492 5.963 10.512 -5.956 1.00 0.00 N ATOM 1046 CA LYS A 492 7.251 11.239 -5.963 1.00 0.00 C ATOM 1047 C LYS A 492 7.175 12.714 -5.522 1.00 0.00 C ATOM 1048 O LYS A 492 8.210 13.319 -5.233 1.00 0.00 O ATOM 1049 CB LYS A 492 7.923 11.072 -7.335 1.00 0.00 C ATOM 1050 CG LYS A 492 7.252 11.883 -8.453 1.00 0.00 C ATOM 1051 CD LYS A 492 7.722 11.376 -9.821 1.00 0.00 C ATOM 1052 CE LYS A 492 7.077 12.202 -10.940 1.00 0.00 C ATOM 1053 NZ LYS A 492 7.295 11.587 -12.274 1.00 0.00 N ATOM 0 H LYS A 492 5.696 10.180 -6.883 1.00 0.00 H new ATOM 0 HA LYS A 492 7.870 10.782 -5.191 1.00 0.00 H new ATOM 0 HB2 LYS A 492 8.968 11.372 -7.257 1.00 0.00 H new ATOM 0 HB3 LYS A 492 7.914 10.017 -7.608 1.00 0.00 H new ATOM 0 HG2 LYS A 492 6.168 11.796 -8.376 1.00 0.00 H new ATOM 0 HG3 LYS A 492 7.496 12.940 -8.344 1.00 0.00 H new ATOM 0 HD2 LYS A 492 8.808 11.443 -9.889 1.00 0.00 H new ATOM 0 HD3 LYS A 492 7.460 10.324 -9.937 1.00 0.00 H new ATOM 0 HE2 LYS A 492 6.007 12.295 -10.753 1.00 0.00 H new ATOM 0 HE3 LYS A 492 7.491 13.210 -10.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 492 7.259 12.325 -13.006 1.00 0.00 H new ATOM 0 HZ2 LYS A 492 8.226 11.124 -12.295 1.00 0.00 H new ATOM 0 HZ3 LYS A 492 6.553 10.882 -12.456 1.00 0.00 H new ATOM 1067 N TYR A 493 5.966 13.276 -5.436 1.00 0.00 N ATOM 1068 CA TYR A 493 5.670 14.629 -4.937 1.00 0.00 C ATOM 1069 C TYR A 493 4.468 14.657 -3.960 1.00 0.00 C ATOM 1070 O TYR A 493 3.765 15.664 -3.842 1.00 0.00 O ATOM 1071 CB TYR A 493 5.583 15.618 -6.113 1.00 0.00 C ATOM 1072 CG TYR A 493 4.776 15.166 -7.316 1.00 0.00 C ATOM 1073 CD1 TYR A 493 3.398 14.914 -7.194 1.00 0.00 C ATOM 1074 CD2 TYR A 493 5.410 15.019 -8.564 1.00 0.00 C ATOM 1075 CE1 TYR A 493 2.650 14.515 -8.320 1.00 0.00 C ATOM 1076 CE2 TYR A 493 4.667 14.628 -9.694 1.00 0.00 C ATOM 1077 CZ TYR A 493 3.283 14.372 -9.574 1.00 0.00 C ATOM 1078 OH TYR A 493 2.556 13.995 -10.660 1.00 0.00 O ATOM 0 H TYR A 493 5.124 12.779 -5.726 1.00 0.00 H new ATOM 0 HA TYR A 493 6.499 14.968 -4.316 1.00 0.00 H new ATOM 0 HB2 TYR A 493 5.154 16.550 -5.745 1.00 0.00 H new ATOM 0 HB3 TYR A 493 6.596 15.843 -6.446 1.00 0.00 H new ATOM 0 HD1 TYR A 493 2.912 15.026 -6.236 1.00 0.00 H new ATOM 0 HD2 TYR A 493 6.470 15.207 -8.655 1.00 0.00 H new ATOM 0 HE1 TYR A 493 1.592 14.319 -8.224 1.00 0.00 H new ATOM 0 HE2 TYR A 493 5.155 14.524 -10.652 1.00 0.00 H new ATOM 0 HH TYR A 493 3.142 13.944 -11.444 1.00 0.00 H new ATOM 1088 N ALA A 494 4.226 13.545 -3.253 1.00 0.00 N ATOM 1089 CA ALA A 494 3.201 13.409 -2.215 1.00 0.00 C ATOM 1090 C ALA A 494 3.307 14.466 -1.091 1.00 0.00 C ATOM 1091 O ALA A 494 4.392 14.944 -0.746 1.00 0.00 O ATOM 1092 CB ALA A 494 3.301 11.995 -1.637 1.00 0.00 C ATOM 0 H ALA A 494 4.758 12.687 -3.395 1.00 0.00 H new ATOM 0 HA ALA A 494 2.229 13.581 -2.677 1.00 0.00 H new ATOM 0 HB1 ALA A 494 2.548 11.865 -0.860 1.00 0.00 H new ATOM 0 HB2 ALA A 494 3.134 11.265 -2.429 1.00 0.00 H new ATOM 0 HB3 ALA A 494 4.293 11.846 -1.209 1.00 0.00 H new ATOM 1098 N GLU A 495 2.161 14.811 -0.498 1.00 0.00 N ATOM 1099 CA GLU A 495 2.028 15.883 0.505 1.00 0.00 C ATOM 1100 C GLU A 495 2.636 15.529 1.880 1.00 0.00 C ATOM 1101 O GLU A 495 3.228 16.386 2.542 1.00 0.00 O ATOM 1102 CB GLU A 495 0.529 16.212 0.647 1.00 0.00 C ATOM 1103 CG GLU A 495 0.217 17.492 1.437 1.00 0.00 C ATOM 1104 CD GLU A 495 0.660 18.763 0.685 1.00 0.00 C ATOM 1105 OE1 GLU A 495 -0.101 19.255 -0.186 1.00 0.00 O ATOM 1106 OE2 GLU A 495 1.767 19.291 0.958 1.00 0.00 O ATOM 0 H GLU A 495 1.277 14.345 -0.703 1.00 0.00 H new ATOM 0 HA GLU A 495 2.595 16.745 0.155 1.00 0.00 H new ATOM 0 HB2 GLU A 495 0.097 16.304 -0.349 1.00 0.00 H new ATOM 0 HB3 GLU A 495 0.033 15.373 1.134 1.00 0.00 H new ATOM 0 HG2 GLU A 495 -0.854 17.543 1.634 1.00 0.00 H new ATOM 0 HG3 GLU A 495 0.718 17.451 2.404 1.00 0.00 H new ATOM 1113 N SER A 496 2.501 14.268 2.314 1.00 0.00 N ATOM 1114 CA SER A 496 2.992 13.759 3.613 1.00 0.00 C ATOM 1115 C SER A 496 3.029 12.222 3.657 1.00 0.00 C ATOM 1116 O SER A 496 3.985 11.623 4.160 1.00 0.00 O ATOM 1117 CB SER A 496 2.075 14.268 4.738 1.00 0.00 C ATOM 1118 OG SER A 496 2.553 13.883 6.018 1.00 0.00 O ATOM 0 H SER A 496 2.035 13.550 1.759 1.00 0.00 H new ATOM 0 HA SER A 496 4.010 14.124 3.746 1.00 0.00 H new ATOM 0 HB2 SER A 496 2.005 15.355 4.687 1.00 0.00 H new ATOM 0 HB3 SER A 496 1.068 13.877 4.592 1.00 0.00 H new ATOM 0 HG SER A 496 1.948 14.224 6.709 1.00 0.00 H new ATOM 1124 N TYR A 497 2.005 11.581 3.082 1.00 0.00 N ATOM 1125 CA TYR A 497 1.934 10.141 2.816 1.00 0.00 C ATOM 1126 C TYR A 497 3.025 9.661 1.829 1.00 0.00 C ATOM 1127 O TYR A 497 3.726 10.462 1.202 1.00 0.00 O ATOM 1128 CB TYR A 497 0.523 9.821 2.283 1.00 0.00 C ATOM 1129 CG TYR A 497 0.210 10.461 0.937 1.00 0.00 C ATOM 1130 CD1 TYR A 497 -0.319 11.767 0.872 1.00 0.00 C ATOM 1131 CD2 TYR A 497 0.497 9.765 -0.252 1.00 0.00 C ATOM 1132 CE1 TYR A 497 -0.519 12.389 -0.375 1.00 0.00 C ATOM 1133 CE2 TYR A 497 0.297 10.381 -1.503 1.00 0.00 C ATOM 1134 CZ TYR A 497 -0.200 11.702 -1.566 1.00 0.00 C ATOM 1135 OH TYR A 497 -0.369 12.324 -2.765 1.00 0.00 O ATOM 0 H TYR A 497 1.166 12.074 2.776 1.00 0.00 H new ATOM 0 HA TYR A 497 2.121 9.603 3.745 1.00 0.00 H new ATOM 0 HB2 TYR A 497 0.416 8.740 2.193 1.00 0.00 H new ATOM 0 HB3 TYR A 497 -0.214 10.155 3.013 1.00 0.00 H new ATOM 0 HD1 TYR A 497 -0.571 12.291 1.782 1.00 0.00 H new ATOM 0 HD2 TYR A 497 0.872 8.753 -0.205 1.00 0.00 H new ATOM 0 HE1 TYR A 497 -0.917 13.392 -0.420 1.00 0.00 H new ATOM 0 HE2 TYR A 497 0.523 9.844 -2.412 1.00 0.00 H new ATOM 0 HH TYR A 497 -0.104 11.718 -3.488 1.00 0.00 H new ATOM 1145 N ARG A 498 3.130 8.340 1.644 1.00 0.00 N ATOM 1146 CA ARG A 498 3.972 7.665 0.638 1.00 0.00 C ATOM 1147 C ARG A 498 3.251 6.431 0.086 1.00 0.00 C ATOM 1148 O ARG A 498 2.480 5.799 0.809 1.00 0.00 O ATOM 1149 CB ARG A 498 5.320 7.304 1.297 1.00 0.00 C ATOM 1150 CG ARG A 498 6.348 6.722 0.314 1.00 0.00 C ATOM 1151 CD ARG A 498 7.702 6.507 1.002 1.00 0.00 C ATOM 1152 NE ARG A 498 8.693 5.924 0.074 1.00 0.00 N ATOM 1153 CZ ARG A 498 9.464 6.568 -0.786 1.00 0.00 C ATOM 1154 NH1 ARG A 498 9.431 7.864 -0.925 1.00 0.00 N ATOM 1155 NH2 ARG A 498 10.298 5.910 -1.539 1.00 0.00 N ATOM 0 H ARG A 498 2.607 7.677 2.217 1.00 0.00 H new ATOM 0 HA ARG A 498 4.162 8.324 -0.209 1.00 0.00 H new ATOM 0 HB2 ARG A 498 5.739 8.197 1.761 1.00 0.00 H new ATOM 0 HB3 ARG A 498 5.143 6.583 2.095 1.00 0.00 H new ATOM 0 HG2 ARG A 498 5.982 5.775 -0.082 1.00 0.00 H new ATOM 0 HG3 ARG A 498 6.469 7.397 -0.534 1.00 0.00 H new ATOM 0 HD2 ARG A 498 8.074 7.459 1.382 1.00 0.00 H new ATOM 0 HD3 ARG A 498 7.575 5.848 1.861 1.00 0.00 H new ATOM 0 HE ARG A 498 8.794 4.909 0.100 1.00 0.00 H new ATOM 0 HH11 ARG A 498 8.793 8.422 -0.358 1.00 0.00 H new ATOM 0 HH12 ARG A 498 10.044 8.320 -1.601 1.00 0.00 H new ATOM 0 HH21 ARG A 498 10.358 4.894 -1.467 1.00 0.00 H new ATOM 0 HH22 ARG A 498 10.891 6.410 -2.201 1.00 0.00 H new ATOM 1169 N ILE A 499 3.510 6.083 -1.175 1.00 0.00 N ATOM 1170 CA ILE A 499 2.907 4.946 -1.896 1.00 0.00 C ATOM 1171 C ILE A 499 4.012 4.164 -2.624 1.00 0.00 C ATOM 1172 O ILE A 499 4.925 4.758 -3.205 1.00 0.00 O ATOM 1173 CB ILE A 499 1.830 5.426 -2.904 1.00 0.00 C ATOM 1174 CG1 ILE A 499 0.697 6.231 -2.229 1.00 0.00 C ATOM 1175 CG2 ILE A 499 1.230 4.242 -3.686 1.00 0.00 C ATOM 1176 CD1 ILE A 499 -0.212 6.978 -3.214 1.00 0.00 C ATOM 0 H ILE A 499 4.172 6.603 -1.751 1.00 0.00 H new ATOM 0 HA ILE A 499 2.414 4.296 -1.174 1.00 0.00 H new ATOM 0 HB ILE A 499 2.343 6.093 -3.597 1.00 0.00 H new ATOM 0 HG12 ILE A 499 0.088 5.551 -1.633 1.00 0.00 H new ATOM 0 HG13 ILE A 499 1.138 6.951 -1.540 1.00 0.00 H new ATOM 0 HG21 ILE A 499 0.478 4.611 -4.384 1.00 0.00 H new ATOM 0 HG22 ILE A 499 2.020 3.733 -4.238 1.00 0.00 H new ATOM 0 HG23 ILE A 499 0.766 3.543 -2.989 1.00 0.00 H new ATOM 0 HD11 ILE A 499 -0.981 7.518 -2.662 1.00 0.00 H new ATOM 0 HD12 ILE A 499 0.382 7.684 -3.793 1.00 0.00 H new ATOM 0 HD13 ILE A 499 -0.684 6.263 -3.888 1.00 0.00 H new ATOM 1188 N GLN A 500 3.902 2.836 -2.624 1.00 0.00 N ATOM 1189 CA GLN A 500 4.747 1.892 -3.366 1.00 0.00 C ATOM 1190 C GLN A 500 3.911 0.683 -3.833 1.00 0.00 C ATOM 1191 O GLN A 500 2.794 0.489 -3.352 1.00 0.00 O ATOM 1192 CB GLN A 500 5.934 1.477 -2.473 1.00 0.00 C ATOM 1193 CG GLN A 500 5.544 0.643 -1.238 1.00 0.00 C ATOM 1194 CD GLN A 500 6.728 0.344 -0.322 1.00 0.00 C ATOM 1195 OE1 GLN A 500 7.876 0.242 -0.733 1.00 0.00 O ATOM 1196 NE2 GLN A 500 6.509 0.201 0.965 1.00 0.00 N ATOM 0 H GLN A 500 3.183 2.361 -2.078 1.00 0.00 H new ATOM 0 HA GLN A 500 5.147 2.363 -4.264 1.00 0.00 H new ATOM 0 HB2 GLN A 500 6.641 0.905 -3.073 1.00 0.00 H new ATOM 0 HB3 GLN A 500 6.453 2.376 -2.140 1.00 0.00 H new ATOM 0 HG2 GLN A 500 4.780 1.177 -0.673 1.00 0.00 H new ATOM 0 HG3 GLN A 500 5.100 -0.296 -1.566 1.00 0.00 H new ATOM 0 HE21 GLN A 500 5.561 0.281 1.333 1.00 0.00 H new ATOM 0 HE22 GLN A 500 7.287 0.010 1.597 1.00 0.00 H new ATOM 1205 N THR A 501 4.407 -0.151 -4.751 1.00 0.00 N ATOM 1206 CA THR A 501 3.703 -1.399 -5.121 1.00 0.00 C ATOM 1207 C THR A 501 3.761 -2.451 -4.005 1.00 0.00 C ATOM 1208 O THR A 501 4.605 -2.393 -3.105 1.00 0.00 O ATOM 1209 CB THR A 501 4.220 -2.026 -6.426 1.00 0.00 C ATOM 1210 OG1 THR A 501 5.513 -2.558 -6.253 1.00 0.00 O ATOM 1211 CG2 THR A 501 4.240 -1.044 -7.595 1.00 0.00 C ATOM 0 H THR A 501 5.282 0.005 -5.251 1.00 0.00 H new ATOM 0 HA THR A 501 2.668 -1.095 -5.277 1.00 0.00 H new ATOM 0 HB THR A 501 3.517 -2.822 -6.670 1.00 0.00 H new ATOM 0 HG1 THR A 501 5.820 -2.953 -7.096 1.00 0.00 H new ATOM 0 HG21 THR A 501 4.615 -1.547 -8.486 1.00 0.00 H new ATOM 0 HG22 THR A 501 3.230 -0.680 -7.781 1.00 0.00 H new ATOM 0 HG23 THR A 501 4.890 -0.203 -7.353 1.00 0.00 H new ATOM 1219 N TYR A 502 2.891 -3.464 -4.084 1.00 0.00 N ATOM 1220 CA TYR A 502 2.970 -4.653 -3.228 1.00 0.00 C ATOM 1221 C TYR A 502 4.356 -5.333 -3.303 1.00 0.00 C ATOM 1222 O TYR A 502 4.920 -5.710 -2.274 1.00 0.00 O ATOM 1223 CB TYR A 502 1.845 -5.613 -3.637 1.00 0.00 C ATOM 1224 CG TYR A 502 1.808 -6.900 -2.838 1.00 0.00 C ATOM 1225 CD1 TYR A 502 1.121 -6.943 -1.610 1.00 0.00 C ATOM 1226 CD2 TYR A 502 2.474 -8.048 -3.314 1.00 0.00 C ATOM 1227 CE1 TYR A 502 1.107 -8.128 -0.851 1.00 0.00 C ATOM 1228 CE2 TYR A 502 2.459 -9.236 -2.559 1.00 0.00 C ATOM 1229 CZ TYR A 502 1.779 -9.275 -1.323 1.00 0.00 C ATOM 1230 OH TYR A 502 1.732 -10.426 -0.600 1.00 0.00 O ATOM 0 H TYR A 502 2.113 -3.483 -4.743 1.00 0.00 H new ATOM 0 HA TYR A 502 2.843 -4.357 -2.187 1.00 0.00 H new ATOM 0 HB2 TYR A 502 0.888 -5.102 -3.527 1.00 0.00 H new ATOM 0 HB3 TYR A 502 1.957 -5.857 -4.693 1.00 0.00 H new ATOM 0 HD1 TYR A 502 0.604 -6.066 -1.250 1.00 0.00 H new ATOM 0 HD2 TYR A 502 2.996 -8.016 -4.259 1.00 0.00 H new ATOM 0 HE1 TYR A 502 0.582 -8.159 0.092 1.00 0.00 H new ATOM 0 HE2 TYR A 502 2.967 -10.116 -2.925 1.00 0.00 H new ATOM 0 HH TYR A 502 2.244 -11.123 -1.061 1.00 0.00 H new ATOM 1240 N ALA A 503 4.941 -5.430 -4.502 1.00 0.00 N ATOM 1241 CA ALA A 503 6.275 -5.995 -4.716 1.00 0.00 C ATOM 1242 C ALA A 503 7.404 -5.151 -4.083 1.00 0.00 C ATOM 1243 O ALA A 503 8.333 -5.707 -3.496 1.00 0.00 O ATOM 1244 CB ALA A 503 6.492 -6.172 -6.224 1.00 0.00 C ATOM 0 H ALA A 503 4.494 -5.113 -5.362 1.00 0.00 H new ATOM 0 HA ALA A 503 6.321 -6.960 -4.211 1.00 0.00 H new ATOM 0 HB1 ALA A 503 7.482 -6.592 -6.402 1.00 0.00 H new ATOM 0 HB2 ALA A 503 5.734 -6.846 -6.624 1.00 0.00 H new ATOM 0 HB3 ALA A 503 6.414 -5.204 -6.719 1.00 0.00 H new ATOM 1250 N GLU A 504 7.320 -3.817 -4.144 1.00 0.00 N ATOM 1251 CA GLU A 504 8.279 -2.914 -3.484 1.00 0.00 C ATOM 1252 C GLU A 504 8.237 -3.017 -1.949 1.00 0.00 C ATOM 1253 O GLU A 504 9.283 -2.916 -1.302 1.00 0.00 O ATOM 1254 CB GLU A 504 8.023 -1.462 -3.909 1.00 0.00 C ATOM 1255 CG GLU A 504 8.498 -1.162 -5.335 1.00 0.00 C ATOM 1256 CD GLU A 504 8.209 0.302 -5.717 1.00 0.00 C ATOM 1257 OE1 GLU A 504 7.020 0.698 -5.775 1.00 0.00 O ATOM 1258 OE2 GLU A 504 9.176 1.069 -5.955 1.00 0.00 O ATOM 0 H GLU A 504 6.584 -3.329 -4.653 1.00 0.00 H new ATOM 0 HA GLU A 504 9.273 -3.227 -3.804 1.00 0.00 H new ATOM 0 HB2 GLU A 504 6.956 -1.251 -3.835 1.00 0.00 H new ATOM 0 HB3 GLU A 504 8.529 -0.791 -3.215 1.00 0.00 H new ATOM 0 HG2 GLU A 504 9.567 -1.358 -5.415 1.00 0.00 H new ATOM 0 HG3 GLU A 504 7.998 -1.830 -6.037 1.00 0.00 H new ATOM 1265 N TYR A 505 7.060 -3.262 -1.359 1.00 0.00 N ATOM 1266 CA TYR A 505 6.920 -3.561 0.071 1.00 0.00 C ATOM 1267 C TYR A 505 7.495 -4.944 0.437 1.00 0.00 C ATOM 1268 O TYR A 505 8.299 -5.058 1.364 1.00 0.00 O ATOM 1269 CB TYR A 505 5.442 -3.453 0.472 1.00 0.00 C ATOM 1270 CG TYR A 505 5.176 -3.878 1.903 1.00 0.00 C ATOM 1271 CD1 TYR A 505 5.561 -3.040 2.968 1.00 0.00 C ATOM 1272 CD2 TYR A 505 4.597 -5.134 2.169 1.00 0.00 C ATOM 1273 CE1 TYR A 505 5.361 -3.452 4.298 1.00 0.00 C ATOM 1274 CE2 TYR A 505 4.390 -5.547 3.499 1.00 0.00 C ATOM 1275 CZ TYR A 505 4.773 -4.707 4.569 1.00 0.00 C ATOM 1276 OH TYR A 505 4.595 -5.103 5.859 1.00 0.00 O ATOM 0 H TYR A 505 6.174 -3.258 -1.864 1.00 0.00 H new ATOM 0 HA TYR A 505 7.502 -2.828 0.631 1.00 0.00 H new ATOM 0 HB2 TYR A 505 5.111 -2.423 0.339 1.00 0.00 H new ATOM 0 HB3 TYR A 505 4.845 -4.069 -0.200 1.00 0.00 H new ATOM 0 HD1 TYR A 505 6.010 -2.080 2.763 1.00 0.00 H new ATOM 0 HD2 TYR A 505 4.312 -5.781 1.352 1.00 0.00 H new ATOM 0 HE1 TYR A 505 5.657 -2.808 5.113 1.00 0.00 H new ATOM 0 HE2 TYR A 505 3.938 -6.507 3.702 1.00 0.00 H new ATOM 0 HH TYR A 505 4.177 -5.989 5.874 1.00 0.00 H new ATOM 1286 N VAL A 506 7.158 -5.991 -0.328 1.00 0.00 N ATOM 1287 CA VAL A 506 7.726 -7.350 -0.194 1.00 0.00 C ATOM 1288 C VAL A 506 9.255 -7.357 -0.248 1.00 0.00 C ATOM 1289 O VAL A 506 9.896 -8.050 0.541 1.00 0.00 O ATOM 1290 CB VAL A 506 7.125 -8.269 -1.281 1.00 0.00 C ATOM 1291 CG1 VAL A 506 7.967 -9.517 -1.580 1.00 0.00 C ATOM 1292 CG2 VAL A 506 5.719 -8.714 -0.862 1.00 0.00 C ATOM 0 H VAL A 506 6.468 -5.921 -1.076 1.00 0.00 H new ATOM 0 HA VAL A 506 7.457 -7.730 0.792 1.00 0.00 H new ATOM 0 HB VAL A 506 7.101 -7.675 -2.195 1.00 0.00 H new ATOM 0 HG11 VAL A 506 7.478 -10.109 -2.353 1.00 0.00 H new ATOM 0 HG12 VAL A 506 8.956 -9.215 -1.926 1.00 0.00 H new ATOM 0 HG13 VAL A 506 8.067 -10.114 -0.674 1.00 0.00 H new ATOM 0 HG21 VAL A 506 5.298 -9.362 -1.631 1.00 0.00 H new ATOM 0 HG22 VAL A 506 5.776 -9.259 0.080 1.00 0.00 H new ATOM 0 HG23 VAL A 506 5.082 -7.838 -0.737 1.00 0.00 H new ATOM 1302 N GLY A 507 9.861 -6.554 -1.124 1.00 0.00 N ATOM 1303 CA GLY A 507 11.316 -6.443 -1.233 1.00 0.00 C ATOM 1304 C GLY A 507 12.004 -5.857 0.014 1.00 0.00 C ATOM 1305 O GLY A 507 13.194 -6.104 0.226 1.00 0.00 O ATOM 0 H GLY A 507 9.354 -5.960 -1.780 1.00 0.00 H new ATOM 0 HA2 GLY A 507 11.730 -7.432 -1.431 1.00 0.00 H new ATOM 0 HA3 GLY A 507 11.557 -5.819 -2.093 1.00 0.00 H new ATOM 1309 N LYS A 508 11.267 -5.145 0.881 1.00 0.00 N ATOM 1310 CA LYS A 508 11.744 -4.628 2.182 1.00 0.00 C ATOM 1311 C LYS A 508 11.526 -5.611 3.345 1.00 0.00 C ATOM 1312 O LYS A 508 12.238 -5.533 4.347 1.00 0.00 O ATOM 1313 CB LYS A 508 11.079 -3.269 2.476 1.00 0.00 C ATOM 1314 CG LYS A 508 11.503 -2.212 1.445 1.00 0.00 C ATOM 1315 CD LYS A 508 10.780 -0.875 1.662 1.00 0.00 C ATOM 1316 CE LYS A 508 11.199 0.151 0.602 1.00 0.00 C ATOM 1317 NZ LYS A 508 10.653 -0.182 -0.739 1.00 0.00 N ATOM 0 H LYS A 508 10.294 -4.904 0.695 1.00 0.00 H new ATOM 0 HA LYS A 508 12.823 -4.499 2.101 1.00 0.00 H new ATOM 0 HB2 LYS A 508 9.995 -3.381 2.462 1.00 0.00 H new ATOM 0 HB3 LYS A 508 11.353 -2.936 3.477 1.00 0.00 H new ATOM 0 HG2 LYS A 508 12.580 -2.056 1.507 1.00 0.00 H new ATOM 0 HG3 LYS A 508 11.292 -2.580 0.441 1.00 0.00 H new ATOM 0 HD2 LYS A 508 9.702 -1.029 1.619 1.00 0.00 H new ATOM 0 HD3 LYS A 508 11.008 -0.491 2.656 1.00 0.00 H new ATOM 0 HE2 LYS A 508 10.853 1.141 0.899 1.00 0.00 H new ATOM 0 HE3 LYS A 508 12.287 0.195 0.550 1.00 0.00 H new ATOM 0 HZ1 LYS A 508 10.987 0.517 -1.433 1.00 0.00 H new ATOM 0 HZ2 LYS A 508 10.975 -1.130 -1.019 1.00 0.00 H new ATOM 0 HZ3 LYS A 508 9.614 -0.166 -0.704 1.00 0.00 H new ATOM 1331 N LYS A 509 10.622 -6.591 3.194 1.00 0.00 N ATOM 1332 CA LYS A 509 10.429 -7.740 4.102 1.00 0.00 C ATOM 1333 C LYS A 509 11.547 -8.802 4.029 1.00 0.00 C ATOM 1334 O LYS A 509 11.476 -9.812 4.733 1.00 0.00 O ATOM 1335 CB LYS A 509 9.045 -8.366 3.837 1.00 0.00 C ATOM 1336 CG LYS A 509 7.885 -7.460 4.277 1.00 0.00 C ATOM 1337 CD LYS A 509 6.573 -8.224 4.535 1.00 0.00 C ATOM 1338 CE LYS A 509 5.934 -8.875 3.298 1.00 0.00 C ATOM 1339 NZ LYS A 509 6.441 -10.252 3.043 1.00 0.00 N ATOM 0 H LYS A 509 9.977 -6.608 2.404 1.00 0.00 H new ATOM 0 HA LYS A 509 10.481 -7.354 5.120 1.00 0.00 H new ATOM 0 HB2 LYS A 509 8.947 -8.582 2.773 1.00 0.00 H new ATOM 0 HB3 LYS A 509 8.976 -9.318 4.363 1.00 0.00 H new ATOM 0 HG2 LYS A 509 8.172 -6.930 5.185 1.00 0.00 H new ATOM 0 HG3 LYS A 509 7.712 -6.706 3.509 1.00 0.00 H new ATOM 0 HD2 LYS A 509 6.765 -9.001 5.275 1.00 0.00 H new ATOM 0 HD3 LYS A 509 5.852 -7.535 4.975 1.00 0.00 H new ATOM 0 HE2 LYS A 509 4.852 -8.910 3.429 1.00 0.00 H new ATOM 0 HE3 LYS A 509 6.129 -8.253 2.424 1.00 0.00 H new ATOM 0 HZ1 LYS A 509 5.861 -10.705 2.308 1.00 0.00 H new ATOM 0 HZ2 LYS A 509 7.430 -10.204 2.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 509 6.386 -10.810 3.919 1.00 0.00 H new ATOM 1353 N GLN A 510 12.588 -8.587 3.215 1.00 0.00 N ATOM 1354 CA GLN A 510 13.727 -9.499 2.999 1.00 0.00 C ATOM 1355 C GLN A 510 14.458 -9.993 4.267 1.00 0.00 C ATOM 1356 O GLN A 510 15.122 -11.030 4.217 1.00 0.00 O ATOM 1357 CB GLN A 510 14.716 -8.868 2.001 1.00 0.00 C ATOM 1358 CG GLN A 510 15.391 -7.581 2.510 1.00 0.00 C ATOM 1359 CD GLN A 510 16.438 -7.066 1.522 1.00 0.00 C ATOM 1360 OE1 GLN A 510 17.635 -7.286 1.668 1.00 0.00 O ATOM 1361 NE2 GLN A 510 16.037 -6.372 0.478 1.00 0.00 N ATOM 0 H GLN A 510 12.666 -7.734 2.662 1.00 0.00 H new ATOM 0 HA GLN A 510 13.287 -10.408 2.589 1.00 0.00 H new ATOM 0 HB2 GLN A 510 15.488 -9.599 1.760 1.00 0.00 H new ATOM 0 HB3 GLN A 510 14.187 -8.646 1.074 1.00 0.00 H new ATOM 0 HG2 GLN A 510 14.635 -6.813 2.673 1.00 0.00 H new ATOM 0 HG3 GLN A 510 15.863 -7.774 3.474 1.00 0.00 H new ATOM 0 HE21 GLN A 510 15.044 -6.181 0.343 1.00 0.00 H new ATOM 0 HE22 GLN A 510 16.719 -6.025 -0.196 1.00 0.00 H new ATOM 1370 N LYS A 511 14.308 -9.320 5.419 1.00 0.00 N ATOM 1371 CA LYS A 511 14.790 -9.794 6.736 1.00 0.00 C ATOM 1372 C LYS A 511 14.254 -11.185 7.127 1.00 0.00 C ATOM 1373 O LYS A 511 14.919 -11.911 7.866 1.00 0.00 O ATOM 1374 CB LYS A 511 14.436 -8.762 7.824 1.00 0.00 C ATOM 1375 CG LYS A 511 15.081 -7.375 7.645 1.00 0.00 C ATOM 1376 CD LYS A 511 16.615 -7.407 7.724 1.00 0.00 C ATOM 1377 CE LYS A 511 17.171 -5.978 7.694 1.00 0.00 C ATOM 1378 NZ LYS A 511 18.653 -5.968 7.801 1.00 0.00 N ATOM 0 H LYS A 511 13.841 -8.415 5.467 1.00 0.00 H new ATOM 0 HA LYS A 511 15.872 -9.899 6.652 1.00 0.00 H new ATOM 0 HB2 LYS A 511 13.353 -8.641 7.849 1.00 0.00 H new ATOM 0 HB3 LYS A 511 14.735 -9.162 8.793 1.00 0.00 H new ATOM 0 HG2 LYS A 511 14.782 -6.964 6.681 1.00 0.00 H new ATOM 0 HG3 LYS A 511 14.698 -6.701 8.412 1.00 0.00 H new ATOM 0 HD2 LYS A 511 16.930 -7.910 8.639 1.00 0.00 H new ATOM 0 HD3 LYS A 511 17.019 -7.981 6.890 1.00 0.00 H new ATOM 0 HE2 LYS A 511 16.869 -5.488 6.768 1.00 0.00 H new ATOM 0 HE3 LYS A 511 16.742 -5.402 8.514 1.00 0.00 H new ATOM 0 HZ1 LYS A 511 18.996 -4.987 7.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 511 18.939 -6.414 8.696 1.00 0.00 H new ATOM 0 HZ3 LYS A 511 19.062 -6.497 7.004 1.00 0.00 H new ATOM 1392 N GLY A 512 13.093 -11.585 6.598 1.00 0.00 N ATOM 1393 CA GLY A 512 12.481 -12.906 6.811 1.00 0.00 C ATOM 1394 C GLY A 512 13.094 -14.055 5.990 1.00 0.00 C ATOM 1395 O GLY A 512 12.758 -15.217 6.229 1.00 0.00 O ATOM 0 H GLY A 512 12.535 -10.983 5.992 1.00 0.00 H new ATOM 0 HA2 GLY A 512 12.557 -13.157 7.869 1.00 0.00 H new ATOM 0 HA3 GLY A 512 11.419 -12.839 6.574 1.00 0.00 H new ATOM 1399 N LYS A 513 13.997 -13.763 5.039 1.00 0.00 N ATOM 1400 CA LYS A 513 14.651 -14.743 4.143 1.00 0.00 C ATOM 1401 C LYS A 513 15.538 -15.776 4.863 1.00 0.00 C ATOM 1402 O LYS A 513 15.810 -16.840 4.308 1.00 0.00 O ATOM 1403 CB LYS A 513 15.431 -13.954 3.072 1.00 0.00 C ATOM 1404 CG LYS A 513 15.983 -14.814 1.922 1.00 0.00 C ATOM 1405 CD LYS A 513 16.518 -13.971 0.754 1.00 0.00 C ATOM 1406 CE LYS A 513 17.690 -13.072 1.171 1.00 0.00 C ATOM 1407 NZ LYS A 513 18.238 -12.320 0.012 1.00 0.00 N ATOM 0 H LYS A 513 14.305 -12.807 4.864 1.00 0.00 H new ATOM 0 HA LYS A 513 13.874 -15.354 3.684 1.00 0.00 H new ATOM 0 HB2 LYS A 513 14.777 -13.188 2.655 1.00 0.00 H new ATOM 0 HB3 LYS A 513 16.261 -13.437 3.553 1.00 0.00 H new ATOM 0 HG2 LYS A 513 16.783 -15.450 2.301 1.00 0.00 H new ATOM 0 HG3 LYS A 513 15.196 -15.474 1.557 1.00 0.00 H new ATOM 0 HD2 LYS A 513 16.839 -14.632 -0.051 1.00 0.00 H new ATOM 0 HD3 LYS A 513 15.713 -13.353 0.357 1.00 0.00 H new ATOM 0 HE2 LYS A 513 17.358 -12.371 1.937 1.00 0.00 H new ATOM 0 HE3 LYS A 513 18.477 -13.681 1.616 1.00 0.00 H new ATOM 0 HZ1 LYS A 513 19.028 -11.722 0.328 1.00 0.00 H new ATOM 0 HZ2 LYS A 513 18.577 -12.990 -0.708 1.00 0.00 H new ATOM 0 HZ3 LYS A 513 17.493 -11.721 -0.397 1.00 0.00 H new ATOM 1421 N GLN A 514 15.954 -15.507 6.104 1.00 0.00 N ATOM 1422 CA GLN A 514 16.807 -16.365 6.949 1.00 0.00 C ATOM 1423 C GLN A 514 16.090 -17.629 7.506 1.00 0.00 C ATOM 1424 O GLN A 514 16.328 -18.052 8.639 1.00 0.00 O ATOM 1425 CB GLN A 514 17.434 -15.483 8.050 1.00 0.00 C ATOM 1426 CG GLN A 514 18.758 -16.053 8.599 1.00 0.00 C ATOM 1427 CD GLN A 514 19.411 -15.164 9.661 1.00 0.00 C ATOM 1428 OE1 GLN A 514 18.794 -14.317 10.299 1.00 0.00 O ATOM 1429 NE2 GLN A 514 20.698 -15.318 9.899 1.00 0.00 N ATOM 0 H GLN A 514 15.694 -14.641 6.576 1.00 0.00 H new ATOM 0 HA GLN A 514 17.596 -16.789 6.328 1.00 0.00 H new ATOM 0 HB2 GLN A 514 17.613 -14.485 7.650 1.00 0.00 H new ATOM 0 HB3 GLN A 514 16.724 -15.375 8.870 1.00 0.00 H new ATOM 0 HG2 GLN A 514 18.571 -17.038 9.026 1.00 0.00 H new ATOM 0 HG3 GLN A 514 19.456 -16.191 7.773 1.00 0.00 H new ATOM 0 HE21 GLN A 514 21.232 -16.016 9.381 1.00 0.00 H new ATOM 0 HE22 GLN A 514 21.160 -14.740 10.601 1.00 0.00 H new ATOM 1438 N VAL A 515 15.205 -18.254 6.717 1.00 0.00 N ATOM 1439 CA VAL A 515 14.433 -19.476 7.053 1.00 0.00 C ATOM 1440 C VAL A 515 15.334 -20.656 7.473 1.00 0.00 C ATOM 1441 O VAL A 515 14.917 -21.522 8.246 1.00 0.00 O ATOM 1442 CB VAL A 515 13.521 -19.869 5.865 1.00 0.00 C ATOM 1443 CG1 VAL A 515 12.613 -21.069 6.170 1.00 0.00 C ATOM 1444 CG2 VAL A 515 12.597 -18.711 5.452 1.00 0.00 C ATOM 0 H VAL A 515 14.992 -17.911 5.780 1.00 0.00 H new ATOM 0 HA VAL A 515 13.814 -19.242 7.919 1.00 0.00 H new ATOM 0 HB VAL A 515 14.214 -20.128 5.064 1.00 0.00 H new ATOM 0 HG11 VAL A 515 12.000 -21.293 5.297 1.00 0.00 H new ATOM 0 HG12 VAL A 515 13.226 -21.936 6.415 1.00 0.00 H new ATOM 0 HG13 VAL A 515 11.967 -20.831 7.015 1.00 0.00 H new ATOM 0 HG21 VAL A 515 11.972 -19.025 4.616 1.00 0.00 H new ATOM 0 HG22 VAL A 515 11.963 -18.433 6.294 1.00 0.00 H new ATOM 0 HG23 VAL A 515 13.200 -17.853 5.153 1.00 0.00 H new ATOM 1454 N LYS A 516 16.600 -20.657 7.028 1.00 0.00 N ATOM 1455 CA LYS A 516 17.679 -21.587 7.419 1.00 0.00 C ATOM 1456 C LYS A 516 18.015 -21.645 8.923 1.00 0.00 C ATOM 1457 O LYS A 516 18.762 -22.537 9.333 1.00 0.00 O ATOM 1458 CB LYS A 516 18.939 -21.268 6.588 1.00 0.00 C ATOM 1459 CG LYS A 516 19.560 -19.892 6.909 1.00 0.00 C ATOM 1460 CD LYS A 516 20.780 -19.561 6.036 1.00 0.00 C ATOM 1461 CE LYS A 516 21.962 -20.501 6.308 1.00 0.00 C ATOM 1462 NZ LYS A 516 23.154 -20.123 5.506 1.00 0.00 N ATOM 0 H LYS A 516 16.920 -19.970 6.346 1.00 0.00 H new ATOM 0 HA LYS A 516 17.299 -22.586 7.204 1.00 0.00 H new ATOM 0 HB2 LYS A 516 19.685 -22.043 6.763 1.00 0.00 H new ATOM 0 HB3 LYS A 516 18.684 -21.304 5.529 1.00 0.00 H new ATOM 0 HG2 LYS A 516 18.804 -19.119 6.774 1.00 0.00 H new ATOM 0 HG3 LYS A 516 19.855 -19.869 7.958 1.00 0.00 H new ATOM 0 HD2 LYS A 516 20.500 -19.627 4.985 1.00 0.00 H new ATOM 0 HD3 LYS A 516 21.087 -18.532 6.220 1.00 0.00 H new ATOM 0 HE2 LYS A 516 22.212 -20.475 7.369 1.00 0.00 H new ATOM 0 HE3 LYS A 516 21.675 -21.526 6.074 1.00 0.00 H new ATOM 0 HZ1 LYS A 516 23.934 -20.778 5.714 1.00 0.00 H new ATOM 0 HZ2 LYS A 516 22.921 -20.172 4.494 1.00 0.00 H new ATOM 0 HZ3 LYS A 516 23.442 -19.154 5.748 1.00 0.00 H new ATOM 1476 N SER A 517 17.506 -20.716 9.739 1.00 0.00 N ATOM 1477 CA SER A 517 17.794 -20.602 11.178 1.00 0.00 C ATOM 1478 C SER A 517 16.557 -20.180 11.990 1.00 0.00 C ATOM 1479 O SER A 517 15.624 -19.565 11.459 1.00 0.00 O ATOM 1480 CB SER A 517 18.931 -19.591 11.371 1.00 0.00 C ATOM 1481 OG SER A 517 19.405 -19.613 12.705 1.00 0.00 O ATOM 0 H SER A 517 16.861 -19.998 9.408 1.00 0.00 H new ATOM 0 HA SER A 517 18.090 -21.583 11.549 1.00 0.00 H new ATOM 0 HB2 SER A 517 19.748 -19.821 10.687 1.00 0.00 H new ATOM 0 HB3 SER A 517 18.579 -18.590 11.122 1.00 0.00 H new ATOM 0 HG SER A 517 20.131 -18.962 12.805 1.00 0.00 H new ATOM 1487 N GLY A 518 16.540 -20.505 13.285 1.00 0.00 N ATOM 1488 CA GLY A 518 15.429 -20.239 14.206 1.00 0.00 C ATOM 1489 C GLY A 518 15.515 -21.037 15.521 1.00 0.00 C ATOM 1490 O GLY A 518 16.467 -21.804 15.709 1.00 0.00 O ATOM 0 H GLY A 518 17.324 -20.976 13.737 1.00 0.00 H new ATOM 0 HA2 GLY A 518 15.407 -19.174 14.438 1.00 0.00 H new ATOM 0 HA3 GLY A 518 14.489 -20.476 13.707 1.00 0.00 H new ATOM 1494 N PRO A 519 14.526 -20.893 16.429 1.00 0.00 N ATOM 1495 CA PRO A 519 14.477 -21.552 17.746 1.00 0.00 C ATOM 1496 C PRO A 519 14.652 -23.086 17.774 1.00 0.00 C ATOM 1497 O PRO A 519 14.947 -23.646 18.833 1.00 0.00 O ATOM 1498 CB PRO A 519 13.119 -21.164 18.343 1.00 0.00 C ATOM 1499 CG PRO A 519 12.810 -19.822 17.689 1.00 0.00 C ATOM 1500 CD PRO A 519 13.394 -19.983 16.289 1.00 0.00 C ATOM 0 HA PRO A 519 15.341 -21.209 18.315 1.00 0.00 H new ATOM 0 HB2 PRO A 519 12.354 -21.906 18.115 1.00 0.00 H new ATOM 0 HB3 PRO A 519 13.168 -21.079 19.429 1.00 0.00 H new ATOM 0 HG2 PRO A 519 11.739 -19.624 17.660 1.00 0.00 H new ATOM 0 HG3 PRO A 519 13.272 -18.994 18.227 1.00 0.00 H new ATOM 0 HD2 PRO A 519 12.652 -20.386 15.600 1.00 0.00 H new ATOM 0 HD3 PRO A 519 13.713 -19.022 15.886 1.00 0.00 H new ATOM 1508 N SER A 520 14.487 -23.766 16.635 1.00 0.00 N ATOM 1509 CA SER A 520 14.580 -25.230 16.476 1.00 0.00 C ATOM 1510 C SER A 520 15.564 -25.677 15.377 1.00 0.00 C ATOM 1511 O SER A 520 15.649 -26.871 15.071 1.00 0.00 O ATOM 1512 CB SER A 520 13.175 -25.796 16.224 1.00 0.00 C ATOM 1513 OG SER A 520 12.597 -25.223 15.057 1.00 0.00 O ATOM 0 H SER A 520 14.275 -23.294 15.756 1.00 0.00 H new ATOM 0 HA SER A 520 14.989 -25.632 17.403 1.00 0.00 H new ATOM 0 HB2 SER A 520 13.230 -26.879 16.113 1.00 0.00 H new ATOM 0 HB3 SER A 520 12.538 -25.596 17.086 1.00 0.00 H new ATOM 0 HG SER A 520 11.703 -25.600 14.916 1.00 0.00 H new ATOM 1519 N SER A 521 16.331 -24.747 14.790 1.00 0.00 N ATOM 1520 CA SER A 521 17.257 -25.001 13.666 1.00 0.00 C ATOM 1521 C SER A 521 18.570 -24.192 13.704 1.00 0.00 C ATOM 1522 O SER A 521 19.433 -24.384 12.840 1.00 0.00 O ATOM 1523 CB SER A 521 16.526 -24.776 12.335 1.00 0.00 C ATOM 1524 OG SER A 521 16.037 -23.447 12.231 1.00 0.00 O ATOM 0 H SER A 521 16.328 -23.771 15.088 1.00 0.00 H new ATOM 0 HA SER A 521 17.567 -26.041 13.767 1.00 0.00 H new ATOM 0 HB2 SER A 521 17.204 -24.982 11.507 1.00 0.00 H new ATOM 0 HB3 SER A 521 15.697 -25.478 12.250 1.00 0.00 H new ATOM 0 HG SER A 521 15.578 -23.334 11.373 1.00 0.00 H new ATOM 1530 N GLY A 522 18.769 -23.330 14.712 1.00 0.00 N ATOM 1531 CA GLY A 522 20.001 -22.560 14.952 1.00 0.00 C ATOM 1532 C GLY A 522 20.061 -21.953 16.354 1.00 0.00 C ATOM 1533 O GLY A 522 20.001 -22.724 17.338 1.00 0.00 O ATOM 1534 OXT GLY A 522 20.191 -20.713 16.465 1.00 0.00 O ATOM 0 H GLY A 522 18.049 -23.142 15.410 1.00 0.00 H new ATOM 0 HA2 GLY A 522 20.864 -23.210 14.806 1.00 0.00 H new ATOM 0 HA3 GLY A 522 20.074 -21.762 14.213 1.00 0.00 H new TER 1538 GLY A 522 HETATM 1539 P 7MG A 523 -8.710 -4.670 10.963 1.00 0.00 P HETATM 1540 OP1 7MG A 523 -9.027 -4.048 9.654 1.00 0.00 O HETATM 1541 OP2 7MG A 523 -8.490 -6.136 11.017 1.00 0.00 O HETATM 1542 O5' 7MG A 523 -7.405 -3.924 11.556 1.00 0.00 O HETATM 1543 C5' 7MG A 523 -7.464 -2.556 11.929 1.00 0.00 C HETATM 1544 C4' 7MG A 523 -6.086 -1.992 12.316 1.00 0.00 C HETATM 1545 O4' 7MG A 523 -5.672 -0.967 11.422 1.00 0.00 O HETATM 1546 C3' 7MG A 523 -6.047 -1.387 13.728 1.00 0.00 C HETATM 1547 O3' 7MG A 523 -5.729 -2.331 14.747 1.00 0.00 O HETATM 1548 C2' 7MG A 523 -4.983 -0.288 13.579 1.00 0.00 C HETATM 1549 O2' 7MG A 523 -3.652 -0.799 13.673 1.00 0.00 O HETATM 1550 C1' 7MG A 523 -5.246 0.182 12.145 1.00 0.00 C HETATM 1551 N9 7MG A 523 -6.310 1.213 12.054 1.00 0.00 N HETATM 1552 C8 7MG A 523 -7.673 1.017 11.936 1.00 0.00 C HETATM 1553 N7 7MG A 523 -8.306 2.267 11.776 1.00 0.00 N HETATM 1554 C5 7MG A 523 -7.293 3.184 11.808 1.00 0.00 C HETATM 1555 C6 7MG A 523 -7.341 4.581 11.660 1.00 0.00 C HETATM 1556 O6 7MG A 523 -8.314 5.291 11.470 1.00 0.00 O HETATM 1557 N1 7MG A 523 -6.135 5.172 11.737 1.00 0.00 N HETATM 1558 C2 7MG A 523 -5.016 4.497 11.869 1.00 0.00 C HETATM 1559 N2 7MG A 523 -3.968 5.226 11.890 1.00 0.00 N HETATM 1560 N3 7MG A 523 -4.885 3.202 12.028 1.00 0.00 N HETATM 1561 C4 7MG A 523 -6.084 2.576 11.977 1.00 0.00 C HETATM 1562 CM7 7MG A 523 -9.790 2.355 11.586 1.00 0.00 C HETATM 0 HO3' 7MG A 523 -6.288 -2.163 15.534 1.00 0.00 H new HETATM 0 HO2' 7MG A 523 -3.655 -1.625 14.200 1.00 0.00 H new HETATM 0 HN22 7MG A 523 -3.049 4.795 11.989 1.00 0.00 H new HETATM 0 HN21 7MG A 523 -4.050 6.239 11.808 1.00 0.00 H new HETATM 0 HM73 7MG A 523 -10.075 1.807 10.688 1.00 0.00 H new HETATM 0 HM72 7MG A 523 -10.294 1.922 12.450 1.00 0.00 H new HETATM 0 HM71 7MG A 523 -10.082 3.400 11.482 1.00 0.00 H new HETATM 0 H5'' 7MG A 523 -7.872 -1.974 11.102 1.00 0.00 H new HETATM 0 HN1 7MG A 523 -6.087 6.190 11.691 1.00 0.00 H new HETATM 0 H82 7MG A 523 -7.888 0.374 11.082 1.00 0.00 H new HETATM 0 H81 7MG A 523 -8.058 0.511 12.821 1.00 0.00 H new HETATM 0 H5' 7MG A 523 -8.149 -2.441 12.769 1.00 0.00 H new HETATM 0 H4' 7MG A 523 -5.419 -2.853 12.272 1.00 0.00 H new HETATM 0 H3' 7MG A 523 -7.018 -1.015 14.056 1.00 0.00 H new HETATM 0 H2' 7MG A 523 -5.051 0.477 14.352 1.00 0.00 H new HETATM 0 H1' 7MG A 523 -4.336 0.634 11.750 1.00 0.00 H new HETATM 1578 PB GDP A 524 -10.562 -4.810 13.202 1.00 0.00 P HETATM 1579 O1B GDP A 524 -9.547 -5.525 14.017 1.00 0.00 O HETATM 1580 O2B GDP A 524 -11.785 -5.523 12.744 1.00 0.00 O HETATM 1581 O3B GDP A 524 -9.874 -4.274 11.919 1.00 0.00 O HETATM 1582 O3A GDP A 524 -10.898 -3.461 13.860 1.00 0.00 O HETATM 1583 PA GDP A 524 -12.021 -3.316 14.908 1.00 0.00 P HETATM 1584 O1A GDP A 524 -12.155 -4.502 15.799 1.00 0.00 O HETATM 1585 O2A GDP A 524 -13.244 -2.771 14.253 1.00 0.00 O HETATM 1586 O5' GDP A 524 -11.473 -2.125 15.857 1.00 0.00 O HETATM 1587 C5' GDP A 524 -10.960 -0.910 15.321 1.00 0.00 C HETATM 1588 C4' GDP A 524 -9.422 -0.896 15.362 1.00 0.00 C HETATM 1589 O4' GDP A 524 -8.950 0.256 14.664 1.00 0.00 O HETATM 1590 C3' GDP A 524 -8.872 -0.814 16.796 1.00 0.00 C HETATM 1591 O3' GDP A 524 -7.609 -1.477 16.879 1.00 0.00 O HETATM 1592 C2' GDP A 524 -8.719 0.703 16.967 1.00 0.00 C HETATM 1593 O2' GDP A 524 -7.814 1.070 18.009 1.00 0.00 O HETATM 1594 C1' GDP A 524 -8.222 1.078 15.570 1.00 0.00 C HETATM 1595 N9 GDP A 524 -8.436 2.504 15.255 1.00 0.00 N HETATM 1596 C8 GDP A 524 -9.622 3.138 15.001 1.00 0.00 C HETATM 1597 N7 GDP A 524 -9.519 4.431 14.830 1.00 0.00 N HETATM 1598 C5 GDP A 524 -8.143 4.670 14.974 1.00 0.00 C HETATM 1599 C6 GDP A 524 -7.368 5.885 14.901 1.00 0.00 C HETATM 1600 O6 GDP A 524 -7.750 7.041 14.712 1.00 0.00 O HETATM 1601 N1 GDP A 524 -6.010 5.684 15.067 1.00 0.00 N HETATM 1602 C2 GDP A 524 -5.449 4.466 15.287 1.00 0.00 C HETATM 1603 N2 GDP A 524 -4.148 4.421 15.403 1.00 0.00 N HETATM 1604 N3 GDP A 524 -6.125 3.320 15.363 1.00 0.00 N HETATM 1605 C4 GDP A 524 -7.474 3.486 15.206 1.00 0.00 C HETATM 0 HO3' GDP A 524 -6.968 -0.902 17.346 1.00 0.00 H new HETATM 0 HO2' GDP A 524 -7.759 2.047 18.066 1.00 0.00 H new HETATM 0 HN22 GDP A 524 -3.681 3.529 15.569 1.00 0.00 H new HETATM 0 HN21 GDP A 524 -3.599 5.278 15.328 1.00 0.00 H new HETATM 0 H5'' GDP A 524 -11.301 -0.789 14.293 1.00 0.00 H new HETATM 0 HN1 GDP A 524 -5.394 6.496 15.022 1.00 0.00 H new HETATM 0 H8 GDP A 524 -10.574 2.609 14.946 1.00 0.00 H new HETATM 0 H5' GDP A 524 -11.350 -0.065 15.888 1.00 0.00 H new HETATM 0 H4' GDP A 524 -9.082 -1.826 14.907 1.00 0.00 H new HETATM 0 H3' GDP A 524 -9.496 -1.284 17.556 1.00 0.00 H new HETATM 0 H2' GDP A 524 -9.628 1.218 17.279 1.00 0.00 H new HETATM 0 H1' GDP A 524 -7.146 0.921 15.500 1.00 0.00 H new