USER MOD reduce.3.24.130724 H: found=0, std=0, add=841, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 843 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 531 ASN : amide:sc= 1.08 K(o=1.1,f=-5.8!) USER MOD Set 1.2: A 533 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 517 SER OG : rot 180:sc= 0.335 USER MOD Set 2.2: A 519 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 510 LYS NZ :NH3+ -170:sc= 1.67 (180deg=1) USER MOD Set 3.2: A 512 TYR OH : rot 180:sc= 0.389 USER MOD Set 4.1: A 484 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 4.2: A 486 TYR OH : rot 150:sc= -0.0513 USER MOD Single : A 434 SER OG : rot 180:sc= 0 USER MOD Single : A 435 SER OG : rot 180:sc= 0.00669 USER MOD Single : A 437 SER OG : rot 180:sc= 0.00394 USER MOD Single : A 438 SER OG : rot 180:sc= 0 USER MOD Single : A 440 SER OG : rot 180:sc= -0.0108 USER MOD Single : A 442 LYS NZ :NH3+ -172:sc= 0.00588 (180deg=0.00147) USER MOD Single : A 458 THR OG1 : rot 80:sc= 1.22 USER MOD Single : A 460 SER OG : rot 69:sc= 1.22 USER MOD Single : A 473 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 474 LYS NZ :NH3+ 178:sc= 1.26 (180deg=1.23) USER MOD Single : A 477 SER OG : rot -133:sc= 0.764 USER MOD Single : A 478 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 479 SER OG : rot 180:sc= 0 USER MOD Single : A 480 TYR OH : rot 180:sc= 0 USER MOD Single : A 492 GLN : amide:sc= -0.0011 X(o=-0.0011,f=-0.0011) USER MOD Single : A 495 SER OG : rot 180:sc= 0 USER MOD Single : A 496 SER OG : rot -77:sc= 0.275 USER MOD Single : A 498 GLN : amide:sc= 0.533 K(o=0.53,f=-0.94) USER MOD Single : A 504 CYS SG : rot 72:sc= 0.558 USER MOD Single : A 514 CYS SG : rot 180:sc= 0 USER MOD Single : A 516 SER OG : rot 180:sc= 0 USER MOD Single : A 521 LYS NZ :NH3+ 177:sc= 1.17 (180deg=1.15) USER MOD Single : A 523 LYS NZ :NH3+ -161:sc= 0.948 (180deg=0.683) USER MOD Single : A 526 GLN : amide:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 535 SER OG : rot 17:sc= 0.496 USER MOD Single : A 539 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 541 SER OG : rot 72:sc= 0.385 USER MOD Single : A 544 SER OG : rot 180:sc= 0 USER MOD Single : A 545 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 433 -18.863 18.311 2.472 1.00 0.00 N ATOM 2 CA GLY A 433 -17.735 18.920 1.736 1.00 0.00 C ATOM 3 C GLY A 433 -16.502 18.034 1.788 1.00 0.00 C ATOM 4 O GLY A 433 -16.178 17.484 2.842 1.00 0.00 O ATOM 0 HA2 GLY A 433 -18.023 19.087 0.698 1.00 0.00 H new ATOM 0 HA3 GLY A 433 -17.503 19.896 2.163 1.00 0.00 H new ATOM 10 N SER A 434 -15.793 17.900 0.666 1.00 0.00 N ATOM 11 CA SER A 434 -14.653 16.979 0.487 1.00 0.00 C ATOM 12 C SER A 434 -13.611 17.558 -0.490 1.00 0.00 C ATOM 13 O SER A 434 -13.945 18.352 -1.373 1.00 0.00 O ATOM 14 CB SER A 434 -15.143 15.621 -0.055 1.00 0.00 C ATOM 15 OG SER A 434 -16.071 14.986 0.819 1.00 0.00 O ATOM 0 H SER A 434 -15.997 18.443 -0.173 1.00 0.00 H new ATOM 0 HA SER A 434 -14.186 16.845 1.463 1.00 0.00 H new ATOM 0 HB2 SER A 434 -15.610 15.769 -1.029 1.00 0.00 H new ATOM 0 HB3 SER A 434 -14.286 14.965 -0.209 1.00 0.00 H new ATOM 0 HG SER A 434 -16.353 14.131 0.432 1.00 0.00 H new ATOM 21 N SER A 435 -12.342 17.156 -0.366 1.00 0.00 N ATOM 22 CA SER A 435 -11.241 17.613 -1.236 1.00 0.00 C ATOM 23 C SER A 435 -11.195 16.918 -2.612 1.00 0.00 C ATOM 24 O SER A 435 -10.585 17.441 -3.550 1.00 0.00 O ATOM 25 CB SER A 435 -9.907 17.422 -0.499 1.00 0.00 C ATOM 26 OG SER A 435 -9.772 16.094 -0.002 1.00 0.00 O ATOM 0 H SER A 435 -12.041 16.495 0.350 1.00 0.00 H new ATOM 0 HA SER A 435 -11.422 18.667 -1.447 1.00 0.00 H new ATOM 0 HB2 SER A 435 -9.081 17.645 -1.175 1.00 0.00 H new ATOM 0 HB3 SER A 435 -9.842 18.130 0.328 1.00 0.00 H new ATOM 0 HG SER A 435 -8.913 16.003 0.460 1.00 0.00 H new ATOM 32 N GLY A 436 -11.858 15.762 -2.764 1.00 0.00 N ATOM 33 CA GLY A 436 -12.016 15.062 -4.043 1.00 0.00 C ATOM 34 C GLY A 436 -10.676 14.635 -4.648 1.00 0.00 C ATOM 35 O GLY A 436 -9.902 13.909 -4.026 1.00 0.00 O ATOM 0 H GLY A 436 -12.307 15.280 -1.985 1.00 0.00 H new ATOM 0 HA2 GLY A 436 -12.642 14.182 -3.897 1.00 0.00 H new ATOM 0 HA3 GLY A 436 -12.538 15.711 -4.746 1.00 0.00 H new ATOM 39 N SER A 437 -10.402 15.091 -5.868 1.00 0.00 N ATOM 40 CA SER A 437 -9.157 14.834 -6.607 1.00 0.00 C ATOM 41 C SER A 437 -8.058 15.899 -6.388 1.00 0.00 C ATOM 42 O SER A 437 -6.962 15.768 -6.937 1.00 0.00 O ATOM 43 CB SER A 437 -9.494 14.707 -8.103 1.00 0.00 C ATOM 44 OG SER A 437 -10.184 15.858 -8.582 1.00 0.00 O ATOM 0 H SER A 437 -11.059 15.669 -6.391 1.00 0.00 H new ATOM 0 HA SER A 437 -8.736 13.907 -6.218 1.00 0.00 H new ATOM 0 HB2 SER A 437 -8.576 14.568 -8.673 1.00 0.00 H new ATOM 0 HB3 SER A 437 -10.107 13.820 -8.265 1.00 0.00 H new ATOM 0 HG SER A 437 -10.382 15.747 -9.535 1.00 0.00 H new ATOM 50 N SER A 438 -8.307 16.955 -5.602 1.00 0.00 N ATOM 51 CA SER A 438 -7.366 18.075 -5.424 1.00 0.00 C ATOM 52 C SER A 438 -6.100 17.688 -4.633 1.00 0.00 C ATOM 53 O SER A 438 -6.163 16.982 -3.620 1.00 0.00 O ATOM 54 CB SER A 438 -8.056 19.266 -4.743 1.00 0.00 C ATOM 55 OG SER A 438 -9.110 19.780 -5.550 1.00 0.00 O ATOM 0 H SER A 438 -9.170 17.059 -5.068 1.00 0.00 H new ATOM 0 HA SER A 438 -7.046 18.358 -6.427 1.00 0.00 H new ATOM 0 HB2 SER A 438 -8.453 18.956 -3.776 1.00 0.00 H new ATOM 0 HB3 SER A 438 -7.325 20.052 -4.551 1.00 0.00 H new ATOM 0 HG SER A 438 -9.533 20.536 -5.092 1.00 0.00 H new ATOM 61 N GLY A 439 -4.939 18.185 -5.081 1.00 0.00 N ATOM 62 CA GLY A 439 -3.610 17.814 -4.580 1.00 0.00 C ATOM 63 C GLY A 439 -2.669 17.480 -5.736 1.00 0.00 C ATOM 64 O GLY A 439 -2.383 18.336 -6.572 1.00 0.00 O ATOM 0 H GLY A 439 -4.899 18.879 -5.827 1.00 0.00 H new ATOM 0 HA2 GLY A 439 -3.196 18.634 -3.993 1.00 0.00 H new ATOM 0 HA3 GLY A 439 -3.694 16.955 -3.914 1.00 0.00 H new ATOM 68 N SER A 440 -2.190 16.240 -5.789 1.00 0.00 N ATOM 69 CA SER A 440 -1.296 15.722 -6.835 1.00 0.00 C ATOM 70 C SER A 440 -1.571 14.237 -7.145 1.00 0.00 C ATOM 71 O SER A 440 -2.269 13.550 -6.391 1.00 0.00 O ATOM 72 CB SER A 440 0.159 15.933 -6.391 1.00 0.00 C ATOM 73 OG SER A 440 1.072 15.612 -7.430 1.00 0.00 O ATOM 0 H SER A 440 -2.418 15.540 -5.083 1.00 0.00 H new ATOM 0 HA SER A 440 -1.482 16.269 -7.759 1.00 0.00 H new ATOM 0 HB2 SER A 440 0.301 16.970 -6.088 1.00 0.00 H new ATOM 0 HB3 SER A 440 0.367 15.314 -5.518 1.00 0.00 H new ATOM 0 HG SER A 440 1.989 15.758 -7.117 1.00 0.00 H new ATOM 79 N ARG A 441 -1.002 13.726 -8.248 1.00 0.00 N ATOM 80 CA ARG A 441 -1.109 12.316 -8.663 1.00 0.00 C ATOM 81 C ARG A 441 -0.235 11.362 -7.828 1.00 0.00 C ATOM 82 O ARG A 441 -0.306 10.144 -8.006 1.00 0.00 O ATOM 83 CB ARG A 441 -0.781 12.159 -10.155 1.00 0.00 C ATOM 84 CG ARG A 441 -1.662 13.047 -11.049 1.00 0.00 C ATOM 85 CD ARG A 441 -1.614 12.628 -12.522 1.00 0.00 C ATOM 86 NE ARG A 441 -0.239 12.537 -13.043 1.00 0.00 N ATOM 87 CZ ARG A 441 0.500 13.512 -13.559 1.00 0.00 C ATOM 88 NH1 ARG A 441 0.062 14.751 -13.654 1.00 0.00 N ATOM 89 NH2 ARG A 441 1.715 13.246 -13.987 1.00 0.00 N ATOM 0 H ARG A 441 -0.444 14.290 -8.889 1.00 0.00 H new ATOM 0 HA ARG A 441 -2.146 12.031 -8.484 1.00 0.00 H new ATOM 0 HB2 ARG A 441 0.267 12.408 -10.321 1.00 0.00 H new ATOM 0 HB3 ARG A 441 -0.910 11.116 -10.444 1.00 0.00 H new ATOM 0 HG2 ARG A 441 -2.692 13.004 -10.696 1.00 0.00 H new ATOM 0 HG3 ARG A 441 -1.337 14.084 -10.959 1.00 0.00 H new ATOM 0 HD2 ARG A 441 -2.106 11.662 -12.637 1.00 0.00 H new ATOM 0 HD3 ARG A 441 -2.177 13.346 -13.118 1.00 0.00 H new ATOM 0 HE ARG A 441 0.197 11.616 -13.003 1.00 0.00 H new ATOM 0 HH11 ARG A 441 -0.874 14.988 -13.325 1.00 0.00 H new ATOM 0 HH12 ARG A 441 0.659 15.474 -14.056 1.00 0.00 H new ATOM 0 HH21 ARG A 441 2.083 12.297 -13.921 1.00 0.00 H new ATOM 0 HH22 ARG A 441 2.290 13.989 -14.385 1.00 0.00 H new ATOM 103 N LYS A 442 0.597 11.893 -6.926 1.00 0.00 N ATOM 104 CA LYS A 442 1.358 11.108 -5.952 1.00 0.00 C ATOM 105 C LYS A 442 0.457 10.634 -4.792 1.00 0.00 C ATOM 106 O LYS A 442 -0.341 11.414 -4.273 1.00 0.00 O ATOM 107 CB LYS A 442 2.566 11.938 -5.475 1.00 0.00 C ATOM 108 CG LYS A 442 3.487 11.132 -4.539 1.00 0.00 C ATOM 109 CD LYS A 442 4.832 11.823 -4.266 1.00 0.00 C ATOM 110 CE LYS A 442 4.658 13.079 -3.403 1.00 0.00 C ATOM 111 NZ LYS A 442 5.965 13.685 -3.034 1.00 0.00 N ATOM 0 H LYS A 442 0.762 12.897 -6.852 1.00 0.00 H new ATOM 0 HA LYS A 442 1.736 10.200 -6.421 1.00 0.00 H new ATOM 0 HB2 LYS A 442 3.136 12.278 -6.339 1.00 0.00 H new ATOM 0 HB3 LYS A 442 2.212 12.829 -4.956 1.00 0.00 H new ATOM 0 HG2 LYS A 442 2.974 10.964 -3.592 1.00 0.00 H new ATOM 0 HG3 LYS A 442 3.673 10.152 -4.979 1.00 0.00 H new ATOM 0 HD2 LYS A 442 5.504 11.127 -3.764 1.00 0.00 H new ATOM 0 HD3 LYS A 442 5.301 12.093 -5.212 1.00 0.00 H new ATOM 0 HE2 LYS A 442 4.059 13.811 -3.944 1.00 0.00 H new ATOM 0 HE3 LYS A 442 4.108 12.824 -2.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 442 5.812 14.447 -2.343 1.00 0.00 H new ATOM 0 HZ2 LYS A 442 6.579 12.957 -2.616 1.00 0.00 H new ATOM 0 HZ3 LYS A 442 6.419 14.075 -3.884 1.00 0.00 H new ATOM 125 N VAL A 443 0.601 9.381 -4.357 1.00 0.00 N ATOM 126 CA VAL A 443 -0.132 8.804 -3.211 1.00 0.00 C ATOM 127 C VAL A 443 0.817 7.951 -2.366 1.00 0.00 C ATOM 128 O VAL A 443 1.331 6.943 -2.842 1.00 0.00 O ATOM 129 CB VAL A 443 -1.346 7.954 -3.666 1.00 0.00 C ATOM 130 CG1 VAL A 443 -2.133 7.419 -2.458 1.00 0.00 C ATOM 131 CG2 VAL A 443 -2.307 8.730 -4.581 1.00 0.00 C ATOM 0 H VAL A 443 1.242 8.719 -4.795 1.00 0.00 H new ATOM 0 HA VAL A 443 -0.517 9.631 -2.614 1.00 0.00 H new ATOM 0 HB VAL A 443 -0.929 7.123 -4.236 1.00 0.00 H new ATOM 0 HG11 VAL A 443 -2.978 6.827 -2.808 1.00 0.00 H new ATOM 0 HG12 VAL A 443 -1.481 6.795 -1.846 1.00 0.00 H new ATOM 0 HG13 VAL A 443 -2.498 8.256 -1.862 1.00 0.00 H new ATOM 0 HG21 VAL A 443 -3.137 8.085 -4.868 1.00 0.00 H new ATOM 0 HG22 VAL A 443 -2.691 9.601 -4.050 1.00 0.00 H new ATOM 0 HG23 VAL A 443 -1.775 9.055 -5.475 1.00 0.00 H new ATOM 141 N PHE A 444 1.041 8.341 -1.110 1.00 0.00 N ATOM 142 CA PHE A 444 1.796 7.546 -0.138 1.00 0.00 C ATOM 143 C PHE A 444 0.980 6.324 0.317 1.00 0.00 C ATOM 144 O PHE A 444 -0.230 6.425 0.529 1.00 0.00 O ATOM 145 CB PHE A 444 2.173 8.439 1.053 1.00 0.00 C ATOM 146 CG PHE A 444 2.838 7.711 2.211 1.00 0.00 C ATOM 147 CD1 PHE A 444 2.058 7.150 3.243 1.00 0.00 C ATOM 148 CD2 PHE A 444 4.237 7.585 2.257 1.00 0.00 C ATOM 149 CE1 PHE A 444 2.672 6.490 4.321 1.00 0.00 C ATOM 150 CE2 PHE A 444 4.854 6.933 3.340 1.00 0.00 C ATOM 151 CZ PHE A 444 4.072 6.386 4.373 1.00 0.00 C ATOM 0 H PHE A 444 0.700 9.226 -0.735 1.00 0.00 H new ATOM 0 HA PHE A 444 2.708 7.170 -0.603 1.00 0.00 H new ATOM 0 HB2 PHE A 444 2.843 9.224 0.703 1.00 0.00 H new ATOM 0 HB3 PHE A 444 1.272 8.930 1.420 1.00 0.00 H new ATOM 0 HD1 PHE A 444 0.982 7.228 3.205 1.00 0.00 H new ATOM 0 HD2 PHE A 444 4.840 7.990 1.458 1.00 0.00 H new ATOM 0 HE1 PHE A 444 2.068 6.063 5.108 1.00 0.00 H new ATOM 0 HE2 PHE A 444 5.930 6.852 3.378 1.00 0.00 H new ATOM 0 HZ PHE A 444 4.547 5.887 5.205 1.00 0.00 H new ATOM 161 N VAL A 445 1.653 5.187 0.504 1.00 0.00 N ATOM 162 CA VAL A 445 1.074 3.930 1.005 1.00 0.00 C ATOM 163 C VAL A 445 1.977 3.350 2.092 1.00 0.00 C ATOM 164 O VAL A 445 3.163 3.135 1.842 1.00 0.00 O ATOM 165 CB VAL A 445 0.884 2.892 -0.121 1.00 0.00 C ATOM 166 CG1 VAL A 445 0.249 1.590 0.399 1.00 0.00 C ATOM 167 CG2 VAL A 445 0.005 3.454 -1.243 1.00 0.00 C ATOM 0 H VAL A 445 2.650 5.109 0.305 1.00 0.00 H new ATOM 0 HA VAL A 445 0.090 4.157 1.415 1.00 0.00 H new ATOM 0 HB VAL A 445 1.879 2.669 -0.507 1.00 0.00 H new ATOM 0 HG11 VAL A 445 0.133 0.887 -0.426 1.00 0.00 H new ATOM 0 HG12 VAL A 445 0.892 1.151 1.162 1.00 0.00 H new ATOM 0 HG13 VAL A 445 -0.728 1.808 0.830 1.00 0.00 H new ATOM 0 HG21 VAL A 445 -0.113 2.703 -2.024 1.00 0.00 H new ATOM 0 HG22 VAL A 445 -0.974 3.717 -0.841 1.00 0.00 H new ATOM 0 HG23 VAL A 445 0.475 4.343 -1.663 1.00 0.00 H new ATOM 177 N GLY A 446 1.416 3.096 3.281 1.00 0.00 N ATOM 178 CA GLY A 446 2.121 2.521 4.435 1.00 0.00 C ATOM 179 C GLY A 446 1.531 1.188 4.903 1.00 0.00 C ATOM 180 O GLY A 446 0.316 0.997 4.870 1.00 0.00 O ATOM 0 H GLY A 446 0.433 3.290 3.473 1.00 0.00 H new ATOM 0 HA2 GLY A 446 3.170 2.375 4.175 1.00 0.00 H new ATOM 0 HA3 GLY A 446 2.093 3.232 5.260 1.00 0.00 H new ATOM 184 N GLY A 447 2.393 0.279 5.368 1.00 0.00 N ATOM 185 CA GLY A 447 2.043 -1.074 5.837 1.00 0.00 C ATOM 186 C GLY A 447 2.305 -2.189 4.816 1.00 0.00 C ATOM 187 O GLY A 447 1.887 -3.325 5.048 1.00 0.00 O ATOM 0 H GLY A 447 3.393 0.468 5.432 1.00 0.00 H new ATOM 0 HA2 GLY A 447 2.609 -1.288 6.743 1.00 0.00 H new ATOM 0 HA3 GLY A 447 0.988 -1.089 6.109 1.00 0.00 H new ATOM 191 N LEU A 448 2.981 -1.886 3.701 1.00 0.00 N ATOM 192 CA LEU A 448 3.331 -2.834 2.634 1.00 0.00 C ATOM 193 C LEU A 448 4.154 -4.025 3.186 1.00 0.00 C ATOM 194 O LEU A 448 5.003 -3.806 4.058 1.00 0.00 O ATOM 195 CB LEU A 448 4.130 -2.096 1.536 1.00 0.00 C ATOM 196 CG LEU A 448 3.358 -0.988 0.787 1.00 0.00 C ATOM 197 CD1 LEU A 448 4.310 -0.237 -0.151 1.00 0.00 C ATOM 198 CD2 LEU A 448 2.193 -1.561 -0.034 1.00 0.00 C ATOM 0 H LEU A 448 3.312 -0.940 3.509 1.00 0.00 H new ATOM 0 HA LEU A 448 2.410 -3.236 2.211 1.00 0.00 H new ATOM 0 HB2 LEU A 448 5.017 -1.654 1.991 1.00 0.00 H new ATOM 0 HB3 LEU A 448 4.477 -2.829 0.808 1.00 0.00 H new ATOM 0 HG LEU A 448 2.948 -0.309 1.535 1.00 0.00 H new ATOM 0 HD11 LEU A 448 3.761 0.544 -0.677 1.00 0.00 H new ATOM 0 HD12 LEU A 448 5.114 0.214 0.431 1.00 0.00 H new ATOM 0 HD13 LEU A 448 4.733 -0.934 -0.874 1.00 0.00 H new ATOM 0 HD21 LEU A 448 1.675 -0.750 -0.546 1.00 0.00 H new ATOM 0 HD22 LEU A 448 2.579 -2.267 -0.770 1.00 0.00 H new ATOM 0 HD23 LEU A 448 1.497 -2.074 0.630 1.00 0.00 H new ATOM 210 N PRO A 449 3.932 -5.265 2.695 1.00 0.00 N ATOM 211 CA PRO A 449 4.716 -6.444 3.071 1.00 0.00 C ATOM 212 C PRO A 449 6.237 -6.274 2.884 1.00 0.00 C ATOM 213 O PRO A 449 6.661 -5.486 2.035 1.00 0.00 O ATOM 214 CB PRO A 449 4.192 -7.578 2.185 1.00 0.00 C ATOM 215 CG PRO A 449 2.746 -7.180 1.904 1.00 0.00 C ATOM 216 CD PRO A 449 2.825 -5.659 1.827 1.00 0.00 C ATOM 0 HA PRO A 449 4.594 -6.639 4.137 1.00 0.00 H new ATOM 0 HB2 PRO A 449 4.769 -7.666 1.264 1.00 0.00 H new ATOM 0 HB3 PRO A 449 4.251 -8.541 2.691 1.00 0.00 H new ATOM 0 HG2 PRO A 449 2.380 -7.614 0.973 1.00 0.00 H new ATOM 0 HG3 PRO A 449 2.074 -7.511 2.696 1.00 0.00 H new ATOM 0 HD2 PRO A 449 2.997 -5.329 0.802 1.00 0.00 H new ATOM 0 HD3 PRO A 449 1.891 -5.203 2.156 1.00 0.00 H new ATOM 224 N PRO A 450 7.072 -7.035 3.620 1.00 0.00 N ATOM 225 CA PRO A 450 8.533 -6.977 3.522 1.00 0.00 C ATOM 226 C PRO A 450 9.101 -7.752 2.313 1.00 0.00 C ATOM 227 O PRO A 450 10.320 -7.838 2.167 1.00 0.00 O ATOM 228 CB PRO A 450 9.021 -7.561 4.852 1.00 0.00 C ATOM 229 CG PRO A 450 7.973 -8.631 5.153 1.00 0.00 C ATOM 230 CD PRO A 450 6.682 -7.984 4.657 1.00 0.00 C ATOM 0 HA PRO A 450 8.877 -5.956 3.354 1.00 0.00 H new ATOM 0 HB2 PRO A 450 10.021 -7.986 4.765 1.00 0.00 H new ATOM 0 HB3 PRO A 450 9.064 -6.804 5.635 1.00 0.00 H new ATOM 0 HG2 PRO A 450 8.185 -9.564 4.631 1.00 0.00 H new ATOM 0 HG3 PRO A 450 7.926 -8.865 6.217 1.00 0.00 H new ATOM 0 HD2 PRO A 450 5.998 -8.735 4.260 1.00 0.00 H new ATOM 0 HD3 PRO A 450 6.163 -7.479 5.471 1.00 0.00 H new ATOM 238 N ASP A 451 8.243 -8.317 1.454 1.00 0.00 N ATOM 239 CA ASP A 451 8.603 -9.243 0.365 1.00 0.00 C ATOM 240 C ASP A 451 7.829 -8.939 -0.939 1.00 0.00 C ATOM 241 O ASP A 451 7.691 -9.792 -1.816 1.00 0.00 O ATOM 242 CB ASP A 451 8.385 -10.684 0.867 1.00 0.00 C ATOM 243 CG ASP A 451 9.113 -11.744 0.019 1.00 0.00 C ATOM 244 OD1 ASP A 451 10.364 -11.702 -0.051 1.00 0.00 O ATOM 245 OD2 ASP A 451 8.443 -12.658 -0.520 1.00 0.00 O ATOM 0 H ASP A 451 7.240 -8.137 1.498 1.00 0.00 H new ATOM 0 HA ASP A 451 9.653 -9.113 0.103 1.00 0.00 H new ATOM 0 HB2 ASP A 451 8.728 -10.757 1.899 1.00 0.00 H new ATOM 0 HB3 ASP A 451 7.317 -10.902 0.870 1.00 0.00 H new ATOM 250 N ILE A 452 7.296 -7.715 -1.060 1.00 0.00 N ATOM 251 CA ILE A 452 6.566 -7.217 -2.238 1.00 0.00 C ATOM 252 C ILE A 452 7.457 -6.279 -3.068 1.00 0.00 C ATOM 253 O ILE A 452 8.155 -5.433 -2.511 1.00 0.00 O ATOM 254 CB ILE A 452 5.239 -6.553 -1.792 1.00 0.00 C ATOM 255 CG1 ILE A 452 4.260 -6.487 -2.978 1.00 0.00 C ATOM 256 CG2 ILE A 452 5.446 -5.160 -1.163 1.00 0.00 C ATOM 257 CD1 ILE A 452 2.869 -5.958 -2.615 1.00 0.00 C ATOM 0 H ILE A 452 7.363 -7.020 -0.316 1.00 0.00 H new ATOM 0 HA ILE A 452 6.305 -8.051 -2.890 1.00 0.00 H new ATOM 0 HB ILE A 452 4.811 -7.177 -1.007 1.00 0.00 H new ATOM 0 HG12 ILE A 452 4.688 -5.851 -3.753 1.00 0.00 H new ATOM 0 HG13 ILE A 452 4.157 -7.484 -3.406 1.00 0.00 H new ATOM 0 HG21 ILE A 452 4.481 -4.746 -0.871 1.00 0.00 H new ATOM 0 HG22 ILE A 452 6.084 -5.249 -0.284 1.00 0.00 H new ATOM 0 HG23 ILE A 452 5.919 -4.499 -1.889 1.00 0.00 H new ATOM 0 HD11 ILE A 452 2.241 -5.943 -3.506 1.00 0.00 H new ATOM 0 HD12 ILE A 452 2.418 -6.606 -1.864 1.00 0.00 H new ATOM 0 HD13 ILE A 452 2.957 -4.947 -2.216 1.00 0.00 H new ATOM 269 N ASP A 453 7.446 -6.421 -4.394 1.00 0.00 N ATOM 270 CA ASP A 453 8.253 -5.611 -5.318 1.00 0.00 C ATOM 271 C ASP A 453 7.411 -4.619 -6.142 1.00 0.00 C ATOM 272 O ASP A 453 6.180 -4.666 -6.134 1.00 0.00 O ATOM 273 CB ASP A 453 9.094 -6.527 -6.222 1.00 0.00 C ATOM 274 CG ASP A 453 8.268 -7.180 -7.339 1.00 0.00 C ATOM 275 OD1 ASP A 453 7.715 -8.281 -7.109 1.00 0.00 O ATOM 276 OD2 ASP A 453 8.184 -6.578 -8.435 1.00 0.00 O ATOM 0 H ASP A 453 6.867 -7.114 -4.868 1.00 0.00 H new ATOM 0 HA ASP A 453 8.922 -4.998 -4.715 1.00 0.00 H new ATOM 0 HB2 ASP A 453 9.904 -5.948 -6.666 1.00 0.00 H new ATOM 0 HB3 ASP A 453 9.555 -7.306 -5.614 1.00 0.00 H new ATOM 281 N GLU A 454 8.104 -3.739 -6.873 1.00 0.00 N ATOM 282 CA GLU A 454 7.532 -2.680 -7.715 1.00 0.00 C ATOM 283 C GLU A 454 6.343 -3.149 -8.572 1.00 0.00 C ATOM 284 O GLU A 454 5.316 -2.472 -8.609 1.00 0.00 O ATOM 285 CB GLU A 454 8.636 -2.130 -8.635 1.00 0.00 C ATOM 286 CG GLU A 454 8.199 -0.905 -9.449 1.00 0.00 C ATOM 287 CD GLU A 454 9.290 -0.502 -10.449 1.00 0.00 C ATOM 288 OE1 GLU A 454 10.312 0.072 -10.010 1.00 0.00 O ATOM 289 OE2 GLU A 454 9.130 -0.750 -11.667 1.00 0.00 O ATOM 0 H GLU A 454 9.124 -3.745 -6.896 1.00 0.00 H new ATOM 0 HA GLU A 454 7.147 -1.911 -7.046 1.00 0.00 H new ATOM 0 HB2 GLU A 454 9.503 -1.864 -8.030 1.00 0.00 H new ATOM 0 HB3 GLU A 454 8.953 -2.917 -9.319 1.00 0.00 H new ATOM 0 HG2 GLU A 454 7.274 -1.127 -9.982 1.00 0.00 H new ATOM 0 HG3 GLU A 454 7.988 -0.072 -8.778 1.00 0.00 H new ATOM 296 N ASP A 455 6.450 -4.299 -9.244 1.00 0.00 N ATOM 297 CA ASP A 455 5.440 -4.777 -10.195 1.00 0.00 C ATOM 298 C ASP A 455 4.198 -5.354 -9.497 1.00 0.00 C ATOM 299 O ASP A 455 3.096 -5.277 -10.041 1.00 0.00 O ATOM 300 CB ASP A 455 6.078 -5.816 -11.128 1.00 0.00 C ATOM 301 CG ASP A 455 5.164 -6.179 -12.310 1.00 0.00 C ATOM 302 OD1 ASP A 455 4.919 -5.301 -13.172 1.00 0.00 O ATOM 303 OD2 ASP A 455 4.728 -7.352 -12.399 1.00 0.00 O ATOM 0 H ASP A 455 7.245 -4.930 -9.143 1.00 0.00 H new ATOM 0 HA ASP A 455 5.092 -3.923 -10.776 1.00 0.00 H new ATOM 0 HB2 ASP A 455 7.023 -5.428 -11.508 1.00 0.00 H new ATOM 0 HB3 ASP A 455 6.309 -6.717 -10.560 1.00 0.00 H new ATOM 308 N GLU A 456 4.357 -5.865 -8.273 1.00 0.00 N ATOM 309 CA GLU A 456 3.248 -6.320 -7.428 1.00 0.00 C ATOM 310 C GLU A 456 2.535 -5.140 -6.756 1.00 0.00 C ATOM 311 O GLU A 456 1.305 -5.132 -6.683 1.00 0.00 O ATOM 312 CB GLU A 456 3.753 -7.289 -6.351 1.00 0.00 C ATOM 313 CG GLU A 456 4.199 -8.651 -6.884 1.00 0.00 C ATOM 314 CD GLU A 456 3.024 -9.494 -7.406 1.00 0.00 C ATOM 315 OE1 GLU A 456 2.279 -10.073 -6.581 1.00 0.00 O ATOM 316 OE2 GLU A 456 2.852 -9.609 -8.643 1.00 0.00 O ATOM 0 H GLU A 456 5.271 -5.976 -7.835 1.00 0.00 H new ATOM 0 HA GLU A 456 2.537 -6.834 -8.075 1.00 0.00 H new ATOM 0 HB2 GLU A 456 4.589 -6.826 -5.827 1.00 0.00 H new ATOM 0 HB3 GLU A 456 2.962 -7.441 -5.617 1.00 0.00 H new ATOM 0 HG2 GLU A 456 4.921 -8.504 -7.687 1.00 0.00 H new ATOM 0 HG3 GLU A 456 4.710 -9.198 -6.092 1.00 0.00 H new ATOM 323 N ILE A 457 3.271 -4.108 -6.321 1.00 0.00 N ATOM 324 CA ILE A 457 2.657 -2.859 -5.833 1.00 0.00 C ATOM 325 C ILE A 457 1.920 -2.166 -6.990 1.00 0.00 C ATOM 326 O ILE A 457 0.795 -1.704 -6.802 1.00 0.00 O ATOM 327 CB ILE A 457 3.693 -1.918 -5.167 1.00 0.00 C ATOM 328 CG1 ILE A 457 4.495 -2.590 -4.027 1.00 0.00 C ATOM 329 CG2 ILE A 457 2.960 -0.687 -4.590 1.00 0.00 C ATOM 330 CD1 ILE A 457 5.806 -1.857 -3.714 1.00 0.00 C ATOM 0 H ILE A 457 4.291 -4.110 -6.296 1.00 0.00 H new ATOM 0 HA ILE A 457 1.937 -3.110 -5.055 1.00 0.00 H new ATOM 0 HB ILE A 457 4.406 -1.639 -5.943 1.00 0.00 H new ATOM 0 HG12 ILE A 457 3.880 -2.626 -3.128 1.00 0.00 H new ATOM 0 HG13 ILE A 457 4.717 -3.621 -4.303 1.00 0.00 H new ATOM 0 HG21 ILE A 457 3.683 -0.020 -4.120 1.00 0.00 H new ATOM 0 HG22 ILE A 457 2.448 -0.158 -5.394 1.00 0.00 H new ATOM 0 HG23 ILE A 457 2.231 -1.012 -3.848 1.00 0.00 H new ATOM 0 HD11 ILE A 457 6.327 -2.372 -2.907 1.00 0.00 H new ATOM 0 HD12 ILE A 457 6.437 -1.844 -4.603 1.00 0.00 H new ATOM 0 HD13 ILE A 457 5.587 -0.834 -3.409 1.00 0.00 H new ATOM 342 N THR A 458 2.494 -2.170 -8.202 1.00 0.00 N ATOM 343 CA THR A 458 1.843 -1.656 -9.416 1.00 0.00 C ATOM 344 C THR A 458 0.575 -2.442 -9.709 1.00 0.00 C ATOM 345 O THR A 458 -0.482 -1.832 -9.814 1.00 0.00 O ATOM 346 CB THR A 458 2.801 -1.661 -10.617 1.00 0.00 C ATOM 347 OG1 THR A 458 3.938 -0.890 -10.310 1.00 0.00 O ATOM 348 CG2 THR A 458 2.176 -1.047 -11.871 1.00 0.00 C ATOM 0 H THR A 458 3.432 -2.534 -8.369 1.00 0.00 H new ATOM 0 HA THR A 458 1.565 -0.617 -9.238 1.00 0.00 H new ATOM 0 HB THR A 458 3.047 -2.704 -10.814 1.00 0.00 H new ATOM 0 HG1 THR A 458 4.556 -1.421 -9.765 1.00 0.00 H new ATOM 0 HG21 THR A 458 2.896 -1.076 -12.688 1.00 0.00 H new ATOM 0 HG22 THR A 458 1.288 -1.614 -12.150 1.00 0.00 H new ATOM 0 HG23 THR A 458 1.898 -0.012 -11.670 1.00 0.00 H new ATOM 356 N ALA A 459 0.629 -3.774 -9.775 1.00 0.00 N ATOM 357 CA ALA A 459 -0.549 -4.608 -10.031 1.00 0.00 C ATOM 358 C ALA A 459 -1.640 -4.468 -8.949 1.00 0.00 C ATOM 359 O ALA A 459 -2.827 -4.579 -9.255 1.00 0.00 O ATOM 360 CB ALA A 459 -0.093 -6.064 -10.179 1.00 0.00 C ATOM 0 H ALA A 459 1.491 -4.306 -9.653 1.00 0.00 H new ATOM 0 HA ALA A 459 -1.016 -4.264 -10.954 1.00 0.00 H new ATOM 0 HB1 ALA A 459 -0.958 -6.699 -10.370 1.00 0.00 H new ATOM 0 HB2 ALA A 459 0.606 -6.143 -11.011 1.00 0.00 H new ATOM 0 HB3 ALA A 459 0.398 -6.387 -9.261 1.00 0.00 H new ATOM 366 N SER A 460 -1.263 -4.166 -7.704 1.00 0.00 N ATOM 367 CA SER A 460 -2.205 -3.923 -6.601 1.00 0.00 C ATOM 368 C SER A 460 -3.025 -2.628 -6.758 1.00 0.00 C ATOM 369 O SER A 460 -4.133 -2.547 -6.220 1.00 0.00 O ATOM 370 CB SER A 460 -1.464 -3.888 -5.255 1.00 0.00 C ATOM 371 OG SER A 460 -0.836 -5.127 -4.960 1.00 0.00 O ATOM 0 H SER A 460 -0.285 -4.082 -7.427 1.00 0.00 H new ATOM 0 HA SER A 460 -2.909 -4.755 -6.630 1.00 0.00 H new ATOM 0 HB2 SER A 460 -0.714 -3.097 -5.275 1.00 0.00 H new ATOM 0 HB3 SER A 460 -2.168 -3.640 -4.460 1.00 0.00 H new ATOM 0 HG SER A 460 -0.093 -5.274 -5.582 1.00 0.00 H new ATOM 377 N PHE A 461 -2.529 -1.639 -7.518 1.00 0.00 N ATOM 378 CA PHE A 461 -3.195 -0.345 -7.731 1.00 0.00 C ATOM 379 C PHE A 461 -3.510 -0.053 -9.215 1.00 0.00 C ATOM 380 O PHE A 461 -4.220 0.908 -9.513 1.00 0.00 O ATOM 381 CB PHE A 461 -2.365 0.756 -7.050 1.00 0.00 C ATOM 382 CG PHE A 461 -2.405 0.719 -5.526 1.00 0.00 C ATOM 383 CD1 PHE A 461 -1.464 -0.038 -4.802 1.00 0.00 C ATOM 384 CD2 PHE A 461 -3.369 1.468 -4.823 1.00 0.00 C ATOM 385 CE1 PHE A 461 -1.487 -0.059 -3.396 1.00 0.00 C ATOM 386 CE2 PHE A 461 -3.380 1.462 -3.414 1.00 0.00 C ATOM 387 CZ PHE A 461 -2.446 0.693 -2.699 1.00 0.00 C ATOM 0 H PHE A 461 -1.639 -1.718 -8.010 1.00 0.00 H new ATOM 0 HA PHE A 461 -4.180 -0.376 -7.265 1.00 0.00 H new ATOM 0 HB2 PHE A 461 -1.329 0.669 -7.377 1.00 0.00 H new ATOM 0 HB3 PHE A 461 -2.725 1.728 -7.388 1.00 0.00 H new ATOM 0 HD1 PHE A 461 -0.716 -0.609 -5.332 1.00 0.00 H new ATOM 0 HD2 PHE A 461 -4.101 2.048 -5.365 1.00 0.00 H new ATOM 0 HE1 PHE A 461 -0.767 -0.653 -2.853 1.00 0.00 H new ATOM 0 HE2 PHE A 461 -4.111 2.052 -2.880 1.00 0.00 H new ATOM 0 HZ PHE A 461 -2.466 0.681 -1.619 1.00 0.00 H new ATOM 397 N ARG A 462 -3.092 -0.921 -10.149 1.00 0.00 N ATOM 398 CA ARG A 462 -3.376 -0.822 -11.593 1.00 0.00 C ATOM 399 C ARG A 462 -4.878 -0.855 -11.925 1.00 0.00 C ATOM 400 O ARG A 462 -5.287 -0.311 -12.954 1.00 0.00 O ATOM 401 CB ARG A 462 -2.599 -1.929 -12.339 1.00 0.00 C ATOM 402 CG ARG A 462 -2.749 -1.928 -13.870 1.00 0.00 C ATOM 403 CD ARG A 462 -2.288 -0.606 -14.498 1.00 0.00 C ATOM 404 NE ARG A 462 -2.571 -0.548 -15.943 1.00 0.00 N ATOM 405 CZ ARG A 462 -3.730 -0.240 -16.516 1.00 0.00 C ATOM 406 NH1 ARG A 462 -4.827 -0.007 -15.820 1.00 0.00 N ATOM 407 NH2 ARG A 462 -3.803 -0.159 -17.826 1.00 0.00 N ATOM 0 H ARG A 462 -2.529 -1.738 -9.915 1.00 0.00 H new ATOM 0 HA ARG A 462 -3.035 0.156 -11.933 1.00 0.00 H new ATOM 0 HB2 ARG A 462 -1.541 -1.833 -12.095 1.00 0.00 H new ATOM 0 HB3 ARG A 462 -2.927 -2.897 -11.960 1.00 0.00 H new ATOM 0 HG2 ARG A 462 -2.169 -2.749 -14.290 1.00 0.00 H new ATOM 0 HG3 ARG A 462 -3.792 -2.108 -14.131 1.00 0.00 H new ATOM 0 HD2 ARG A 462 -2.786 0.225 -13.998 1.00 0.00 H new ATOM 0 HD3 ARG A 462 -1.218 -0.481 -14.334 1.00 0.00 H new ATOM 0 HE ARG A 462 -1.796 -0.767 -16.569 1.00 0.00 H new ATOM 0 HH11 ARG A 462 -4.806 -0.060 -14.802 1.00 0.00 H new ATOM 0 HH12 ARG A 462 -5.696 0.226 -16.301 1.00 0.00 H new ATOM 0 HH21 ARG A 462 -2.974 -0.332 -18.395 1.00 0.00 H new ATOM 0 HH22 ARG A 462 -4.689 0.077 -18.274 1.00 0.00 H new ATOM 421 N ARG A 463 -5.702 -1.403 -11.023 1.00 0.00 N ATOM 422 CA ARG A 463 -7.175 -1.377 -11.054 1.00 0.00 C ATOM 423 C ARG A 463 -7.798 0.032 -11.157 1.00 0.00 C ATOM 424 O ARG A 463 -8.953 0.157 -11.566 1.00 0.00 O ATOM 425 CB ARG A 463 -7.717 -2.130 -9.822 1.00 0.00 C ATOM 426 CG ARG A 463 -7.261 -1.511 -8.487 1.00 0.00 C ATOM 427 CD ARG A 463 -7.811 -2.257 -7.269 1.00 0.00 C ATOM 428 NE ARG A 463 -9.246 -1.986 -7.060 1.00 0.00 N ATOM 429 CZ ARG A 463 -9.968 -2.349 -6.007 1.00 0.00 C ATOM 430 NH1 ARG A 463 -9.453 -3.044 -5.013 1.00 0.00 N ATOM 431 NH2 ARG A 463 -11.238 -2.010 -5.937 1.00 0.00 N ATOM 0 H ARG A 463 -5.344 -1.903 -10.209 1.00 0.00 H new ATOM 0 HA ARG A 463 -7.475 -1.875 -11.976 1.00 0.00 H new ATOM 0 HB2 ARG A 463 -8.806 -2.138 -9.859 1.00 0.00 H new ATOM 0 HB3 ARG A 463 -7.389 -3.169 -9.865 1.00 0.00 H new ATOM 0 HG2 ARG A 463 -6.172 -1.510 -8.445 1.00 0.00 H new ATOM 0 HG3 ARG A 463 -7.582 -0.470 -8.446 1.00 0.00 H new ATOM 0 HD2 ARG A 463 -7.659 -3.328 -7.400 1.00 0.00 H new ATOM 0 HD3 ARG A 463 -7.253 -1.963 -6.380 1.00 0.00 H new ATOM 0 HE ARG A 463 -9.730 -1.470 -7.795 1.00 0.00 H new ATOM 0 HH11 ARG A 463 -8.471 -3.319 -5.038 1.00 0.00 H new ATOM 0 HH12 ARG A 463 -10.036 -3.307 -4.218 1.00 0.00 H new ATOM 0 HH21 ARG A 463 -11.664 -1.470 -6.690 1.00 0.00 H new ATOM 0 HH22 ARG A 463 -11.796 -2.287 -5.129 1.00 0.00 H new ATOM 445 N PHE A 464 -7.043 1.086 -10.819 1.00 0.00 N ATOM 446 CA PHE A 464 -7.473 2.491 -10.859 1.00 0.00 C ATOM 447 C PHE A 464 -7.009 3.245 -12.121 1.00 0.00 C ATOM 448 O PHE A 464 -7.387 4.401 -12.315 1.00 0.00 O ATOM 449 CB PHE A 464 -6.961 3.171 -9.578 1.00 0.00 C ATOM 450 CG PHE A 464 -7.437 2.496 -8.302 1.00 0.00 C ATOM 451 CD1 PHE A 464 -8.815 2.339 -8.065 1.00 0.00 C ATOM 452 CD2 PHE A 464 -6.510 1.956 -7.388 1.00 0.00 C ATOM 453 CE1 PHE A 464 -9.265 1.643 -6.933 1.00 0.00 C ATOM 454 CE2 PHE A 464 -6.963 1.243 -6.263 1.00 0.00 C ATOM 455 CZ PHE A 464 -8.340 1.094 -6.028 1.00 0.00 C ATOM 0 H PHE A 464 -6.081 0.980 -10.498 1.00 0.00 H new ATOM 0 HA PHE A 464 -8.562 2.520 -10.908 1.00 0.00 H new ATOM 0 HB2 PHE A 464 -5.871 3.179 -9.591 1.00 0.00 H new ATOM 0 HB3 PHE A 464 -7.287 4.211 -9.573 1.00 0.00 H new ATOM 0 HD1 PHE A 464 -9.530 2.757 -8.758 1.00 0.00 H new ATOM 0 HD2 PHE A 464 -5.451 2.090 -7.551 1.00 0.00 H new ATOM 0 HE1 PHE A 464 -10.324 1.529 -6.757 1.00 0.00 H new ATOM 0 HE2 PHE A 464 -6.250 0.809 -5.578 1.00 0.00 H new ATOM 0 HZ PHE A 464 -8.687 0.560 -5.156 1.00 0.00 H new ATOM 465 N GLY A 465 -6.205 2.602 -12.976 1.00 0.00 N ATOM 466 CA GLY A 465 -5.510 3.200 -14.123 1.00 0.00 C ATOM 467 C GLY A 465 -3.989 2.998 -14.044 1.00 0.00 C ATOM 468 O GLY A 465 -3.494 2.518 -13.020 1.00 0.00 O ATOM 0 H GLY A 465 -6.012 1.605 -12.883 1.00 0.00 H new ATOM 0 HA2 GLY A 465 -5.887 2.758 -15.046 1.00 0.00 H new ATOM 0 HA3 GLY A 465 -5.732 4.266 -14.166 1.00 0.00 H new ATOM 472 N PRO A 466 -3.239 3.323 -15.116 1.00 0.00 N ATOM 473 CA PRO A 466 -1.793 3.125 -15.181 1.00 0.00 C ATOM 474 C PRO A 466 -1.038 4.057 -14.224 1.00 0.00 C ATOM 475 O PRO A 466 -1.486 5.165 -13.916 1.00 0.00 O ATOM 476 CB PRO A 466 -1.411 3.343 -16.648 1.00 0.00 C ATOM 477 CG PRO A 466 -2.508 4.266 -17.172 1.00 0.00 C ATOM 478 CD PRO A 466 -3.742 3.842 -16.380 1.00 0.00 C ATOM 0 HA PRO A 466 -1.512 2.124 -14.853 1.00 0.00 H new ATOM 0 HB2 PRO A 466 -0.425 3.798 -16.742 1.00 0.00 H new ATOM 0 HB3 PRO A 466 -1.382 2.403 -17.198 1.00 0.00 H new ATOM 0 HG2 PRO A 466 -2.264 5.315 -17.003 1.00 0.00 H new ATOM 0 HG3 PRO A 466 -2.658 4.142 -18.245 1.00 0.00 H new ATOM 0 HD2 PRO A 466 -4.412 4.686 -16.218 1.00 0.00 H new ATOM 0 HD3 PRO A 466 -4.310 3.082 -16.917 1.00 0.00 H new ATOM 486 N LEU A 467 0.121 3.583 -13.753 1.00 0.00 N ATOM 487 CA LEU A 467 0.933 4.200 -12.704 1.00 0.00 C ATOM 488 C LEU A 467 2.388 3.695 -12.719 1.00 0.00 C ATOM 489 O LEU A 467 2.717 2.734 -13.417 1.00 0.00 O ATOM 490 CB LEU A 467 0.275 3.961 -11.316 1.00 0.00 C ATOM 491 CG LEU A 467 0.395 2.537 -10.720 1.00 0.00 C ATOM 492 CD1 LEU A 467 0.174 2.588 -9.205 1.00 0.00 C ATOM 493 CD2 LEU A 467 -0.612 1.551 -11.327 1.00 0.00 C ATOM 0 H LEU A 467 0.534 2.721 -14.110 1.00 0.00 H new ATOM 0 HA LEU A 467 0.973 5.271 -12.901 1.00 0.00 H new ATOM 0 HB2 LEU A 467 0.713 4.663 -10.607 1.00 0.00 H new ATOM 0 HB3 LEU A 467 -0.784 4.207 -11.396 1.00 0.00 H new ATOM 0 HG LEU A 467 1.398 2.182 -10.958 1.00 0.00 H new ATOM 0 HD11 LEU A 467 0.260 1.583 -8.791 1.00 0.00 H new ATOM 0 HD12 LEU A 467 0.925 3.234 -8.749 1.00 0.00 H new ATOM 0 HD13 LEU A 467 -0.820 2.983 -8.995 1.00 0.00 H new ATOM 0 HD21 LEU A 467 -0.481 0.570 -10.871 1.00 0.00 H new ATOM 0 HD22 LEU A 467 -1.626 1.905 -11.140 1.00 0.00 H new ATOM 0 HD23 LEU A 467 -0.446 1.477 -12.402 1.00 0.00 H new ATOM 505 N VAL A 468 3.235 4.313 -11.892 1.00 0.00 N ATOM 506 CA VAL A 468 4.586 3.840 -11.539 1.00 0.00 C ATOM 507 C VAL A 468 4.770 3.957 -10.016 1.00 0.00 C ATOM 508 O VAL A 468 4.025 4.693 -9.369 1.00 0.00 O ATOM 509 CB VAL A 468 5.695 4.563 -12.350 1.00 0.00 C ATOM 510 CG1 VAL A 468 6.101 5.937 -11.824 1.00 0.00 C ATOM 511 CG2 VAL A 468 6.936 3.672 -12.490 1.00 0.00 C ATOM 0 H VAL A 468 2.994 5.190 -11.430 1.00 0.00 H new ATOM 0 HA VAL A 468 4.686 2.791 -11.816 1.00 0.00 H new ATOM 0 HB VAL A 468 5.242 4.747 -13.324 1.00 0.00 H new ATOM 0 HG11 VAL A 468 6.881 6.355 -12.461 1.00 0.00 H new ATOM 0 HG12 VAL A 468 5.235 6.599 -11.829 1.00 0.00 H new ATOM 0 HG13 VAL A 468 6.478 5.840 -10.806 1.00 0.00 H new ATOM 0 HG21 VAL A 468 7.700 4.199 -13.062 1.00 0.00 H new ATOM 0 HG22 VAL A 468 7.325 3.432 -11.500 1.00 0.00 H new ATOM 0 HG23 VAL A 468 6.666 2.751 -13.007 1.00 0.00 H new ATOM 521 N VAL A 469 5.724 3.224 -9.433 1.00 0.00 N ATOM 522 CA VAL A 469 5.914 3.120 -7.972 1.00 0.00 C ATOM 523 C VAL A 469 7.384 3.360 -7.605 1.00 0.00 C ATOM 524 O VAL A 469 8.288 2.840 -8.259 1.00 0.00 O ATOM 525 CB VAL A 469 5.426 1.750 -7.443 1.00 0.00 C ATOM 526 CG1 VAL A 469 5.570 1.645 -5.914 1.00 0.00 C ATOM 527 CG2 VAL A 469 3.953 1.496 -7.812 1.00 0.00 C ATOM 0 H VAL A 469 6.399 2.676 -9.966 1.00 0.00 H new ATOM 0 HA VAL A 469 5.311 3.892 -7.494 1.00 0.00 H new ATOM 0 HB VAL A 469 6.057 0.999 -7.917 1.00 0.00 H new ATOM 0 HG11 VAL A 469 5.217 0.669 -5.581 1.00 0.00 H new ATOM 0 HG12 VAL A 469 6.618 1.765 -5.638 1.00 0.00 H new ATOM 0 HG13 VAL A 469 4.978 2.427 -5.438 1.00 0.00 H new ATOM 0 HG21 VAL A 469 3.643 0.525 -7.425 1.00 0.00 H new ATOM 0 HG22 VAL A 469 3.329 2.276 -7.376 1.00 0.00 H new ATOM 0 HG23 VAL A 469 3.843 1.506 -8.896 1.00 0.00 H new ATOM 537 N ASP A 470 7.613 4.148 -6.552 1.00 0.00 N ATOM 538 CA ASP A 470 8.927 4.629 -6.106 1.00 0.00 C ATOM 539 C ASP A 470 8.981 4.800 -4.573 1.00 0.00 C ATOM 540 O ASP A 470 7.947 4.920 -3.917 1.00 0.00 O ATOM 541 CB ASP A 470 9.230 5.949 -6.836 1.00 0.00 C ATOM 542 CG ASP A 470 10.650 6.467 -6.563 1.00 0.00 C ATOM 543 OD1 ASP A 470 11.615 5.716 -6.838 1.00 0.00 O ATOM 544 OD2 ASP A 470 10.791 7.617 -6.087 1.00 0.00 O ATOM 0 H ASP A 470 6.855 4.485 -5.959 1.00 0.00 H new ATOM 0 HA ASP A 470 9.690 3.891 -6.354 1.00 0.00 H new ATOM 0 HB2 ASP A 470 9.101 5.804 -7.909 1.00 0.00 H new ATOM 0 HB3 ASP A 470 8.507 6.704 -6.527 1.00 0.00 H new ATOM 549 N TRP A 471 10.185 4.808 -3.991 1.00 0.00 N ATOM 550 CA TRP A 471 10.407 4.894 -2.540 1.00 0.00 C ATOM 551 C TRP A 471 11.820 5.419 -2.185 1.00 0.00 C ATOM 552 O TRP A 471 12.717 5.363 -3.034 1.00 0.00 O ATOM 553 CB TRP A 471 10.109 3.525 -1.896 1.00 0.00 C ATOM 554 CG TRP A 471 10.842 2.337 -2.447 1.00 0.00 C ATOM 555 CD1 TRP A 471 12.104 1.977 -2.131 1.00 0.00 C ATOM 556 CD2 TRP A 471 10.369 1.325 -3.390 1.00 0.00 C ATOM 557 NE1 TRP A 471 12.434 0.801 -2.773 1.00 0.00 N ATOM 558 CE2 TRP A 471 11.403 0.359 -3.571 1.00 0.00 C ATOM 559 CE3 TRP A 471 9.173 1.123 -4.115 1.00 0.00 C ATOM 560 CZ2 TRP A 471 11.257 -0.750 -4.414 1.00 0.00 C ATOM 561 CZ3 TRP A 471 9.014 0.010 -4.962 1.00 0.00 C ATOM 562 CH2 TRP A 471 10.051 -0.928 -5.108 1.00 0.00 C ATOM 0 H TRP A 471 11.052 4.754 -4.525 1.00 0.00 H new ATOM 0 HA TRP A 471 9.718 5.631 -2.128 1.00 0.00 H new ATOM 0 HB2 TRP A 471 10.332 3.596 -0.831 1.00 0.00 H new ATOM 0 HB3 TRP A 471 9.040 3.334 -1.986 1.00 0.00 H new ATOM 0 HD1 TRP A 471 12.759 2.528 -1.473 1.00 0.00 H new ATOM 0 HE1 TRP A 471 13.328 0.321 -2.670 1.00 0.00 H new ATOM 0 HE3 TRP A 471 8.367 1.835 -4.018 1.00 0.00 H new ATOM 0 HZ2 TRP A 471 12.063 -1.459 -4.528 1.00 0.00 H new ATOM 0 HZ3 TRP A 471 8.089 -0.124 -5.503 1.00 0.00 H new ATOM 0 HH2 TRP A 471 9.919 -1.784 -5.753 1.00 0.00 H new ATOM 573 N PRO A 472 12.040 5.941 -0.955 1.00 0.00 N ATOM 574 CA PRO A 472 13.341 6.442 -0.506 1.00 0.00 C ATOM 575 C PRO A 472 14.446 5.380 -0.555 1.00 0.00 C ATOM 576 O PRO A 472 14.186 4.198 -0.346 1.00 0.00 O ATOM 577 CB PRO A 472 13.129 6.939 0.929 1.00 0.00 C ATOM 578 CG PRO A 472 11.647 7.293 0.959 1.00 0.00 C ATOM 579 CD PRO A 472 11.037 6.213 0.071 1.00 0.00 C ATOM 0 HA PRO A 472 13.682 7.234 -1.172 1.00 0.00 H new ATOM 0 HB2 PRO A 472 13.374 6.170 1.662 1.00 0.00 H new ATOM 0 HB3 PRO A 472 13.754 7.803 1.152 1.00 0.00 H new ATOM 0 HG2 PRO A 472 11.242 7.264 1.971 1.00 0.00 H new ATOM 0 HG3 PRO A 472 11.460 8.294 0.569 1.00 0.00 H new ATOM 0 HD2 PRO A 472 10.809 5.315 0.645 1.00 0.00 H new ATOM 0 HD3 PRO A 472 10.102 6.553 -0.374 1.00 0.00 H new ATOM 587 N HIS A 473 15.682 5.819 -0.823 1.00 0.00 N ATOM 588 CA HIS A 473 16.918 4.984 -0.818 1.00 0.00 C ATOM 589 C HIS A 473 16.977 3.907 -1.931 1.00 0.00 C ATOM 590 O HIS A 473 17.925 3.120 -1.992 1.00 0.00 O ATOM 591 CB HIS A 473 17.139 4.366 0.580 1.00 0.00 C ATOM 592 CG HIS A 473 17.068 5.359 1.710 1.00 0.00 C ATOM 593 ND1 HIS A 473 17.999 6.370 1.961 1.00 0.00 N ATOM 594 CD2 HIS A 473 16.083 5.420 2.652 1.00 0.00 C ATOM 595 CE1 HIS A 473 17.544 7.019 3.047 1.00 0.00 C ATOM 596 NE2 HIS A 473 16.396 6.472 3.484 1.00 0.00 N ATOM 0 H HIS A 473 15.869 6.794 -1.058 1.00 0.00 H new ATOM 0 HA HIS A 473 17.739 5.662 -1.051 1.00 0.00 H new ATOM 0 HB2 HIS A 473 16.391 3.590 0.745 1.00 0.00 H new ATOM 0 HB3 HIS A 473 18.114 3.878 0.600 1.00 0.00 H new ATOM 0 HD2 HIS A 473 15.224 4.770 2.730 1.00 0.00 H new ATOM 0 HE1 HIS A 473 18.034 7.865 3.506 1.00 0.00 H new ATOM 0 HE2 HIS A 473 15.853 6.782 4.290 1.00 0.00 H new ATOM 604 N LYS A 474 16.009 3.880 -2.857 1.00 0.00 N ATOM 605 CA LYS A 474 15.882 2.859 -3.915 1.00 0.00 C ATOM 606 C LYS A 474 17.085 2.867 -4.875 1.00 0.00 C ATOM 607 O LYS A 474 17.564 1.818 -5.306 1.00 0.00 O ATOM 608 CB LYS A 474 14.554 3.118 -4.645 1.00 0.00 C ATOM 609 CG LYS A 474 14.165 2.026 -5.650 1.00 0.00 C ATOM 610 CD LYS A 474 12.797 2.360 -6.257 1.00 0.00 C ATOM 611 CE LYS A 474 12.350 1.267 -7.230 1.00 0.00 C ATOM 612 NZ LYS A 474 11.034 1.591 -7.830 1.00 0.00 N ATOM 0 H LYS A 474 15.272 4.584 -2.895 1.00 0.00 H new ATOM 0 HA LYS A 474 15.878 1.862 -3.475 1.00 0.00 H new ATOM 0 HB2 LYS A 474 13.759 3.215 -3.906 1.00 0.00 H new ATOM 0 HB3 LYS A 474 14.620 4.071 -5.169 1.00 0.00 H new ATOM 0 HG2 LYS A 474 14.917 1.955 -6.436 1.00 0.00 H new ATOM 0 HG3 LYS A 474 14.129 1.056 -5.154 1.00 0.00 H new ATOM 0 HD2 LYS A 474 12.059 2.469 -5.462 1.00 0.00 H new ATOM 0 HD3 LYS A 474 12.849 3.316 -6.777 1.00 0.00 H new ATOM 0 HE2 LYS A 474 13.094 1.151 -8.018 1.00 0.00 H new ATOM 0 HE3 LYS A 474 12.289 0.313 -6.707 1.00 0.00 H new ATOM 0 HZ1 LYS A 474 10.771 0.850 -8.511 1.00 0.00 H new ATOM 0 HZ2 LYS A 474 10.315 1.644 -7.081 1.00 0.00 H new ATOM 0 HZ3 LYS A 474 11.092 2.507 -8.320 1.00 0.00 H new ATOM 626 N ALA A 475 17.637 4.063 -5.101 1.00 0.00 N ATOM 627 CA ALA A 475 18.843 4.348 -5.878 1.00 0.00 C ATOM 628 C ALA A 475 20.142 3.716 -5.325 1.00 0.00 C ATOM 629 O ALA A 475 21.135 3.637 -6.049 1.00 0.00 O ATOM 630 CB ALA A 475 18.949 5.877 -5.914 1.00 0.00 C ATOM 0 H ALA A 475 17.224 4.914 -4.719 1.00 0.00 H new ATOM 0 HA ALA A 475 18.747 3.898 -6.866 1.00 0.00 H new ATOM 0 HB1 ALA A 475 19.833 6.167 -6.482 1.00 0.00 H new ATOM 0 HB2 ALA A 475 18.060 6.292 -6.389 1.00 0.00 H new ATOM 0 HB3 ALA A 475 19.029 6.260 -4.897 1.00 0.00 H new ATOM 636 N GLU A 476 20.139 3.261 -4.066 1.00 0.00 N ATOM 637 CA GLU A 476 21.295 2.685 -3.361 1.00 0.00 C ATOM 638 C GLU A 476 20.984 1.313 -2.720 1.00 0.00 C ATOM 639 O GLU A 476 21.797 0.757 -1.979 1.00 0.00 O ATOM 640 CB GLU A 476 21.782 3.682 -2.296 1.00 0.00 C ATOM 641 CG GLU A 476 22.354 4.972 -2.901 1.00 0.00 C ATOM 642 CD GLU A 476 22.948 5.874 -1.809 1.00 0.00 C ATOM 643 OE1 GLU A 476 24.154 5.738 -1.494 1.00 0.00 O ATOM 644 OE2 GLU A 476 22.215 6.735 -1.263 1.00 0.00 O ATOM 0 H GLU A 476 19.300 3.284 -3.487 1.00 0.00 H new ATOM 0 HA GLU A 476 22.080 2.507 -4.096 1.00 0.00 H new ATOM 0 HB2 GLU A 476 20.953 3.934 -1.635 1.00 0.00 H new ATOM 0 HB3 GLU A 476 22.546 3.205 -1.682 1.00 0.00 H new ATOM 0 HG2 GLU A 476 23.123 4.725 -3.633 1.00 0.00 H new ATOM 0 HG3 GLU A 476 21.568 5.508 -3.433 1.00 0.00 H new ATOM 651 N SER A 477 19.808 0.748 -2.992 1.00 0.00 N ATOM 652 CA SER A 477 19.342 -0.522 -2.416 1.00 0.00 C ATOM 653 C SER A 477 19.903 -1.754 -3.149 1.00 0.00 C ATOM 654 O SER A 477 20.079 -1.756 -4.372 1.00 0.00 O ATOM 655 CB SER A 477 17.808 -0.570 -2.425 1.00 0.00 C ATOM 656 OG SER A 477 17.349 -1.735 -1.753 1.00 0.00 O ATOM 0 H SER A 477 19.134 1.167 -3.633 1.00 0.00 H new ATOM 0 HA SER A 477 19.715 -0.560 -1.392 1.00 0.00 H new ATOM 0 HB2 SER A 477 17.406 0.320 -1.941 1.00 0.00 H new ATOM 0 HB3 SER A 477 17.443 -0.566 -3.452 1.00 0.00 H new ATOM 0 HG SER A 477 16.657 -2.173 -2.292 1.00 0.00 H new ATOM 662 N LYS A 478 20.129 -2.840 -2.399 1.00 0.00 N ATOM 663 CA LYS A 478 20.498 -4.165 -2.925 1.00 0.00 C ATOM 664 C LYS A 478 19.276 -5.083 -3.176 1.00 0.00 C ATOM 665 O LYS A 478 19.442 -6.220 -3.623 1.00 0.00 O ATOM 666 CB LYS A 478 21.519 -4.815 -1.969 1.00 0.00 C ATOM 667 CG LYS A 478 22.839 -4.027 -1.895 1.00 0.00 C ATOM 668 CD LYS A 478 23.861 -4.743 -1.003 1.00 0.00 C ATOM 669 CE LYS A 478 25.166 -3.938 -0.952 1.00 0.00 C ATOM 670 NZ LYS A 478 26.190 -4.599 -0.101 1.00 0.00 N ATOM 0 H LYS A 478 20.059 -2.823 -1.382 1.00 0.00 H new ATOM 0 HA LYS A 478 20.953 -4.027 -3.906 1.00 0.00 H new ATOM 0 HB2 LYS A 478 21.085 -4.885 -0.972 1.00 0.00 H new ATOM 0 HB3 LYS A 478 21.725 -5.833 -2.300 1.00 0.00 H new ATOM 0 HG2 LYS A 478 23.249 -3.904 -2.897 1.00 0.00 H new ATOM 0 HG3 LYS A 478 22.648 -3.028 -1.504 1.00 0.00 H new ATOM 0 HD2 LYS A 478 23.458 -4.863 0.003 1.00 0.00 H new ATOM 0 HD3 LYS A 478 24.056 -5.743 -1.389 1.00 0.00 H new ATOM 0 HE2 LYS A 478 25.557 -3.815 -1.962 1.00 0.00 H new ATOM 0 HE3 LYS A 478 24.962 -2.939 -0.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 478 27.057 -4.025 -0.092 1.00 0.00 H new ATOM 0 HZ2 LYS A 478 25.827 -4.693 0.869 1.00 0.00 H new ATOM 0 HZ3 LYS A 478 26.403 -5.542 -0.484 1.00 0.00 H new ATOM 684 N SER A 479 18.055 -4.601 -2.923 1.00 0.00 N ATOM 685 CA SER A 479 16.809 -5.386 -2.977 1.00 0.00 C ATOM 686 C SER A 479 15.640 -4.581 -3.571 1.00 0.00 C ATOM 687 O SER A 479 15.549 -3.363 -3.409 1.00 0.00 O ATOM 688 CB SER A 479 16.427 -5.876 -1.569 1.00 0.00 C ATOM 689 OG SER A 479 17.427 -6.722 -1.011 1.00 0.00 O ATOM 0 H SER A 479 17.897 -3.626 -2.667 1.00 0.00 H new ATOM 0 HA SER A 479 16.997 -6.238 -3.630 1.00 0.00 H new ATOM 0 HB2 SER A 479 16.272 -5.017 -0.916 1.00 0.00 H new ATOM 0 HB3 SER A 479 15.481 -6.415 -1.617 1.00 0.00 H new ATOM 0 HG SER A 479 17.149 -7.011 -0.117 1.00 0.00 H new ATOM 695 N TYR A 480 14.720 -5.266 -4.261 1.00 0.00 N ATOM 696 CA TYR A 480 13.654 -4.643 -5.063 1.00 0.00 C ATOM 697 C TYR A 480 12.366 -4.306 -4.277 1.00 0.00 C ATOM 698 O TYR A 480 11.315 -4.058 -4.874 1.00 0.00 O ATOM 699 CB TYR A 480 13.385 -5.524 -6.298 1.00 0.00 C ATOM 700 CG TYR A 480 13.409 -4.735 -7.592 1.00 0.00 C ATOM 701 CD1 TYR A 480 12.250 -4.084 -8.056 1.00 0.00 C ATOM 702 CD2 TYR A 480 14.615 -4.618 -8.309 1.00 0.00 C ATOM 703 CE1 TYR A 480 12.291 -3.331 -9.245 1.00 0.00 C ATOM 704 CE2 TYR A 480 14.664 -3.868 -9.499 1.00 0.00 C ATOM 705 CZ TYR A 480 13.499 -3.223 -9.973 1.00 0.00 C ATOM 706 OH TYR A 480 13.536 -2.494 -11.124 1.00 0.00 O ATOM 0 H TYR A 480 14.693 -6.285 -4.280 1.00 0.00 H new ATOM 0 HA TYR A 480 14.012 -3.663 -5.380 1.00 0.00 H new ATOM 0 HB2 TYR A 480 14.133 -6.315 -6.345 1.00 0.00 H new ATOM 0 HB3 TYR A 480 12.415 -6.009 -6.190 1.00 0.00 H new ATOM 0 HD1 TYR A 480 11.328 -4.162 -7.499 1.00 0.00 H new ATOM 0 HD2 TYR A 480 15.507 -5.106 -7.944 1.00 0.00 H new ATOM 0 HE1 TYR A 480 11.400 -2.836 -9.601 1.00 0.00 H new ATOM 0 HE2 TYR A 480 15.590 -3.785 -10.049 1.00 0.00 H new ATOM 0 HH TYR A 480 14.441 -2.521 -11.499 1.00 0.00 H new ATOM 716 N PHE A 481 12.437 -4.313 -2.942 1.00 0.00 N ATOM 717 CA PHE A 481 11.305 -4.132 -2.026 1.00 0.00 C ATOM 718 C PHE A 481 11.350 -2.747 -1.340 1.00 0.00 C ATOM 719 O PHE A 481 12.445 -2.198 -1.163 1.00 0.00 O ATOM 720 CB PHE A 481 11.337 -5.259 -0.972 1.00 0.00 C ATOM 721 CG PHE A 481 11.516 -6.688 -1.472 1.00 0.00 C ATOM 722 CD1 PHE A 481 10.943 -7.126 -2.684 1.00 0.00 C ATOM 723 CD2 PHE A 481 12.254 -7.601 -0.693 1.00 0.00 C ATOM 724 CE1 PHE A 481 11.107 -8.454 -3.111 1.00 0.00 C ATOM 725 CE2 PHE A 481 12.422 -8.929 -1.122 1.00 0.00 C ATOM 726 CZ PHE A 481 11.847 -9.358 -2.330 1.00 0.00 C ATOM 0 H PHE A 481 13.320 -4.450 -2.450 1.00 0.00 H new ATOM 0 HA PHE A 481 10.376 -4.180 -2.594 1.00 0.00 H new ATOM 0 HB2 PHE A 481 12.146 -5.043 -0.274 1.00 0.00 H new ATOM 0 HB3 PHE A 481 10.407 -5.215 -0.405 1.00 0.00 H new ATOM 0 HD1 PHE A 481 10.374 -6.435 -3.288 1.00 0.00 H new ATOM 0 HD2 PHE A 481 12.693 -7.279 0.239 1.00 0.00 H new ATOM 0 HE1 PHE A 481 10.664 -8.781 -4.040 1.00 0.00 H new ATOM 0 HE2 PHE A 481 12.994 -9.621 -0.522 1.00 0.00 H new ATOM 0 HZ PHE A 481 11.973 -10.379 -2.657 1.00 0.00 H new ATOM 736 N PRO A 482 10.201 -2.178 -0.915 1.00 0.00 N ATOM 737 CA PRO A 482 10.155 -0.900 -0.211 1.00 0.00 C ATOM 738 C PRO A 482 10.710 -1.039 1.222 1.00 0.00 C ATOM 739 O PRO A 482 10.301 -1.959 1.937 1.00 0.00 O ATOM 740 CB PRO A 482 8.680 -0.490 -0.217 1.00 0.00 C ATOM 741 CG PRO A 482 7.930 -1.818 -0.264 1.00 0.00 C ATOM 742 CD PRO A 482 8.855 -2.705 -1.092 1.00 0.00 C ATOM 0 HA PRO A 482 10.776 -0.143 -0.691 1.00 0.00 H new ATOM 0 HB2 PRO A 482 8.421 0.084 0.673 1.00 0.00 H new ATOM 0 HB3 PRO A 482 8.442 0.134 -1.079 1.00 0.00 H new ATOM 0 HG2 PRO A 482 7.767 -2.225 0.734 1.00 0.00 H new ATOM 0 HG3 PRO A 482 6.950 -1.712 -0.729 1.00 0.00 H new ATOM 0 HD2 PRO A 482 8.798 -3.742 -0.760 1.00 0.00 H new ATOM 0 HD3 PRO A 482 8.568 -2.690 -2.143 1.00 0.00 H new ATOM 750 N PRO A 483 11.619 -0.147 1.668 1.00 0.00 N ATOM 751 CA PRO A 483 12.193 -0.189 3.009 1.00 0.00 C ATOM 752 C PRO A 483 11.158 0.257 4.047 1.00 0.00 C ATOM 753 O PRO A 483 10.372 1.173 3.805 1.00 0.00 O ATOM 754 CB PRO A 483 13.402 0.749 2.970 1.00 0.00 C ATOM 755 CG PRO A 483 13.005 1.787 1.924 1.00 0.00 C ATOM 756 CD PRO A 483 12.179 0.973 0.928 1.00 0.00 C ATOM 0 HA PRO A 483 12.494 -1.196 3.297 1.00 0.00 H new ATOM 0 HB2 PRO A 483 13.588 1.207 3.941 1.00 0.00 H new ATOM 0 HB3 PRO A 483 14.313 0.221 2.687 1.00 0.00 H new ATOM 0 HG2 PRO A 483 12.424 2.599 2.361 1.00 0.00 H new ATOM 0 HG3 PRO A 483 13.878 2.238 1.451 1.00 0.00 H new ATOM 0 HD2 PRO A 483 11.388 1.583 0.491 1.00 0.00 H new ATOM 0 HD3 PRO A 483 12.801 0.621 0.105 1.00 0.00 H new ATOM 764 N LYS A 484 11.153 -0.419 5.202 1.00 0.00 N ATOM 765 CA LYS A 484 10.276 -0.135 6.356 1.00 0.00 C ATOM 766 C LYS A 484 8.760 -0.273 6.059 1.00 0.00 C ATOM 767 O LYS A 484 7.925 0.085 6.895 1.00 0.00 O ATOM 768 CB LYS A 484 10.655 1.224 6.984 1.00 0.00 C ATOM 769 CG LYS A 484 12.097 1.222 7.522 1.00 0.00 C ATOM 770 CD LYS A 484 12.439 2.513 8.275 1.00 0.00 C ATOM 771 CE LYS A 484 12.496 3.722 7.330 1.00 0.00 C ATOM 772 NZ LYS A 484 12.785 4.983 8.061 1.00 0.00 N ATOM 0 H LYS A 484 11.779 -1.207 5.370 1.00 0.00 H new ATOM 0 HA LYS A 484 10.456 -0.916 7.095 1.00 0.00 H new ATOM 0 HB2 LYS A 484 10.546 2.012 6.239 1.00 0.00 H new ATOM 0 HB3 LYS A 484 9.965 1.455 7.795 1.00 0.00 H new ATOM 0 HG2 LYS A 484 12.233 0.369 8.187 1.00 0.00 H new ATOM 0 HG3 LYS A 484 12.792 1.093 6.692 1.00 0.00 H new ATOM 0 HD2 LYS A 484 11.693 2.691 9.050 1.00 0.00 H new ATOM 0 HD3 LYS A 484 13.399 2.398 8.778 1.00 0.00 H new ATOM 0 HE2 LYS A 484 13.264 3.556 6.574 1.00 0.00 H new ATOM 0 HE3 LYS A 484 11.546 3.817 6.804 1.00 0.00 H new ATOM 0 HZ1 LYS A 484 12.815 5.775 7.388 1.00 0.00 H new ATOM 0 HZ2 LYS A 484 12.039 5.155 8.765 1.00 0.00 H new ATOM 0 HZ3 LYS A 484 13.703 4.903 8.542 1.00 0.00 H new ATOM 786 N GLY A 485 8.394 -0.817 4.889 1.00 0.00 N ATOM 787 CA GLY A 485 7.015 -1.136 4.502 1.00 0.00 C ATOM 788 C GLY A 485 6.210 0.056 3.986 1.00 0.00 C ATOM 789 O GLY A 485 5.007 0.114 4.232 1.00 0.00 O ATOM 0 H GLY A 485 9.072 -1.054 4.165 1.00 0.00 H new ATOM 0 HA2 GLY A 485 7.036 -1.905 3.730 1.00 0.00 H new ATOM 0 HA3 GLY A 485 6.499 -1.562 5.362 1.00 0.00 H new ATOM 793 N TYR A 486 6.824 1.000 3.264 1.00 0.00 N ATOM 794 CA TYR A 486 6.104 2.141 2.676 1.00 0.00 C ATOM 795 C TYR A 486 6.688 2.652 1.346 1.00 0.00 C ATOM 796 O TYR A 486 7.894 2.564 1.104 1.00 0.00 O ATOM 797 CB TYR A 486 5.953 3.272 3.707 1.00 0.00 C ATOM 798 CG TYR A 486 7.235 3.917 4.203 1.00 0.00 C ATOM 799 CD1 TYR A 486 7.898 4.880 3.417 1.00 0.00 C ATOM 800 CD2 TYR A 486 7.729 3.605 5.486 1.00 0.00 C ATOM 801 CE1 TYR A 486 9.050 5.526 3.903 1.00 0.00 C ATOM 802 CE2 TYR A 486 8.873 4.257 5.984 1.00 0.00 C ATOM 803 CZ TYR A 486 9.542 5.217 5.191 1.00 0.00 C ATOM 804 OH TYR A 486 10.647 5.850 5.675 1.00 0.00 O ATOM 0 H TYR A 486 7.825 0.998 3.070 1.00 0.00 H new ATOM 0 HA TYR A 486 5.115 1.766 2.411 1.00 0.00 H new ATOM 0 HB2 TYR A 486 5.328 4.050 3.270 1.00 0.00 H new ATOM 0 HB3 TYR A 486 5.415 2.877 4.569 1.00 0.00 H new ATOM 0 HD1 TYR A 486 7.520 5.124 2.435 1.00 0.00 H new ATOM 0 HD2 TYR A 486 7.228 2.863 6.089 1.00 0.00 H new ATOM 0 HE1 TYR A 486 9.558 6.258 3.292 1.00 0.00 H new ATOM 0 HE2 TYR A 486 9.240 4.024 6.973 1.00 0.00 H new ATOM 0 HH TYR A 486 10.587 5.912 6.651 1.00 0.00 H new ATOM 814 N ALA A 487 5.821 3.202 0.488 1.00 0.00 N ATOM 815 CA ALA A 487 6.157 3.677 -0.858 1.00 0.00 C ATOM 816 C ALA A 487 5.189 4.769 -1.347 1.00 0.00 C ATOM 817 O ALA A 487 4.170 5.051 -0.710 1.00 0.00 O ATOM 818 CB ALA A 487 6.169 2.471 -1.814 1.00 0.00 C ATOM 0 H ALA A 487 4.836 3.333 0.719 1.00 0.00 H new ATOM 0 HA ALA A 487 7.144 4.139 -0.834 1.00 0.00 H new ATOM 0 HB1 ALA A 487 6.417 2.807 -2.821 1.00 0.00 H new ATOM 0 HB2 ALA A 487 6.913 1.748 -1.479 1.00 0.00 H new ATOM 0 HB3 ALA A 487 5.185 2.002 -1.821 1.00 0.00 H new ATOM 824 N PHE A 488 5.509 5.350 -2.504 1.00 0.00 N ATOM 825 CA PHE A 488 4.723 6.356 -3.210 1.00 0.00 C ATOM 826 C PHE A 488 4.300 5.830 -4.590 1.00 0.00 C ATOM 827 O PHE A 488 5.135 5.493 -5.433 1.00 0.00 O ATOM 828 CB PHE A 488 5.553 7.639 -3.369 1.00 0.00 C ATOM 829 CG PHE A 488 5.910 8.349 -2.077 1.00 0.00 C ATOM 830 CD1 PHE A 488 5.025 9.293 -1.520 1.00 0.00 C ATOM 831 CD2 PHE A 488 7.150 8.102 -1.455 1.00 0.00 C ATOM 832 CE1 PHE A 488 5.392 10.010 -0.367 1.00 0.00 C ATOM 833 CE2 PHE A 488 7.508 8.805 -0.290 1.00 0.00 C ATOM 834 CZ PHE A 488 6.633 9.765 0.249 1.00 0.00 C ATOM 0 H PHE A 488 6.370 5.117 -2.998 1.00 0.00 H new ATOM 0 HA PHE A 488 3.826 6.576 -2.632 1.00 0.00 H new ATOM 0 HB2 PHE A 488 6.475 7.392 -3.894 1.00 0.00 H new ATOM 0 HB3 PHE A 488 5.001 8.332 -4.004 1.00 0.00 H new ATOM 0 HD1 PHE A 488 4.063 9.466 -1.979 1.00 0.00 H new ATOM 0 HD2 PHE A 488 7.827 7.372 -1.873 1.00 0.00 H new ATOM 0 HE1 PHE A 488 4.721 10.749 0.046 1.00 0.00 H new ATOM 0 HE2 PHE A 488 8.455 8.607 0.190 1.00 0.00 H new ATOM 0 HZ PHE A 488 6.914 10.314 1.136 1.00 0.00 H new ATOM 844 N LEU A 489 2.989 5.799 -4.822 1.00 0.00 N ATOM 845 CA LEU A 489 2.365 5.563 -6.123 1.00 0.00 C ATOM 846 C LEU A 489 2.323 6.887 -6.889 1.00 0.00 C ATOM 847 O LEU A 489 2.022 7.924 -6.293 1.00 0.00 O ATOM 848 CB LEU A 489 0.920 5.058 -5.939 1.00 0.00 C ATOM 849 CG LEU A 489 0.693 3.930 -4.916 1.00 0.00 C ATOM 850 CD1 LEU A 489 -0.811 3.669 -4.809 1.00 0.00 C ATOM 851 CD2 LEU A 489 1.428 2.637 -5.281 1.00 0.00 C ATOM 0 H LEU A 489 2.305 5.943 -4.079 1.00 0.00 H new ATOM 0 HA LEU A 489 2.941 4.815 -6.667 1.00 0.00 H new ATOM 0 HB2 LEU A 489 0.300 5.906 -5.649 1.00 0.00 H new ATOM 0 HB3 LEU A 489 0.557 4.714 -6.907 1.00 0.00 H new ATOM 0 HG LEU A 489 1.102 4.254 -3.959 1.00 0.00 H new ATOM 0 HD11 LEU A 489 -0.992 2.872 -4.088 1.00 0.00 H new ATOM 0 HD12 LEU A 489 -1.315 4.577 -4.480 1.00 0.00 H new ATOM 0 HD13 LEU A 489 -1.199 3.372 -5.783 1.00 0.00 H new ATOM 0 HD21 LEU A 489 1.230 1.879 -4.523 1.00 0.00 H new ATOM 0 HD22 LEU A 489 1.078 2.281 -6.250 1.00 0.00 H new ATOM 0 HD23 LEU A 489 2.500 2.829 -5.330 1.00 0.00 H new ATOM 863 N LEU A 490 2.559 6.840 -8.198 1.00 0.00 N ATOM 864 CA LEU A 490 2.447 7.961 -9.132 1.00 0.00 C ATOM 865 C LEU A 490 1.511 7.543 -10.271 1.00 0.00 C ATOM 866 O LEU A 490 1.915 6.766 -11.141 1.00 0.00 O ATOM 867 CB LEU A 490 3.837 8.307 -9.702 1.00 0.00 C ATOM 868 CG LEU A 490 4.981 8.596 -8.717 1.00 0.00 C ATOM 869 CD1 LEU A 490 6.263 8.816 -9.534 1.00 0.00 C ATOM 870 CD2 LEU A 490 4.683 9.818 -7.843 1.00 0.00 C ATOM 0 H LEU A 490 2.848 5.978 -8.660 1.00 0.00 H new ATOM 0 HA LEU A 490 2.051 8.838 -8.620 1.00 0.00 H new ATOM 0 HB2 LEU A 490 4.149 7.480 -10.340 1.00 0.00 H new ATOM 0 HB3 LEU A 490 3.724 9.180 -10.345 1.00 0.00 H new ATOM 0 HG LEU A 490 5.098 7.750 -8.040 1.00 0.00 H new ATOM 0 HD11 LEU A 490 7.093 9.024 -8.859 1.00 0.00 H new ATOM 0 HD12 LEU A 490 6.483 7.920 -10.115 1.00 0.00 H new ATOM 0 HD13 LEU A 490 6.124 9.661 -10.209 1.00 0.00 H new ATOM 0 HD21 LEU A 490 5.516 9.989 -7.160 1.00 0.00 H new ATOM 0 HD22 LEU A 490 4.548 10.694 -8.477 1.00 0.00 H new ATOM 0 HD23 LEU A 490 3.773 9.642 -7.269 1.00 0.00 H new ATOM 882 N PHE A 491 0.267 8.025 -10.263 1.00 0.00 N ATOM 883 CA PHE A 491 -0.733 7.693 -11.284 1.00 0.00 C ATOM 884 C PHE A 491 -0.596 8.574 -12.537 1.00 0.00 C ATOM 885 O PHE A 491 -0.064 9.685 -12.483 1.00 0.00 O ATOM 886 CB PHE A 491 -2.140 7.789 -10.675 1.00 0.00 C ATOM 887 CG PHE A 491 -2.447 6.725 -9.635 1.00 0.00 C ATOM 888 CD1 PHE A 491 -2.975 5.477 -10.028 1.00 0.00 C ATOM 889 CD2 PHE A 491 -2.210 6.976 -8.269 1.00 0.00 C ATOM 890 CE1 PHE A 491 -3.254 4.492 -9.065 1.00 0.00 C ATOM 891 CE2 PHE A 491 -2.509 5.996 -7.305 1.00 0.00 C ATOM 892 CZ PHE A 491 -3.031 4.754 -7.704 1.00 0.00 C ATOM 0 H PHE A 491 -0.079 8.661 -9.544 1.00 0.00 H new ATOM 0 HA PHE A 491 -0.560 6.669 -11.614 1.00 0.00 H new ATOM 0 HB2 PHE A 491 -2.259 8.771 -10.218 1.00 0.00 H new ATOM 0 HB3 PHE A 491 -2.875 7.719 -11.477 1.00 0.00 H new ATOM 0 HD1 PHE A 491 -3.165 5.278 -11.072 1.00 0.00 H new ATOM 0 HD2 PHE A 491 -1.797 7.925 -7.961 1.00 0.00 H new ATOM 0 HE1 PHE A 491 -3.641 3.532 -9.373 1.00 0.00 H new ATOM 0 HE2 PHE A 491 -2.337 6.198 -6.258 1.00 0.00 H new ATOM 0 HZ PHE A 491 -3.261 4.001 -6.964 1.00 0.00 H new ATOM 902 N GLN A 492 -1.105 8.092 -13.675 1.00 0.00 N ATOM 903 CA GLN A 492 -1.113 8.840 -14.940 1.00 0.00 C ATOM 904 C GLN A 492 -2.180 9.954 -14.965 1.00 0.00 C ATOM 905 O GLN A 492 -2.001 10.953 -15.661 1.00 0.00 O ATOM 906 CB GLN A 492 -1.314 7.843 -16.092 1.00 0.00 C ATOM 907 CG GLN A 492 -1.064 8.456 -17.481 1.00 0.00 C ATOM 908 CD GLN A 492 -1.172 7.414 -18.596 1.00 0.00 C ATOM 909 OE1 GLN A 492 -2.221 7.206 -19.194 1.00 0.00 O ATOM 910 NE2 GLN A 492 -0.103 6.711 -18.919 1.00 0.00 N ATOM 0 H GLN A 492 -1.526 7.166 -13.747 1.00 0.00 H new ATOM 0 HA GLN A 492 -0.156 9.350 -15.051 1.00 0.00 H new ATOM 0 HB2 GLN A 492 -0.643 6.996 -15.951 1.00 0.00 H new ATOM 0 HB3 GLN A 492 -2.331 7.454 -16.053 1.00 0.00 H new ATOM 0 HG2 GLN A 492 -1.784 9.254 -17.660 1.00 0.00 H new ATOM 0 HG3 GLN A 492 -0.073 8.910 -17.504 1.00 0.00 H new ATOM 0 HE21 GLN A 492 0.779 6.871 -18.432 1.00 0.00 H new ATOM 0 HE22 GLN A 492 -0.158 6.008 -19.656 1.00 0.00 H new ATOM 919 N GLU A 493 -3.257 9.822 -14.179 1.00 0.00 N ATOM 920 CA GLU A 493 -4.379 10.768 -14.115 1.00 0.00 C ATOM 921 C GLU A 493 -4.828 10.993 -12.664 1.00 0.00 C ATOM 922 O GLU A 493 -4.840 10.066 -11.852 1.00 0.00 O ATOM 923 CB GLU A 493 -5.567 10.239 -14.940 1.00 0.00 C ATOM 924 CG GLU A 493 -5.346 10.247 -16.462 1.00 0.00 C ATOM 925 CD GLU A 493 -5.186 11.653 -17.074 1.00 0.00 C ATOM 926 OE1 GLU A 493 -5.624 12.659 -16.465 1.00 0.00 O ATOM 927 OE2 GLU A 493 -4.660 11.755 -18.207 1.00 0.00 O ATOM 0 H GLU A 493 -3.375 9.028 -13.550 1.00 0.00 H new ATOM 0 HA GLU A 493 -4.040 11.718 -14.528 1.00 0.00 H new ATOM 0 HB2 GLU A 493 -5.786 9.219 -14.624 1.00 0.00 H new ATOM 0 HB3 GLU A 493 -6.447 10.840 -14.711 1.00 0.00 H new ATOM 0 HG2 GLU A 493 -4.456 9.661 -16.691 1.00 0.00 H new ATOM 0 HG3 GLU A 493 -6.188 9.749 -16.942 1.00 0.00 H new ATOM 934 N GLU A 494 -5.242 12.222 -12.340 1.00 0.00 N ATOM 935 CA GLU A 494 -5.807 12.568 -11.024 1.00 0.00 C ATOM 936 C GLU A 494 -7.094 11.769 -10.742 1.00 0.00 C ATOM 937 O GLU A 494 -7.344 11.352 -9.610 1.00 0.00 O ATOM 938 CB GLU A 494 -6.092 14.079 -10.952 1.00 0.00 C ATOM 939 CG GLU A 494 -4.822 14.938 -11.014 1.00 0.00 C ATOM 940 CD GLU A 494 -5.154 16.439 -11.045 1.00 0.00 C ATOM 941 OE1 GLU A 494 -5.695 16.921 -12.069 1.00 0.00 O ATOM 942 OE2 GLU A 494 -4.849 17.153 -10.061 1.00 0.00 O ATOM 0 H GLU A 494 -5.196 13.012 -12.984 1.00 0.00 H new ATOM 0 HA GLU A 494 -5.074 12.305 -10.261 1.00 0.00 H new ATOM 0 HB2 GLU A 494 -6.751 14.357 -11.774 1.00 0.00 H new ATOM 0 HB3 GLU A 494 -6.626 14.298 -10.027 1.00 0.00 H new ATOM 0 HG2 GLU A 494 -4.193 14.722 -10.150 1.00 0.00 H new ATOM 0 HG3 GLU A 494 -4.246 14.674 -11.901 1.00 0.00 H new ATOM 949 N SER A 495 -7.869 11.455 -11.782 1.00 0.00 N ATOM 950 CA SER A 495 -9.054 10.589 -11.711 1.00 0.00 C ATOM 951 C SER A 495 -8.744 9.191 -11.148 1.00 0.00 C ATOM 952 O SER A 495 -9.596 8.591 -10.495 1.00 0.00 O ATOM 953 CB SER A 495 -9.677 10.445 -13.108 1.00 0.00 C ATOM 954 OG SER A 495 -9.923 11.717 -13.699 1.00 0.00 O ATOM 0 H SER A 495 -7.687 11.804 -12.723 1.00 0.00 H new ATOM 0 HA SER A 495 -9.753 11.068 -11.025 1.00 0.00 H new ATOM 0 HB2 SER A 495 -9.010 9.867 -13.748 1.00 0.00 H new ATOM 0 HB3 SER A 495 -10.611 9.888 -13.036 1.00 0.00 H new ATOM 0 HG SER A 495 -10.318 11.594 -14.588 1.00 0.00 H new ATOM 960 N SER A 496 -7.517 8.683 -11.310 1.00 0.00 N ATOM 961 CA SER A 496 -7.091 7.410 -10.715 1.00 0.00 C ATOM 962 C SER A 496 -6.896 7.522 -9.194 1.00 0.00 C ATOM 963 O SER A 496 -7.131 6.555 -8.470 1.00 0.00 O ATOM 964 CB SER A 496 -5.780 6.936 -11.353 1.00 0.00 C ATOM 965 OG SER A 496 -5.850 6.889 -12.772 1.00 0.00 O ATOM 0 H SER A 496 -6.790 9.143 -11.858 1.00 0.00 H new ATOM 0 HA SER A 496 -7.884 6.687 -10.907 1.00 0.00 H new ATOM 0 HB2 SER A 496 -4.972 7.604 -11.054 1.00 0.00 H new ATOM 0 HB3 SER A 496 -5.532 5.945 -10.972 1.00 0.00 H new ATOM 0 HG SER A 496 -6.352 6.094 -13.049 1.00 0.00 H new ATOM 971 N VAL A 497 -6.540 8.710 -8.688 1.00 0.00 N ATOM 972 CA VAL A 497 -6.434 8.966 -7.241 1.00 0.00 C ATOM 973 C VAL A 497 -7.833 9.061 -6.628 1.00 0.00 C ATOM 974 O VAL A 497 -8.072 8.504 -5.561 1.00 0.00 O ATOM 975 CB VAL A 497 -5.599 10.229 -6.923 1.00 0.00 C ATOM 976 CG1 VAL A 497 -5.477 10.457 -5.408 1.00 0.00 C ATOM 977 CG2 VAL A 497 -4.189 10.120 -7.528 1.00 0.00 C ATOM 0 H VAL A 497 -6.317 9.520 -9.266 1.00 0.00 H new ATOM 0 HA VAL A 497 -5.902 8.127 -6.793 1.00 0.00 H new ATOM 0 HB VAL A 497 -6.122 11.076 -7.367 1.00 0.00 H new ATOM 0 HG11 VAL A 497 -4.884 11.352 -5.221 1.00 0.00 H new ATOM 0 HG12 VAL A 497 -6.471 10.583 -4.978 1.00 0.00 H new ATOM 0 HG13 VAL A 497 -4.990 9.597 -4.949 1.00 0.00 H new ATOM 0 HG21 VAL A 497 -3.621 11.020 -7.291 1.00 0.00 H new ATOM 0 HG22 VAL A 497 -3.681 9.250 -7.112 1.00 0.00 H new ATOM 0 HG23 VAL A 497 -4.265 10.013 -8.610 1.00 0.00 H new ATOM 987 N GLN A 498 -8.791 9.684 -7.324 1.00 0.00 N ATOM 988 CA GLN A 498 -10.194 9.700 -6.900 1.00 0.00 C ATOM 989 C GLN A 498 -10.825 8.301 -6.951 1.00 0.00 C ATOM 990 O GLN A 498 -11.570 7.946 -6.041 1.00 0.00 O ATOM 991 CB GLN A 498 -10.964 10.679 -7.800 1.00 0.00 C ATOM 992 CG GLN A 498 -12.472 10.793 -7.511 1.00 0.00 C ATOM 993 CD GLN A 498 -12.792 11.258 -6.090 1.00 0.00 C ATOM 994 OE1 GLN A 498 -12.933 12.442 -5.813 1.00 0.00 O ATOM 995 NE2 GLN A 498 -12.918 10.355 -5.139 1.00 0.00 N ATOM 0 H GLN A 498 -8.616 10.189 -8.193 1.00 0.00 H new ATOM 0 HA GLN A 498 -10.246 10.026 -5.861 1.00 0.00 H new ATOM 0 HB2 GLN A 498 -10.516 11.668 -7.700 1.00 0.00 H new ATOM 0 HB3 GLN A 498 -10.832 10.373 -8.838 1.00 0.00 H new ATOM 0 HG2 GLN A 498 -12.917 11.490 -8.221 1.00 0.00 H new ATOM 0 HG3 GLN A 498 -12.940 9.823 -7.680 1.00 0.00 H new ATOM 0 HE21 GLN A 498 -12.803 9.365 -5.357 1.00 0.00 H new ATOM 0 HE22 GLN A 498 -13.131 10.646 -4.185 1.00 0.00 H new ATOM 1004 N ALA A 499 -10.507 7.494 -7.967 1.00 0.00 N ATOM 1005 CA ALA A 499 -10.953 6.099 -8.052 1.00 0.00 C ATOM 1006 C ALA A 499 -10.416 5.242 -6.891 1.00 0.00 C ATOM 1007 O ALA A 499 -11.151 4.410 -6.354 1.00 0.00 O ATOM 1008 CB ALA A 499 -10.530 5.513 -9.403 1.00 0.00 C ATOM 0 H ALA A 499 -9.932 7.789 -8.756 1.00 0.00 H new ATOM 0 HA ALA A 499 -12.040 6.085 -7.970 1.00 0.00 H new ATOM 0 HB1 ALA A 499 -10.860 4.476 -9.469 1.00 0.00 H new ATOM 0 HB2 ALA A 499 -10.984 6.091 -10.208 1.00 0.00 H new ATOM 0 HB3 ALA A 499 -9.445 5.555 -9.494 1.00 0.00 H new ATOM 1014 N LEU A 500 -9.168 5.481 -6.469 1.00 0.00 N ATOM 1015 CA LEU A 500 -8.593 4.877 -5.267 1.00 0.00 C ATOM 1016 C LEU A 500 -9.339 5.340 -4.006 1.00 0.00 C ATOM 1017 O LEU A 500 -9.759 4.506 -3.208 1.00 0.00 O ATOM 1018 CB LEU A 500 -7.079 5.166 -5.237 1.00 0.00 C ATOM 1019 CG LEU A 500 -6.362 4.815 -3.918 1.00 0.00 C ATOM 1020 CD1 LEU A 500 -6.549 3.357 -3.487 1.00 0.00 C ATOM 1021 CD2 LEU A 500 -4.860 5.086 -4.077 1.00 0.00 C ATOM 0 H LEU A 500 -8.526 6.105 -6.958 1.00 0.00 H new ATOM 0 HA LEU A 500 -8.717 3.794 -5.289 1.00 0.00 H new ATOM 0 HB2 LEU A 500 -6.605 4.611 -6.047 1.00 0.00 H new ATOM 0 HB3 LEU A 500 -6.925 6.225 -5.443 1.00 0.00 H new ATOM 0 HG LEU A 500 -6.809 5.440 -3.145 1.00 0.00 H new ATOM 0 HD11 LEU A 500 -6.017 3.183 -2.552 1.00 0.00 H new ATOM 0 HD12 LEU A 500 -7.610 3.153 -3.344 1.00 0.00 H new ATOM 0 HD13 LEU A 500 -6.153 2.696 -4.258 1.00 0.00 H new ATOM 0 HD21 LEU A 500 -4.346 4.840 -3.148 1.00 0.00 H new ATOM 0 HD22 LEU A 500 -4.463 4.472 -4.885 1.00 0.00 H new ATOM 0 HD23 LEU A 500 -4.703 6.139 -4.311 1.00 0.00 H new ATOM 1033 N ILE A 501 -9.567 6.648 -3.843 1.00 0.00 N ATOM 1034 CA ILE A 501 -10.333 7.220 -2.715 1.00 0.00 C ATOM 1035 C ILE A 501 -11.739 6.599 -2.618 1.00 0.00 C ATOM 1036 O ILE A 501 -12.184 6.252 -1.526 1.00 0.00 O ATOM 1037 CB ILE A 501 -10.388 8.765 -2.830 1.00 0.00 C ATOM 1038 CG1 ILE A 501 -8.987 9.383 -2.615 1.00 0.00 C ATOM 1039 CG2 ILE A 501 -11.380 9.371 -1.817 1.00 0.00 C ATOM 1040 CD1 ILE A 501 -8.848 10.830 -3.102 1.00 0.00 C ATOM 0 H ILE A 501 -9.223 7.353 -4.495 1.00 0.00 H new ATOM 0 HA ILE A 501 -9.817 6.972 -1.787 1.00 0.00 H new ATOM 0 HB ILE A 501 -10.733 9.001 -3.837 1.00 0.00 H new ATOM 0 HG12 ILE A 501 -8.747 9.346 -1.552 1.00 0.00 H new ATOM 0 HG13 ILE A 501 -8.249 8.767 -3.130 1.00 0.00 H new ATOM 0 HG21 ILE A 501 -11.393 10.456 -1.925 1.00 0.00 H new ATOM 0 HG22 ILE A 501 -12.378 8.975 -2.004 1.00 0.00 H new ATOM 0 HG23 ILE A 501 -11.071 9.111 -0.805 1.00 0.00 H new ATOM 0 HD11 ILE A 501 -7.834 11.182 -2.912 1.00 0.00 H new ATOM 0 HD12 ILE A 501 -9.053 10.875 -4.172 1.00 0.00 H new ATOM 0 HD13 ILE A 501 -9.558 11.463 -2.570 1.00 0.00 H new ATOM 1052 N ASP A 502 -12.411 6.397 -3.753 1.00 0.00 N ATOM 1053 CA ASP A 502 -13.749 5.794 -3.838 1.00 0.00 C ATOM 1054 C ASP A 502 -13.775 4.289 -3.484 1.00 0.00 C ATOM 1055 O ASP A 502 -14.836 3.754 -3.153 1.00 0.00 O ATOM 1056 CB ASP A 502 -14.307 6.050 -5.248 1.00 0.00 C ATOM 1057 CG ASP A 502 -15.777 5.627 -5.393 1.00 0.00 C ATOM 1058 OD1 ASP A 502 -16.652 6.267 -4.760 1.00 0.00 O ATOM 1059 OD2 ASP A 502 -16.062 4.686 -6.172 1.00 0.00 O ATOM 0 H ASP A 502 -12.032 6.654 -4.665 1.00 0.00 H new ATOM 0 HA ASP A 502 -14.382 6.267 -3.087 1.00 0.00 H new ATOM 0 HB2 ASP A 502 -14.214 7.110 -5.484 1.00 0.00 H new ATOM 0 HB3 ASP A 502 -13.704 5.508 -5.976 1.00 0.00 H new ATOM 1064 N ALA A 503 -12.617 3.615 -3.500 1.00 0.00 N ATOM 1065 CA ALA A 503 -12.452 2.214 -3.100 1.00 0.00 C ATOM 1066 C ALA A 503 -11.886 2.045 -1.676 1.00 0.00 C ATOM 1067 O ALA A 503 -11.947 0.944 -1.121 1.00 0.00 O ATOM 1068 CB ALA A 503 -11.559 1.531 -4.142 1.00 0.00 C ATOM 0 H ALA A 503 -11.743 4.045 -3.802 1.00 0.00 H new ATOM 0 HA ALA A 503 -13.435 1.744 -3.066 1.00 0.00 H new ATOM 0 HB1 ALA A 503 -11.418 0.485 -3.871 1.00 0.00 H new ATOM 0 HB2 ALA A 503 -12.032 1.591 -5.122 1.00 0.00 H new ATOM 0 HB3 ALA A 503 -10.591 2.031 -4.175 1.00 0.00 H new ATOM 1074 N CYS A 504 -11.355 3.112 -1.068 1.00 0.00 N ATOM 1075 CA CYS A 504 -10.772 3.080 0.273 1.00 0.00 C ATOM 1076 C CYS A 504 -11.828 3.025 1.395 1.00 0.00 C ATOM 1077 O CYS A 504 -12.909 3.615 1.302 1.00 0.00 O ATOM 1078 CB CYS A 504 -9.890 4.323 0.474 1.00 0.00 C ATOM 1079 SG CYS A 504 -8.316 4.166 -0.414 1.00 0.00 S ATOM 0 H CYS A 504 -11.319 4.034 -1.502 1.00 0.00 H new ATOM 0 HA CYS A 504 -10.185 2.164 0.340 1.00 0.00 H new ATOM 0 HB2 CYS A 504 -10.421 5.208 0.124 1.00 0.00 H new ATOM 0 HB3 CYS A 504 -9.697 4.467 1.537 1.00 0.00 H new ATOM 0 HG CYS A 504 -8.525 4.282 -1.692 1.00 0.00 H new ATOM 1085 N LEU A 505 -11.466 2.350 2.488 1.00 0.00 N ATOM 1086 CA LEU A 505 -12.143 2.406 3.787 1.00 0.00 C ATOM 1087 C LEU A 505 -11.639 3.651 4.539 1.00 0.00 C ATOM 1088 O LEU A 505 -10.703 4.310 4.085 1.00 0.00 O ATOM 1089 CB LEU A 505 -11.852 1.112 4.577 1.00 0.00 C ATOM 1090 CG LEU A 505 -12.399 -0.172 3.926 1.00 0.00 C ATOM 1091 CD1 LEU A 505 -11.893 -1.397 4.702 1.00 0.00 C ATOM 1092 CD2 LEU A 505 -13.935 -0.192 3.870 1.00 0.00 C ATOM 0 H LEU A 505 -10.661 1.724 2.493 1.00 0.00 H new ATOM 0 HA LEU A 505 -13.223 2.481 3.661 1.00 0.00 H new ATOM 0 HB2 LEU A 505 -10.774 1.011 4.699 1.00 0.00 H new ATOM 0 HB3 LEU A 505 -12.278 1.208 5.576 1.00 0.00 H new ATOM 0 HG LEU A 505 -12.036 -0.199 2.898 1.00 0.00 H new ATOM 0 HD11 LEU A 505 -12.281 -2.305 4.241 1.00 0.00 H new ATOM 0 HD12 LEU A 505 -10.803 -1.416 4.682 1.00 0.00 H new ATOM 0 HD13 LEU A 505 -12.236 -1.340 5.735 1.00 0.00 H new ATOM 0 HD21 LEU A 505 -14.270 -1.118 3.402 1.00 0.00 H new ATOM 0 HD22 LEU A 505 -14.337 -0.130 4.881 1.00 0.00 H new ATOM 0 HD23 LEU A 505 -14.289 0.658 3.286 1.00 0.00 H new ATOM 1104 N GLU A 506 -12.233 3.969 5.689 1.00 0.00 N ATOM 1105 CA GLU A 506 -11.982 5.230 6.404 1.00 0.00 C ATOM 1106 C GLU A 506 -12.041 5.064 7.934 1.00 0.00 C ATOM 1107 O GLU A 506 -12.904 4.353 8.457 1.00 0.00 O ATOM 1108 CB GLU A 506 -12.985 6.291 5.912 1.00 0.00 C ATOM 1109 CG GLU A 506 -12.685 7.706 6.426 1.00 0.00 C ATOM 1110 CD GLU A 506 -13.726 8.708 5.904 1.00 0.00 C ATOM 1111 OE1 GLU A 506 -14.810 8.833 6.523 1.00 0.00 O ATOM 1112 OE2 GLU A 506 -13.469 9.381 4.878 1.00 0.00 O ATOM 0 H GLU A 506 -12.905 3.360 6.156 1.00 0.00 H new ATOM 0 HA GLU A 506 -10.966 5.556 6.182 1.00 0.00 H new ATOM 0 HB2 GLU A 506 -12.984 6.302 4.822 1.00 0.00 H new ATOM 0 HB3 GLU A 506 -13.988 6.004 6.227 1.00 0.00 H new ATOM 0 HG2 GLU A 506 -12.685 7.709 7.516 1.00 0.00 H new ATOM 0 HG3 GLU A 506 -11.688 8.010 6.106 1.00 0.00 H new ATOM 1119 N GLU A 507 -11.140 5.748 8.648 1.00 0.00 N ATOM 1120 CA GLU A 507 -11.069 5.793 10.114 1.00 0.00 C ATOM 1121 C GLU A 507 -10.360 7.082 10.568 1.00 0.00 C ATOM 1122 O GLU A 507 -9.188 7.279 10.261 1.00 0.00 O ATOM 1123 CB GLU A 507 -10.328 4.546 10.636 1.00 0.00 C ATOM 1124 CG GLU A 507 -10.267 4.496 12.168 1.00 0.00 C ATOM 1125 CD GLU A 507 -9.430 3.305 12.651 1.00 0.00 C ATOM 1126 OE1 GLU A 507 -9.996 2.204 12.859 1.00 0.00 O ATOM 1127 OE2 GLU A 507 -8.201 3.469 12.835 1.00 0.00 O ATOM 0 H GLU A 507 -10.412 6.307 8.204 1.00 0.00 H new ATOM 0 HA GLU A 507 -12.078 5.796 10.526 1.00 0.00 H new ATOM 0 HB2 GLU A 507 -10.827 3.650 10.266 1.00 0.00 H new ATOM 0 HB3 GLU A 507 -9.315 4.535 10.235 1.00 0.00 H new ATOM 0 HG2 GLU A 507 -9.838 5.423 12.548 1.00 0.00 H new ATOM 0 HG3 GLU A 507 -11.276 4.422 12.573 1.00 0.00 H new ATOM 1134 N ASP A 508 -11.058 7.968 11.289 1.00 0.00 N ATOM 1135 CA ASP A 508 -10.517 9.207 11.898 1.00 0.00 C ATOM 1136 C ASP A 508 -9.933 10.226 10.882 1.00 0.00 C ATOM 1137 O ASP A 508 -9.203 11.147 11.260 1.00 0.00 O ATOM 1138 CB ASP A 508 -9.519 8.861 13.028 1.00 0.00 C ATOM 1139 CG ASP A 508 -10.154 8.093 14.201 1.00 0.00 C ATOM 1140 OD1 ASP A 508 -11.271 8.463 14.640 1.00 0.00 O ATOM 1141 OD2 ASP A 508 -9.509 7.150 14.716 1.00 0.00 O ATOM 0 H ASP A 508 -12.053 7.844 11.476 1.00 0.00 H new ATOM 0 HA ASP A 508 -11.369 9.730 12.332 1.00 0.00 H new ATOM 0 HB2 ASP A 508 -8.706 8.265 12.613 1.00 0.00 H new ATOM 0 HB3 ASP A 508 -9.078 9.783 13.406 1.00 0.00 H new ATOM 1146 N GLY A 509 -10.252 10.067 9.591 1.00 0.00 N ATOM 1147 CA GLY A 509 -9.708 10.848 8.467 1.00 0.00 C ATOM 1148 C GLY A 509 -8.563 10.156 7.722 1.00 0.00 C ATOM 1149 O GLY A 509 -8.130 10.640 6.674 1.00 0.00 O ATOM 0 H GLY A 509 -10.924 9.362 9.286 1.00 0.00 H new ATOM 0 HA2 GLY A 509 -10.512 11.058 7.762 1.00 0.00 H new ATOM 0 HA3 GLY A 509 -9.355 11.808 8.843 1.00 0.00 H new ATOM 1153 N LYS A 510 -8.080 9.016 8.223 1.00 0.00 N ATOM 1154 CA LYS A 510 -7.160 8.120 7.518 1.00 0.00 C ATOM 1155 C LYS A 510 -7.953 7.284 6.498 1.00 0.00 C ATOM 1156 O LYS A 510 -9.104 6.922 6.761 1.00 0.00 O ATOM 1157 CB LYS A 510 -6.461 7.185 8.519 1.00 0.00 C ATOM 1158 CG LYS A 510 -5.759 7.898 9.689 1.00 0.00 C ATOM 1159 CD LYS A 510 -5.243 6.889 10.723 1.00 0.00 C ATOM 1160 CE LYS A 510 -6.404 6.237 11.495 1.00 0.00 C ATOM 1161 NZ LYS A 510 -5.966 5.057 12.279 1.00 0.00 N ATOM 0 H LYS A 510 -8.325 8.682 9.155 1.00 0.00 H new ATOM 0 HA LYS A 510 -6.404 8.712 7.003 1.00 0.00 H new ATOM 0 HB2 LYS A 510 -7.199 6.493 8.924 1.00 0.00 H new ATOM 0 HB3 LYS A 510 -5.725 6.587 7.982 1.00 0.00 H new ATOM 0 HG2 LYS A 510 -4.927 8.492 9.310 1.00 0.00 H new ATOM 0 HG3 LYS A 510 -6.453 8.589 10.166 1.00 0.00 H new ATOM 0 HD2 LYS A 510 -4.658 6.118 10.222 1.00 0.00 H new ATOM 0 HD3 LYS A 510 -4.575 7.391 11.423 1.00 0.00 H new ATOM 0 HE2 LYS A 510 -6.849 6.972 12.166 1.00 0.00 H new ATOM 0 HE3 LYS A 510 -7.181 5.936 10.792 1.00 0.00 H new ATOM 0 HZ1 LYS A 510 -6.800 4.553 12.643 1.00 0.00 H new ATOM 0 HZ2 LYS A 510 -5.415 4.420 11.669 1.00 0.00 H new ATOM 0 HZ3 LYS A 510 -5.375 5.369 13.076 1.00 0.00 H new ATOM 1175 N LEU A 511 -7.338 6.939 5.363 1.00 0.00 N ATOM 1176 CA LEU A 511 -7.907 6.025 4.365 1.00 0.00 C ATOM 1177 C LEU A 511 -7.129 4.707 4.358 1.00 0.00 C ATOM 1178 O LEU A 511 -5.938 4.690 4.669 1.00 0.00 O ATOM 1179 CB LEU A 511 -7.906 6.687 2.972 1.00 0.00 C ATOM 1180 CG LEU A 511 -8.861 7.886 2.798 1.00 0.00 C ATOM 1181 CD1 LEU A 511 -8.677 8.466 1.388 1.00 0.00 C ATOM 1182 CD2 LEU A 511 -10.334 7.505 3.008 1.00 0.00 C ATOM 0 H LEU A 511 -6.416 7.292 5.107 1.00 0.00 H new ATOM 0 HA LEU A 511 -8.942 5.805 4.628 1.00 0.00 H new ATOM 0 HB2 LEU A 511 -6.892 7.019 2.749 1.00 0.00 H new ATOM 0 HB3 LEU A 511 -8.164 5.931 2.231 1.00 0.00 H new ATOM 0 HG LEU A 511 -8.610 8.624 3.560 1.00 0.00 H new ATOM 0 HD11 LEU A 511 -9.347 9.315 1.253 1.00 0.00 H new ATOM 0 HD12 LEU A 511 -7.645 8.795 1.262 1.00 0.00 H new ATOM 0 HD13 LEU A 511 -8.907 7.701 0.647 1.00 0.00 H new ATOM 0 HD21 LEU A 511 -10.961 8.387 2.873 1.00 0.00 H new ATOM 0 HD22 LEU A 511 -10.620 6.743 2.283 1.00 0.00 H new ATOM 0 HD23 LEU A 511 -10.469 7.115 4.017 1.00 0.00 H new ATOM 1194 N TYR A 512 -7.785 3.607 3.986 1.00 0.00 N ATOM 1195 CA TYR A 512 -7.178 2.270 3.941 1.00 0.00 C ATOM 1196 C TYR A 512 -7.632 1.434 2.734 1.00 0.00 C ATOM 1197 O TYR A 512 -8.808 1.423 2.371 1.00 0.00 O ATOM 1198 CB TYR A 512 -7.456 1.496 5.243 1.00 0.00 C ATOM 1199 CG TYR A 512 -6.774 2.043 6.484 1.00 0.00 C ATOM 1200 CD1 TYR A 512 -7.400 3.030 7.273 1.00 0.00 C ATOM 1201 CD2 TYR A 512 -5.517 1.536 6.866 1.00 0.00 C ATOM 1202 CE1 TYR A 512 -6.767 3.516 8.433 1.00 0.00 C ATOM 1203 CE2 TYR A 512 -4.880 2.015 8.025 1.00 0.00 C ATOM 1204 CZ TYR A 512 -5.503 3.009 8.812 1.00 0.00 C ATOM 1205 OH TYR A 512 -4.888 3.470 9.936 1.00 0.00 O ATOM 0 H TYR A 512 -8.765 3.616 3.703 1.00 0.00 H new ATOM 0 HA TYR A 512 -6.106 2.435 3.832 1.00 0.00 H new ATOM 0 HB2 TYR A 512 -8.532 1.484 5.416 1.00 0.00 H new ATOM 0 HB3 TYR A 512 -7.144 0.461 5.104 1.00 0.00 H new ATOM 0 HD1 TYR A 512 -8.368 3.414 6.987 1.00 0.00 H new ATOM 0 HD2 TYR A 512 -5.040 0.775 6.266 1.00 0.00 H new ATOM 0 HE1 TYR A 512 -7.247 4.275 9.033 1.00 0.00 H new ATOM 0 HE2 TYR A 512 -3.916 1.623 8.313 1.00 0.00 H new ATOM 0 HH TYR A 512 -4.028 3.014 10.049 1.00 0.00 H new ATOM 1215 N LEU A 513 -6.695 0.678 2.159 1.00 0.00 N ATOM 1216 CA LEU A 513 -6.921 -0.365 1.152 1.00 0.00 C ATOM 1217 C LEU A 513 -6.284 -1.675 1.659 1.00 0.00 C ATOM 1218 O LEU A 513 -5.855 -1.729 2.814 1.00 0.00 O ATOM 1219 CB LEU A 513 -6.341 0.120 -0.197 1.00 0.00 C ATOM 1220 CG LEU A 513 -7.113 -0.429 -1.411 1.00 0.00 C ATOM 1221 CD1 LEU A 513 -8.408 0.376 -1.624 1.00 0.00 C ATOM 1222 CD2 LEU A 513 -6.268 -0.349 -2.684 1.00 0.00 C ATOM 0 H LEU A 513 -5.708 0.780 2.394 1.00 0.00 H new ATOM 0 HA LEU A 513 -7.981 -0.562 0.991 1.00 0.00 H new ATOM 0 HB2 LEU A 513 -6.358 1.210 -0.224 1.00 0.00 H new ATOM 0 HB3 LEU A 513 -5.297 -0.184 -0.269 1.00 0.00 H new ATOM 0 HG LEU A 513 -7.351 -1.473 -1.207 1.00 0.00 H new ATOM 0 HD11 LEU A 513 -8.946 -0.021 -2.485 1.00 0.00 H new ATOM 0 HD12 LEU A 513 -9.036 0.297 -0.736 1.00 0.00 H new ATOM 0 HD13 LEU A 513 -8.161 1.423 -1.802 1.00 0.00 H new ATOM 0 HD21 LEU A 513 -6.839 -0.743 -3.525 1.00 0.00 H new ATOM 0 HD22 LEU A 513 -6.004 0.690 -2.880 1.00 0.00 H new ATOM 0 HD23 LEU A 513 -5.359 -0.937 -2.555 1.00 0.00 H new ATOM 1234 N CYS A 514 -6.175 -2.720 0.833 1.00 0.00 N ATOM 1235 CA CYS A 514 -5.571 -4.002 1.218 1.00 0.00 C ATOM 1236 C CYS A 514 -4.729 -4.649 0.099 1.00 0.00 C ATOM 1237 O CYS A 514 -4.995 -4.442 -1.087 1.00 0.00 O ATOM 1238 CB CYS A 514 -6.663 -4.935 1.777 1.00 0.00 C ATOM 1239 SG CYS A 514 -7.938 -5.268 0.522 1.00 0.00 S ATOM 0 H CYS A 514 -6.506 -2.701 -0.131 1.00 0.00 H new ATOM 0 HA CYS A 514 -4.845 -3.810 2.008 1.00 0.00 H new ATOM 0 HB2 CYS A 514 -6.214 -5.873 2.102 1.00 0.00 H new ATOM 0 HB3 CYS A 514 -7.121 -4.480 2.655 1.00 0.00 H new ATOM 0 HG CYS A 514 -8.842 -6.058 1.021 1.00 0.00 H new ATOM 1245 N VAL A 515 -3.702 -5.412 0.494 1.00 0.00 N ATOM 1246 CA VAL A 515 -2.654 -6.001 -0.374 1.00 0.00 C ATOM 1247 C VAL A 515 -2.088 -7.303 0.228 1.00 0.00 C ATOM 1248 O VAL A 515 -2.468 -7.699 1.330 1.00 0.00 O ATOM 1249 CB VAL A 515 -1.500 -5.000 -0.671 1.00 0.00 C ATOM 1250 CG1 VAL A 515 -1.951 -3.760 -1.459 1.00 0.00 C ATOM 1251 CG2 VAL A 515 -0.785 -4.540 0.607 1.00 0.00 C ATOM 0 H VAL A 515 -3.565 -5.652 1.476 1.00 0.00 H new ATOM 0 HA VAL A 515 -3.139 -6.238 -1.321 1.00 0.00 H new ATOM 0 HB VAL A 515 -0.806 -5.565 -1.294 1.00 0.00 H new ATOM 0 HG11 VAL A 515 -1.095 -3.107 -1.630 1.00 0.00 H new ATOM 0 HG12 VAL A 515 -2.368 -4.070 -2.417 1.00 0.00 H new ATOM 0 HG13 VAL A 515 -2.710 -3.223 -0.889 1.00 0.00 H new ATOM 0 HG21 VAL A 515 0.012 -3.843 0.347 1.00 0.00 H new ATOM 0 HG22 VAL A 515 -1.499 -4.046 1.266 1.00 0.00 H new ATOM 0 HG23 VAL A 515 -0.359 -5.404 1.117 1.00 0.00 H new ATOM 1261 N SER A 516 -1.176 -7.977 -0.478 1.00 0.00 N ATOM 1262 CA SER A 516 -0.622 -9.292 -0.108 1.00 0.00 C ATOM 1263 C SER A 516 0.717 -9.603 -0.817 1.00 0.00 C ATOM 1264 O SER A 516 1.149 -8.889 -1.725 1.00 0.00 O ATOM 1265 CB SER A 516 -1.660 -10.397 -0.391 1.00 0.00 C ATOM 1266 OG SER A 516 -2.034 -10.449 -1.763 1.00 0.00 O ATOM 0 H SER A 516 -0.788 -7.616 -1.350 1.00 0.00 H new ATOM 0 HA SER A 516 -0.403 -9.262 0.959 1.00 0.00 H new ATOM 0 HB2 SER A 516 -1.251 -11.362 -0.092 1.00 0.00 H new ATOM 0 HB3 SER A 516 -2.547 -10.224 0.219 1.00 0.00 H new ATOM 0 HG SER A 516 -2.691 -11.164 -1.896 1.00 0.00 H new ATOM 1272 N SER A 517 1.390 -10.677 -0.401 1.00 0.00 N ATOM 1273 CA SER A 517 2.696 -11.141 -0.892 1.00 0.00 C ATOM 1274 C SER A 517 2.839 -12.670 -0.686 1.00 0.00 C ATOM 1275 O SER A 517 1.925 -13.297 -0.128 1.00 0.00 O ATOM 1276 CB SER A 517 3.807 -10.383 -0.140 1.00 0.00 C ATOM 1277 OG SER A 517 3.977 -10.919 1.166 1.00 0.00 O ATOM 0 H SER A 517 1.020 -11.284 0.330 1.00 0.00 H new ATOM 0 HA SER A 517 2.780 -10.940 -1.960 1.00 0.00 H new ATOM 0 HB2 SER A 517 4.743 -10.454 -0.694 1.00 0.00 H new ATOM 0 HB3 SER A 517 3.554 -9.325 -0.075 1.00 0.00 H new ATOM 0 HG SER A 517 4.687 -10.429 1.631 1.00 0.00 H new ATOM 1283 N PRO A 518 3.972 -13.302 -1.057 1.00 0.00 N ATOM 1284 CA PRO A 518 4.251 -14.698 -0.715 1.00 0.00 C ATOM 1285 C PRO A 518 4.286 -14.986 0.797 1.00 0.00 C ATOM 1286 O PRO A 518 4.104 -16.141 1.185 1.00 0.00 O ATOM 1287 CB PRO A 518 5.599 -15.027 -1.368 1.00 0.00 C ATOM 1288 CG PRO A 518 5.687 -14.031 -2.521 1.00 0.00 C ATOM 1289 CD PRO A 518 5.022 -12.793 -1.928 1.00 0.00 C ATOM 0 HA PRO A 518 3.440 -15.327 -1.083 1.00 0.00 H new ATOM 0 HB2 PRO A 518 6.425 -14.905 -0.668 1.00 0.00 H new ATOM 0 HB3 PRO A 518 5.632 -16.057 -1.723 1.00 0.00 H new ATOM 0 HG2 PRO A 518 6.719 -13.838 -2.814 1.00 0.00 H new ATOM 0 HG3 PRO A 518 5.165 -14.388 -3.409 1.00 0.00 H new ATOM 0 HD2 PRO A 518 5.739 -12.191 -1.370 1.00 0.00 H new ATOM 0 HD3 PRO A 518 4.610 -12.155 -2.710 1.00 0.00 H new ATOM 1297 N THR A 519 4.474 -13.962 1.648 1.00 0.00 N ATOM 1298 CA THR A 519 4.637 -14.093 3.108 1.00 0.00 C ATOM 1299 C THR A 519 3.511 -13.459 3.926 1.00 0.00 C ATOM 1300 O THR A 519 3.328 -13.841 5.082 1.00 0.00 O ATOM 1301 CB THR A 519 5.981 -13.496 3.548 1.00 0.00 C ATOM 1302 OG1 THR A 519 6.065 -12.154 3.117 1.00 0.00 O ATOM 1303 CG2 THR A 519 7.169 -14.264 2.965 1.00 0.00 C ATOM 0 H THR A 519 4.518 -12.993 1.331 1.00 0.00 H new ATOM 0 HA THR A 519 4.602 -15.164 3.310 1.00 0.00 H new ATOM 0 HB THR A 519 6.025 -13.563 4.635 1.00 0.00 H new ATOM 0 HG1 THR A 519 6.922 -11.773 3.399 1.00 0.00 H new ATOM 0 HG21 THR A 519 8.099 -13.807 3.303 1.00 0.00 H new ATOM 0 HG22 THR A 519 7.132 -15.301 3.300 1.00 0.00 H new ATOM 0 HG23 THR A 519 7.124 -14.233 1.876 1.00 0.00 H new ATOM 1311 N ILE A 520 2.728 -12.543 3.348 1.00 0.00 N ATOM 1312 CA ILE A 520 1.699 -11.739 4.037 1.00 0.00 C ATOM 1313 C ILE A 520 0.381 -11.769 3.250 1.00 0.00 C ATOM 1314 O ILE A 520 0.374 -11.639 2.028 1.00 0.00 O ATOM 1315 CB ILE A 520 2.227 -10.291 4.213 1.00 0.00 C ATOM 1316 CG1 ILE A 520 3.493 -10.176 5.093 1.00 0.00 C ATOM 1317 CG2 ILE A 520 1.143 -9.340 4.743 1.00 0.00 C ATOM 1318 CD1 ILE A 520 3.325 -10.579 6.564 1.00 0.00 C ATOM 0 H ILE A 520 2.791 -12.329 2.353 1.00 0.00 H new ATOM 0 HA ILE A 520 1.496 -12.159 5.022 1.00 0.00 H new ATOM 0 HB ILE A 520 2.513 -9.989 3.205 1.00 0.00 H new ATOM 0 HG12 ILE A 520 4.275 -10.795 4.654 1.00 0.00 H new ATOM 0 HG13 ILE A 520 3.845 -9.145 5.057 1.00 0.00 H new ATOM 0 HG21 ILE A 520 1.559 -8.338 4.850 1.00 0.00 H new ATOM 0 HG22 ILE A 520 0.308 -9.313 4.043 1.00 0.00 H new ATOM 0 HG23 ILE A 520 0.792 -9.693 5.713 1.00 0.00 H new ATOM 0 HD11 ILE A 520 4.275 -10.459 7.085 1.00 0.00 H new ATOM 0 HD12 ILE A 520 2.572 -9.945 7.031 1.00 0.00 H new ATOM 0 HD13 ILE A 520 3.009 -11.620 6.622 1.00 0.00 H new ATOM 1330 N LYS A 521 -0.748 -11.924 3.946 1.00 0.00 N ATOM 1331 CA LYS A 521 -2.075 -12.150 3.351 1.00 0.00 C ATOM 1332 C LYS A 521 -3.147 -11.217 3.952 1.00 0.00 C ATOM 1333 O LYS A 521 -3.181 -11.014 5.167 1.00 0.00 O ATOM 1334 CB LYS A 521 -2.466 -13.627 3.566 1.00 0.00 C ATOM 1335 CG LYS A 521 -1.525 -14.673 2.941 1.00 0.00 C ATOM 1336 CD LYS A 521 -1.466 -14.614 1.406 1.00 0.00 C ATOM 1337 CE LYS A 521 -0.607 -15.748 0.825 1.00 0.00 C ATOM 1338 NZ LYS A 521 0.836 -15.582 1.142 1.00 0.00 N ATOM 0 H LYS A 521 -0.769 -11.896 4.965 1.00 0.00 H new ATOM 0 HA LYS A 521 -2.022 -11.923 2.286 1.00 0.00 H new ATOM 0 HB2 LYS A 521 -2.524 -13.814 4.638 1.00 0.00 H new ATOM 0 HB3 LYS A 521 -3.466 -13.780 3.161 1.00 0.00 H new ATOM 0 HG2 LYS A 521 -0.521 -14.529 3.340 1.00 0.00 H new ATOM 0 HG3 LYS A 521 -1.850 -15.668 3.245 1.00 0.00 H new ATOM 0 HD2 LYS A 521 -2.476 -14.678 1.001 1.00 0.00 H new ATOM 0 HD3 LYS A 521 -1.058 -13.652 1.094 1.00 0.00 H new ATOM 0 HE2 LYS A 521 -0.956 -16.703 1.218 1.00 0.00 H new ATOM 0 HE3 LYS A 521 -0.738 -15.782 -0.257 1.00 0.00 H new ATOM 0 HZ1 LYS A 521 1.368 -16.396 0.773 1.00 0.00 H new ATOM 0 HZ2 LYS A 521 1.190 -14.709 0.702 1.00 0.00 H new ATOM 0 HZ3 LYS A 521 0.961 -15.525 2.173 1.00 0.00 H new ATOM 1352 N ASP A 522 -4.020 -10.666 3.095 1.00 0.00 N ATOM 1353 CA ASP A 522 -5.198 -9.834 3.477 1.00 0.00 C ATOM 1354 C ASP A 522 -4.821 -8.587 4.314 1.00 0.00 C ATOM 1355 O ASP A 522 -5.593 -8.101 5.141 1.00 0.00 O ATOM 1356 CB ASP A 522 -6.245 -10.741 4.162 1.00 0.00 C ATOM 1357 CG ASP A 522 -7.633 -10.088 4.306 1.00 0.00 C ATOM 1358 OD1 ASP A 522 -8.149 -9.537 3.304 1.00 0.00 O ATOM 1359 OD2 ASP A 522 -8.229 -10.178 5.407 1.00 0.00 O ATOM 0 H ASP A 522 -3.934 -10.783 2.085 1.00 0.00 H new ATOM 0 HA ASP A 522 -5.639 -9.413 2.574 1.00 0.00 H new ATOM 0 HB2 ASP A 522 -6.345 -11.662 3.588 1.00 0.00 H new ATOM 0 HB3 ASP A 522 -5.880 -11.019 5.151 1.00 0.00 H new ATOM 1364 N LYS A 523 -3.604 -8.068 4.119 1.00 0.00 N ATOM 1365 CA LYS A 523 -3.038 -6.973 4.911 1.00 0.00 C ATOM 1366 C LYS A 523 -3.716 -5.628 4.580 1.00 0.00 C ATOM 1367 O LYS A 523 -3.721 -5.258 3.397 1.00 0.00 O ATOM 1368 CB LYS A 523 -1.530 -6.914 4.618 1.00 0.00 C ATOM 1369 CG LYS A 523 -0.754 -5.899 5.472 1.00 0.00 C ATOM 1370 CD LYS A 523 -0.445 -6.436 6.876 1.00 0.00 C ATOM 1371 CE LYS A 523 0.278 -5.399 7.747 1.00 0.00 C ATOM 1372 NZ LYS A 523 1.670 -5.131 7.298 1.00 0.00 N ATOM 0 H LYS A 523 -2.973 -8.405 3.392 1.00 0.00 H new ATOM 0 HA LYS A 523 -3.212 -7.156 5.971 1.00 0.00 H new ATOM 0 HB2 LYS A 523 -1.103 -7.904 4.776 1.00 0.00 H new ATOM 0 HB3 LYS A 523 -1.387 -6.669 3.566 1.00 0.00 H new ATOM 0 HG2 LYS A 523 0.179 -5.643 4.970 1.00 0.00 H new ATOM 0 HG3 LYS A 523 -1.334 -4.980 5.556 1.00 0.00 H new ATOM 0 HD2 LYS A 523 -1.374 -6.732 7.363 1.00 0.00 H new ATOM 0 HD3 LYS A 523 0.171 -7.331 6.793 1.00 0.00 H new ATOM 0 HE2 LYS A 523 -0.287 -4.467 7.737 1.00 0.00 H new ATOM 0 HE3 LYS A 523 0.296 -5.749 8.779 1.00 0.00 H new ATOM 0 HZ1 LYS A 523 2.207 -4.693 8.074 1.00 0.00 H new ATOM 0 HZ2 LYS A 523 2.125 -6.025 7.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 523 1.653 -4.487 6.481 1.00 0.00 H new ATOM 1386 N PRO A 524 -4.229 -4.874 5.577 1.00 0.00 N ATOM 1387 CA PRO A 524 -4.716 -3.516 5.383 1.00 0.00 C ATOM 1388 C PRO A 524 -3.526 -2.553 5.322 1.00 0.00 C ATOM 1389 O PRO A 524 -2.542 -2.721 6.042 1.00 0.00 O ATOM 1390 CB PRO A 524 -5.620 -3.223 6.583 1.00 0.00 C ATOM 1391 CG PRO A 524 -5.012 -4.070 7.703 1.00 0.00 C ATOM 1392 CD PRO A 524 -4.315 -5.232 6.987 1.00 0.00 C ATOM 0 HA PRO A 524 -5.269 -3.396 4.451 1.00 0.00 H new ATOM 0 HB2 PRO A 524 -5.620 -2.163 6.836 1.00 0.00 H new ATOM 0 HB3 PRO A 524 -6.654 -3.503 6.384 1.00 0.00 H new ATOM 0 HG2 PRO A 524 -4.305 -3.491 8.296 1.00 0.00 H new ATOM 0 HG3 PRO A 524 -5.781 -4.431 8.386 1.00 0.00 H new ATOM 0 HD2 PRO A 524 -3.322 -5.401 7.403 1.00 0.00 H new ATOM 0 HD3 PRO A 524 -4.877 -6.157 7.116 1.00 0.00 H new ATOM 1400 N VAL A 525 -3.625 -1.538 4.465 1.00 0.00 N ATOM 1401 CA VAL A 525 -2.549 -0.573 4.186 1.00 0.00 C ATOM 1402 C VAL A 525 -3.106 0.844 4.105 1.00 0.00 C ATOM 1403 O VAL A 525 -4.144 1.073 3.491 1.00 0.00 O ATOM 1404 CB VAL A 525 -1.746 -0.938 2.916 1.00 0.00 C ATOM 1405 CG1 VAL A 525 -0.847 -2.148 3.220 1.00 0.00 C ATOM 1406 CG2 VAL A 525 -2.607 -1.225 1.668 1.00 0.00 C ATOM 0 H VAL A 525 -4.474 -1.355 3.930 1.00 0.00 H new ATOM 0 HA VAL A 525 -1.847 -0.619 5.019 1.00 0.00 H new ATOM 0 HB VAL A 525 -1.156 -0.056 2.664 1.00 0.00 H new ATOM 0 HG11 VAL A 525 -0.278 -2.411 2.329 1.00 0.00 H new ATOM 0 HG12 VAL A 525 -0.160 -1.897 4.028 1.00 0.00 H new ATOM 0 HG13 VAL A 525 -1.465 -2.995 3.519 1.00 0.00 H new ATOM 0 HG21 VAL A 525 -1.958 -1.472 0.827 1.00 0.00 H new ATOM 0 HG22 VAL A 525 -3.273 -2.064 1.871 1.00 0.00 H new ATOM 0 HG23 VAL A 525 -3.198 -0.343 1.423 1.00 0.00 H new ATOM 1416 N GLN A 526 -2.437 1.779 4.780 1.00 0.00 N ATOM 1417 CA GLN A 526 -2.891 3.156 4.964 1.00 0.00 C ATOM 1418 C GLN A 526 -2.557 3.989 3.724 1.00 0.00 C ATOM 1419 O GLN A 526 -1.426 3.963 3.246 1.00 0.00 O ATOM 1420 CB GLN A 526 -2.231 3.739 6.224 1.00 0.00 C ATOM 1421 CG GLN A 526 -2.938 5.023 6.694 1.00 0.00 C ATOM 1422 CD GLN A 526 -2.336 5.614 7.974 1.00 0.00 C ATOM 1423 OE1 GLN A 526 -1.731 4.941 8.800 1.00 0.00 O ATOM 1424 NE2 GLN A 526 -2.474 6.907 8.190 1.00 0.00 N ATOM 0 H GLN A 526 -1.539 1.593 5.226 1.00 0.00 H new ATOM 0 HA GLN A 526 -3.973 3.177 5.095 1.00 0.00 H new ATOM 0 HB2 GLN A 526 -2.254 2.998 7.023 1.00 0.00 H new ATOM 0 HB3 GLN A 526 -1.182 3.955 6.019 1.00 0.00 H new ATOM 0 HG2 GLN A 526 -2.888 5.768 5.900 1.00 0.00 H new ATOM 0 HG3 GLN A 526 -3.993 4.807 6.863 1.00 0.00 H new ATOM 0 HE21 GLN A 526 -2.974 7.486 7.516 1.00 0.00 H new ATOM 0 HE22 GLN A 526 -2.081 7.328 9.032 1.00 0.00 H new ATOM 1433 N ILE A 527 -3.536 4.736 3.212 1.00 0.00 N ATOM 1434 CA ILE A 527 -3.472 5.466 1.939 1.00 0.00 C ATOM 1435 C ILE A 527 -3.522 6.970 2.224 1.00 0.00 C ATOM 1436 O ILE A 527 -4.409 7.448 2.939 1.00 0.00 O ATOM 1437 CB ILE A 527 -4.641 5.024 1.023 1.00 0.00 C ATOM 1438 CG1 ILE A 527 -4.782 3.491 0.878 1.00 0.00 C ATOM 1439 CG2 ILE A 527 -4.534 5.657 -0.375 1.00 0.00 C ATOM 1440 CD1 ILE A 527 -3.553 2.756 0.328 1.00 0.00 C ATOM 0 H ILE A 527 -4.430 4.856 3.688 1.00 0.00 H new ATOM 0 HA ILE A 527 -2.540 5.242 1.421 1.00 0.00 H new ATOM 0 HB ILE A 527 -5.538 5.385 1.527 1.00 0.00 H new ATOM 0 HG12 ILE A 527 -5.024 3.073 1.855 1.00 0.00 H new ATOM 0 HG13 ILE A 527 -5.629 3.283 0.224 1.00 0.00 H new ATOM 0 HG21 ILE A 527 -5.370 5.325 -0.990 1.00 0.00 H new ATOM 0 HG22 ILE A 527 -4.559 6.743 -0.286 1.00 0.00 H new ATOM 0 HG23 ILE A 527 -3.597 5.353 -0.842 1.00 0.00 H new ATOM 0 HD11 ILE A 527 -3.764 1.688 0.269 1.00 0.00 H new ATOM 0 HD12 ILE A 527 -3.317 3.135 -0.666 1.00 0.00 H new ATOM 0 HD13 ILE A 527 -2.703 2.922 0.990 1.00 0.00 H new ATOM 1452 N ARG A 528 -2.575 7.728 1.670 1.00 0.00 N ATOM 1453 CA ARG A 528 -2.401 9.166 1.912 1.00 0.00 C ATOM 1454 C ARG A 528 -2.131 9.897 0.584 1.00 0.00 C ATOM 1455 O ARG A 528 -0.967 10.035 0.192 1.00 0.00 O ATOM 1456 CB ARG A 528 -1.263 9.375 2.934 1.00 0.00 C ATOM 1457 CG ARG A 528 -1.535 8.946 4.389 1.00 0.00 C ATOM 1458 CD ARG A 528 -2.531 9.826 5.157 1.00 0.00 C ATOM 1459 NE ARG A 528 -3.920 9.569 4.742 1.00 0.00 N ATOM 1460 CZ ARG A 528 -5.011 10.207 5.138 1.00 0.00 C ATOM 1461 NH1 ARG A 528 -4.998 11.116 6.087 1.00 0.00 N ATOM 1462 NH2 ARG A 528 -6.161 9.912 4.575 1.00 0.00 N ATOM 0 H ARG A 528 -1.886 7.350 1.020 1.00 0.00 H new ATOM 0 HA ARG A 528 -3.313 9.590 2.332 1.00 0.00 H new ATOM 0 HB2 ARG A 528 -0.387 8.832 2.580 1.00 0.00 H new ATOM 0 HB3 ARG A 528 -1.002 10.433 2.937 1.00 0.00 H new ATOM 0 HG2 ARG A 528 -1.908 7.922 4.385 1.00 0.00 H new ATOM 0 HG3 ARG A 528 -0.589 8.938 4.931 1.00 0.00 H new ATOM 0 HD2 ARG A 528 -2.431 9.640 6.226 1.00 0.00 H new ATOM 0 HD3 ARG A 528 -2.291 10.876 4.992 1.00 0.00 H new ATOM 0 HE ARG A 528 -4.058 8.812 4.072 1.00 0.00 H new ATOM 0 HH11 ARG A 528 -4.122 11.356 6.552 1.00 0.00 H new ATOM 0 HH12 ARG A 528 -5.864 11.582 6.359 1.00 0.00 H new ATOM 0 HH21 ARG A 528 -6.204 9.201 3.845 1.00 0.00 H new ATOM 0 HH22 ARG A 528 -7.011 10.394 4.868 1.00 0.00 H new ATOM 1476 N PRO A 529 -3.190 10.351 -0.122 1.00 0.00 N ATOM 1477 CA PRO A 529 -3.070 11.180 -1.317 1.00 0.00 C ATOM 1478 C PRO A 529 -2.301 12.467 -1.012 1.00 0.00 C ATOM 1479 O PRO A 529 -2.547 13.108 0.012 1.00 0.00 O ATOM 1480 CB PRO A 529 -4.505 11.469 -1.773 1.00 0.00 C ATOM 1481 CG PRO A 529 -5.302 10.298 -1.203 1.00 0.00 C ATOM 1482 CD PRO A 529 -4.594 10.043 0.125 1.00 0.00 C ATOM 0 HA PRO A 529 -2.508 10.676 -2.103 1.00 0.00 H new ATOM 0 HB2 PRO A 529 -4.864 12.424 -1.389 1.00 0.00 H new ATOM 0 HB3 PRO A 529 -4.580 11.514 -2.859 1.00 0.00 H new ATOM 0 HG2 PRO A 529 -6.353 10.551 -1.062 1.00 0.00 H new ATOM 0 HG3 PRO A 529 -5.269 9.426 -1.856 1.00 0.00 H new ATOM 0 HD2 PRO A 529 -5.002 10.673 0.915 1.00 0.00 H new ATOM 0 HD3 PRO A 529 -4.719 9.009 0.445 1.00 0.00 H new ATOM 1490 N TRP A 530 -1.356 12.840 -1.879 1.00 0.00 N ATOM 1491 CA TRP A 530 -0.478 13.987 -1.646 1.00 0.00 C ATOM 1492 C TRP A 530 -1.213 15.323 -1.835 1.00 0.00 C ATOM 1493 O TRP A 530 -1.754 15.608 -2.906 1.00 0.00 O ATOM 1494 CB TRP A 530 0.753 13.883 -2.550 1.00 0.00 C ATOM 1495 CG TRP A 530 1.820 14.891 -2.256 1.00 0.00 C ATOM 1496 CD1 TRP A 530 1.975 16.081 -2.878 1.00 0.00 C ATOM 1497 CD2 TRP A 530 2.885 14.824 -1.258 1.00 0.00 C ATOM 1498 NE1 TRP A 530 3.068 16.743 -2.355 1.00 0.00 N ATOM 1499 CE2 TRP A 530 3.675 16.008 -1.359 1.00 0.00 C ATOM 1500 CE3 TRP A 530 3.280 13.867 -0.296 1.00 0.00 C ATOM 1501 CZ2 TRP A 530 4.807 16.225 -0.559 1.00 0.00 C ATOM 1502 CZ3 TRP A 530 4.414 14.076 0.513 1.00 0.00 C ATOM 1503 CH2 TRP A 530 5.178 15.250 0.382 1.00 0.00 C ATOM 0 H TRP A 530 -1.179 12.356 -2.759 1.00 0.00 H new ATOM 0 HA TRP A 530 -0.151 13.966 -0.606 1.00 0.00 H new ATOM 0 HB2 TRP A 530 1.177 12.884 -2.453 1.00 0.00 H new ATOM 0 HB3 TRP A 530 0.438 13.996 -3.587 1.00 0.00 H new ATOM 0 HD1 TRP A 530 1.339 16.457 -3.666 1.00 0.00 H new ATOM 0 HE1 TRP A 530 3.386 17.661 -2.666 1.00 0.00 H new ATOM 0 HE3 TRP A 530 2.703 12.961 -0.179 1.00 0.00 H new ATOM 0 HZ2 TRP A 530 5.386 17.130 -0.665 1.00 0.00 H new ATOM 0 HZ3 TRP A 530 4.699 13.329 1.239 1.00 0.00 H new ATOM 0 HH2 TRP A 530 6.048 15.401 1.004 1.00 0.00 H new ATOM 1514 N ASN A 531 -1.204 16.149 -0.787 1.00 0.00 N ATOM 1515 CA ASN A 531 -1.859 17.459 -0.702 1.00 0.00 C ATOM 1516 C ASN A 531 -1.246 18.255 0.471 1.00 0.00 C ATOM 1517 O ASN A 531 -1.035 17.704 1.556 1.00 0.00 O ATOM 1518 CB ASN A 531 -3.383 17.253 -0.552 1.00 0.00 C ATOM 1519 CG ASN A 531 -4.175 18.559 -0.585 1.00 0.00 C ATOM 1520 OD1 ASN A 531 -3.900 19.495 0.154 1.00 0.00 O ATOM 1521 ND2 ASN A 531 -5.175 18.674 -1.439 1.00 0.00 N ATOM 0 H ASN A 531 -0.712 15.910 0.074 1.00 0.00 H new ATOM 0 HA ASN A 531 -1.696 18.040 -1.610 1.00 0.00 H new ATOM 0 HB2 ASN A 531 -3.735 16.602 -1.352 1.00 0.00 H new ATOM 0 HB3 ASN A 531 -3.582 16.739 0.388 1.00 0.00 H new ATOM 0 HD21 ASN A 531 -5.713 19.539 -1.480 1.00 0.00 H new ATOM 0 HD22 ASN A 531 -5.409 17.898 -2.058 1.00 0.00 H new ATOM 1528 N LEU A 532 -0.922 19.536 0.248 1.00 0.00 N ATOM 1529 CA LEU A 532 -0.161 20.379 1.185 1.00 0.00 C ATOM 1530 C LEU A 532 -1.035 21.256 2.107 1.00 0.00 C ATOM 1531 O LEU A 532 -0.498 21.958 2.966 1.00 0.00 O ATOM 1532 CB LEU A 532 0.852 21.223 0.385 1.00 0.00 C ATOM 1533 CG LEU A 532 1.864 20.414 -0.459 1.00 0.00 C ATOM 1534 CD1 LEU A 532 2.817 21.390 -1.160 1.00 0.00 C ATOM 1535 CD2 LEU A 532 2.681 19.418 0.379 1.00 0.00 C ATOM 0 H LEU A 532 -1.186 20.027 -0.606 1.00 0.00 H new ATOM 0 HA LEU A 532 0.362 19.712 1.870 1.00 0.00 H new ATOM 0 HB2 LEU A 532 0.301 21.890 -0.279 1.00 0.00 H new ATOM 0 HB3 LEU A 532 1.406 21.853 1.081 1.00 0.00 H new ATOM 0 HG LEU A 532 1.295 19.830 -1.183 1.00 0.00 H new ATOM 0 HD11 LEU A 532 3.536 20.830 -1.759 1.00 0.00 H new ATOM 0 HD12 LEU A 532 2.245 22.055 -1.807 1.00 0.00 H new ATOM 0 HD13 LEU A 532 3.348 21.980 -0.413 1.00 0.00 H new ATOM 0 HD21 LEU A 532 3.374 18.880 -0.268 1.00 0.00 H new ATOM 0 HD22 LEU A 532 3.242 19.958 1.141 1.00 0.00 H new ATOM 0 HD23 LEU A 532 2.007 18.708 0.859 1.00 0.00 H new ATOM 1547 N SER A 533 -2.360 21.233 1.965 1.00 0.00 N ATOM 1548 CA SER A 533 -3.289 22.004 2.810 1.00 0.00 C ATOM 1549 C SER A 533 -3.487 21.385 4.210 1.00 0.00 C ATOM 1550 O SER A 533 -3.465 20.162 4.383 1.00 0.00 O ATOM 1551 CB SER A 533 -4.651 22.151 2.114 1.00 0.00 C ATOM 1552 OG SER A 533 -4.531 22.873 0.892 1.00 0.00 O ATOM 0 H SER A 533 -2.830 20.674 1.253 1.00 0.00 H new ATOM 0 HA SER A 533 -2.834 22.985 2.951 1.00 0.00 H new ATOM 0 HB2 SER A 533 -5.070 21.164 1.917 1.00 0.00 H new ATOM 0 HB3 SER A 533 -5.347 22.666 2.776 1.00 0.00 H new ATOM 0 HG SER A 533 -5.412 22.950 0.470 1.00 0.00 H new ATOM 1558 N ASP A 534 -3.707 22.233 5.222 1.00 0.00 N ATOM 1559 CA ASP A 534 -3.970 21.832 6.613 1.00 0.00 C ATOM 1560 C ASP A 534 -5.410 21.308 6.816 1.00 0.00 C ATOM 1561 O ASP A 534 -6.337 21.703 6.107 1.00 0.00 O ATOM 1562 CB ASP A 534 -3.675 23.035 7.528 1.00 0.00 C ATOM 1563 CG ASP A 534 -3.807 22.693 9.021 1.00 0.00 C ATOM 1564 OD1 ASP A 534 -3.154 21.723 9.473 1.00 0.00 O ATOM 1565 OD2 ASP A 534 -4.556 23.401 9.736 1.00 0.00 O ATOM 0 H ASP A 534 -3.707 23.245 5.094 1.00 0.00 H new ATOM 0 HA ASP A 534 -3.316 20.999 6.869 1.00 0.00 H new ATOM 0 HB2 ASP A 534 -2.666 23.397 7.331 1.00 0.00 H new ATOM 0 HB3 ASP A 534 -4.359 23.848 7.284 1.00 0.00 H new ATOM 1570 N SER A 535 -5.605 20.426 7.800 1.00 0.00 N ATOM 1571 CA SER A 535 -6.891 19.794 8.157 1.00 0.00 C ATOM 1572 C SER A 535 -6.881 19.267 9.606 1.00 0.00 C ATOM 1573 O SER A 535 -5.825 18.964 10.168 1.00 0.00 O ATOM 1574 CB SER A 535 -7.215 18.632 7.198 1.00 0.00 C ATOM 1575 OG SER A 535 -7.634 19.083 5.917 1.00 0.00 O ATOM 0 H SER A 535 -4.841 20.115 8.400 1.00 0.00 H new ATOM 0 HA SER A 535 -7.659 20.563 8.070 1.00 0.00 H new ATOM 0 HB2 SER A 535 -6.333 18.001 7.087 1.00 0.00 H new ATOM 0 HB3 SER A 535 -7.998 18.012 7.635 1.00 0.00 H new ATOM 0 HG SER A 535 -7.378 20.022 5.801 1.00 0.00 H new ATOM 1581 N ASP A 536 -8.064 19.134 10.218 1.00 0.00 N ATOM 1582 CA ASP A 536 -8.250 18.756 11.632 1.00 0.00 C ATOM 1583 C ASP A 536 -8.129 17.238 11.908 1.00 0.00 C ATOM 1584 O ASP A 536 -8.286 16.796 13.050 1.00 0.00 O ATOM 1585 CB ASP A 536 -9.611 19.289 12.112 1.00 0.00 C ATOM 1586 CG ASP A 536 -9.699 20.823 12.048 1.00 0.00 C ATOM 1587 OD1 ASP A 536 -9.205 21.493 12.987 1.00 0.00 O ATOM 1588 OD2 ASP A 536 -10.274 21.352 11.066 1.00 0.00 O ATOM 0 H ASP A 536 -8.947 19.290 9.732 1.00 0.00 H new ATOM 0 HA ASP A 536 -7.433 19.210 12.194 1.00 0.00 H new ATOM 0 HB2 ASP A 536 -10.403 18.857 11.500 1.00 0.00 H new ATOM 0 HB3 ASP A 536 -9.785 18.961 13.137 1.00 0.00 H new ATOM 1593 N PHE A 537 -7.852 16.428 10.881 1.00 0.00 N ATOM 1594 CA PHE A 537 -7.734 14.973 10.981 1.00 0.00 C ATOM 1595 C PHE A 537 -6.401 14.560 11.631 1.00 0.00 C ATOM 1596 O PHE A 537 -5.379 14.420 10.957 1.00 0.00 O ATOM 1597 CB PHE A 537 -7.926 14.346 9.590 1.00 0.00 C ATOM 1598 CG PHE A 537 -9.275 14.628 8.951 1.00 0.00 C ATOM 1599 CD1 PHE A 537 -10.461 14.185 9.574 1.00 0.00 C ATOM 1600 CD2 PHE A 537 -9.352 15.327 7.730 1.00 0.00 C ATOM 1601 CE1 PHE A 537 -11.710 14.444 8.983 1.00 0.00 C ATOM 1602 CE2 PHE A 537 -10.604 15.589 7.142 1.00 0.00 C ATOM 1603 CZ PHE A 537 -11.782 15.148 7.769 1.00 0.00 C ATOM 0 H PHE A 537 -7.700 16.777 9.934 1.00 0.00 H new ATOM 0 HA PHE A 537 -8.519 14.594 11.636 1.00 0.00 H new ATOM 0 HB2 PHE A 537 -7.141 14.713 8.929 1.00 0.00 H new ATOM 0 HB3 PHE A 537 -7.795 13.267 9.671 1.00 0.00 H new ATOM 0 HD1 PHE A 537 -10.409 13.645 10.508 1.00 0.00 H new ATOM 0 HD2 PHE A 537 -8.448 15.663 7.244 1.00 0.00 H new ATOM 0 HE1 PHE A 537 -12.615 14.102 9.463 1.00 0.00 H new ATOM 0 HE2 PHE A 537 -10.659 16.129 6.208 1.00 0.00 H new ATOM 0 HZ PHE A 537 -12.742 15.350 7.318 1.00 0.00 H new ATOM 1613 N VAL A 538 -6.426 14.345 12.949 1.00 0.00 N ATOM 1614 CA VAL A 538 -5.290 13.908 13.771 1.00 0.00 C ATOM 1615 C VAL A 538 -5.798 13.188 15.029 1.00 0.00 C ATOM 1616 O VAL A 538 -6.789 13.599 15.633 1.00 0.00 O ATOM 1617 CB VAL A 538 -4.339 15.086 14.101 1.00 0.00 C ATOM 1618 CG1 VAL A 538 -4.991 16.211 14.926 1.00 0.00 C ATOM 1619 CG2 VAL A 538 -3.081 14.583 14.823 1.00 0.00 C ATOM 0 H VAL A 538 -7.275 14.476 13.498 1.00 0.00 H new ATOM 0 HA VAL A 538 -4.696 13.195 13.199 1.00 0.00 H new ATOM 0 HB VAL A 538 -4.074 15.520 13.137 1.00 0.00 H new ATOM 0 HG11 VAL A 538 -4.258 16.996 15.114 1.00 0.00 H new ATOM 0 HG12 VAL A 538 -5.834 16.626 14.373 1.00 0.00 H new ATOM 0 HG13 VAL A 538 -5.343 15.809 15.876 1.00 0.00 H new ATOM 0 HG21 VAL A 538 -2.427 15.426 15.045 1.00 0.00 H new ATOM 0 HG22 VAL A 538 -3.367 14.091 15.753 1.00 0.00 H new ATOM 0 HG23 VAL A 538 -2.554 13.874 14.185 1.00 0.00 H new ATOM 1629 N MET A 539 -5.129 12.088 15.387 1.00 0.00 N ATOM 1630 CA MET A 539 -5.560 11.126 16.416 1.00 0.00 C ATOM 1631 C MET A 539 -4.393 10.468 17.181 1.00 0.00 C ATOM 1632 O MET A 539 -4.596 9.510 17.930 1.00 0.00 O ATOM 1633 CB MET A 539 -6.509 10.091 15.770 1.00 0.00 C ATOM 1634 CG MET A 539 -5.839 9.057 14.841 1.00 0.00 C ATOM 1635 SD MET A 539 -4.870 9.659 13.424 1.00 0.00 S ATOM 1636 CE MET A 539 -6.166 10.463 12.448 1.00 0.00 C ATOM 0 H MET A 539 -4.241 11.830 14.956 1.00 0.00 H new ATOM 0 HA MET A 539 -6.100 11.676 17.187 1.00 0.00 H new ATOM 0 HB2 MET A 539 -7.028 9.555 16.565 1.00 0.00 H new ATOM 0 HB3 MET A 539 -7.267 10.627 15.199 1.00 0.00 H new ATOM 0 HG2 MET A 539 -5.182 8.439 15.453 1.00 0.00 H new ATOM 0 HG3 MET A 539 -6.621 8.404 14.454 1.00 0.00 H new ATOM 0 HE1 MET A 539 -5.731 10.884 11.542 1.00 0.00 H new ATOM 0 HE2 MET A 539 -6.926 9.730 12.178 1.00 0.00 H new ATOM 0 HE3 MET A 539 -6.623 11.260 13.035 1.00 0.00 H new ATOM 1646 N ASP A 540 -3.168 10.975 17.001 1.00 0.00 N ATOM 1647 CA ASP A 540 -1.941 10.460 17.623 1.00 0.00 C ATOM 1648 C ASP A 540 -2.013 10.482 19.163 1.00 0.00 C ATOM 1649 O ASP A 540 -2.435 11.472 19.763 1.00 0.00 O ATOM 1650 CB ASP A 540 -0.740 11.274 17.119 1.00 0.00 C ATOM 1651 CG ASP A 540 0.585 10.724 17.672 1.00 0.00 C ATOM 1652 OD1 ASP A 540 1.140 9.782 17.060 1.00 0.00 O ATOM 1653 OD2 ASP A 540 1.054 11.222 18.722 1.00 0.00 O ATOM 0 H ASP A 540 -2.997 11.781 16.399 1.00 0.00 H new ATOM 0 HA ASP A 540 -1.824 9.415 17.334 1.00 0.00 H new ATOM 0 HB2 ASP A 540 -0.717 11.254 16.029 1.00 0.00 H new ATOM 0 HB3 ASP A 540 -0.855 12.316 17.416 1.00 0.00 H new ATOM 1658 N SER A 541 -1.617 9.369 19.793 1.00 0.00 N ATOM 1659 CA SER A 541 -1.615 9.137 21.256 1.00 0.00 C ATOM 1660 C SER A 541 -3.021 9.048 21.899 1.00 0.00 C ATOM 1661 O SER A 541 -3.134 8.808 23.106 1.00 0.00 O ATOM 1662 CB SER A 541 -0.727 10.159 21.995 1.00 0.00 C ATOM 1663 OG SER A 541 0.615 10.145 21.520 1.00 0.00 O ATOM 0 H SER A 541 -1.270 8.561 19.276 1.00 0.00 H new ATOM 0 HA SER A 541 -1.181 8.145 21.378 1.00 0.00 H new ATOM 0 HB2 SER A 541 -1.145 11.158 21.871 1.00 0.00 H new ATOM 0 HB3 SER A 541 -0.735 9.941 23.063 1.00 0.00 H new ATOM 0 HG SER A 541 0.649 10.540 20.624 1.00 0.00 H new ATOM 1669 N GLY A 542 -4.098 9.201 21.113 1.00 0.00 N ATOM 1670 CA GLY A 542 -5.495 9.118 21.563 1.00 0.00 C ATOM 1671 C GLY A 542 -6.004 10.376 22.295 1.00 0.00 C ATOM 1672 O GLY A 542 -5.252 11.343 22.468 1.00 0.00 O ATOM 0 H GLY A 542 -4.017 9.392 20.114 1.00 0.00 H new ATOM 0 HA2 GLY A 542 -6.132 8.933 20.698 1.00 0.00 H new ATOM 0 HA3 GLY A 542 -5.600 8.259 22.226 1.00 0.00 H new ATOM 1676 N PRO A 543 -7.286 10.380 22.717 1.00 0.00 N ATOM 1677 CA PRO A 543 -7.909 11.484 23.443 1.00 0.00 C ATOM 1678 C PRO A 543 -7.473 11.515 24.917 1.00 0.00 C ATOM 1679 O PRO A 543 -7.028 10.511 25.475 1.00 0.00 O ATOM 1680 CB PRO A 543 -9.416 11.244 23.305 1.00 0.00 C ATOM 1681 CG PRO A 543 -9.520 9.721 23.249 1.00 0.00 C ATOM 1682 CD PRO A 543 -8.261 9.322 22.478 1.00 0.00 C ATOM 0 HA PRO A 543 -7.612 12.452 23.040 1.00 0.00 H new ATOM 0 HB2 PRO A 543 -9.969 11.655 24.150 1.00 0.00 H new ATOM 0 HB3 PRO A 543 -9.818 11.709 22.405 1.00 0.00 H new ATOM 0 HG2 PRO A 543 -9.540 9.280 24.246 1.00 0.00 H new ATOM 0 HG3 PRO A 543 -10.427 9.396 22.738 1.00 0.00 H new ATOM 0 HD2 PRO A 543 -7.883 8.359 22.821 1.00 0.00 H new ATOM 0 HD3 PRO A 543 -8.472 9.220 21.413 1.00 0.00 H new ATOM 1690 N SER A 544 -7.637 12.670 25.564 1.00 0.00 N ATOM 1691 CA SER A 544 -7.271 12.906 26.973 1.00 0.00 C ATOM 1692 C SER A 544 -7.989 14.142 27.553 1.00 0.00 C ATOM 1693 O SER A 544 -8.149 15.160 26.876 1.00 0.00 O ATOM 1694 CB SER A 544 -5.741 13.044 27.127 1.00 0.00 C ATOM 1695 OG SER A 544 -5.170 14.053 26.296 1.00 0.00 O ATOM 0 H SER A 544 -8.039 13.493 25.115 1.00 0.00 H new ATOM 0 HA SER A 544 -7.601 12.038 27.543 1.00 0.00 H new ATOM 0 HB2 SER A 544 -5.508 13.268 28.168 1.00 0.00 H new ATOM 0 HB3 SER A 544 -5.274 12.087 26.895 1.00 0.00 H new ATOM 0 HG SER A 544 -4.202 14.089 26.443 1.00 0.00 H new ATOM 1701 N SER A 545 -8.429 14.072 28.814 1.00 0.00 N ATOM 1702 CA SER A 545 -9.239 15.124 29.464 1.00 0.00 C ATOM 1703 C SER A 545 -8.418 16.280 30.077 1.00 0.00 C ATOM 1704 O SER A 545 -8.994 17.276 30.529 1.00 0.00 O ATOM 1705 CB SER A 545 -10.124 14.491 30.555 1.00 0.00 C ATOM 1706 OG SER A 545 -10.867 13.372 30.074 1.00 0.00 O ATOM 0 H SER A 545 -8.234 13.278 29.424 1.00 0.00 H new ATOM 0 HA SER A 545 -9.841 15.570 28.672 1.00 0.00 H new ATOM 0 HB2 SER A 545 -9.497 14.176 31.389 1.00 0.00 H new ATOM 0 HB3 SER A 545 -10.813 15.242 30.941 1.00 0.00 H new ATOM 0 HG SER A 545 -11.411 13.004 30.801 1.00 0.00 H new ATOM 1712 N GLY A 546 -7.081 16.166 30.105 1.00 0.00 N ATOM 1713 CA GLY A 546 -6.154 17.151 30.686 1.00 0.00 C ATOM 1714 C GLY A 546 -4.686 16.742 30.559 1.00 0.00 C ATOM 1715 O GLY A 546 -4.325 15.660 31.074 1.00 0.00 O ATOM 1716 OXT GLY A 546 -3.908 17.507 29.949 1.00 0.00 O ATOM 0 H GLY A 546 -6.599 15.358 29.711 1.00 0.00 H new ATOM 0 HA2 GLY A 546 -6.301 18.113 30.195 1.00 0.00 H new ATOM 0 HA3 GLY A 546 -6.396 17.291 31.740 1.00 0.00 H new TER 1720 GLY A 546