USER MOD reduce.3.24.130724 H: found=0, std=0, add=785, rem=0, adj=35 USER MOD reduce.3.24.130724 removed 785 hydrogens (27 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 505 TYR OH : rot 180:sc= 0.66 USER MOD Set 1.2: A 511 LYS NZ :NH3+ -168:sc= 0.74 (180deg=0) USER MOD Set 2.1: A 489 ASN : amide:sc= 0.537 K(o=1.1,f=-1.4) USER MOD Set 2.2: A 492 LYS NZ :NH3+ 163:sc= 0.596 (180deg=0) USER MOD Set 3.1: A 479 SER OG : rot 180:sc= 0.625 USER MOD Set 3.2: A 480 GLN : amide:sc= 0.503 K(o=2.4,f=0.34) USER MOD Set 3.3: A 483 GLN : amide:sc= 1.24 K(o=2.4,f=0.34) USER MOD Set 4.1: A 442 HIS : no HD1:sc= 0.247 K(o=4.6,f=-6.7) USER MOD Set 4.2: A 444 THR OG1 : rot 180:sc= 0 USER MOD Set 4.3: A 473 SER OG : rot 180:sc= 0 USER MOD Set 4.4: A 500 GLN : amide:sc= 2.06 K(o=4.6,f=-4.9!) USER MOD Set 4.5: A 508 LYS NZ :NH3+ -158:sc= 2.31 (180deg=0.558) USER MOD Single : A 424 SER OG : rot 180:sc= 0 USER MOD Single : A 425 SER OG : rot 180:sc=0.000543 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= 1.1 K(o=1.1,f=0) USER MOD Single : A 436 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 439 HIS : no HD1:sc= 0.171 K(o=0.17,f=-1.3!) USER MOD Single : A 447 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 450 LYS NZ :NH3+ -175:sc= 0.727 (180deg=0.707) USER MOD Single : A 451 THR OG1 : rot 180:sc= 0.0384 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= 0.39 X(o=0.39,f=-0.014) USER MOD Single : A 459 SER OG : rot 180:sc= 0 USER MOD Single : A 463 ASN : amide:sc= 0 X(o=0,f=-0.2) USER MOD Single : A 465 GLN : amide:sc= 0.869 K(o=0.87,f=-0.028) 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 485 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 490 THR OG1 : rot -79:sc= 0.858 USER MOD Single : A 491 SER OG : rot 172:sc= 0.0866 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= 0.528 USER MOD Single : A 502 TYR OH : rot 180:sc= 0 USER MOD Single : A 509 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 510 GLN : amide:sc= 1.3 K(o=1.3,f=-3.6!) USER MOD Single : A 513 LYS NZ :NH3+ 170:sc= 1.19 (180deg=1.15) USER MOD Single : A 514 GLN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 516 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.00861) USER MOD Single : A 517 SER OG : rot 180:sc= 0 USER MOD Single : A 520 SER OG : rot 180:sc= 0 USER MOD Single : A 521 SER OG : rot 180:sc= 0 USER MOD Single : A 523 7MG O2' : rot -20:sc= 0.063 USER MOD Single : A 523 7MG O3' : rot 180:sc= 0.0695 USER MOD Single : A 524 GDP O2' : rot 180:sc= 0 USER MOD Single : A 524 GDP O3' : rot 134:sc= 0.0668 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 423 -12.199 -16.664 -12.006 1.00 0.00 N ATOM 2 CA GLY A 423 -11.981 -17.153 -10.628 1.00 0.00 C ATOM 3 C GLY A 423 -12.704 -18.468 -10.395 1.00 0.00 C ATOM 4 O GLY A 423 -12.662 -19.365 -11.241 1.00 0.00 O ATOM 0 HA2 GLY A 423 -10.914 -17.284 -10.450 1.00 0.00 H new ATOM 0 HA3 GLY A 423 -12.334 -16.409 -9.914 1.00 0.00 H new ATOM 10 N SER A 424 -13.420 -18.583 -9.270 1.00 0.00 N ATOM 11 CA SER A 424 -14.225 -19.765 -8.882 1.00 0.00 C ATOM 12 C SER A 424 -15.291 -20.182 -9.914 1.00 0.00 C ATOM 13 O SER A 424 -15.777 -21.315 -9.886 1.00 0.00 O ATOM 14 CB SER A 424 -14.908 -19.512 -7.530 1.00 0.00 C ATOM 15 OG SER A 424 -13.966 -19.101 -6.546 1.00 0.00 O ATOM 0 H SER A 424 -13.461 -17.836 -8.577 1.00 0.00 H new ATOM 0 HA SER A 424 -13.517 -20.591 -8.821 1.00 0.00 H new ATOM 0 HB2 SER A 424 -15.675 -18.746 -7.645 1.00 0.00 H new ATOM 0 HB3 SER A 424 -15.411 -20.420 -7.198 1.00 0.00 H new ATOM 0 HG SER A 424 -14.428 -18.945 -5.696 1.00 0.00 H new ATOM 21 N SER A 425 -15.629 -19.289 -10.850 1.00 0.00 N ATOM 22 CA SER A 425 -16.444 -19.541 -12.047 1.00 0.00 C ATOM 23 C SER A 425 -15.894 -20.637 -12.980 1.00 0.00 C ATOM 24 O SER A 425 -16.678 -21.253 -13.708 1.00 0.00 O ATOM 25 CB SER A 425 -16.592 -18.229 -12.830 1.00 0.00 C ATOM 26 OG SER A 425 -15.322 -17.618 -13.051 1.00 0.00 O ATOM 0 H SER A 425 -15.325 -18.317 -10.791 1.00 0.00 H new ATOM 0 HA SER A 425 -17.405 -19.912 -11.692 1.00 0.00 H new ATOM 0 HB2 SER A 425 -17.076 -18.425 -13.787 1.00 0.00 H new ATOM 0 HB3 SER A 425 -17.238 -17.544 -12.280 1.00 0.00 H new ATOM 0 HG SER A 425 -15.443 -16.785 -13.553 1.00 0.00 H new ATOM 32 N GLY A 426 -14.581 -20.917 -12.953 1.00 0.00 N ATOM 33 CA GLY A 426 -13.981 -22.074 -13.640 1.00 0.00 C ATOM 34 C GLY A 426 -12.527 -21.936 -14.124 1.00 0.00 C ATOM 35 O GLY A 426 -12.033 -22.860 -14.776 1.00 0.00 O ATOM 0 H GLY A 426 -13.902 -20.345 -12.452 1.00 0.00 H new ATOM 0 HA2 GLY A 426 -14.032 -22.929 -12.966 1.00 0.00 H new ATOM 0 HA3 GLY A 426 -14.602 -22.312 -14.504 1.00 0.00 H new ATOM 39 N SER A 427 -11.834 -20.819 -13.860 1.00 0.00 N ATOM 40 CA SER A 427 -10.457 -20.581 -14.337 1.00 0.00 C ATOM 41 C SER A 427 -9.685 -19.575 -13.471 1.00 0.00 C ATOM 42 O SER A 427 -10.261 -18.633 -12.922 1.00 0.00 O ATOM 43 CB SER A 427 -10.495 -20.065 -15.784 1.00 0.00 C ATOM 44 OG SER A 427 -9.183 -19.963 -16.321 1.00 0.00 O ATOM 0 H SER A 427 -12.212 -20.049 -13.307 1.00 0.00 H new ATOM 0 HA SER A 427 -9.934 -21.535 -14.274 1.00 0.00 H new ATOM 0 HB2 SER A 427 -11.092 -20.738 -16.399 1.00 0.00 H new ATOM 0 HB3 SER A 427 -10.981 -19.090 -15.814 1.00 0.00 H new ATOM 0 HG SER A 427 -9.232 -19.634 -17.243 1.00 0.00 H new ATOM 50 N SER A 428 -8.362 -19.744 -13.404 1.00 0.00 N ATOM 51 CA SER A 428 -7.410 -18.909 -12.650 1.00 0.00 C ATOM 52 C SER A 428 -6.337 -18.244 -13.534 1.00 0.00 C ATOM 53 O SER A 428 -5.488 -17.504 -13.029 1.00 0.00 O ATOM 54 CB SER A 428 -6.750 -19.766 -11.561 1.00 0.00 C ATOM 55 OG SER A 428 -6.073 -20.874 -12.142 1.00 0.00 O ATOM 0 H SER A 428 -7.897 -20.505 -13.898 1.00 0.00 H new ATOM 0 HA SER A 428 -7.977 -18.090 -12.206 1.00 0.00 H new ATOM 0 HB2 SER A 428 -6.046 -19.161 -10.990 1.00 0.00 H new ATOM 0 HB3 SER A 428 -7.506 -20.121 -10.861 1.00 0.00 H new ATOM 0 HG SER A 428 -5.656 -21.410 -11.435 1.00 0.00 H new ATOM 61 N GLY A 429 -6.369 -18.487 -14.852 1.00 0.00 N ATOM 62 CA GLY A 429 -5.475 -17.896 -15.860 1.00 0.00 C ATOM 63 C GLY A 429 -4.454 -18.880 -16.450 1.00 0.00 C ATOM 64 O GLY A 429 -4.072 -18.743 -17.616 1.00 0.00 O ATOM 0 H GLY A 429 -7.047 -19.128 -15.263 1.00 0.00 H new ATOM 0 HA2 GLY A 429 -6.079 -17.487 -16.670 1.00 0.00 H new ATOM 0 HA3 GLY A 429 -4.939 -17.061 -15.409 1.00 0.00 H new ATOM 68 N GLY A 430 -4.036 -19.889 -15.679 1.00 0.00 N ATOM 69 CA GLY A 430 -3.102 -20.939 -16.109 1.00 0.00 C ATOM 70 C GLY A 430 -2.497 -21.758 -14.953 1.00 0.00 C ATOM 71 O GLY A 430 -2.736 -21.445 -13.780 1.00 0.00 O ATOM 0 H GLY A 430 -4.345 -20.003 -14.714 1.00 0.00 H new ATOM 0 HA2 GLY A 430 -3.622 -21.617 -16.786 1.00 0.00 H new ATOM 0 HA3 GLY A 430 -2.293 -20.480 -16.676 1.00 0.00 H new ATOM 75 N PRO A 431 -1.708 -22.808 -15.261 1.00 0.00 N ATOM 76 CA PRO A 431 -1.052 -23.670 -14.268 1.00 0.00 C ATOM 77 C PRO A 431 0.203 -23.043 -13.622 1.00 0.00 C ATOM 78 O PRO A 431 0.747 -23.594 -12.662 1.00 0.00 O ATOM 79 CB PRO A 431 -0.691 -24.940 -15.047 1.00 0.00 C ATOM 80 CG PRO A 431 -0.407 -24.416 -16.454 1.00 0.00 C ATOM 81 CD PRO A 431 -1.426 -23.287 -16.609 1.00 0.00 C ATOM 0 HA PRO A 431 -1.716 -23.851 -13.423 1.00 0.00 H new ATOM 0 HB2 PRO A 431 0.178 -25.441 -14.621 1.00 0.00 H new ATOM 0 HB3 PRO A 431 -1.508 -25.661 -15.043 1.00 0.00 H new ATOM 0 HG2 PRO A 431 0.616 -24.053 -16.551 1.00 0.00 H new ATOM 0 HG3 PRO A 431 -0.544 -25.190 -17.209 1.00 0.00 H new ATOM 0 HD2 PRO A 431 -1.028 -22.486 -17.232 1.00 0.00 H new ATOM 0 HD3 PRO A 431 -2.334 -23.646 -17.093 1.00 0.00 H new ATOM 89 N ASP A 432 0.684 -21.913 -14.148 1.00 0.00 N ATOM 90 CA ASP A 432 1.832 -21.148 -13.640 1.00 0.00 C ATOM 91 C ASP A 432 1.611 -20.527 -12.239 1.00 0.00 C ATOM 92 O ASP A 432 0.493 -20.494 -11.713 1.00 0.00 O ATOM 93 CB ASP A 432 2.207 -20.076 -14.675 1.00 0.00 C ATOM 94 CG ASP A 432 1.131 -18.988 -14.812 1.00 0.00 C ATOM 95 OD1 ASP A 432 0.133 -19.209 -15.539 1.00 0.00 O ATOM 96 OD2 ASP A 432 1.302 -17.901 -14.210 1.00 0.00 O ATOM 0 H ASP A 432 0.268 -21.486 -14.975 1.00 0.00 H new ATOM 0 HA ASP A 432 2.655 -21.849 -13.502 1.00 0.00 H new ATOM 0 HB2 ASP A 432 3.152 -19.614 -14.389 1.00 0.00 H new ATOM 0 HB3 ASP A 432 2.365 -20.550 -15.644 1.00 0.00 H new ATOM 101 N LEU A 433 2.693 -20.012 -11.641 1.00 0.00 N ATOM 102 CA LEU A 433 2.767 -19.564 -10.238 1.00 0.00 C ATOM 103 C LEU A 433 3.221 -18.091 -10.102 1.00 0.00 C ATOM 104 O LEU A 433 3.794 -17.694 -9.082 1.00 0.00 O ATOM 105 CB LEU A 433 3.676 -20.539 -9.452 1.00 0.00 C ATOM 106 CG LEU A 433 3.212 -22.010 -9.418 1.00 0.00 C ATOM 107 CD1 LEU A 433 4.255 -22.858 -8.688 1.00 0.00 C ATOM 108 CD2 LEU A 433 1.873 -22.187 -8.696 1.00 0.00 C ATOM 0 H LEU A 433 3.576 -19.890 -12.137 1.00 0.00 H new ATOM 0 HA LEU A 433 1.765 -19.586 -9.809 1.00 0.00 H new ATOM 0 HB2 LEU A 433 4.676 -20.503 -9.885 1.00 0.00 H new ATOM 0 HB3 LEU A 433 3.760 -20.180 -8.426 1.00 0.00 H new ATOM 0 HG LEU A 433 3.091 -22.327 -10.454 1.00 0.00 H new ATOM 0 HD11 LEU A 433 3.927 -23.897 -8.664 1.00 0.00 H new ATOM 0 HD12 LEU A 433 5.209 -22.791 -9.211 1.00 0.00 H new ATOM 0 HD13 LEU A 433 4.373 -22.491 -7.668 1.00 0.00 H new ATOM 0 HD21 LEU A 433 1.593 -23.240 -8.701 1.00 0.00 H new ATOM 0 HD22 LEU A 433 1.966 -21.841 -7.666 1.00 0.00 H new ATOM 0 HD23 LEU A 433 1.105 -21.605 -9.206 1.00 0.00 H new ATOM 120 N GLN A 434 2.992 -17.273 -11.136 1.00 0.00 N ATOM 121 CA GLN A 434 3.276 -15.828 -11.136 1.00 0.00 C ATOM 122 C GLN A 434 2.485 -15.060 -10.042 1.00 0.00 C ATOM 123 O GLN A 434 1.440 -15.547 -9.587 1.00 0.00 O ATOM 124 CB GLN A 434 2.956 -15.251 -12.527 1.00 0.00 C ATOM 125 CG GLN A 434 3.912 -15.765 -13.615 1.00 0.00 C ATOM 126 CD GLN A 434 3.534 -15.225 -14.992 1.00 0.00 C ATOM 127 OE1 GLN A 434 4.156 -14.318 -15.534 1.00 0.00 O ATOM 128 NE2 GLN A 434 2.497 -15.753 -15.607 1.00 0.00 N ATOM 0 H GLN A 434 2.596 -17.602 -12.016 1.00 0.00 H new ATOM 0 HA GLN A 434 4.333 -15.698 -10.905 1.00 0.00 H new ATOM 0 HB2 GLN A 434 1.932 -15.510 -12.797 1.00 0.00 H new ATOM 0 HB3 GLN A 434 3.010 -14.163 -12.486 1.00 0.00 H new ATOM 0 HG2 GLN A 434 4.933 -15.468 -13.374 1.00 0.00 H new ATOM 0 HG3 GLN A 434 3.893 -16.855 -13.632 1.00 0.00 H new ATOM 0 HE21 GLN A 434 1.972 -16.508 -15.165 1.00 0.00 H new ATOM 0 HE22 GLN A 434 2.218 -15.407 -16.525 1.00 0.00 H new ATOM 137 N PRO A 435 2.941 -13.857 -9.622 1.00 0.00 N ATOM 138 CA PRO A 435 2.232 -12.991 -8.670 1.00 0.00 C ATOM 139 C PRO A 435 0.757 -12.703 -9.011 1.00 0.00 C ATOM 140 O PRO A 435 0.344 -12.736 -10.175 1.00 0.00 O ATOM 141 CB PRO A 435 3.038 -11.687 -8.619 1.00 0.00 C ATOM 142 CG PRO A 435 4.454 -12.133 -8.968 1.00 0.00 C ATOM 143 CD PRO A 435 4.218 -13.249 -9.983 1.00 0.00 C ATOM 0 HA PRO A 435 2.174 -13.505 -7.710 1.00 0.00 H new ATOM 0 HB2 PRO A 435 2.661 -10.953 -9.331 1.00 0.00 H new ATOM 0 HB3 PRO A 435 2.994 -11.226 -7.633 1.00 0.00 H new ATOM 0 HG2 PRO A 435 5.041 -11.319 -9.392 1.00 0.00 H new ATOM 0 HG3 PRO A 435 4.993 -12.492 -8.091 1.00 0.00 H new ATOM 0 HD2 PRO A 435 4.189 -12.853 -10.998 1.00 0.00 H new ATOM 0 HD3 PRO A 435 5.023 -13.983 -9.950 1.00 0.00 H new ATOM 151 N LYS A 436 -0.021 -12.344 -7.979 1.00 0.00 N ATOM 152 CA LYS A 436 -1.480 -12.093 -8.034 1.00 0.00 C ATOM 153 C LYS A 436 -1.910 -10.775 -7.363 1.00 0.00 C ATOM 154 O LYS A 436 -3.069 -10.616 -6.972 1.00 0.00 O ATOM 155 CB LYS A 436 -2.228 -13.329 -7.489 1.00 0.00 C ATOM 156 CG LYS A 436 -1.959 -13.628 -6.002 1.00 0.00 C ATOM 157 CD LYS A 436 -2.771 -14.848 -5.538 1.00 0.00 C ATOM 158 CE LYS A 436 -2.577 -15.156 -4.046 1.00 0.00 C ATOM 159 NZ LYS A 436 -1.221 -15.689 -3.746 1.00 0.00 N ATOM 0 H LYS A 436 0.359 -12.214 -7.042 1.00 0.00 H new ATOM 0 HA LYS A 436 -1.760 -11.949 -9.078 1.00 0.00 H new ATOM 0 HB2 LYS A 436 -3.299 -13.183 -7.630 1.00 0.00 H new ATOM 0 HB3 LYS A 436 -1.945 -14.200 -8.080 1.00 0.00 H new ATOM 0 HG2 LYS A 436 -0.896 -13.813 -5.850 1.00 0.00 H new ATOM 0 HG3 LYS A 436 -2.221 -12.759 -5.398 1.00 0.00 H new ATOM 0 HD2 LYS A 436 -3.829 -14.671 -5.734 1.00 0.00 H new ATOM 0 HD3 LYS A 436 -2.479 -15.718 -6.126 1.00 0.00 H new ATOM 0 HE2 LYS A 436 -2.743 -14.248 -3.466 1.00 0.00 H new ATOM 0 HE3 LYS A 436 -3.327 -15.880 -3.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 436 -1.141 -15.881 -2.727 1.00 0.00 H new ATOM 0 HZ2 LYS A 436 -1.069 -16.570 -4.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 436 -0.504 -14.989 -4.024 1.00 0.00 H new ATOM 173 N ARG A 437 -0.966 -9.841 -7.191 1.00 0.00 N ATOM 174 CA ARG A 437 -1.102 -8.550 -6.474 1.00 0.00 C ATOM 175 C ARG A 437 -0.583 -7.354 -7.296 1.00 0.00 C ATOM 176 O ARG A 437 -0.349 -6.277 -6.755 1.00 0.00 O ATOM 177 CB ARG A 437 -0.371 -8.643 -5.115 1.00 0.00 C ATOM 178 CG ARG A 437 -0.882 -9.692 -4.109 1.00 0.00 C ATOM 179 CD ARG A 437 -2.226 -9.344 -3.451 1.00 0.00 C ATOM 180 NE ARG A 437 -3.370 -9.694 -4.311 1.00 0.00 N ATOM 181 CZ ARG A 437 -4.650 -9.668 -4.000 1.00 0.00 C ATOM 182 NH1 ARG A 437 -5.083 -9.219 -2.856 1.00 0.00 N ATOM 183 NH2 ARG A 437 -5.523 -10.112 -4.855 1.00 0.00 N ATOM 0 H ARG A 437 -0.027 -9.966 -7.569 1.00 0.00 H new ATOM 0 HA ARG A 437 -2.164 -8.368 -6.312 1.00 0.00 H new ATOM 0 HB2 ARG A 437 0.681 -8.848 -5.311 1.00 0.00 H new ATOM 0 HB3 ARG A 437 -0.421 -7.665 -4.637 1.00 0.00 H new ATOM 0 HG2 ARG A 437 -0.980 -10.650 -4.620 1.00 0.00 H new ATOM 0 HG3 ARG A 437 -0.133 -9.823 -3.328 1.00 0.00 H new ATOM 0 HD2 ARG A 437 -2.312 -9.872 -2.501 1.00 0.00 H new ATOM 0 HD3 ARG A 437 -2.254 -8.278 -3.227 1.00 0.00 H new ATOM 0 HE ARG A 437 -3.144 -9.992 -5.260 1.00 0.00 H new ATOM 0 HH11 ARG A 437 -4.422 -8.870 -2.162 1.00 0.00 H new ATOM 0 HH12 ARG A 437 -6.083 -9.216 -2.655 1.00 0.00 H new ATOM 0 HH21 ARG A 437 -5.214 -10.476 -5.757 1.00 0.00 H new ATOM 0 HH22 ARG A 437 -6.516 -10.096 -4.624 1.00 0.00 H new ATOM 197 N ASP A 438 -0.399 -7.521 -8.607 1.00 0.00 N ATOM 198 CA ASP A 438 0.102 -6.476 -9.523 1.00 0.00 C ATOM 199 C ASP A 438 -0.820 -5.235 -9.624 1.00 0.00 C ATOM 200 O ASP A 438 -0.383 -4.149 -10.007 1.00 0.00 O ATOM 201 CB ASP A 438 0.330 -7.117 -10.900 1.00 0.00 C ATOM 202 CG ASP A 438 1.117 -6.211 -11.862 1.00 0.00 C ATOM 203 OD1 ASP A 438 2.268 -5.831 -11.533 1.00 0.00 O ATOM 204 OD2 ASP A 438 0.612 -5.923 -12.973 1.00 0.00 O ATOM 0 H ASP A 438 -0.596 -8.403 -9.079 1.00 0.00 H new ATOM 0 HA ASP A 438 1.037 -6.091 -9.116 1.00 0.00 H new ATOM 0 HB2 ASP A 438 0.868 -8.056 -10.773 1.00 0.00 H new ATOM 0 HB3 ASP A 438 -0.635 -7.360 -11.346 1.00 0.00 H new ATOM 209 N HIS A 439 -2.089 -5.384 -9.227 1.00 0.00 N ATOM 210 CA HIS A 439 -3.116 -4.336 -9.123 1.00 0.00 C ATOM 211 C HIS A 439 -3.274 -3.765 -7.692 1.00 0.00 C ATOM 212 O HIS A 439 -4.238 -3.049 -7.411 1.00 0.00 O ATOM 213 CB HIS A 439 -4.436 -4.926 -9.640 1.00 0.00 C ATOM 214 CG HIS A 439 -4.945 -6.071 -8.796 1.00 0.00 C ATOM 215 ND1 HIS A 439 -4.462 -7.384 -8.840 1.00 0.00 N ATOM 216 CD2 HIS A 439 -5.906 -5.987 -7.833 1.00 0.00 C ATOM 217 CE1 HIS A 439 -5.159 -8.062 -7.913 1.00 0.00 C ATOM 218 NE2 HIS A 439 -6.029 -7.247 -7.291 1.00 0.00 N ATOM 0 H HIS A 439 -2.451 -6.297 -8.952 1.00 0.00 H new ATOM 0 HA HIS A 439 -2.807 -3.483 -9.728 1.00 0.00 H new ATOM 0 HB2 HIS A 439 -5.191 -4.141 -9.669 1.00 0.00 H new ATOM 0 HB3 HIS A 439 -4.296 -5.272 -10.664 1.00 0.00 H new ATOM 0 HD2 HIS A 439 -6.462 -5.105 -7.550 1.00 0.00 H new ATOM 0 HE1 HIS A 439 -5.038 -9.113 -7.698 1.00 0.00 H new ATOM 0 HE2 HIS A 439 -6.671 -7.516 -6.545 1.00 0.00 H new ATOM 226 N VAL A 440 -2.338 -4.066 -6.781 1.00 0.00 N ATOM 227 CA VAL A 440 -2.389 -3.696 -5.353 1.00 0.00 C ATOM 228 C VAL A 440 -1.183 -2.832 -4.966 1.00 0.00 C ATOM 229 O VAL A 440 -0.052 -3.040 -5.416 1.00 0.00 O ATOM 230 CB VAL A 440 -2.487 -4.951 -4.452 1.00 0.00 C ATOM 231 CG1 VAL A 440 -2.634 -4.613 -2.959 1.00 0.00 C ATOM 232 CG2 VAL A 440 -3.691 -5.822 -4.839 1.00 0.00 C ATOM 0 H VAL A 440 -1.497 -4.590 -7.022 1.00 0.00 H new ATOM 0 HA VAL A 440 -3.290 -3.104 -5.195 1.00 0.00 H new ATOM 0 HB VAL A 440 -1.549 -5.483 -4.609 1.00 0.00 H new ATOM 0 HG11 VAL A 440 -2.698 -5.535 -2.382 1.00 0.00 H new ATOM 0 HG12 VAL A 440 -1.769 -4.037 -2.629 1.00 0.00 H new ATOM 0 HG13 VAL A 440 -3.540 -4.026 -2.806 1.00 0.00 H new ATOM 0 HG21 VAL A 440 -3.732 -6.695 -4.188 1.00 0.00 H new ATOM 0 HG22 VAL A 440 -4.609 -5.244 -4.729 1.00 0.00 H new ATOM 0 HG23 VAL A 440 -3.588 -6.146 -5.875 1.00 0.00 H new ATOM 242 N LEU A 441 -1.444 -1.861 -4.095 1.00 0.00 N ATOM 243 CA LEU A 441 -0.502 -0.892 -3.546 1.00 0.00 C ATOM 244 C LEU A 441 -0.295 -1.105 -2.045 1.00 0.00 C ATOM 245 O LEU A 441 -1.127 -1.699 -1.361 1.00 0.00 O ATOM 246 CB LEU A 441 -1.082 0.524 -3.732 1.00 0.00 C ATOM 247 CG LEU A 441 -1.245 0.988 -5.184 1.00 0.00 C ATOM 248 CD1 LEU A 441 -1.980 2.322 -5.201 1.00 0.00 C ATOM 249 CD2 LEU A 441 0.110 1.172 -5.862 1.00 0.00 C ATOM 0 H LEU A 441 -2.386 -1.722 -3.729 1.00 0.00 H new ATOM 0 HA LEU A 441 0.449 -1.015 -4.065 1.00 0.00 H new ATOM 0 HB2 LEU A 441 -2.056 0.565 -3.245 1.00 0.00 H new ATOM 0 HB3 LEU A 441 -0.436 1.233 -3.213 1.00 0.00 H new ATOM 0 HG LEU A 441 -1.807 0.226 -5.724 1.00 0.00 H new ATOM 0 HD11 LEU A 441 -2.100 2.658 -6.231 1.00 0.00 H new ATOM 0 HD12 LEU A 441 -2.961 2.203 -4.742 1.00 0.00 H new ATOM 0 HD13 LEU A 441 -1.406 3.061 -4.642 1.00 0.00 H new ATOM 0 HD21 LEU A 441 -0.039 1.501 -6.890 1.00 0.00 H new ATOM 0 HD22 LEU A 441 0.689 1.921 -5.321 1.00 0.00 H new ATOM 0 HD23 LEU A 441 0.650 0.225 -5.859 1.00 0.00 H new ATOM 261 N HIS A 442 0.777 -0.513 -1.535 1.00 0.00 N ATOM 262 CA HIS A 442 1.090 -0.328 -0.123 1.00 0.00 C ATOM 263 C HIS A 442 1.277 1.176 0.113 1.00 0.00 C ATOM 264 O HIS A 442 1.860 1.879 -0.717 1.00 0.00 O ATOM 265 CB HIS A 442 2.347 -1.127 0.241 1.00 0.00 C ATOM 266 CG HIS A 442 2.841 -0.822 1.632 1.00 0.00 C ATOM 267 ND1 HIS A 442 3.792 0.151 1.953 1.00 0.00 N ATOM 268 CD2 HIS A 442 2.361 -1.371 2.785 1.00 0.00 C ATOM 269 CE1 HIS A 442 3.863 0.167 3.296 1.00 0.00 C ATOM 270 NE2 HIS A 442 3.024 -0.743 3.816 1.00 0.00 N ATOM 0 H HIS A 442 1.501 -0.122 -2.138 1.00 0.00 H new ATOM 0 HA HIS A 442 0.286 -0.696 0.515 1.00 0.00 H new ATOM 0 HB2 HIS A 442 2.132 -2.193 0.160 1.00 0.00 H new ATOM 0 HB3 HIS A 442 3.136 -0.905 -0.478 1.00 0.00 H new ATOM 0 HD2 HIS A 442 1.611 -2.143 2.872 1.00 0.00 H new ATOM 0 HE1 HIS A 442 4.503 0.818 3.873 1.00 0.00 H new ATOM 0 HE2 HIS A 442 2.898 -0.937 4.809 1.00 0.00 H new ATOM 278 N VAL A 443 0.751 1.674 1.230 1.00 0.00 N ATOM 279 CA VAL A 443 0.631 3.106 1.534 1.00 0.00 C ATOM 280 C VAL A 443 1.123 3.355 2.955 1.00 0.00 C ATOM 281 O VAL A 443 0.787 2.594 3.864 1.00 0.00 O ATOM 282 CB VAL A 443 -0.833 3.579 1.405 1.00 0.00 C ATOM 283 CG1 VAL A 443 -0.937 5.110 1.398 1.00 0.00 C ATOM 284 CG2 VAL A 443 -1.513 3.083 0.124 1.00 0.00 C ATOM 0 H VAL A 443 0.385 1.079 1.973 1.00 0.00 H new ATOM 0 HA VAL A 443 1.235 3.667 0.821 1.00 0.00 H new ATOM 0 HB VAL A 443 -1.335 3.156 2.275 1.00 0.00 H new ATOM 0 HG11 VAL A 443 -1.983 5.403 1.306 1.00 0.00 H new ATOM 0 HG12 VAL A 443 -0.530 5.507 2.328 1.00 0.00 H new ATOM 0 HG13 VAL A 443 -0.373 5.509 0.555 1.00 0.00 H new ATOM 0 HG21 VAL A 443 -2.539 3.449 0.092 1.00 0.00 H new ATOM 0 HG22 VAL A 443 -0.968 3.454 -0.744 1.00 0.00 H new ATOM 0 HG23 VAL A 443 -1.516 1.993 0.112 1.00 0.00 H new ATOM 294 N THR A 444 1.884 4.432 3.151 1.00 0.00 N ATOM 295 CA THR A 444 2.485 4.814 4.441 1.00 0.00 C ATOM 296 C THR A 444 2.123 6.262 4.771 1.00 0.00 C ATOM 297 O THR A 444 2.174 7.134 3.899 1.00 0.00 O ATOM 298 CB THR A 444 4.015 4.646 4.411 1.00 0.00 C ATOM 299 OG1 THR A 444 4.381 3.384 3.891 1.00 0.00 O ATOM 300 CG2 THR A 444 4.636 4.715 5.806 1.00 0.00 C ATOM 0 H THR A 444 2.109 5.084 2.400 1.00 0.00 H new ATOM 0 HA THR A 444 2.088 4.155 5.213 1.00 0.00 H new ATOM 0 HB THR A 444 4.378 5.463 3.787 1.00 0.00 H new ATOM 0 HG1 THR A 444 5.358 3.305 3.882 1.00 0.00 H new ATOM 0 HG21 THR A 444 5.716 4.591 5.730 1.00 0.00 H new ATOM 0 HG22 THR A 444 4.413 5.682 6.256 1.00 0.00 H new ATOM 0 HG23 THR A 444 4.223 3.921 6.428 1.00 0.00 H new ATOM 308 N PHE A 445 1.735 6.521 6.020 1.00 0.00 N ATOM 309 CA PHE A 445 1.143 7.790 6.468 1.00 0.00 C ATOM 310 C PHE A 445 1.295 8.003 7.995 1.00 0.00 C ATOM 311 O PHE A 445 1.470 7.031 8.737 1.00 0.00 O ATOM 312 CB PHE A 445 -0.351 7.792 6.072 1.00 0.00 C ATOM 313 CG PHE A 445 -1.078 6.466 6.270 1.00 0.00 C ATOM 314 CD1 PHE A 445 -1.354 5.988 7.565 1.00 0.00 C ATOM 315 CD2 PHE A 445 -1.419 5.672 5.156 1.00 0.00 C ATOM 316 CE1 PHE A 445 -1.930 4.720 7.746 1.00 0.00 C ATOM 317 CE2 PHE A 445 -1.995 4.402 5.336 1.00 0.00 C ATOM 318 CZ PHE A 445 -2.245 3.923 6.631 1.00 0.00 C ATOM 0 H PHE A 445 1.825 5.837 6.772 1.00 0.00 H new ATOM 0 HA PHE A 445 1.672 8.612 5.986 1.00 0.00 H new ATOM 0 HB2 PHE A 445 -0.863 8.559 6.653 1.00 0.00 H new ATOM 0 HB3 PHE A 445 -0.432 8.079 5.024 1.00 0.00 H new ATOM 0 HD1 PHE A 445 -1.122 6.600 8.424 1.00 0.00 H new ATOM 0 HD2 PHE A 445 -1.237 6.042 4.158 1.00 0.00 H new ATOM 0 HE1 PHE A 445 -2.131 4.356 8.743 1.00 0.00 H new ATOM 0 HE2 PHE A 445 -2.245 3.796 4.478 1.00 0.00 H new ATOM 0 HZ PHE A 445 -2.679 2.944 6.771 1.00 0.00 H new ATOM 328 N PRO A 446 1.214 9.253 8.499 1.00 0.00 N ATOM 329 CA PRO A 446 1.109 9.551 9.931 1.00 0.00 C ATOM 330 C PRO A 446 -0.046 8.806 10.621 1.00 0.00 C ATOM 331 O PRO A 446 -1.106 8.599 10.026 1.00 0.00 O ATOM 332 CB PRO A 446 0.903 11.069 10.023 1.00 0.00 C ATOM 333 CG PRO A 446 1.529 11.600 8.736 1.00 0.00 C ATOM 334 CD PRO A 446 1.255 10.486 7.729 1.00 0.00 C ATOM 0 HA PRO A 446 2.009 9.218 10.448 1.00 0.00 H new ATOM 0 HB2 PRO A 446 -0.154 11.326 10.089 1.00 0.00 H new ATOM 0 HB3 PRO A 446 1.388 11.486 10.906 1.00 0.00 H new ATOM 0 HG2 PRO A 446 1.076 12.542 8.427 1.00 0.00 H new ATOM 0 HG3 PRO A 446 2.597 11.783 8.853 1.00 0.00 H new ATOM 0 HD2 PRO A 446 0.312 10.653 7.209 1.00 0.00 H new ATOM 0 HD3 PRO A 446 2.035 10.446 6.969 1.00 0.00 H new ATOM 342 N LYS A 447 0.123 8.461 11.905 1.00 0.00 N ATOM 343 CA LYS A 447 -0.848 7.683 12.711 1.00 0.00 C ATOM 344 C LYS A 447 -2.249 8.302 12.849 1.00 0.00 C ATOM 345 O LYS A 447 -3.187 7.608 13.244 1.00 0.00 O ATOM 346 CB LYS A 447 -0.236 7.366 14.090 1.00 0.00 C ATOM 347 CG LYS A 447 -0.031 8.608 14.976 1.00 0.00 C ATOM 348 CD LYS A 447 0.614 8.229 16.315 1.00 0.00 C ATOM 349 CE LYS A 447 0.810 9.482 17.176 1.00 0.00 C ATOM 350 NZ LYS A 447 1.440 9.155 18.481 1.00 0.00 N ATOM 0 H LYS A 447 0.958 8.718 12.432 1.00 0.00 H new ATOM 0 HA LYS A 447 -1.027 6.765 12.151 1.00 0.00 H new ATOM 0 HB2 LYS A 447 -0.883 6.661 14.612 1.00 0.00 H new ATOM 0 HB3 LYS A 447 0.724 6.871 13.946 1.00 0.00 H new ATOM 0 HG2 LYS A 447 0.599 9.330 14.456 1.00 0.00 H new ATOM 0 HG3 LYS A 447 -0.990 9.093 15.155 1.00 0.00 H new ATOM 0 HD2 LYS A 447 -0.015 7.511 16.841 1.00 0.00 H new ATOM 0 HD3 LYS A 447 1.574 7.743 16.141 1.00 0.00 H new ATOM 0 HE2 LYS A 447 1.432 10.199 16.640 1.00 0.00 H new ATOM 0 HE3 LYS A 447 -0.154 9.962 17.347 1.00 0.00 H new ATOM 0 HZ1 LYS A 447 1.558 10.026 19.038 1.00 0.00 H new ATOM 0 HZ2 LYS A 447 0.834 8.490 19.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 447 2.370 8.720 18.318 1.00 0.00 H new ATOM 364 N GLU A 448 -2.399 9.590 12.542 1.00 0.00 N ATOM 365 CA GLU A 448 -3.670 10.329 12.574 1.00 0.00 C ATOM 366 C GLU A 448 -4.535 10.143 11.309 1.00 0.00 C ATOM 367 O GLU A 448 -5.726 10.471 11.334 1.00 0.00 O ATOM 368 CB GLU A 448 -3.384 11.826 12.787 1.00 0.00 C ATOM 369 CG GLU A 448 -2.706 12.112 14.135 1.00 0.00 C ATOM 370 CD GLU A 448 -2.536 13.627 14.357 1.00 0.00 C ATOM 371 OE1 GLU A 448 -1.500 14.198 13.934 1.00 0.00 O ATOM 372 OE2 GLU A 448 -3.434 14.264 14.965 1.00 0.00 O ATOM 0 H GLU A 448 -1.613 10.173 12.253 1.00 0.00 H new ATOM 0 HA GLU A 448 -4.247 9.917 13.402 1.00 0.00 H new ATOM 0 HB2 GLU A 448 -2.747 12.189 11.980 1.00 0.00 H new ATOM 0 HB3 GLU A 448 -4.319 12.383 12.730 1.00 0.00 H new ATOM 0 HG2 GLU A 448 -3.301 11.687 14.943 1.00 0.00 H new ATOM 0 HG3 GLU A 448 -1.732 11.625 14.167 1.00 0.00 H new ATOM 379 N TRP A 449 -3.978 9.615 10.209 1.00 0.00 N ATOM 380 CA TRP A 449 -4.745 9.278 8.999 1.00 0.00 C ATOM 381 C TRP A 449 -5.797 8.197 9.265 1.00 0.00 C ATOM 382 O TRP A 449 -5.592 7.296 10.085 1.00 0.00 O ATOM 383 CB TRP A 449 -3.814 8.820 7.867 1.00 0.00 C ATOM 384 CG TRP A 449 -3.225 9.913 7.029 1.00 0.00 C ATOM 385 CD1 TRP A 449 -2.452 10.929 7.473 1.00 0.00 C ATOM 386 CD2 TRP A 449 -3.362 10.115 5.587 1.00 0.00 C ATOM 387 NE1 TRP A 449 -2.105 11.746 6.413 1.00 0.00 N ATOM 388 CE2 TRP A 449 -2.647 11.297 5.227 1.00 0.00 C ATOM 389 CE3 TRP A 449 -4.026 9.424 4.547 1.00 0.00 C ATOM 390 CZ2 TRP A 449 -2.604 11.778 3.910 1.00 0.00 C ATOM 391 CZ3 TRP A 449 -3.991 9.899 3.222 1.00 0.00 C ATOM 392 CH2 TRP A 449 -3.283 11.072 2.901 1.00 0.00 C ATOM 0 H TRP A 449 -2.982 9.409 10.133 1.00 0.00 H new ATOM 0 HA TRP A 449 -5.262 10.188 8.695 1.00 0.00 H new ATOM 0 HB2 TRP A 449 -2.999 8.242 8.303 1.00 0.00 H new ATOM 0 HB3 TRP A 449 -4.369 8.146 7.215 1.00 0.00 H new ATOM 0 HD1 TRP A 449 -2.151 11.080 8.499 1.00 0.00 H new ATOM 0 HE1 TRP A 449 -1.521 12.578 6.498 1.00 0.00 H new ATOM 0 HE3 TRP A 449 -4.568 8.518 4.773 1.00 0.00 H new ATOM 0 HZ2 TRP A 449 -2.057 12.679 3.674 1.00 0.00 H new ATOM 0 HZ3 TRP A 449 -4.512 9.359 2.445 1.00 0.00 H new ATOM 0 HH2 TRP A 449 -3.261 11.429 1.882 1.00 0.00 H new ATOM 403 N LYS A 450 -6.909 8.262 8.527 1.00 0.00 N ATOM 404 CA LYS A 450 -8.088 7.390 8.661 1.00 0.00 C ATOM 405 C LYS A 450 -8.513 6.798 7.314 1.00 0.00 C ATOM 406 O LYS A 450 -8.122 7.292 6.257 1.00 0.00 O ATOM 407 CB LYS A 450 -9.219 8.196 9.314 1.00 0.00 C ATOM 408 CG LYS A 450 -8.910 8.326 10.810 1.00 0.00 C ATOM 409 CD LYS A 450 -9.890 9.219 11.556 1.00 0.00 C ATOM 410 CE LYS A 450 -9.705 10.717 11.261 1.00 0.00 C ATOM 411 NZ LYS A 450 -8.443 11.258 11.832 1.00 0.00 N ATOM 0 H LYS A 450 -7.021 8.954 7.786 1.00 0.00 H new ATOM 0 HA LYS A 450 -7.839 6.539 9.295 1.00 0.00 H new ATOM 0 HB2 LYS A 450 -9.298 9.181 8.855 1.00 0.00 H new ATOM 0 HB3 LYS A 450 -10.177 7.697 9.165 1.00 0.00 H new ATOM 0 HG2 LYS A 450 -8.918 7.334 11.262 1.00 0.00 H new ATOM 0 HG3 LYS A 450 -7.903 8.724 10.932 1.00 0.00 H new ATOM 0 HD2 LYS A 450 -10.907 8.928 11.292 1.00 0.00 H new ATOM 0 HD3 LYS A 450 -9.778 9.052 12.627 1.00 0.00 H new ATOM 0 HE2 LYS A 450 -9.709 10.875 10.182 1.00 0.00 H new ATOM 0 HE3 LYS A 450 -10.551 11.271 11.667 1.00 0.00 H new ATOM 0 HZ1 LYS A 450 -8.406 12.286 11.680 1.00 0.00 H new ATOM 0 HZ2 LYS A 450 -8.410 11.058 12.852 1.00 0.00 H new ATOM 0 HZ3 LYS A 450 -7.630 10.809 11.364 1.00 0.00 H new ATOM 425 N THR A 451 -9.374 5.779 7.340 1.00 0.00 N ATOM 426 CA THR A 451 -10.008 5.183 6.149 1.00 0.00 C ATOM 427 C THR A 451 -10.652 6.237 5.240 1.00 0.00 C ATOM 428 O THR A 451 -10.579 6.133 4.018 1.00 0.00 O ATOM 429 CB THR A 451 -11.088 4.162 6.547 1.00 0.00 C ATOM 430 OG1 THR A 451 -10.730 3.424 7.697 1.00 0.00 O ATOM 431 CG2 THR A 451 -11.357 3.161 5.427 1.00 0.00 C ATOM 0 H THR A 451 -9.661 5.330 8.209 1.00 0.00 H new ATOM 0 HA THR A 451 -9.207 4.688 5.601 1.00 0.00 H new ATOM 0 HB THR A 451 -11.981 4.752 6.752 1.00 0.00 H new ATOM 0 HG1 THR A 451 -11.445 2.790 7.914 1.00 0.00 H new ATOM 0 HG21 THR A 451 -12.125 2.456 5.746 1.00 0.00 H new ATOM 0 HG22 THR A 451 -11.698 3.692 4.538 1.00 0.00 H new ATOM 0 HG23 THR A 451 -10.440 2.618 5.196 1.00 0.00 H new ATOM 439 N SER A 452 -11.234 7.292 5.818 1.00 0.00 N ATOM 440 CA SER A 452 -11.811 8.413 5.065 1.00 0.00 C ATOM 441 C SER A 452 -10.774 9.235 4.291 1.00 0.00 C ATOM 442 O SER A 452 -11.010 9.587 3.135 1.00 0.00 O ATOM 443 CB SER A 452 -12.542 9.361 6.013 1.00 0.00 C ATOM 444 OG SER A 452 -13.638 8.705 6.633 1.00 0.00 O ATOM 0 H SER A 452 -11.319 7.394 6.829 1.00 0.00 H new ATOM 0 HA SER A 452 -12.490 7.960 4.342 1.00 0.00 H new ATOM 0 HB2 SER A 452 -11.852 9.725 6.774 1.00 0.00 H new ATOM 0 HB3 SER A 452 -12.897 10.232 5.462 1.00 0.00 H new ATOM 0 HG SER A 452 -14.093 9.328 7.238 1.00 0.00 H new ATOM 450 N ASP A 453 -9.609 9.514 4.888 1.00 0.00 N ATOM 451 CA ASP A 453 -8.492 10.180 4.197 1.00 0.00 C ATOM 452 C ASP A 453 -7.940 9.304 3.062 1.00 0.00 C ATOM 453 O ASP A 453 -7.504 9.811 2.028 1.00 0.00 O ATOM 454 CB ASP A 453 -7.348 10.501 5.172 1.00 0.00 C ATOM 455 CG ASP A 453 -7.778 11.382 6.351 1.00 0.00 C ATOM 456 OD1 ASP A 453 -8.211 12.539 6.127 1.00 0.00 O ATOM 457 OD2 ASP A 453 -7.665 10.914 7.508 1.00 0.00 O ATOM 0 H ASP A 453 -9.412 9.286 5.862 1.00 0.00 H new ATOM 0 HA ASP A 453 -8.885 11.108 3.781 1.00 0.00 H new ATOM 0 HB2 ASP A 453 -6.937 9.568 5.557 1.00 0.00 H new ATOM 0 HB3 ASP A 453 -6.547 11.002 4.628 1.00 0.00 H new ATOM 462 N LEU A 454 -8.005 7.981 3.236 1.00 0.00 N ATOM 463 CA LEU A 454 -7.583 6.999 2.234 1.00 0.00 C ATOM 464 C LEU A 454 -8.573 6.930 1.057 1.00 0.00 C ATOM 465 O LEU A 454 -8.153 7.029 -0.097 1.00 0.00 O ATOM 466 CB LEU A 454 -7.372 5.634 2.918 1.00 0.00 C ATOM 467 CG LEU A 454 -6.116 5.570 3.809 1.00 0.00 C ATOM 468 CD1 LEU A 454 -6.128 4.266 4.609 1.00 0.00 C ATOM 469 CD2 LEU A 454 -4.820 5.619 2.995 1.00 0.00 C ATOM 0 H LEU A 454 -8.359 7.555 4.093 1.00 0.00 H new ATOM 0 HA LEU A 454 -6.633 7.310 1.800 1.00 0.00 H new ATOM 0 HB2 LEU A 454 -8.248 5.403 3.524 1.00 0.00 H new ATOM 0 HB3 LEU A 454 -7.302 4.862 2.152 1.00 0.00 H new ATOM 0 HG LEU A 454 -6.142 6.440 4.465 1.00 0.00 H new ATOM 0 HD11 LEU A 454 -5.241 4.218 5.240 1.00 0.00 H new ATOM 0 HD12 LEU A 454 -7.020 4.231 5.234 1.00 0.00 H new ATOM 0 HD13 LEU A 454 -6.132 3.419 3.923 1.00 0.00 H new ATOM 0 HD21 LEU A 454 -3.965 5.571 3.669 1.00 0.00 H new ATOM 0 HD22 LEU A 454 -4.789 4.773 2.309 1.00 0.00 H new ATOM 0 HD23 LEU A 454 -4.782 6.548 2.427 1.00 0.00 H new ATOM 481 N TYR A 455 -9.884 6.869 1.315 1.00 0.00 N ATOM 482 CA TYR A 455 -10.905 7.017 0.268 1.00 0.00 C ATOM 483 C TYR A 455 -10.799 8.362 -0.471 1.00 0.00 C ATOM 484 O TYR A 455 -10.951 8.395 -1.692 1.00 0.00 O ATOM 485 CB TYR A 455 -12.319 6.822 0.843 1.00 0.00 C ATOM 486 CG TYR A 455 -12.776 5.374 0.915 1.00 0.00 C ATOM 487 CD1 TYR A 455 -13.032 4.664 -0.276 1.00 0.00 C ATOM 488 CD2 TYR A 455 -12.983 4.746 2.158 1.00 0.00 C ATOM 489 CE1 TYR A 455 -13.467 3.325 -0.224 1.00 0.00 C ATOM 490 CE2 TYR A 455 -13.417 3.406 2.215 1.00 0.00 C ATOM 491 CZ TYR A 455 -13.652 2.689 1.021 1.00 0.00 C ATOM 492 OH TYR A 455 -14.069 1.393 1.063 1.00 0.00 O ATOM 0 H TYR A 455 -10.267 6.717 2.248 1.00 0.00 H new ATOM 0 HA TYR A 455 -10.717 6.233 -0.466 1.00 0.00 H new ATOM 0 HB2 TYR A 455 -12.352 7.251 1.845 1.00 0.00 H new ATOM 0 HB3 TYR A 455 -13.026 7.383 0.232 1.00 0.00 H new ATOM 0 HD1 TYR A 455 -12.894 5.148 -1.231 1.00 0.00 H new ATOM 0 HD2 TYR A 455 -12.808 5.294 3.072 1.00 0.00 H new ATOM 0 HE1 TYR A 455 -13.659 2.785 -1.139 1.00 0.00 H new ATOM 0 HE2 TYR A 455 -13.570 2.928 3.171 1.00 0.00 H new ATOM 0 HH TYR A 455 -14.146 1.104 1.996 1.00 0.00 H new ATOM 502 N GLN A 456 -10.489 9.461 0.227 1.00 0.00 N ATOM 503 CA GLN A 456 -10.268 10.775 -0.390 1.00 0.00 C ATOM 504 C GLN A 456 -9.002 10.819 -1.270 1.00 0.00 C ATOM 505 O GLN A 456 -9.036 11.412 -2.351 1.00 0.00 O ATOM 506 CB GLN A 456 -10.233 11.850 0.713 1.00 0.00 C ATOM 507 CG GLN A 456 -10.044 13.291 0.204 1.00 0.00 C ATOM 508 CD GLN A 456 -11.165 13.760 -0.724 1.00 0.00 C ATOM 509 OE1 GLN A 456 -12.172 14.316 -0.300 1.00 0.00 O ATOM 510 NE2 GLN A 456 -11.040 13.561 -2.021 1.00 0.00 N ATOM 0 H GLN A 456 -10.384 9.464 1.242 1.00 0.00 H new ATOM 0 HA GLN A 456 -11.098 10.977 -1.067 1.00 0.00 H new ATOM 0 HB2 GLN A 456 -11.162 11.799 1.280 1.00 0.00 H new ATOM 0 HB3 GLN A 456 -9.424 11.615 1.405 1.00 0.00 H new ATOM 0 HG2 GLN A 456 -9.984 13.965 1.058 1.00 0.00 H new ATOM 0 HG3 GLN A 456 -9.093 13.360 -0.324 1.00 0.00 H new ATOM 0 HE21 GLN A 456 -10.208 13.100 -2.388 1.00 0.00 H new ATOM 0 HE22 GLN A 456 -11.776 13.868 -2.657 1.00 0.00 H new ATOM 519 N LEU A 457 -7.903 10.182 -0.847 1.00 0.00 N ATOM 520 CA LEU A 457 -6.636 10.115 -1.587 1.00 0.00 C ATOM 521 C LEU A 457 -6.785 9.327 -2.898 1.00 0.00 C ATOM 522 O LEU A 457 -6.321 9.765 -3.953 1.00 0.00 O ATOM 523 CB LEU A 457 -5.569 9.487 -0.662 1.00 0.00 C ATOM 524 CG LEU A 457 -4.222 9.148 -1.330 1.00 0.00 C ATOM 525 CD1 LEU A 457 -3.553 10.372 -1.953 1.00 0.00 C ATOM 526 CD2 LEU A 457 -3.261 8.555 -0.298 1.00 0.00 C ATOM 0 H LEU A 457 -7.869 9.686 0.043 1.00 0.00 H new ATOM 0 HA LEU A 457 -6.326 11.120 -1.874 1.00 0.00 H new ATOM 0 HB2 LEU A 457 -5.382 10.173 0.164 1.00 0.00 H new ATOM 0 HB3 LEU A 457 -5.980 8.574 -0.231 1.00 0.00 H new ATOM 0 HG LEU A 457 -4.439 8.431 -2.122 1.00 0.00 H new ATOM 0 HD11 LEU A 457 -2.608 10.077 -2.410 1.00 0.00 H new ATOM 0 HD12 LEU A 457 -4.207 10.796 -2.715 1.00 0.00 H new ATOM 0 HD13 LEU A 457 -3.365 11.117 -1.180 1.00 0.00 H new ATOM 0 HD21 LEU A 457 -2.312 8.318 -0.779 1.00 0.00 H new ATOM 0 HD22 LEU A 457 -3.093 9.278 0.500 1.00 0.00 H new ATOM 0 HD23 LEU A 457 -3.692 7.646 0.121 1.00 0.00 H new ATOM 538 N PHE A 458 -7.473 8.186 -2.840 1.00 0.00 N ATOM 539 CA PHE A 458 -7.635 7.267 -3.975 1.00 0.00 C ATOM 540 C PHE A 458 -8.942 7.478 -4.770 1.00 0.00 C ATOM 541 O PHE A 458 -9.220 6.737 -5.715 1.00 0.00 O ATOM 542 CB PHE A 458 -7.438 5.828 -3.476 1.00 0.00 C ATOM 543 CG PHE A 458 -6.002 5.518 -3.090 1.00 0.00 C ATOM 544 CD1 PHE A 458 -5.043 5.287 -4.094 1.00 0.00 C ATOM 545 CD2 PHE A 458 -5.611 5.487 -1.738 1.00 0.00 C ATOM 546 CE1 PHE A 458 -3.701 5.052 -3.751 1.00 0.00 C ATOM 547 CE2 PHE A 458 -4.269 5.251 -1.394 1.00 0.00 C ATOM 548 CZ PHE A 458 -3.313 5.034 -2.401 1.00 0.00 C ATOM 0 H PHE A 458 -7.942 7.867 -1.992 1.00 0.00 H new ATOM 0 HA PHE A 458 -6.865 7.489 -4.713 1.00 0.00 H new ATOM 0 HB2 PHE A 458 -8.083 5.658 -2.614 1.00 0.00 H new ATOM 0 HB3 PHE A 458 -7.756 5.134 -4.254 1.00 0.00 H new ATOM 0 HD1 PHE A 458 -5.340 5.290 -5.132 1.00 0.00 H new ATOM 0 HD2 PHE A 458 -6.345 5.645 -0.962 1.00 0.00 H new ATOM 0 HE1 PHE A 458 -2.967 4.885 -4.526 1.00 0.00 H new ATOM 0 HE2 PHE A 458 -3.972 5.236 -0.356 1.00 0.00 H new ATOM 0 HZ PHE A 458 -2.281 4.854 -2.137 1.00 0.00 H new ATOM 558 N SER A 459 -9.712 8.530 -4.459 1.00 0.00 N ATOM 559 CA SER A 459 -10.919 8.950 -5.200 1.00 0.00 C ATOM 560 C SER A 459 -10.664 9.189 -6.700 1.00 0.00 C ATOM 561 O SER A 459 -11.563 9.003 -7.525 1.00 0.00 O ATOM 562 CB SER A 459 -11.497 10.221 -4.558 1.00 0.00 C ATOM 563 OG SER A 459 -12.811 10.497 -5.020 1.00 0.00 O ATOM 0 H SER A 459 -9.510 9.133 -3.662 1.00 0.00 H new ATOM 0 HA SER A 459 -11.633 8.129 -5.136 1.00 0.00 H new ATOM 0 HB2 SER A 459 -11.510 10.107 -3.474 1.00 0.00 H new ATOM 0 HB3 SER A 459 -10.848 11.068 -4.781 1.00 0.00 H new ATOM 0 HG SER A 459 -13.145 11.311 -4.589 1.00 0.00 H new ATOM 569 N ALA A 460 -9.426 9.538 -7.072 1.00 0.00 N ATOM 570 CA ALA A 460 -8.958 9.689 -8.455 1.00 0.00 C ATOM 571 C ALA A 460 -9.039 8.404 -9.317 1.00 0.00 C ATOM 572 O ALA A 460 -8.874 8.477 -10.539 1.00 0.00 O ATOM 573 CB ALA A 460 -7.520 10.222 -8.400 1.00 0.00 C ATOM 0 H ALA A 460 -8.693 9.731 -6.389 1.00 0.00 H new ATOM 0 HA ALA A 460 -9.631 10.384 -8.956 1.00 0.00 H new ATOM 0 HB1 ALA A 460 -7.139 10.347 -9.414 1.00 0.00 H new ATOM 0 HB2 ALA A 460 -7.508 11.184 -7.887 1.00 0.00 H new ATOM 0 HB3 ALA A 460 -6.890 9.515 -7.860 1.00 0.00 H new ATOM 579 N PHE A 461 -9.308 7.241 -8.709 1.00 0.00 N ATOM 580 CA PHE A 461 -9.306 5.920 -9.354 1.00 0.00 C ATOM 581 C PHE A 461 -10.650 5.168 -9.225 1.00 0.00 C ATOM 582 O PHE A 461 -10.745 3.998 -9.606 1.00 0.00 O ATOM 583 CB PHE A 461 -8.137 5.101 -8.782 1.00 0.00 C ATOM 584 CG PHE A 461 -6.786 5.795 -8.843 1.00 0.00 C ATOM 585 CD1 PHE A 461 -6.132 5.971 -10.077 1.00 0.00 C ATOM 586 CD2 PHE A 461 -6.192 6.286 -7.666 1.00 0.00 C ATOM 587 CE1 PHE A 461 -4.882 6.614 -10.130 1.00 0.00 C ATOM 588 CE2 PHE A 461 -4.945 6.935 -7.717 1.00 0.00 C ATOM 589 CZ PHE A 461 -4.287 7.095 -8.950 1.00 0.00 C ATOM 0 H PHE A 461 -9.542 7.192 -7.717 1.00 0.00 H new ATOM 0 HA PHE A 461 -9.173 6.065 -10.426 1.00 0.00 H new ATOM 0 HB2 PHE A 461 -8.357 4.855 -7.743 1.00 0.00 H new ATOM 0 HB3 PHE A 461 -8.071 4.159 -9.326 1.00 0.00 H new ATOM 0 HD1 PHE A 461 -6.591 5.611 -10.986 1.00 0.00 H new ATOM 0 HD2 PHE A 461 -6.696 6.164 -6.719 1.00 0.00 H new ATOM 0 HE1 PHE A 461 -4.379 6.738 -11.078 1.00 0.00 H new ATOM 0 HE2 PHE A 461 -4.493 7.310 -6.811 1.00 0.00 H new ATOM 0 HZ PHE A 461 -3.326 7.587 -8.990 1.00 0.00 H new ATOM 599 N GLY A 462 -11.702 5.819 -8.712 1.00 0.00 N ATOM 600 CA GLY A 462 -13.034 5.220 -8.544 1.00 0.00 C ATOM 601 C GLY A 462 -13.151 4.348 -7.286 1.00 0.00 C ATOM 602 O GLY A 462 -12.564 4.659 -6.246 1.00 0.00 O ATOM 0 H GLY A 462 -11.652 6.788 -8.398 1.00 0.00 H new ATOM 0 HA2 GLY A 462 -13.779 6.014 -8.498 1.00 0.00 H new ATOM 0 HA3 GLY A 462 -13.266 4.615 -9.420 1.00 0.00 H new ATOM 606 N ASN A 463 -13.940 3.271 -7.362 1.00 0.00 N ATOM 607 CA ASN A 463 -14.092 2.284 -6.284 1.00 0.00 C ATOM 608 C ASN A 463 -12.768 1.543 -5.971 1.00 0.00 C ATOM 609 O ASN A 463 -11.992 1.227 -6.878 1.00 0.00 O ATOM 610 CB ASN A 463 -15.210 1.303 -6.687 1.00 0.00 C ATOM 611 CG ASN A 463 -15.561 0.321 -5.578 1.00 0.00 C ATOM 612 OD1 ASN A 463 -15.629 0.665 -4.406 1.00 0.00 O ATOM 613 ND2 ASN A 463 -15.785 -0.933 -5.904 1.00 0.00 N ATOM 0 H ASN A 463 -14.500 3.056 -8.187 1.00 0.00 H new ATOM 0 HA ASN A 463 -14.362 2.799 -5.362 1.00 0.00 H new ATOM 0 HB2 ASN A 463 -16.101 1.868 -6.962 1.00 0.00 H new ATOM 0 HB3 ASN A 463 -14.899 0.748 -7.572 1.00 0.00 H new ATOM 0 HD21 ASN A 463 -16.014 -1.615 -5.181 1.00 0.00 H new ATOM 0 HD22 ASN A 463 -15.729 -1.224 -6.880 1.00 0.00 H new ATOM 620 N ILE A 464 -12.537 1.234 -4.690 1.00 0.00 N ATOM 621 CA ILE A 464 -11.305 0.625 -4.144 1.00 0.00 C ATOM 622 C ILE A 464 -11.618 -0.338 -2.984 1.00 0.00 C ATOM 623 O ILE A 464 -12.760 -0.427 -2.525 1.00 0.00 O ATOM 624 CB ILE A 464 -10.313 1.720 -3.661 1.00 0.00 C ATOM 625 CG1 ILE A 464 -10.874 2.521 -2.461 1.00 0.00 C ATOM 626 CG2 ILE A 464 -9.887 2.642 -4.815 1.00 0.00 C ATOM 627 CD1 ILE A 464 -9.936 3.611 -1.942 1.00 0.00 C ATOM 0 H ILE A 464 -13.234 1.408 -3.966 1.00 0.00 H new ATOM 0 HA ILE A 464 -10.843 0.055 -4.950 1.00 0.00 H new ATOM 0 HB ILE A 464 -9.418 1.209 -3.307 1.00 0.00 H new ATOM 0 HG12 ILE A 464 -11.818 2.979 -2.754 1.00 0.00 H new ATOM 0 HG13 ILE A 464 -11.094 1.829 -1.648 1.00 0.00 H new ATOM 0 HG21 ILE A 464 -9.194 3.396 -4.442 1.00 0.00 H new ATOM 0 HG22 ILE A 464 -9.399 2.052 -5.591 1.00 0.00 H new ATOM 0 HG23 ILE A 464 -10.766 3.133 -5.232 1.00 0.00 H new ATOM 0 HD11 ILE A 464 -10.404 4.124 -1.102 1.00 0.00 H new ATOM 0 HD12 ILE A 464 -8.999 3.160 -1.615 1.00 0.00 H new ATOM 0 HD13 ILE A 464 -9.735 4.327 -2.738 1.00 0.00 H new ATOM 639 N GLN A 465 -10.592 -1.018 -2.465 1.00 0.00 N ATOM 640 CA GLN A 465 -10.627 -1.795 -1.215 1.00 0.00 C ATOM 641 C GLN A 465 -9.354 -1.509 -0.400 1.00 0.00 C ATOM 642 O GLN A 465 -8.304 -1.215 -0.976 1.00 0.00 O ATOM 643 CB GLN A 465 -10.755 -3.302 -1.513 1.00 0.00 C ATOM 644 CG GLN A 465 -12.109 -3.733 -2.104 1.00 0.00 C ATOM 645 CD GLN A 465 -13.256 -3.646 -1.097 1.00 0.00 C ATOM 646 OE1 GLN A 465 -13.537 -4.578 -0.351 1.00 0.00 O ATOM 647 NE2 GLN A 465 -13.964 -2.539 -1.026 1.00 0.00 N ATOM 0 H GLN A 465 -9.678 -1.046 -2.918 1.00 0.00 H new ATOM 0 HA GLN A 465 -11.499 -1.495 -0.633 1.00 0.00 H new ATOM 0 HB2 GLN A 465 -9.965 -3.589 -2.207 1.00 0.00 H new ATOM 0 HB3 GLN A 465 -10.585 -3.856 -0.590 1.00 0.00 H new ATOM 0 HG2 GLN A 465 -12.340 -3.105 -2.964 1.00 0.00 H new ATOM 0 HG3 GLN A 465 -12.030 -4.757 -2.469 1.00 0.00 H new ATOM 0 HE21 GLN A 465 -13.745 -1.753 -1.638 1.00 0.00 H new ATOM 0 HE22 GLN A 465 -14.732 -2.467 -0.358 1.00 0.00 H new ATOM 656 N ILE A 466 -9.439 -1.593 0.932 1.00 0.00 N ATOM 657 CA ILE A 466 -8.386 -1.178 1.880 1.00 0.00 C ATOM 658 C ILE A 466 -8.194 -2.279 2.938 1.00 0.00 C ATOM 659 O ILE A 466 -9.171 -2.784 3.497 1.00 0.00 O ATOM 660 CB ILE A 466 -8.753 0.180 2.543 1.00 0.00 C ATOM 661 CG1 ILE A 466 -9.018 1.293 1.494 1.00 0.00 C ATOM 662 CG2 ILE A 466 -7.642 0.617 3.522 1.00 0.00 C ATOM 663 CD1 ILE A 466 -9.552 2.608 2.077 1.00 0.00 C ATOM 0 H ILE A 466 -10.267 -1.963 1.400 1.00 0.00 H new ATOM 0 HA ILE A 466 -7.448 -1.038 1.343 1.00 0.00 H new ATOM 0 HB ILE A 466 -9.680 0.030 3.096 1.00 0.00 H new ATOM 0 HG12 ILE A 466 -8.090 1.498 0.960 1.00 0.00 H new ATOM 0 HG13 ILE A 466 -9.733 0.920 0.760 1.00 0.00 H new ATOM 0 HG21 ILE A 466 -7.913 1.569 3.978 1.00 0.00 H new ATOM 0 HG22 ILE A 466 -7.525 -0.138 4.300 1.00 0.00 H new ATOM 0 HG23 ILE A 466 -6.703 0.729 2.980 1.00 0.00 H new ATOM 0 HD11 ILE A 466 -9.707 3.326 1.272 1.00 0.00 H new ATOM 0 HD12 ILE A 466 -10.498 2.423 2.586 1.00 0.00 H new ATOM 0 HD13 ILE A 466 -8.830 3.010 2.788 1.00 0.00 H new ATOM 675 N SER A 467 -6.938 -2.642 3.219 1.00 0.00 N ATOM 676 CA SER A 467 -6.542 -3.705 4.154 1.00 0.00 C ATOM 677 C SER A 467 -5.375 -3.256 5.042 1.00 0.00 C ATOM 678 O SER A 467 -4.219 -3.245 4.614 1.00 0.00 O ATOM 679 CB SER A 467 -6.152 -4.966 3.374 1.00 0.00 C ATOM 680 OG SER A 467 -7.288 -5.591 2.792 1.00 0.00 O ATOM 0 H SER A 467 -6.136 -2.186 2.785 1.00 0.00 H new ATOM 0 HA SER A 467 -7.392 -3.926 4.799 1.00 0.00 H new ATOM 0 HB2 SER A 467 -5.439 -4.705 2.592 1.00 0.00 H new ATOM 0 HB3 SER A 467 -5.651 -5.668 4.041 1.00 0.00 H new ATOM 0 HG SER A 467 -7.006 -6.390 2.301 1.00 0.00 H new ATOM 686 N TRP A 468 -5.673 -2.860 6.281 1.00 0.00 N ATOM 687 CA TRP A 468 -4.682 -2.418 7.274 1.00 0.00 C ATOM 688 C TRP A 468 -3.628 -3.480 7.621 1.00 0.00 C ATOM 689 O TRP A 468 -3.923 -4.680 7.640 1.00 0.00 O ATOM 690 CB TRP A 468 -5.404 -2.032 8.568 1.00 0.00 C ATOM 691 CG TRP A 468 -6.373 -0.899 8.455 1.00 0.00 C ATOM 692 CD1 TRP A 468 -7.718 -1.006 8.397 1.00 0.00 C ATOM 693 CD2 TRP A 468 -6.087 0.528 8.430 1.00 0.00 C ATOM 694 NE1 TRP A 468 -8.276 0.249 8.232 1.00 0.00 N ATOM 695 CE2 TRP A 468 -7.309 1.233 8.223 1.00 0.00 C ATOM 696 CE3 TRP A 468 -4.916 1.296 8.585 1.00 0.00 C ATOM 697 CZ2 TRP A 468 -7.352 2.628 8.082 1.00 0.00 C ATOM 698 CZ3 TRP A 468 -4.956 2.697 8.467 1.00 0.00 C ATOM 699 CH2 TRP A 468 -6.161 3.364 8.186 1.00 0.00 C ATOM 0 H TRP A 468 -6.630 -2.836 6.633 1.00 0.00 H new ATOM 0 HA TRP A 468 -4.159 -1.575 6.823 1.00 0.00 H new ATOM 0 HB2 TRP A 468 -5.937 -2.907 8.940 1.00 0.00 H new ATOM 0 HB3 TRP A 468 -4.656 -1.773 9.317 1.00 0.00 H new ATOM 0 HD1 TRP A 468 -8.273 -1.930 8.468 1.00 0.00 H new ATOM 0 HE1 TRP A 468 -9.276 0.425 8.130 1.00 0.00 H new ATOM 0 HE3 TRP A 468 -3.978 0.804 8.797 1.00 0.00 H new ATOM 0 HZ2 TRP A 468 -8.290 3.130 7.896 1.00 0.00 H new ATOM 0 HZ3 TRP A 468 -4.048 3.268 8.594 1.00 0.00 H new ATOM 0 HH2 TRP A 468 -6.171 4.435 8.051 1.00 0.00 H new ATOM 710 N ILE A 469 -2.428 -3.021 7.998 1.00 0.00 N ATOM 711 CA ILE A 469 -1.357 -3.846 8.578 1.00 0.00 C ATOM 712 C ILE A 469 -0.679 -3.205 9.802 1.00 0.00 C ATOM 713 O ILE A 469 -0.088 -3.921 10.613 1.00 0.00 O ATOM 714 CB ILE A 469 -0.307 -4.221 7.514 1.00 0.00 C ATOM 715 CG1 ILE A 469 0.295 -3.006 6.775 1.00 0.00 C ATOM 716 CG2 ILE A 469 -0.898 -5.231 6.523 1.00 0.00 C ATOM 717 CD1 ILE A 469 1.528 -3.363 5.940 1.00 0.00 C ATOM 0 H ILE A 469 -2.167 -2.039 7.906 1.00 0.00 H new ATOM 0 HA ILE A 469 -1.844 -4.753 8.936 1.00 0.00 H new ATOM 0 HB ILE A 469 0.526 -4.678 8.048 1.00 0.00 H new ATOM 0 HG12 ILE A 469 -0.464 -2.571 6.124 1.00 0.00 H new ATOM 0 HG13 ILE A 469 0.566 -2.242 7.504 1.00 0.00 H new ATOM 0 HG21 ILE A 469 -0.148 -5.489 5.776 1.00 0.00 H new ATOM 0 HG22 ILE A 469 -1.202 -6.131 7.058 1.00 0.00 H new ATOM 0 HG23 ILE A 469 -1.765 -4.792 6.030 1.00 0.00 H new ATOM 0 HD11 ILE A 469 1.904 -2.467 5.446 1.00 0.00 H new ATOM 0 HD12 ILE A 469 2.302 -3.771 6.590 1.00 0.00 H new ATOM 0 HD13 ILE A 469 1.257 -4.105 5.189 1.00 0.00 H new ATOM 729 N ASP A 470 -0.790 -1.885 9.980 1.00 0.00 N ATOM 730 CA ASP A 470 -0.274 -1.151 11.148 1.00 0.00 C ATOM 731 C ASP A 470 -1.085 0.135 11.432 1.00 0.00 C ATOM 732 O ASP A 470 -2.023 0.479 10.708 1.00 0.00 O ATOM 733 CB ASP A 470 1.218 -0.826 10.923 1.00 0.00 C ATOM 734 CG ASP A 470 2.037 -0.899 12.224 1.00 0.00 C ATOM 735 OD1 ASP A 470 1.920 0.020 13.067 1.00 0.00 O ATOM 736 OD2 ASP A 470 2.801 -1.878 12.412 1.00 0.00 O ATOM 0 H ASP A 470 -1.252 -1.279 9.302 1.00 0.00 H new ATOM 0 HA ASP A 470 -0.381 -1.785 12.028 1.00 0.00 H new ATOM 0 HB2 ASP A 470 1.633 -1.524 10.196 1.00 0.00 H new ATOM 0 HB3 ASP A 470 1.309 0.172 10.495 1.00 0.00 H new ATOM 741 N ASP A 471 -0.688 0.885 12.461 1.00 0.00 N ATOM 742 CA ASP A 471 -1.192 2.236 12.763 1.00 0.00 C ATOM 743 C ASP A 471 -0.841 3.261 11.667 1.00 0.00 C ATOM 744 O ASP A 471 -1.543 4.262 11.505 1.00 0.00 O ATOM 745 CB ASP A 471 -0.580 2.729 14.085 1.00 0.00 C ATOM 746 CG ASP A 471 -1.240 2.106 15.324 1.00 0.00 C ATOM 747 OD1 ASP A 471 -2.209 2.714 15.839 1.00 0.00 O ATOM 748 OD2 ASP A 471 -0.765 1.054 15.818 1.00 0.00 O ATOM 0 H ASP A 471 0.013 0.565 13.129 1.00 0.00 H new ATOM 0 HA ASP A 471 -2.277 2.159 12.826 1.00 0.00 H new ATOM 0 HB2 ASP A 471 0.485 2.498 14.094 1.00 0.00 H new ATOM 0 HB3 ASP A 471 -0.672 3.814 14.139 1.00 0.00 H new ATOM 753 N THR A 472 0.238 3.011 10.918 1.00 0.00 N ATOM 754 CA THR A 472 0.880 3.954 9.981 1.00 0.00 C ATOM 755 C THR A 472 1.030 3.412 8.555 1.00 0.00 C ATOM 756 O THR A 472 1.615 4.087 7.704 1.00 0.00 O ATOM 757 CB THR A 472 2.262 4.380 10.516 1.00 0.00 C ATOM 758 OG1 THR A 472 3.065 3.248 10.802 1.00 0.00 O ATOM 759 CG2 THR A 472 2.150 5.192 11.807 1.00 0.00 C ATOM 0 H THR A 472 0.712 2.108 10.946 1.00 0.00 H new ATOM 0 HA THR A 472 0.210 4.812 9.919 1.00 0.00 H new ATOM 0 HB THR A 472 2.713 4.989 9.733 1.00 0.00 H new ATOM 0 HG1 THR A 472 3.937 3.542 11.138 1.00 0.00 H new ATOM 0 HG21 THR A 472 3.147 5.471 12.149 1.00 0.00 H new ATOM 0 HG22 THR A 472 1.565 6.092 11.621 1.00 0.00 H new ATOM 0 HG23 THR A 472 1.659 4.592 12.573 1.00 0.00 H new ATOM 767 N SER A 473 0.512 2.212 8.259 1.00 0.00 N ATOM 768 CA SER A 473 0.459 1.692 6.885 1.00 0.00 C ATOM 769 C SER A 473 -0.650 0.662 6.628 1.00 0.00 C ATOM 770 O SER A 473 -1.148 -0.013 7.537 1.00 0.00 O ATOM 771 CB SER A 473 1.821 1.131 6.451 1.00 0.00 C ATOM 772 OG SER A 473 2.214 -0.005 7.203 1.00 0.00 O ATOM 0 H SER A 473 0.121 1.579 8.957 1.00 0.00 H new ATOM 0 HA SER A 473 0.205 2.556 6.271 1.00 0.00 H new ATOM 0 HB2 SER A 473 1.779 0.865 5.395 1.00 0.00 H new ATOM 0 HB3 SER A 473 2.578 1.908 6.554 1.00 0.00 H new ATOM 0 HG SER A 473 3.085 -0.322 6.885 1.00 0.00 H new ATOM 778 N ALA A 474 -1.039 0.555 5.355 1.00 0.00 N ATOM 779 CA ALA A 474 -2.088 -0.330 4.849 1.00 0.00 C ATOM 780 C ALA A 474 -1.857 -0.689 3.368 1.00 0.00 C ATOM 781 O ALA A 474 -1.158 0.028 2.645 1.00 0.00 O ATOM 782 CB ALA A 474 -3.439 0.387 5.009 1.00 0.00 C ATOM 0 H ALA A 474 -0.610 1.110 4.615 1.00 0.00 H new ATOM 0 HA ALA A 474 -2.075 -1.261 5.416 1.00 0.00 H new ATOM 0 HB1 ALA A 474 -4.238 -0.255 4.638 1.00 0.00 H new ATOM 0 HB2 ALA A 474 -3.611 0.608 6.062 1.00 0.00 H new ATOM 0 HB3 ALA A 474 -3.427 1.317 4.440 1.00 0.00 H new ATOM 788 N PHE A 475 -2.476 -1.775 2.903 1.00 0.00 N ATOM 789 CA PHE A 475 -2.572 -2.104 1.479 1.00 0.00 C ATOM 790 C PHE A 475 -3.855 -1.498 0.881 1.00 0.00 C ATOM 791 O PHE A 475 -4.869 -1.371 1.575 1.00 0.00 O ATOM 792 CB PHE A 475 -2.569 -3.626 1.271 1.00 0.00 C ATOM 793 CG PHE A 475 -1.286 -4.335 1.663 1.00 0.00 C ATOM 794 CD1 PHE A 475 -0.107 -4.125 0.921 1.00 0.00 C ATOM 795 CD2 PHE A 475 -1.279 -5.250 2.734 1.00 0.00 C ATOM 796 CE1 PHE A 475 1.076 -4.806 1.260 1.00 0.00 C ATOM 797 CE2 PHE A 475 -0.103 -5.951 3.054 1.00 0.00 C ATOM 798 CZ PHE A 475 1.076 -5.723 2.325 1.00 0.00 C ATOM 0 H PHE A 475 -2.929 -2.458 3.510 1.00 0.00 H new ATOM 0 HA PHE A 475 -1.705 -1.682 0.971 1.00 0.00 H new ATOM 0 HB2 PHE A 475 -3.391 -4.055 1.844 1.00 0.00 H new ATOM 0 HB3 PHE A 475 -2.771 -3.832 0.220 1.00 0.00 H new ATOM 0 HD1 PHE A 475 -0.112 -3.438 0.088 1.00 0.00 H new ATOM 0 HD2 PHE A 475 -2.178 -5.413 3.310 1.00 0.00 H new ATOM 0 HE1 PHE A 475 1.983 -4.624 0.703 1.00 0.00 H new ATOM 0 HE2 PHE A 475 -0.106 -6.667 3.863 1.00 0.00 H new ATOM 0 HZ PHE A 475 1.982 -6.252 2.583 1.00 0.00 H new ATOM 808 N VAL A 476 -3.837 -1.172 -0.416 1.00 0.00 N ATOM 809 CA VAL A 476 -4.983 -0.613 -1.162 1.00 0.00 C ATOM 810 C VAL A 476 -5.068 -1.259 -2.547 1.00 0.00 C ATOM 811 O VAL A 476 -4.094 -1.267 -3.298 1.00 0.00 O ATOM 812 CB VAL A 476 -4.893 0.926 -1.284 1.00 0.00 C ATOM 813 CG1 VAL A 476 -6.078 1.509 -2.071 1.00 0.00 C ATOM 814 CG2 VAL A 476 -4.887 1.605 0.093 1.00 0.00 C ATOM 0 H VAL A 476 -3.006 -1.291 -0.996 1.00 0.00 H new ATOM 0 HA VAL A 476 -5.891 -0.840 -0.603 1.00 0.00 H new ATOM 0 HB VAL A 476 -3.958 1.123 -1.809 1.00 0.00 H new ATOM 0 HG11 VAL A 476 -5.976 2.592 -2.133 1.00 0.00 H new ATOM 0 HG12 VAL A 476 -6.090 1.087 -3.076 1.00 0.00 H new ATOM 0 HG13 VAL A 476 -7.010 1.261 -1.562 1.00 0.00 H new ATOM 0 HG21 VAL A 476 -4.823 2.686 -0.034 1.00 0.00 H new ATOM 0 HG22 VAL A 476 -5.805 1.356 0.625 1.00 0.00 H new ATOM 0 HG23 VAL A 476 -4.029 1.256 0.667 1.00 0.00 H new ATOM 824 N SER A 477 -6.233 -1.806 -2.894 1.00 0.00 N ATOM 825 CA SER A 477 -6.495 -2.458 -4.185 1.00 0.00 C ATOM 826 C SER A 477 -7.140 -1.485 -5.178 1.00 0.00 C ATOM 827 O SER A 477 -8.065 -0.750 -4.815 1.00 0.00 O ATOM 828 CB SER A 477 -7.434 -3.646 -3.968 1.00 0.00 C ATOM 829 OG SER A 477 -7.471 -4.461 -5.125 1.00 0.00 O ATOM 0 H SER A 477 -7.042 -1.810 -2.273 1.00 0.00 H new ATOM 0 HA SER A 477 -5.544 -2.793 -4.598 1.00 0.00 H new ATOM 0 HB2 SER A 477 -7.098 -4.232 -3.113 1.00 0.00 H new ATOM 0 HB3 SER A 477 -8.437 -3.288 -3.735 1.00 0.00 H new ATOM 0 HG SER A 477 -8.074 -5.218 -4.972 1.00 0.00 H new ATOM 835 N LEU A 478 -6.687 -1.515 -6.435 1.00 0.00 N ATOM 836 CA LEU A 478 -7.199 -0.717 -7.559 1.00 0.00 C ATOM 837 C LEU A 478 -7.657 -1.644 -8.705 1.00 0.00 C ATOM 838 O LEU A 478 -7.242 -2.803 -8.777 1.00 0.00 O ATOM 839 CB LEU A 478 -6.103 0.264 -8.032 1.00 0.00 C ATOM 840 CG LEU A 478 -5.593 1.277 -6.984 1.00 0.00 C ATOM 841 CD1 LEU A 478 -4.586 2.222 -7.637 1.00 0.00 C ATOM 842 CD2 LEU A 478 -6.707 2.147 -6.404 1.00 0.00 C ATOM 0 H LEU A 478 -5.917 -2.124 -6.712 1.00 0.00 H new ATOM 0 HA LEU A 478 -8.065 -0.139 -7.236 1.00 0.00 H new ATOM 0 HB2 LEU A 478 -5.253 -0.318 -8.387 1.00 0.00 H new ATOM 0 HB3 LEU A 478 -6.488 0.820 -8.887 1.00 0.00 H new ATOM 0 HG LEU A 478 -5.150 0.688 -6.180 1.00 0.00 H new ATOM 0 HD11 LEU A 478 -4.226 2.937 -6.898 1.00 0.00 H new ATOM 0 HD12 LEU A 478 -3.745 1.646 -8.025 1.00 0.00 H new ATOM 0 HD13 LEU A 478 -5.067 2.758 -8.455 1.00 0.00 H new ATOM 0 HD21 LEU A 478 -6.286 2.838 -5.674 1.00 0.00 H new ATOM 0 HD22 LEU A 478 -7.183 2.712 -7.206 1.00 0.00 H new ATOM 0 HD23 LEU A 478 -7.448 1.513 -5.918 1.00 0.00 H new ATOM 854 N SER A 479 -8.525 -1.167 -9.605 1.00 0.00 N ATOM 855 CA SER A 479 -9.155 -2.027 -10.627 1.00 0.00 C ATOM 856 C SER A 479 -8.280 -2.321 -11.860 1.00 0.00 C ATOM 857 O SER A 479 -8.629 -3.199 -12.654 1.00 0.00 O ATOM 858 CB SER A 479 -10.529 -1.480 -11.038 1.00 0.00 C ATOM 859 OG SER A 479 -10.444 -0.215 -11.673 1.00 0.00 O ATOM 0 H SER A 479 -8.811 -0.189 -9.650 1.00 0.00 H new ATOM 0 HA SER A 479 -9.284 -2.994 -10.141 1.00 0.00 H new ATOM 0 HB2 SER A 479 -11.012 -2.189 -11.711 1.00 0.00 H new ATOM 0 HB3 SER A 479 -11.162 -1.397 -10.155 1.00 0.00 H new ATOM 0 HG SER A 479 -11.343 0.090 -11.917 1.00 0.00 H new ATOM 865 N GLN A 480 -7.135 -1.641 -12.018 1.00 0.00 N ATOM 866 CA GLN A 480 -6.175 -1.841 -13.119 1.00 0.00 C ATOM 867 C GLN A 480 -4.715 -1.625 -12.658 1.00 0.00 C ATOM 868 O GLN A 480 -4.468 -0.779 -11.792 1.00 0.00 O ATOM 869 CB GLN A 480 -6.466 -0.843 -14.258 1.00 0.00 C ATOM 870 CG GLN A 480 -7.833 -1.003 -14.943 1.00 0.00 C ATOM 871 CD GLN A 480 -8.067 0.088 -15.986 1.00 0.00 C ATOM 872 OE1 GLN A 480 -8.108 1.275 -15.679 1.00 0.00 O ATOM 873 NE2 GLN A 480 -8.231 -0.254 -17.247 1.00 0.00 N ATOM 0 H GLN A 480 -6.841 -0.915 -11.365 1.00 0.00 H new ATOM 0 HA GLN A 480 -6.291 -2.870 -13.460 1.00 0.00 H new ATOM 0 HB2 GLN A 480 -6.395 0.169 -13.858 1.00 0.00 H new ATOM 0 HB3 GLN A 480 -5.686 -0.943 -15.013 1.00 0.00 H new ATOM 0 HG2 GLN A 480 -7.890 -1.982 -15.419 1.00 0.00 H new ATOM 0 HG3 GLN A 480 -8.623 -0.967 -14.193 1.00 0.00 H new ATOM 0 HE21 GLN A 480 -8.199 -1.237 -17.517 1.00 0.00 H new ATOM 0 HE22 GLN A 480 -8.390 0.464 -17.954 1.00 0.00 H new ATOM 882 N PRO A 481 -3.721 -2.293 -13.280 1.00 0.00 N ATOM 883 CA PRO A 481 -2.299 -2.033 -13.030 1.00 0.00 C ATOM 884 C PRO A 481 -1.813 -0.688 -13.610 1.00 0.00 C ATOM 885 O PRO A 481 -0.808 -0.141 -13.157 1.00 0.00 O ATOM 886 CB PRO A 481 -1.563 -3.221 -13.654 1.00 0.00 C ATOM 887 CG PRO A 481 -2.472 -3.634 -14.810 1.00 0.00 C ATOM 888 CD PRO A 481 -3.873 -3.360 -14.263 1.00 0.00 C ATOM 0 HA PRO A 481 -2.105 -1.941 -11.961 1.00 0.00 H new ATOM 0 HB2 PRO A 481 -0.570 -2.939 -14.005 1.00 0.00 H new ATOM 0 HB3 PRO A 481 -1.430 -4.032 -12.938 1.00 0.00 H new ATOM 0 HG2 PRO A 481 -2.270 -3.053 -15.710 1.00 0.00 H new ATOM 0 HG3 PRO A 481 -2.340 -4.684 -15.072 1.00 0.00 H new ATOM 0 HD2 PRO A 481 -4.552 -3.061 -15.062 1.00 0.00 H new ATOM 0 HD3 PRO A 481 -4.295 -4.255 -13.805 1.00 0.00 H new ATOM 896 N GLU A 482 -2.534 -0.102 -14.573 1.00 0.00 N ATOM 897 CA GLU A 482 -2.274 1.265 -15.051 1.00 0.00 C ATOM 898 C GLU A 482 -2.533 2.312 -13.950 1.00 0.00 C ATOM 899 O GLU A 482 -1.740 3.235 -13.765 1.00 0.00 O ATOM 900 CB GLU A 482 -3.133 1.533 -16.298 1.00 0.00 C ATOM 901 CG GLU A 482 -2.801 2.874 -16.964 1.00 0.00 C ATOM 902 CD GLU A 482 -3.564 3.035 -18.293 1.00 0.00 C ATOM 903 OE1 GLU A 482 -4.699 3.572 -18.290 1.00 0.00 O ATOM 904 OE2 GLU A 482 -3.031 2.634 -19.358 1.00 0.00 O ATOM 0 H GLU A 482 -3.314 -0.560 -15.044 1.00 0.00 H new ATOM 0 HA GLU A 482 -1.221 1.353 -15.317 1.00 0.00 H new ATOM 0 HB2 GLU A 482 -2.985 0.727 -17.017 1.00 0.00 H new ATOM 0 HB3 GLU A 482 -4.187 1.521 -16.019 1.00 0.00 H new ATOM 0 HG2 GLU A 482 -3.059 3.692 -16.291 1.00 0.00 H new ATOM 0 HG3 GLU A 482 -1.728 2.938 -17.146 1.00 0.00 H new ATOM 911 N GLN A 483 -3.599 2.134 -13.161 1.00 0.00 N ATOM 912 CA GLN A 483 -3.916 2.993 -12.011 1.00 0.00 C ATOM 913 C GLN A 483 -2.842 2.881 -10.913 1.00 0.00 C ATOM 914 O GLN A 483 -2.435 3.892 -10.340 1.00 0.00 O ATOM 915 CB GLN A 483 -5.292 2.614 -11.445 1.00 0.00 C ATOM 916 CG GLN A 483 -6.460 2.808 -12.427 1.00 0.00 C ATOM 917 CD GLN A 483 -7.733 2.111 -11.942 1.00 0.00 C ATOM 918 OE1 GLN A 483 -7.947 1.865 -10.762 1.00 0.00 O ATOM 919 NE2 GLN A 483 -8.610 1.714 -12.833 1.00 0.00 N ATOM 0 H GLN A 483 -4.274 1.382 -13.303 1.00 0.00 H new ATOM 0 HA GLN A 483 -3.935 4.028 -12.354 1.00 0.00 H new ATOM 0 HB2 GLN A 483 -5.267 1.570 -11.131 1.00 0.00 H new ATOM 0 HB3 GLN A 483 -5.481 3.211 -10.553 1.00 0.00 H new ATOM 0 HG2 GLN A 483 -6.655 3.873 -12.554 1.00 0.00 H new ATOM 0 HG3 GLN A 483 -6.181 2.416 -13.405 1.00 0.00 H new ATOM 0 HE21 GLN A 483 -8.455 1.907 -13.823 1.00 0.00 H new ATOM 0 HE22 GLN A 483 -9.447 1.213 -12.536 1.00 0.00 H new ATOM 928 N VAL A 484 -2.325 1.666 -10.675 1.00 0.00 N ATOM 929 CA VAL A 484 -1.155 1.413 -9.812 1.00 0.00 C ATOM 930 C VAL A 484 0.065 2.206 -10.288 1.00 0.00 C ATOM 931 O VAL A 484 0.664 2.933 -9.497 1.00 0.00 O ATOM 932 CB VAL A 484 -0.853 -0.101 -9.738 1.00 0.00 C ATOM 933 CG1 VAL A 484 0.544 -0.455 -9.216 1.00 0.00 C ATOM 934 CG2 VAL A 484 -1.897 -0.796 -8.862 1.00 0.00 C ATOM 0 H VAL A 484 -2.713 0.815 -11.083 1.00 0.00 H new ATOM 0 HA VAL A 484 -1.392 1.757 -8.805 1.00 0.00 H new ATOM 0 HB VAL A 484 -0.893 -0.452 -10.769 1.00 0.00 H new ATOM 0 HG11 VAL A 484 0.663 -1.538 -9.200 1.00 0.00 H new ATOM 0 HG12 VAL A 484 1.298 -0.017 -9.869 1.00 0.00 H new ATOM 0 HG13 VAL A 484 0.666 -0.062 -8.207 1.00 0.00 H new ATOM 0 HG21 VAL A 484 -1.679 -1.863 -8.813 1.00 0.00 H new ATOM 0 HG22 VAL A 484 -1.868 -0.374 -7.858 1.00 0.00 H new ATOM 0 HG23 VAL A 484 -2.888 -0.647 -9.290 1.00 0.00 H new ATOM 944 N GLN A 485 0.412 2.126 -11.577 1.00 0.00 N ATOM 945 CA GLN A 485 1.549 2.858 -12.145 1.00 0.00 C ATOM 946 C GLN A 485 1.393 4.384 -12.001 1.00 0.00 C ATOM 947 O GLN A 485 2.349 5.066 -11.626 1.00 0.00 O ATOM 948 CB GLN A 485 1.733 2.432 -13.612 1.00 0.00 C ATOM 949 CG GLN A 485 3.017 2.999 -14.236 1.00 0.00 C ATOM 950 CD GLN A 485 3.223 2.484 -15.660 1.00 0.00 C ATOM 951 OE1 GLN A 485 3.770 1.412 -15.893 1.00 0.00 O ATOM 952 NE2 GLN A 485 2.795 3.216 -16.670 1.00 0.00 N ATOM 0 H GLN A 485 -0.088 1.552 -12.256 1.00 0.00 H new ATOM 0 HA GLN A 485 2.448 2.603 -11.584 1.00 0.00 H new ATOM 0 HB2 GLN A 485 1.755 1.344 -13.670 1.00 0.00 H new ATOM 0 HB3 GLN A 485 0.873 2.765 -14.194 1.00 0.00 H new ATOM 0 HG2 GLN A 485 2.968 4.088 -14.245 1.00 0.00 H new ATOM 0 HG3 GLN A 485 3.874 2.724 -13.621 1.00 0.00 H new ATOM 0 HE21 GLN A 485 2.338 4.111 -16.494 1.00 0.00 H new ATOM 0 HE22 GLN A 485 2.921 2.888 -17.627 1.00 0.00 H new ATOM 961 N ILE A 486 0.190 4.924 -12.233 1.00 0.00 N ATOM 962 CA ILE A 486 -0.120 6.352 -12.041 1.00 0.00 C ATOM 963 C ILE A 486 0.045 6.766 -10.569 1.00 0.00 C ATOM 964 O ILE A 486 0.708 7.766 -10.294 1.00 0.00 O ATOM 965 CB ILE A 486 -1.531 6.678 -12.591 1.00 0.00 C ATOM 966 CG1 ILE A 486 -1.547 6.538 -14.133 1.00 0.00 C ATOM 967 CG2 ILE A 486 -1.978 8.103 -12.204 1.00 0.00 C ATOM 968 CD1 ILE A 486 -2.957 6.455 -14.734 1.00 0.00 C ATOM 0 H ILE A 486 -0.606 4.378 -12.563 1.00 0.00 H new ATOM 0 HA ILE A 486 0.597 6.943 -12.611 1.00 0.00 H new ATOM 0 HB ILE A 486 -2.228 5.968 -12.146 1.00 0.00 H new ATOM 0 HG12 ILE A 486 -1.025 7.389 -14.571 1.00 0.00 H new ATOM 0 HG13 ILE A 486 -0.990 5.644 -14.413 1.00 0.00 H new ATOM 0 HG21 ILE A 486 -2.972 8.295 -12.608 1.00 0.00 H new ATOM 0 HG22 ILE A 486 -2.004 8.194 -11.118 1.00 0.00 H new ATOM 0 HG23 ILE A 486 -1.274 8.829 -12.612 1.00 0.00 H new ATOM 0 HD11 ILE A 486 -2.886 6.358 -15.817 1.00 0.00 H new ATOM 0 HD12 ILE A 486 -3.476 5.588 -14.326 1.00 0.00 H new ATOM 0 HD13 ILE A 486 -3.512 7.360 -14.486 1.00 0.00 H new ATOM 980 N ALA A 487 -0.491 6.002 -9.612 1.00 0.00 N ATOM 981 CA ALA A 487 -0.352 6.291 -8.180 1.00 0.00 C ATOM 982 C ALA A 487 1.114 6.249 -7.699 1.00 0.00 C ATOM 983 O ALA A 487 1.546 7.116 -6.939 1.00 0.00 O ATOM 984 CB ALA A 487 -1.218 5.294 -7.401 1.00 0.00 C ATOM 0 H ALA A 487 -1.036 5.162 -9.809 1.00 0.00 H new ATOM 0 HA ALA A 487 -0.691 7.311 -7.998 1.00 0.00 H new ATOM 0 HB1 ALA A 487 -1.129 5.492 -6.333 1.00 0.00 H new ATOM 0 HB2 ALA A 487 -2.259 5.402 -7.704 1.00 0.00 H new ATOM 0 HB3 ALA A 487 -0.882 4.279 -7.611 1.00 0.00 H new ATOM 990 N VAL A 488 1.904 5.279 -8.176 1.00 0.00 N ATOM 991 CA VAL A 488 3.348 5.169 -7.889 1.00 0.00 C ATOM 992 C VAL A 488 4.154 6.320 -8.516 1.00 0.00 C ATOM 993 O VAL A 488 5.122 6.790 -7.917 1.00 0.00 O ATOM 994 CB VAL A 488 3.874 3.791 -8.344 1.00 0.00 C ATOM 995 CG1 VAL A 488 5.399 3.647 -8.251 1.00 0.00 C ATOM 996 CG2 VAL A 488 3.273 2.681 -7.470 1.00 0.00 C ATOM 0 H VAL A 488 1.557 4.535 -8.782 1.00 0.00 H new ATOM 0 HA VAL A 488 3.484 5.253 -6.811 1.00 0.00 H new ATOM 0 HB VAL A 488 3.578 3.705 -9.390 1.00 0.00 H new ATOM 0 HG11 VAL A 488 5.692 2.652 -8.588 1.00 0.00 H new ATOM 0 HG12 VAL A 488 5.875 4.398 -8.882 1.00 0.00 H new ATOM 0 HG13 VAL A 488 5.715 3.788 -7.217 1.00 0.00 H new ATOM 0 HG21 VAL A 488 3.651 1.713 -7.800 1.00 0.00 H new ATOM 0 HG22 VAL A 488 3.554 2.845 -6.430 1.00 0.00 H new ATOM 0 HG23 VAL A 488 2.187 2.696 -7.559 1.00 0.00 H new ATOM 1006 N ASN A 489 3.756 6.824 -9.690 1.00 0.00 N ATOM 1007 CA ASN A 489 4.376 8.007 -10.296 1.00 0.00 C ATOM 1008 C ASN A 489 4.042 9.300 -9.525 1.00 0.00 C ATOM 1009 O ASN A 489 4.923 10.110 -9.236 1.00 0.00 O ATOM 1010 CB ASN A 489 3.928 8.114 -11.765 1.00 0.00 C ATOM 1011 CG ASN A 489 4.678 9.206 -12.516 1.00 0.00 C ATOM 1012 OD1 ASN A 489 5.895 9.326 -12.443 1.00 0.00 O ATOM 1013 ND2 ASN A 489 3.986 10.042 -13.255 1.00 0.00 N ATOM 0 H ASN A 489 2.998 6.425 -10.244 1.00 0.00 H new ATOM 0 HA ASN A 489 5.459 7.889 -10.248 1.00 0.00 H new ATOM 0 HB2 ASN A 489 4.088 7.157 -12.263 1.00 0.00 H new ATOM 0 HB3 ASN A 489 2.858 8.318 -11.803 1.00 0.00 H new ATOM 0 HD21 ASN A 489 4.462 10.786 -13.765 1.00 0.00 H new ATOM 0 HD22 ASN A 489 2.972 9.947 -13.320 1.00 0.00 H new ATOM 1020 N THR A 490 2.769 9.495 -9.178 1.00 0.00 N ATOM 1021 CA THR A 490 2.261 10.725 -8.541 1.00 0.00 C ATOM 1022 C THR A 490 2.655 10.874 -7.067 1.00 0.00 C ATOM 1023 O THR A 490 2.779 11.999 -6.577 1.00 0.00 O ATOM 1024 CB THR A 490 0.733 10.839 -8.690 1.00 0.00 C ATOM 1025 OG1 THR A 490 0.067 9.662 -8.306 1.00 0.00 O ATOM 1026 CG2 THR A 490 0.341 11.142 -10.138 1.00 0.00 C ATOM 0 H THR A 490 2.044 8.794 -9.332 1.00 0.00 H new ATOM 0 HA THR A 490 2.744 11.543 -9.076 1.00 0.00 H new ATOM 0 HB THR A 490 0.433 11.654 -8.032 1.00 0.00 H new ATOM 0 HG1 THR A 490 0.127 9.002 -9.028 1.00 0.00 H new ATOM 0 HG21 THR A 490 -0.744 11.217 -10.213 1.00 0.00 H new ATOM 0 HG22 THR A 490 0.792 12.085 -10.447 1.00 0.00 H new ATOM 0 HG23 THR A 490 0.695 10.340 -10.786 1.00 0.00 H new ATOM 1034 N SER A 491 2.927 9.775 -6.356 1.00 0.00 N ATOM 1035 CA SER A 491 3.350 9.796 -4.945 1.00 0.00 C ATOM 1036 C SER A 491 4.728 10.428 -4.697 1.00 0.00 C ATOM 1037 O SER A 491 4.994 10.885 -3.583 1.00 0.00 O ATOM 1038 CB SER A 491 3.315 8.381 -4.374 1.00 0.00 C ATOM 1039 OG SER A 491 4.399 7.607 -4.860 1.00 0.00 O ATOM 0 H SER A 491 2.860 8.834 -6.745 1.00 0.00 H new ATOM 0 HA SER A 491 2.636 10.440 -4.432 1.00 0.00 H new ATOM 0 HB2 SER A 491 3.354 8.424 -3.286 1.00 0.00 H new ATOM 0 HB3 SER A 491 2.373 7.901 -4.641 1.00 0.00 H new ATOM 0 HG SER A 491 4.431 6.752 -4.382 1.00 0.00 H new ATOM 1045 N LYS A 492 5.586 10.531 -5.725 1.00 0.00 N ATOM 1046 CA LYS A 492 6.892 11.224 -5.669 1.00 0.00 C ATOM 1047 C LYS A 492 6.792 12.700 -5.253 1.00 0.00 C ATOM 1048 O LYS A 492 7.767 13.260 -4.748 1.00 0.00 O ATOM 1049 CB LYS A 492 7.605 11.109 -7.029 1.00 0.00 C ATOM 1050 CG LYS A 492 8.072 9.673 -7.328 1.00 0.00 C ATOM 1051 CD LYS A 492 8.819 9.557 -8.667 1.00 0.00 C ATOM 1052 CE LYS A 492 7.864 9.778 -9.845 1.00 0.00 C ATOM 1053 NZ LYS A 492 8.518 9.573 -11.160 1.00 0.00 N ATOM 0 H LYS A 492 5.390 10.127 -6.641 1.00 0.00 H new ATOM 0 HA LYS A 492 7.471 10.725 -4.892 1.00 0.00 H new ATOM 0 HB2 LYS A 492 6.931 11.441 -7.819 1.00 0.00 H new ATOM 0 HB3 LYS A 492 8.465 11.778 -7.043 1.00 0.00 H new ATOM 0 HG2 LYS A 492 8.723 9.332 -6.523 1.00 0.00 H new ATOM 0 HG3 LYS A 492 7.207 9.010 -7.341 1.00 0.00 H new ATOM 0 HD2 LYS A 492 9.624 10.290 -8.704 1.00 0.00 H new ATOM 0 HD3 LYS A 492 9.280 8.573 -8.747 1.00 0.00 H new ATOM 0 HE2 LYS A 492 7.018 9.096 -9.754 1.00 0.00 H new ATOM 0 HE3 LYS A 492 7.463 10.791 -9.797 1.00 0.00 H new ATOM 0 HZ1 LYS A 492 7.791 9.449 -11.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 492 9.104 10.401 -11.389 1.00 0.00 H new ATOM 0 HZ3 LYS A 492 9.119 8.725 -11.121 1.00 0.00 H new ATOM 1067 N TYR A 493 5.622 13.317 -5.432 1.00 0.00 N ATOM 1068 CA TYR A 493 5.346 14.721 -5.101 1.00 0.00 C ATOM 1069 C TYR A 493 4.635 14.903 -3.742 1.00 0.00 C ATOM 1070 O TYR A 493 4.435 16.037 -3.297 1.00 0.00 O ATOM 1071 CB TYR A 493 4.520 15.338 -6.244 1.00 0.00 C ATOM 1072 CG TYR A 493 5.064 15.056 -7.638 1.00 0.00 C ATOM 1073 CD1 TYR A 493 6.349 15.509 -8.000 1.00 0.00 C ATOM 1074 CD2 TYR A 493 4.301 14.307 -8.556 1.00 0.00 C ATOM 1075 CE1 TYR A 493 6.873 15.203 -9.271 1.00 0.00 C ATOM 1076 CE2 TYR A 493 4.822 13.998 -9.828 1.00 0.00 C ATOM 1077 CZ TYR A 493 6.114 14.444 -10.189 1.00 0.00 C ATOM 1078 OH TYR A 493 6.630 14.151 -11.414 1.00 0.00 O ATOM 0 H TYR A 493 4.811 12.838 -5.825 1.00 0.00 H new ATOM 0 HA TYR A 493 6.301 15.237 -4.997 1.00 0.00 H new ATOM 0 HB2 TYR A 493 3.499 14.961 -6.183 1.00 0.00 H new ATOM 0 HB3 TYR A 493 4.470 16.417 -6.098 1.00 0.00 H new ATOM 0 HD1 TYR A 493 6.932 16.091 -7.302 1.00 0.00 H new ATOM 0 HD2 TYR A 493 3.312 13.968 -8.283 1.00 0.00 H new ATOM 0 HE1 TYR A 493 7.859 15.550 -9.545 1.00 0.00 H new ATOM 0 HE2 TYR A 493 4.235 13.421 -10.527 1.00 0.00 H new ATOM 0 HH TYR A 493 5.982 13.621 -11.924 1.00 0.00 H new ATOM 1088 N ALA A 494 4.245 13.809 -3.074 1.00 0.00 N ATOM 1089 CA ALA A 494 3.562 13.828 -1.780 1.00 0.00 C ATOM 1090 C ALA A 494 4.523 14.110 -0.608 1.00 0.00 C ATOM 1091 O ALA A 494 5.664 13.638 -0.595 1.00 0.00 O ATOM 1092 CB ALA A 494 2.866 12.476 -1.590 1.00 0.00 C ATOM 0 H ALA A 494 4.401 12.866 -3.429 1.00 0.00 H new ATOM 0 HA ALA A 494 2.836 14.641 -1.780 1.00 0.00 H new ATOM 0 HB1 ALA A 494 2.349 12.465 -0.631 1.00 0.00 H new ATOM 0 HB2 ALA A 494 2.145 12.322 -2.393 1.00 0.00 H new ATOM 0 HB3 ALA A 494 3.609 11.678 -1.611 1.00 0.00 H new ATOM 1098 N GLU A 495 4.033 14.823 0.412 1.00 0.00 N ATOM 1099 CA GLU A 495 4.803 15.230 1.607 1.00 0.00 C ATOM 1100 C GLU A 495 4.112 14.902 2.951 1.00 0.00 C ATOM 1101 O GLU A 495 4.681 15.151 4.018 1.00 0.00 O ATOM 1102 CB GLU A 495 5.178 16.721 1.497 1.00 0.00 C ATOM 1103 CG GLU A 495 3.975 17.674 1.545 1.00 0.00 C ATOM 1104 CD GLU A 495 4.434 19.142 1.446 1.00 0.00 C ATOM 1105 OE1 GLU A 495 4.749 19.761 2.494 1.00 0.00 O ATOM 1106 OE2 GLU A 495 4.479 19.698 0.320 1.00 0.00 O ATOM 0 H GLU A 495 3.065 15.145 0.436 1.00 0.00 H new ATOM 0 HA GLU A 495 5.712 14.628 1.620 1.00 0.00 H new ATOM 0 HB2 GLU A 495 5.861 16.974 2.308 1.00 0.00 H new ATOM 0 HB3 GLU A 495 5.718 16.881 0.564 1.00 0.00 H new ATOM 0 HG2 GLU A 495 3.292 17.446 0.727 1.00 0.00 H new ATOM 0 HG3 GLU A 495 3.423 17.523 2.472 1.00 0.00 H new ATOM 1113 N SER A 496 2.922 14.290 2.904 1.00 0.00 N ATOM 1114 CA SER A 496 2.126 13.855 4.072 1.00 0.00 C ATOM 1115 C SER A 496 1.725 12.369 4.007 1.00 0.00 C ATOM 1116 O SER A 496 1.051 11.865 4.905 1.00 0.00 O ATOM 1117 CB SER A 496 0.868 14.727 4.216 1.00 0.00 C ATOM 1118 OG SER A 496 1.204 16.102 4.347 1.00 0.00 O ATOM 0 H SER A 496 2.464 14.073 2.019 1.00 0.00 H new ATOM 0 HA SER A 496 2.766 13.977 4.946 1.00 0.00 H new ATOM 0 HB2 SER A 496 0.226 14.589 3.346 1.00 0.00 H new ATOM 0 HB3 SER A 496 0.298 14.405 5.088 1.00 0.00 H new ATOM 0 HG SER A 496 0.384 16.632 4.435 1.00 0.00 H new ATOM 1124 N TYR A 497 2.142 11.664 2.951 1.00 0.00 N ATOM 1125 CA TYR A 497 1.965 10.228 2.709 1.00 0.00 C ATOM 1126 C TYR A 497 2.976 9.750 1.644 1.00 0.00 C ATOM 1127 O TYR A 497 3.644 10.568 0.999 1.00 0.00 O ATOM 1128 CB TYR A 497 0.520 9.942 2.250 1.00 0.00 C ATOM 1129 CG TYR A 497 0.148 10.554 0.908 1.00 0.00 C ATOM 1130 CD1 TYR A 497 -0.342 11.874 0.841 1.00 0.00 C ATOM 1131 CD2 TYR A 497 0.320 9.810 -0.277 1.00 0.00 C ATOM 1132 CE1 TYR A 497 -0.642 12.458 -0.405 1.00 0.00 C ATOM 1133 CE2 TYR A 497 0.034 10.394 -1.526 1.00 0.00 C ATOM 1134 CZ TYR A 497 -0.447 11.720 -1.594 1.00 0.00 C ATOM 1135 OH TYR A 497 -0.709 12.282 -2.806 1.00 0.00 O ATOM 0 H TYR A 497 2.648 12.114 2.188 1.00 0.00 H new ATOM 0 HA TYR A 497 2.147 9.683 3.635 1.00 0.00 H new ATOM 0 HB2 TYR A 497 0.378 8.863 2.194 1.00 0.00 H new ATOM 0 HB3 TYR A 497 -0.168 10.316 3.008 1.00 0.00 H new ATOM 0 HD1 TYR A 497 -0.488 12.440 1.749 1.00 0.00 H new ATOM 0 HD2 TYR A 497 0.672 8.790 -0.227 1.00 0.00 H new ATOM 0 HE1 TYR A 497 -1.021 13.468 -0.452 1.00 0.00 H new ATOM 0 HE2 TYR A 497 0.183 9.827 -2.433 1.00 0.00 H new ATOM 0 HH TYR A 497 -0.518 11.633 -3.515 1.00 0.00 H new ATOM 1145 N ARG A 498 3.072 8.434 1.424 1.00 0.00 N ATOM 1146 CA ARG A 498 3.818 7.817 0.309 1.00 0.00 C ATOM 1147 C ARG A 498 3.162 6.502 -0.135 1.00 0.00 C ATOM 1148 O ARG A 498 2.457 5.867 0.649 1.00 0.00 O ATOM 1149 CB ARG A 498 5.292 7.638 0.737 1.00 0.00 C ATOM 1150 CG ARG A 498 6.295 7.368 -0.402 1.00 0.00 C ATOM 1151 CD ARG A 498 6.307 8.413 -1.536 1.00 0.00 C ATOM 1152 NE ARG A 498 6.524 9.797 -1.062 1.00 0.00 N ATOM 1153 CZ ARG A 498 7.678 10.388 -0.808 1.00 0.00 C ATOM 1154 NH1 ARG A 498 8.814 9.748 -0.853 1.00 0.00 N ATOM 1155 NH2 ARG A 498 7.722 11.651 -0.502 1.00 0.00 N ATOM 0 H ARG A 498 2.623 7.746 2.029 1.00 0.00 H new ATOM 0 HA ARG A 498 3.793 8.469 -0.564 1.00 0.00 H new ATOM 0 HB2 ARG A 498 5.608 8.536 1.268 1.00 0.00 H new ATOM 0 HB3 ARG A 498 5.347 6.812 1.447 1.00 0.00 H new ATOM 0 HG2 ARG A 498 7.296 7.309 0.025 1.00 0.00 H new ATOM 0 HG3 ARG A 498 6.074 6.392 -0.833 1.00 0.00 H new ATOM 0 HD2 ARG A 498 7.090 8.155 -2.249 1.00 0.00 H new ATOM 0 HD3 ARG A 498 5.359 8.366 -2.073 1.00 0.00 H new ATOM 0 HE ARG A 498 5.686 10.360 -0.914 1.00 0.00 H new ATOM 0 HH11 ARG A 498 8.832 8.756 -1.091 1.00 0.00 H new ATOM 0 HH12 ARG A 498 9.685 10.239 -0.650 1.00 0.00 H new ATOM 0 HH21 ARG A 498 6.860 12.195 -0.456 1.00 0.00 H new ATOM 0 HH22 ARG A 498 8.618 12.098 -0.308 1.00 0.00 H new ATOM 1169 N ILE A 499 3.384 6.108 -1.392 1.00 0.00 N ATOM 1170 CA ILE A 499 2.752 4.957 -2.066 1.00 0.00 C ATOM 1171 C ILE A 499 3.825 4.155 -2.820 1.00 0.00 C ATOM 1172 O ILE A 499 4.714 4.739 -3.445 1.00 0.00 O ATOM 1173 CB ILE A 499 1.654 5.433 -3.054 1.00 0.00 C ATOM 1174 CG1 ILE A 499 0.557 6.277 -2.363 1.00 0.00 C ATOM 1175 CG2 ILE A 499 1.018 4.251 -3.802 1.00 0.00 C ATOM 1176 CD1 ILE A 499 -0.406 6.980 -3.327 1.00 0.00 C ATOM 0 H ILE A 499 4.038 6.601 -2.000 1.00 0.00 H new ATOM 0 HA ILE A 499 2.282 4.323 -1.314 1.00 0.00 H new ATOM 0 HB ILE A 499 2.157 6.075 -3.777 1.00 0.00 H new ATOM 0 HG12 ILE A 499 -0.019 5.630 -1.702 1.00 0.00 H new ATOM 0 HG13 ILE A 499 1.036 7.029 -1.735 1.00 0.00 H new ATOM 0 HG21 ILE A 499 0.254 4.622 -4.485 1.00 0.00 H new ATOM 0 HG22 ILE A 499 1.786 3.723 -4.368 1.00 0.00 H new ATOM 0 HG23 ILE A 499 0.563 3.569 -3.084 1.00 0.00 H new ATOM 0 HD11 ILE A 499 -1.141 7.548 -2.757 1.00 0.00 H new ATOM 0 HD12 ILE A 499 0.154 7.656 -3.972 1.00 0.00 H new ATOM 0 HD13 ILE A 499 -0.917 6.236 -3.938 1.00 0.00 H new ATOM 1188 N GLN A 500 3.706 2.827 -2.804 1.00 0.00 N ATOM 1189 CA GLN A 500 4.511 1.873 -3.579 1.00 0.00 C ATOM 1190 C GLN A 500 3.660 0.654 -3.989 1.00 0.00 C ATOM 1191 O GLN A 500 2.548 0.486 -3.486 1.00 0.00 O ATOM 1192 CB GLN A 500 5.746 1.471 -2.754 1.00 0.00 C ATOM 1193 CG GLN A 500 5.426 0.693 -1.464 1.00 0.00 C ATOM 1194 CD GLN A 500 6.664 0.426 -0.612 1.00 0.00 C ATOM 1195 OE1 GLN A 500 7.800 0.488 -1.063 1.00 0.00 O ATOM 1196 NE2 GLN A 500 6.502 0.135 0.659 1.00 0.00 N ATOM 0 H GLN A 500 3.011 2.360 -2.221 1.00 0.00 H new ATOM 0 HA GLN A 500 4.855 2.339 -4.503 1.00 0.00 H new ATOM 0 HB2 GLN A 500 6.401 0.863 -3.377 1.00 0.00 H new ATOM 0 HB3 GLN A 500 6.301 2.372 -2.492 1.00 0.00 H new ATOM 0 HG2 GLN A 500 4.701 1.256 -0.876 1.00 0.00 H new ATOM 0 HG3 GLN A 500 4.958 -0.256 -1.724 1.00 0.00 H new ATOM 0 HE21 GLN A 500 5.563 0.079 1.054 1.00 0.00 H new ATOM 0 HE22 GLN A 500 7.315 -0.035 1.251 1.00 0.00 H new ATOM 1205 N THR A 501 4.140 -0.212 -4.885 1.00 0.00 N ATOM 1206 CA THR A 501 3.429 -1.469 -5.215 1.00 0.00 C ATOM 1207 C THR A 501 3.500 -2.497 -4.075 1.00 0.00 C ATOM 1208 O THR A 501 4.366 -2.424 -3.196 1.00 0.00 O ATOM 1209 CB THR A 501 3.950 -2.121 -6.508 1.00 0.00 C ATOM 1210 OG1 THR A 501 5.245 -2.640 -6.321 1.00 0.00 O ATOM 1211 CG2 THR A 501 4.002 -1.157 -7.690 1.00 0.00 C ATOM 0 H THR A 501 5.012 -0.075 -5.397 1.00 0.00 H new ATOM 0 HA THR A 501 2.390 -1.176 -5.365 1.00 0.00 H new ATOM 0 HB THR A 501 3.239 -2.914 -6.737 1.00 0.00 H new ATOM 0 HG1 THR A 501 5.556 -3.051 -7.154 1.00 0.00 H new ATOM 0 HG21 THR A 501 4.378 -1.680 -8.570 1.00 0.00 H new ATOM 0 HG22 THR A 501 3.001 -0.777 -7.894 1.00 0.00 H new ATOM 0 HG23 THR A 501 4.664 -0.325 -7.452 1.00 0.00 H new ATOM 1219 N TYR A 502 2.625 -3.508 -4.105 1.00 0.00 N ATOM 1220 CA TYR A 502 2.730 -4.678 -3.220 1.00 0.00 C ATOM 1221 C TYR A 502 4.088 -5.394 -3.378 1.00 0.00 C ATOM 1222 O TYR A 502 4.715 -5.783 -2.391 1.00 0.00 O ATOM 1223 CB TYR A 502 1.563 -5.631 -3.522 1.00 0.00 C ATOM 1224 CG TYR A 502 1.495 -6.845 -2.612 1.00 0.00 C ATOM 1225 CD1 TYR A 502 2.269 -7.990 -2.892 1.00 0.00 C ATOM 1226 CD2 TYR A 502 0.654 -6.829 -1.482 1.00 0.00 C ATOM 1227 CE1 TYR A 502 2.221 -9.106 -2.033 1.00 0.00 C ATOM 1228 CE2 TYR A 502 0.602 -7.942 -0.622 1.00 0.00 C ATOM 1229 CZ TYR A 502 1.389 -9.083 -0.891 1.00 0.00 C ATOM 1230 OH TYR A 502 1.333 -10.157 -0.057 1.00 0.00 O ATOM 0 H TYR A 502 1.827 -3.541 -4.739 1.00 0.00 H new ATOM 0 HA TYR A 502 2.673 -4.346 -2.183 1.00 0.00 H new ATOM 0 HB2 TYR A 502 0.627 -5.078 -3.441 1.00 0.00 H new ATOM 0 HB3 TYR A 502 1.644 -5.970 -4.555 1.00 0.00 H new ATOM 0 HD1 TYR A 502 2.901 -8.012 -3.768 1.00 0.00 H new ATOM 0 HD2 TYR A 502 0.047 -5.960 -1.275 1.00 0.00 H new ATOM 0 HE1 TYR A 502 2.820 -9.979 -2.247 1.00 0.00 H new ATOM 0 HE2 TYR A 502 -0.041 -7.923 0.245 1.00 0.00 H new ATOM 0 HH TYR A 502 0.712 -9.969 0.677 1.00 0.00 H new ATOM 1240 N ALA A 503 4.578 -5.526 -4.618 1.00 0.00 N ATOM 1241 CA ALA A 503 5.873 -6.137 -4.920 1.00 0.00 C ATOM 1242 C ALA A 503 7.065 -5.332 -4.362 1.00 0.00 C ATOM 1243 O ALA A 503 8.027 -5.925 -3.870 1.00 0.00 O ATOM 1244 CB ALA A 503 5.983 -6.320 -6.438 1.00 0.00 C ATOM 0 H ALA A 503 4.078 -5.207 -5.447 1.00 0.00 H new ATOM 0 HA ALA A 503 5.921 -7.105 -4.421 1.00 0.00 H new ATOM 0 HB1 ALA A 503 6.943 -6.775 -6.681 1.00 0.00 H new ATOM 0 HB2 ALA A 503 5.177 -6.966 -6.786 1.00 0.00 H new ATOM 0 HB3 ALA A 503 5.907 -5.349 -6.928 1.00 0.00 H new ATOM 1250 N GLU A 504 7.004 -3.994 -4.370 1.00 0.00 N ATOM 1251 CA GLU A 504 7.999 -3.146 -3.700 1.00 0.00 C ATOM 1252 C GLU A 504 7.994 -3.338 -2.178 1.00 0.00 C ATOM 1253 O GLU A 504 9.066 -3.450 -1.585 1.00 0.00 O ATOM 1254 CB GLU A 504 7.772 -1.662 -4.017 1.00 0.00 C ATOM 1255 CG GLU A 504 8.336 -1.239 -5.375 1.00 0.00 C ATOM 1256 CD GLU A 504 8.268 0.292 -5.507 1.00 0.00 C ATOM 1257 OE1 GLU A 504 9.204 0.973 -5.017 1.00 0.00 O ATOM 1258 OE2 GLU A 504 7.272 0.815 -6.062 1.00 0.00 O ATOM 0 H GLU A 504 6.266 -3.470 -4.840 1.00 0.00 H new ATOM 0 HA GLU A 504 8.970 -3.456 -4.086 1.00 0.00 H new ATOM 0 HB2 GLU A 504 6.703 -1.452 -3.995 1.00 0.00 H new ATOM 0 HB3 GLU A 504 8.232 -1.056 -3.236 1.00 0.00 H new ATOM 0 HG2 GLU A 504 9.368 -1.577 -5.473 1.00 0.00 H new ATOM 0 HG3 GLU A 504 7.769 -1.709 -6.178 1.00 0.00 H new ATOM 1265 N TYR A 505 6.822 -3.430 -1.539 1.00 0.00 N ATOM 1266 CA TYR A 505 6.732 -3.724 -0.102 1.00 0.00 C ATOM 1267 C TYR A 505 7.386 -5.074 0.253 1.00 0.00 C ATOM 1268 O TYR A 505 8.208 -5.146 1.169 1.00 0.00 O ATOM 1269 CB TYR A 505 5.269 -3.671 0.356 1.00 0.00 C ATOM 1270 CG TYR A 505 5.096 -4.043 1.815 1.00 0.00 C ATOM 1271 CD1 TYR A 505 5.357 -3.089 2.817 1.00 0.00 C ATOM 1272 CD2 TYR A 505 4.740 -5.359 2.173 1.00 0.00 C ATOM 1273 CE1 TYR A 505 5.250 -3.443 4.175 1.00 0.00 C ATOM 1274 CE2 TYR A 505 4.646 -5.721 3.530 1.00 0.00 C ATOM 1275 CZ TYR A 505 4.898 -4.761 4.536 1.00 0.00 C ATOM 1276 OH TYR A 505 4.827 -5.101 5.852 1.00 0.00 O ATOM 0 H TYR A 505 5.919 -3.305 -1.996 1.00 0.00 H new ATOM 0 HA TYR A 505 7.292 -2.958 0.435 1.00 0.00 H new ATOM 0 HB2 TYR A 505 4.878 -2.667 0.193 1.00 0.00 H new ATOM 0 HB3 TYR A 505 4.676 -4.347 -0.259 1.00 0.00 H new ATOM 0 HD1 TYR A 505 5.640 -2.083 2.543 1.00 0.00 H new ATOM 0 HD2 TYR A 505 4.539 -6.091 1.405 1.00 0.00 H new ATOM 0 HE1 TYR A 505 5.437 -2.705 4.941 1.00 0.00 H new ATOM 0 HE2 TYR A 505 4.381 -6.732 3.802 1.00 0.00 H new ATOM 0 HH TYR A 505 4.571 -6.044 5.933 1.00 0.00 H new ATOM 1286 N VAL A 506 7.091 -6.130 -0.517 1.00 0.00 N ATOM 1287 CA VAL A 506 7.729 -7.457 -0.399 1.00 0.00 C ATOM 1288 C VAL A 506 9.250 -7.384 -0.593 1.00 0.00 C ATOM 1289 O VAL A 506 10.005 -7.954 0.196 1.00 0.00 O ATOM 1290 CB VAL A 506 7.091 -8.433 -1.411 1.00 0.00 C ATOM 1291 CG1 VAL A 506 7.905 -9.716 -1.623 1.00 0.00 C ATOM 1292 CG2 VAL A 506 5.682 -8.824 -0.950 1.00 0.00 C ATOM 0 H VAL A 506 6.389 -6.089 -1.256 1.00 0.00 H new ATOM 0 HA VAL A 506 7.558 -7.825 0.613 1.00 0.00 H new ATOM 0 HB VAL A 506 7.062 -7.900 -2.361 1.00 0.00 H new ATOM 0 HG11 VAL A 506 7.397 -10.354 -2.346 1.00 0.00 H new ATOM 0 HG12 VAL A 506 8.896 -9.460 -1.998 1.00 0.00 H new ATOM 0 HG13 VAL A 506 8.001 -10.247 -0.676 1.00 0.00 H new ATOM 0 HG21 VAL A 506 5.241 -9.513 -1.671 1.00 0.00 H new ATOM 0 HG22 VAL A 506 5.739 -9.307 0.025 1.00 0.00 H new ATOM 0 HG23 VAL A 506 5.062 -7.930 -0.876 1.00 0.00 H new ATOM 1302 N GLY A 507 9.716 -6.646 -1.603 1.00 0.00 N ATOM 1303 CA GLY A 507 11.139 -6.480 -1.920 1.00 0.00 C ATOM 1304 C GLY A 507 11.934 -5.626 -0.916 1.00 0.00 C ATOM 1305 O GLY A 507 13.165 -5.584 -0.987 1.00 0.00 O ATOM 0 H GLY A 507 9.102 -6.135 -2.238 1.00 0.00 H new ATOM 0 HA2 GLY A 507 11.600 -7.466 -1.980 1.00 0.00 H new ATOM 0 HA3 GLY A 507 11.225 -6.027 -2.908 1.00 0.00 H new ATOM 1309 N LYS A 508 11.247 -4.968 0.029 1.00 0.00 N ATOM 1310 CA LYS A 508 11.799 -4.108 1.097 1.00 0.00 C ATOM 1311 C LYS A 508 11.499 -4.644 2.512 1.00 0.00 C ATOM 1312 O LYS A 508 11.764 -3.954 3.498 1.00 0.00 O ATOM 1313 CB LYS A 508 11.274 -2.671 0.905 1.00 0.00 C ATOM 1314 CG LYS A 508 11.726 -2.029 -0.421 1.00 0.00 C ATOM 1315 CD LYS A 508 10.981 -0.710 -0.666 1.00 0.00 C ATOM 1316 CE LYS A 508 11.082 -0.291 -2.138 1.00 0.00 C ATOM 1317 NZ LYS A 508 10.261 0.914 -2.409 1.00 0.00 N ATOM 0 H LYS A 508 10.229 -5.022 0.075 1.00 0.00 H new ATOM 0 HA LYS A 508 12.886 -4.111 1.013 1.00 0.00 H new ATOM 0 HB2 LYS A 508 10.185 -2.681 0.943 1.00 0.00 H new ATOM 0 HB3 LYS A 508 11.616 -2.053 1.735 1.00 0.00 H new ATOM 0 HG2 LYS A 508 12.800 -1.846 -0.395 1.00 0.00 H new ATOM 0 HG3 LYS A 508 11.540 -2.717 -1.246 1.00 0.00 H new ATOM 0 HD2 LYS A 508 9.933 -0.822 -0.386 1.00 0.00 H new ATOM 0 HD3 LYS A 508 11.399 0.072 -0.031 1.00 0.00 H new ATOM 0 HE2 LYS A 508 12.123 -0.090 -2.391 1.00 0.00 H new ATOM 0 HE3 LYS A 508 10.752 -1.111 -2.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 508 10.040 0.963 -3.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 508 9.377 0.861 -1.864 1.00 0.00 H new ATOM 0 HZ3 LYS A 508 10.790 1.765 -2.129 1.00 0.00 H new ATOM 1331 N LYS A 509 10.954 -5.867 2.626 1.00 0.00 N ATOM 1332 CA LYS A 509 10.544 -6.540 3.880 1.00 0.00 C ATOM 1333 C LYS A 509 11.651 -6.614 4.949 1.00 0.00 C ATOM 1334 O LYS A 509 11.358 -6.591 6.144 1.00 0.00 O ATOM 1335 CB LYS A 509 9.987 -7.927 3.510 1.00 0.00 C ATOM 1336 CG LYS A 509 9.298 -8.648 4.680 1.00 0.00 C ATOM 1337 CD LYS A 509 8.644 -9.974 4.261 1.00 0.00 C ATOM 1338 CE LYS A 509 9.677 -11.007 3.789 1.00 0.00 C ATOM 1339 NZ LYS A 509 9.040 -12.312 3.473 1.00 0.00 N ATOM 0 H LYS A 509 10.776 -6.447 1.806 1.00 0.00 H new ATOM 0 HA LYS A 509 9.772 -5.938 4.359 1.00 0.00 H new ATOM 0 HB2 LYS A 509 9.274 -7.816 2.693 1.00 0.00 H new ATOM 0 HB3 LYS A 509 10.802 -8.549 3.140 1.00 0.00 H new ATOM 0 HG2 LYS A 509 10.031 -8.841 5.464 1.00 0.00 H new ATOM 0 HG3 LYS A 509 8.539 -7.993 5.108 1.00 0.00 H new ATOM 0 HD2 LYS A 509 8.083 -10.382 5.102 1.00 0.00 H new ATOM 0 HD3 LYS A 509 7.928 -9.787 3.461 1.00 0.00 H new ATOM 0 HE2 LYS A 509 10.192 -10.630 2.906 1.00 0.00 H new ATOM 0 HE3 LYS A 509 10.432 -11.148 4.563 1.00 0.00 H new ATOM 0 HZ1 LYS A 509 9.767 -12.986 3.158 1.00 0.00 H new ATOM 0 HZ2 LYS A 509 8.569 -12.683 4.323 1.00 0.00 H new ATOM 0 HZ3 LYS A 509 8.338 -12.181 2.717 1.00 0.00 H new ATOM 1353 N GLN A 510 12.918 -6.629 4.532 1.00 0.00 N ATOM 1354 CA GLN A 510 14.133 -6.472 5.350 1.00 0.00 C ATOM 1355 C GLN A 510 14.324 -5.026 5.891 1.00 0.00 C ATOM 1356 O GLN A 510 15.399 -4.432 5.778 1.00 0.00 O ATOM 1357 CB GLN A 510 15.352 -7.040 4.580 1.00 0.00 C ATOM 1358 CG GLN A 510 15.848 -6.317 3.303 1.00 0.00 C ATOM 1359 CD GLN A 510 14.938 -6.384 2.074 1.00 0.00 C ATOM 1360 OE1 GLN A 510 13.985 -7.147 1.981 1.00 0.00 O ATOM 1361 NE2 GLN A 510 15.186 -5.569 1.073 1.00 0.00 N ATOM 0 H GLN A 510 13.144 -6.760 3.546 1.00 0.00 H new ATOM 0 HA GLN A 510 14.024 -7.062 6.260 1.00 0.00 H new ATOM 0 HB2 GLN A 510 16.189 -7.083 5.277 1.00 0.00 H new ATOM 0 HB3 GLN A 510 15.115 -8.067 4.303 1.00 0.00 H new ATOM 0 HG2 GLN A 510 16.011 -5.268 3.548 1.00 0.00 H new ATOM 0 HG3 GLN A 510 16.817 -6.735 3.031 1.00 0.00 H new ATOM 0 HE21 GLN A 510 15.974 -4.923 1.124 1.00 0.00 H new ATOM 0 HE22 GLN A 510 14.591 -5.583 0.245 1.00 0.00 H new ATOM 1370 N LYS A 511 13.257 -4.439 6.456 1.00 0.00 N ATOM 1371 CA LYS A 511 13.103 -3.016 6.831 1.00 0.00 C ATOM 1372 C LYS A 511 14.257 -2.406 7.642 1.00 0.00 C ATOM 1373 O LYS A 511 14.604 -1.246 7.411 1.00 0.00 O ATOM 1374 CB LYS A 511 11.773 -2.835 7.590 1.00 0.00 C ATOM 1375 CG LYS A 511 10.532 -3.123 6.724 1.00 0.00 C ATOM 1376 CD LYS A 511 9.253 -3.136 7.573 1.00 0.00 C ATOM 1377 CE LYS A 511 8.060 -3.598 6.728 1.00 0.00 C ATOM 1378 NZ LYS A 511 6.829 -3.729 7.550 1.00 0.00 N ATOM 0 H LYS A 511 12.421 -4.978 6.680 1.00 0.00 H new ATOM 0 HA LYS A 511 13.112 -2.467 5.890 1.00 0.00 H new ATOM 0 HB2 LYS A 511 11.764 -3.497 8.456 1.00 0.00 H new ATOM 0 HB3 LYS A 511 11.715 -1.814 7.968 1.00 0.00 H new ATOM 0 HG2 LYS A 511 10.446 -2.366 5.944 1.00 0.00 H new ATOM 0 HG3 LYS A 511 10.649 -4.084 6.224 1.00 0.00 H new ATOM 0 HD2 LYS A 511 9.382 -3.801 8.427 1.00 0.00 H new ATOM 0 HD3 LYS A 511 9.062 -2.139 7.971 1.00 0.00 H new ATOM 0 HE2 LYS A 511 7.886 -2.886 5.922 1.00 0.00 H new ATOM 0 HE3 LYS A 511 8.292 -4.556 6.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 511 6.099 -4.231 7.005 1.00 0.00 H new ATOM 0 HZ2 LYS A 511 7.045 -4.264 8.415 1.00 0.00 H new ATOM 0 HZ3 LYS A 511 6.480 -2.783 7.806 1.00 0.00 H new ATOM 1392 N GLY A 512 14.848 -3.161 8.577 1.00 0.00 N ATOM 1393 CA GLY A 512 15.972 -2.715 9.423 1.00 0.00 C ATOM 1394 C GLY A 512 15.707 -1.403 10.181 1.00 0.00 C ATOM 1395 O GLY A 512 16.574 -0.526 10.228 1.00 0.00 O ATOM 0 H GLY A 512 14.555 -4.118 8.773 1.00 0.00 H new ATOM 0 HA2 GLY A 512 16.202 -3.499 10.145 1.00 0.00 H new ATOM 0 HA3 GLY A 512 16.855 -2.588 8.797 1.00 0.00 H new ATOM 1399 N LYS A 513 14.487 -1.249 10.721 1.00 0.00 N ATOM 1400 CA LYS A 513 13.927 -0.005 11.293 1.00 0.00 C ATOM 1401 C LYS A 513 14.834 0.715 12.306 1.00 0.00 C ATOM 1402 O LYS A 513 14.915 1.945 12.280 1.00 0.00 O ATOM 1403 CB LYS A 513 12.558 -0.342 11.914 1.00 0.00 C ATOM 1404 CG LYS A 513 11.734 0.903 12.295 1.00 0.00 C ATOM 1405 CD LYS A 513 10.427 0.551 13.024 1.00 0.00 C ATOM 1406 CE LYS A 513 10.717 -0.062 14.400 1.00 0.00 C ATOM 1407 NZ LYS A 513 9.481 -0.411 15.139 1.00 0.00 N ATOM 0 H LYS A 513 13.828 -2.026 10.775 1.00 0.00 H new ATOM 0 HA LYS A 513 13.831 0.711 10.477 1.00 0.00 H new ATOM 0 HB2 LYS A 513 11.986 -0.945 11.208 1.00 0.00 H new ATOM 0 HB3 LYS A 513 12.712 -0.953 12.804 1.00 0.00 H new ATOM 0 HG2 LYS A 513 12.336 1.551 12.931 1.00 0.00 H new ATOM 0 HG3 LYS A 513 11.501 1.469 11.393 1.00 0.00 H new ATOM 0 HD2 LYS A 513 9.818 1.448 13.142 1.00 0.00 H new ATOM 0 HD3 LYS A 513 9.848 -0.151 12.423 1.00 0.00 H new ATOM 0 HE2 LYS A 513 11.326 -0.957 14.274 1.00 0.00 H new ATOM 0 HE3 LYS A 513 11.303 0.642 14.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 513 9.726 -0.971 15.980 1.00 0.00 H new ATOM 0 HZ2 LYS A 513 8.995 0.460 15.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 513 8.854 -0.967 14.523 1.00 0.00 H new ATOM 1421 N GLN A 514 15.514 -0.033 13.180 1.00 0.00 N ATOM 1422 CA GLN A 514 16.405 0.490 14.229 1.00 0.00 C ATOM 1423 C GLN A 514 17.673 -0.370 14.381 1.00 0.00 C ATOM 1424 O GLN A 514 17.690 -1.553 14.026 1.00 0.00 O ATOM 1425 CB GLN A 514 15.650 0.584 15.573 1.00 0.00 C ATOM 1426 CG GLN A 514 14.520 1.627 15.552 1.00 0.00 C ATOM 1427 CD GLN A 514 13.897 1.840 16.930 1.00 0.00 C ATOM 1428 OE1 GLN A 514 12.860 1.284 17.270 1.00 0.00 O ATOM 1429 NE2 GLN A 514 14.491 2.659 17.776 1.00 0.00 N ATOM 0 H GLN A 514 15.460 -1.052 13.180 1.00 0.00 H new ATOM 0 HA GLN A 514 16.722 1.489 13.929 1.00 0.00 H new ATOM 0 HB2 GLN A 514 15.232 -0.392 15.818 1.00 0.00 H new ATOM 0 HB3 GLN A 514 16.356 0.836 16.364 1.00 0.00 H new ATOM 0 HG2 GLN A 514 14.911 2.575 15.183 1.00 0.00 H new ATOM 0 HG3 GLN A 514 13.747 1.307 14.853 1.00 0.00 H new ATOM 0 HE21 GLN A 514 15.355 3.130 17.508 1.00 0.00 H new ATOM 0 HE22 GLN A 514 14.086 2.821 18.698 1.00 0.00 H new ATOM 1438 N VAL A 515 18.734 0.233 14.935 1.00 0.00 N ATOM 1439 CA VAL A 515 20.105 -0.327 14.976 1.00 0.00 C ATOM 1440 C VAL A 515 20.767 -0.262 16.369 1.00 0.00 C ATOM 1441 O VAL A 515 21.900 -0.715 16.542 1.00 0.00 O ATOM 1442 CB VAL A 515 20.946 0.349 13.864 1.00 0.00 C ATOM 1443 CG1 VAL A 515 21.342 1.793 14.203 1.00 0.00 C ATOM 1444 CG2 VAL A 515 22.197 -0.441 13.463 1.00 0.00 C ATOM 0 H VAL A 515 18.668 1.148 15.381 1.00 0.00 H new ATOM 0 HA VAL A 515 20.047 -1.398 14.780 1.00 0.00 H new ATOM 0 HB VAL A 515 20.273 0.363 13.007 1.00 0.00 H new ATOM 0 HG11 VAL A 515 21.929 2.211 13.385 1.00 0.00 H new ATOM 0 HG12 VAL A 515 20.443 2.392 14.348 1.00 0.00 H new ATOM 0 HG13 VAL A 515 21.935 1.802 15.117 1.00 0.00 H new ATOM 0 HG21 VAL A 515 22.732 0.097 12.680 1.00 0.00 H new ATOM 0 HG22 VAL A 515 22.846 -0.559 14.331 1.00 0.00 H new ATOM 0 HG23 VAL A 515 21.904 -1.423 13.093 1.00 0.00 H new ATOM 1454 N LYS A 516 20.059 0.247 17.393 1.00 0.00 N ATOM 1455 CA LYS A 516 20.531 0.306 18.797 1.00 0.00 C ATOM 1456 C LYS A 516 20.914 -1.075 19.359 1.00 0.00 C ATOM 1457 O LYS A 516 21.899 -1.193 20.092 1.00 0.00 O ATOM 1458 CB LYS A 516 19.461 0.967 19.690 1.00 0.00 C ATOM 1459 CG LYS A 516 19.065 2.404 19.302 1.00 0.00 C ATOM 1460 CD LYS A 516 20.241 3.395 19.348 1.00 0.00 C ATOM 1461 CE LYS A 516 19.808 4.836 19.040 1.00 0.00 C ATOM 1462 NZ LYS A 516 18.992 5.431 20.133 1.00 0.00 N ATOM 0 H LYS A 516 19.125 0.637 17.270 1.00 0.00 H new ATOM 0 HA LYS A 516 21.438 0.910 18.801 1.00 0.00 H new ATOM 0 HB2 LYS A 516 18.566 0.346 19.674 1.00 0.00 H new ATOM 0 HB3 LYS A 516 19.825 0.974 20.717 1.00 0.00 H new ATOM 0 HG2 LYS A 516 18.644 2.398 18.297 1.00 0.00 H new ATOM 0 HG3 LYS A 516 18.280 2.751 19.974 1.00 0.00 H new ATOM 0 HD2 LYS A 516 20.702 3.361 20.335 1.00 0.00 H new ATOM 0 HD3 LYS A 516 21.001 3.086 18.630 1.00 0.00 H new ATOM 0 HE2 LYS A 516 20.693 5.451 18.876 1.00 0.00 H new ATOM 0 HE3 LYS A 516 19.234 4.849 18.114 1.00 0.00 H new ATOM 0 HZ1 LYS A 516 18.782 6.424 19.908 1.00 0.00 H new ATOM 0 HZ2 LYS A 516 18.102 4.902 20.229 1.00 0.00 H new ATOM 0 HZ3 LYS A 516 19.521 5.383 21.027 1.00 0.00 H new ATOM 1476 N SER A 517 20.170 -2.103 18.941 1.00 0.00 N ATOM 1477 CA SER A 517 20.453 -3.536 19.153 1.00 0.00 C ATOM 1478 C SER A 517 20.002 -4.377 17.947 1.00 0.00 C ATOM 1479 O SER A 517 20.716 -5.288 17.522 1.00 0.00 O ATOM 1480 CB SER A 517 19.742 -4.061 20.411 1.00 0.00 C ATOM 1481 OG SER A 517 20.194 -3.401 21.586 1.00 0.00 O ATOM 0 H SER A 517 19.307 -1.956 18.417 1.00 0.00 H new ATOM 0 HA SER A 517 21.532 -3.630 19.278 1.00 0.00 H new ATOM 0 HB2 SER A 517 18.666 -3.921 20.306 1.00 0.00 H new ATOM 0 HB3 SER A 517 19.916 -5.133 20.506 1.00 0.00 H new ATOM 0 HG SER A 517 19.720 -3.759 22.365 1.00 0.00 H new ATOM 1487 N GLY A 518 18.845 -4.043 17.360 1.00 0.00 N ATOM 1488 CA GLY A 518 18.307 -4.630 16.125 1.00 0.00 C ATOM 1489 C GLY A 518 16.778 -4.497 16.022 1.00 0.00 C ATOM 1490 O GLY A 518 16.135 -4.057 16.984 1.00 0.00 O ATOM 0 H GLY A 518 18.232 -3.326 17.749 1.00 0.00 H new ATOM 0 HA2 GLY A 518 18.769 -4.144 15.265 1.00 0.00 H new ATOM 0 HA3 GLY A 518 18.580 -5.684 16.080 1.00 0.00 H new ATOM 1494 N PRO A 519 16.161 -4.919 14.900 1.00 0.00 N ATOM 1495 CA PRO A 519 14.703 -4.907 14.725 1.00 0.00 C ATOM 1496 C PRO A 519 13.969 -5.877 15.674 1.00 0.00 C ATOM 1497 O PRO A 519 12.787 -5.688 15.967 1.00 0.00 O ATOM 1498 CB PRO A 519 14.472 -5.251 13.249 1.00 0.00 C ATOM 1499 CG PRO A 519 15.700 -6.079 12.873 1.00 0.00 C ATOM 1500 CD PRO A 519 16.815 -5.457 13.714 1.00 0.00 C ATOM 0 HA PRO A 519 14.288 -3.933 14.984 1.00 0.00 H new ATOM 0 HB2 PRO A 519 13.550 -5.816 13.109 1.00 0.00 H new ATOM 0 HB3 PRO A 519 14.392 -4.353 12.636 1.00 0.00 H new ATOM 0 HG2 PRO A 519 15.561 -7.134 13.107 1.00 0.00 H new ATOM 0 HG3 PRO A 519 15.917 -6.015 11.807 1.00 0.00 H new ATOM 0 HD2 PRO A 519 17.564 -6.202 13.984 1.00 0.00 H new ATOM 0 HD3 PRO A 519 17.331 -4.672 13.161 1.00 0.00 H new ATOM 1508 N SER A 520 14.673 -6.879 16.217 1.00 0.00 N ATOM 1509 CA SER A 520 14.200 -7.772 17.291 1.00 0.00 C ATOM 1510 C SER A 520 13.990 -7.073 18.650 1.00 0.00 C ATOM 1511 O SER A 520 13.438 -7.679 19.572 1.00 0.00 O ATOM 1512 CB SER A 520 15.197 -8.924 17.486 1.00 0.00 C ATOM 1513 OG SER A 520 15.441 -9.600 16.259 1.00 0.00 O ATOM 0 H SER A 520 15.621 -7.100 15.912 1.00 0.00 H new ATOM 0 HA SER A 520 13.225 -8.133 16.964 1.00 0.00 H new ATOM 0 HB2 SER A 520 16.134 -8.535 17.884 1.00 0.00 H new ATOM 0 HB3 SER A 520 14.806 -9.627 18.221 1.00 0.00 H new ATOM 0 HG SER A 520 16.080 -10.328 16.408 1.00 0.00 H new ATOM 1519 N SER A 521 14.416 -5.810 18.786 1.00 0.00 N ATOM 1520 CA SER A 521 14.463 -5.047 20.048 1.00 0.00 C ATOM 1521 C SER A 521 13.869 -3.629 19.932 1.00 0.00 C ATOM 1522 O SER A 521 13.988 -2.829 20.868 1.00 0.00 O ATOM 1523 CB SER A 521 15.917 -4.957 20.540 1.00 0.00 C ATOM 1524 OG SER A 521 16.531 -6.236 20.644 1.00 0.00 O ATOM 0 H SER A 521 14.751 -5.267 17.990 1.00 0.00 H new ATOM 0 HA SER A 521 13.844 -5.588 20.764 1.00 0.00 H new ATOM 0 HB2 SER A 521 16.492 -4.335 19.855 1.00 0.00 H new ATOM 0 HB3 SER A 521 15.940 -4.465 21.513 1.00 0.00 H new ATOM 0 HG SER A 521 17.453 -6.131 20.958 1.00 0.00 H new ATOM 1530 N GLY A 522 13.229 -3.298 18.801 1.00 0.00 N ATOM 1531 CA GLY A 522 12.631 -1.984 18.515 1.00 0.00 C ATOM 1532 C GLY A 522 11.803 -1.980 17.234 1.00 0.00 C ATOM 1533 O GLY A 522 12.391 -2.165 16.147 1.00 0.00 O ATOM 1534 OXT GLY A 522 10.568 -1.796 17.327 1.00 0.00 O ATOM 0 H GLY A 522 13.109 -3.959 18.034 1.00 0.00 H new ATOM 0 HA2 GLY A 522 11.999 -1.687 19.352 1.00 0.00 H new ATOM 0 HA3 GLY A 522 13.423 -1.239 18.433 1.00 0.00 H new TER 1538 GLY A 522 HETATM 1539 P 7MG A 523 -9.703 -3.222 11.640 1.00 0.00 P HETATM 1540 OP1 7MG A 523 -10.826 -2.311 11.965 1.00 0.00 O HETATM 1541 OP2 7MG A 523 -9.542 -3.666 10.234 1.00 0.00 O HETATM 1542 O5' 7MG A 523 -8.330 -2.509 12.095 1.00 0.00 O HETATM 1543 C5' 7MG A 523 -7.074 -3.155 11.954 1.00 0.00 C HETATM 1544 C4' 7MG A 523 -5.894 -2.241 12.325 1.00 0.00 C HETATM 1545 O4' 7MG A 523 -5.772 -1.124 11.460 1.00 0.00 O HETATM 1546 C3' 7MG A 523 -5.951 -1.680 13.753 1.00 0.00 C HETATM 1547 O3' 7MG A 523 -5.497 -2.588 14.756 1.00 0.00 O HETATM 1548 C2' 7MG A 523 -5.033 -0.455 13.624 1.00 0.00 C HETATM 1549 O2' 7MG A 523 -3.648 -0.794 13.715 1.00 0.00 O HETATM 1550 C1' 7MG A 523 -5.340 0.013 12.197 1.00 0.00 C HETATM 1551 N9 7MG A 523 -6.437 1.004 12.126 1.00 0.00 N HETATM 1552 C8 7MG A 523 -7.794 0.758 12.165 1.00 0.00 C HETATM 1553 N7 7MG A 523 -8.480 1.928 11.773 1.00 0.00 N HETATM 1554 C5 7MG A 523 -7.502 2.863 11.579 1.00 0.00 C HETATM 1555 C6 7MG A 523 -7.608 4.198 11.156 1.00 0.00 C HETATM 1556 O6 7MG A 523 -8.607 4.822 10.832 1.00 0.00 O HETATM 1557 N1 7MG A 523 -6.422 4.836 11.106 1.00 0.00 N HETATM 1558 C2 7MG A 523 -5.273 4.245 11.350 1.00 0.00 C HETATM 1559 N2 7MG A 523 -4.261 5.017 11.216 1.00 0.00 N HETATM 1560 N3 7MG A 523 -5.090 3.007 11.738 1.00 0.00 N HETATM 1561 C4 7MG A 523 -6.267 2.341 11.825 1.00 0.00 C HETATM 1562 CM7 7MG A 523 -9.972 1.939 11.638 1.00 0.00 C HETATM 0 HO3' 7MG A 523 -5.561 -2.162 15.636 1.00 0.00 H new HETATM 0 HO2' 7MG A 523 -3.553 -1.669 14.146 1.00 0.00 H new HETATM 0 HN22 7MG A 523 -3.321 4.659 11.382 1.00 0.00 H new HETATM 0 HN21 7MG A 523 -4.395 5.991 10.943 1.00 0.00 H new HETATM 0 HM73 7MG A 523 -10.275 1.206 10.891 1.00 0.00 H new HETATM 0 HM72 7MG A 523 -10.426 1.689 12.597 1.00 0.00 H new HETATM 0 HM71 7MG A 523 -10.302 2.931 11.328 1.00 0.00 H new HETATM 0 H5'' 7MG A 523 -7.053 -4.043 12.586 1.00 0.00 H new HETATM 0 HN1 7MG A 523 -6.415 5.828 10.867 1.00 0.00 H new HETATM 0 H82 7MG A 523 -8.047 -0.068 11.501 1.00 0.00 H new HETATM 0 H81 7MG A 523 -8.095 0.463 13.170 1.00 0.00 H new HETATM 0 H5' 7MG A 523 -6.957 -3.493 10.924 1.00 0.00 H new HETATM 0 H4' 7MG A 523 -5.037 -2.908 12.231 1.00 0.00 H new HETATM 0 H3' 7MG A 523 -6.966 -1.462 14.085 1.00 0.00 H new HETATM 0 H2' 7MG A 523 -5.205 0.278 14.412 1.00 0.00 H new HETATM 0 H1' 7MG A 523 -4.435 0.479 11.806 1.00 0.00 H new HETATM 1578 PB GDP A 524 -10.278 -4.752 13.958 1.00 0.00 P HETATM 1579 O1B GDP A 524 -9.452 -5.896 14.425 1.00 0.00 O HETATM 1580 O2B GDP A 524 -11.753 -4.936 13.885 1.00 0.00 O HETATM 1581 O3B GDP A 524 -9.816 -4.529 12.487 1.00 0.00 O HETATM 1582 O3A GDP A 524 -9.927 -3.467 14.726 1.00 0.00 O HETATM 1583 PA GDP A 524 -9.811 -3.418 16.262 1.00 0.00 P HETATM 1584 O1A GDP A 524 -8.395 -3.634 16.667 1.00 0.00 O HETATM 1585 O2A GDP A 524 -10.875 -4.205 16.947 1.00 0.00 O HETATM 1586 O5' GDP A 524 -10.141 -1.866 16.600 1.00 0.00 O HETATM 1587 C5' GDP A 524 -9.558 -0.783 15.875 1.00 0.00 C HETATM 1588 C4' GDP A 524 -8.127 -0.440 16.324 1.00 0.00 C HETATM 1589 O4' GDP A 524 -7.625 0.560 15.440 1.00 0.00 O HETATM 1590 C3' GDP A 524 -8.069 0.122 17.755 1.00 0.00 C HETATM 1591 O3' GDP A 524 -6.836 -0.227 18.392 1.00 0.00 O HETATM 1592 C2' GDP A 524 -8.141 1.629 17.478 1.00 0.00 C HETATM 1593 O2' GDP A 524 -7.612 2.426 18.534 1.00 0.00 O HETATM 1594 C1' GDP A 524 -7.323 1.725 16.188 1.00 0.00 C HETATM 1595 N9 GDP A 524 -7.638 2.938 15.404 1.00 0.00 N HETATM 1596 C8 GDP A 524 -8.858 3.366 14.948 1.00 0.00 C HETATM 1597 N7 GDP A 524 -8.839 4.554 14.396 1.00 0.00 N HETATM 1598 C5 GDP A 524 -7.490 4.933 14.470 1.00 0.00 C HETATM 1599 C6 GDP A 524 -6.795 6.119 14.029 1.00 0.00 C HETATM 1600 O6 GDP A 524 -7.243 7.138 13.501 1.00 0.00 O HETATM 1601 N1 GDP A 524 -5.427 6.056 14.219 1.00 0.00 N HETATM 1602 C2 GDP A 524 -4.794 4.999 14.784 1.00 0.00 C HETATM 1603 N2 GDP A 524 -3.493 5.055 14.852 1.00 0.00 N HETATM 1604 N3 GDP A 524 -5.396 3.903 15.239 1.00 0.00 N HETATM 1605 C4 GDP A 524 -6.748 3.924 15.049 1.00 0.00 C HETATM 0 HO3' GDP A 524 -6.464 0.562 18.839 1.00 0.00 H new HETATM 0 HO2' GDP A 524 -7.685 3.374 18.297 1.00 0.00 H new HETATM 0 HN22 GDP A 524 -2.970 4.284 15.268 1.00 0.00 H new HETATM 0 HN21 GDP A 524 -2.998 5.869 14.489 1.00 0.00 H new HETATM 0 H5'' GDP A 524 -9.547 -1.032 14.814 1.00 0.00 H new HETATM 0 HN1 GDP A 524 -4.862 6.850 13.917 1.00 0.00 H new HETATM 0 H8 GDP A 524 -9.766 2.769 15.037 1.00 0.00 H new HETATM 0 H5' GDP A 524 -10.187 0.100 15.989 1.00 0.00 H new HETATM 0 H4' GDP A 524 -7.539 -1.358 16.304 1.00 0.00 H new HETATM 0 H3' GDP A 524 -8.847 -0.252 18.421 1.00 0.00 H new HETATM 0 H2' GDP A 524 -9.157 2.013 17.394 1.00 0.00 H new HETATM 0 H1' GDP A 524 -6.262 1.796 16.426 1.00 0.00 H new