USER MOD reduce.3.24.130724 H: found=0, std=0, add=612, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 614 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 Single : A 536 SER OG : rot 180:sc= 0 USER MOD Single : A 540 SER OG : rot -52:sc= 0.0621 USER MOD Single : A 544 THR OG1 : rot -130:sc= -1.06 USER MOD Single : A 570 SER OG : rot -65:sc= 0.84 USER MOD Single : B 536 SER OG : rot 180:sc= 0 USER MOD Single : B 540 SER OG : rot 64:sc= 0.0555 USER MOD Single : B 544 THR OG1 : rot 180:sc= -1.12 USER MOD Single : B 570 SER OG : rot 76:sc= 0.27 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 536 10.698 19.846 7.836 1.00 0.00 N ATOM 2 CA SER A 536 10.395 19.549 6.440 1.00 0.00 C ATOM 3 C SER A 536 11.559 19.943 5.536 1.00 0.00 C ATOM 4 O SER A 536 12.420 20.742 5.903 1.00 0.00 O ATOM 5 CB SER A 536 9.125 20.281 6.005 1.00 0.00 C ATOM 6 OG SER A 536 7.980 19.465 6.177 1.00 0.00 O ATOM 0 HA SER A 536 10.235 18.475 6.349 1.00 0.00 H new ATOM 0 HB2 SER A 536 9.013 21.197 6.585 1.00 0.00 H new ATOM 0 HB3 SER A 536 9.212 20.575 4.959 1.00 0.00 H new ATOM 0 HG SER A 536 7.182 19.957 5.893 1.00 0.00 H new ATOM 12 N PRO A 537 11.585 19.370 4.323 1.00 0.00 N ATOM 13 CA PRO A 537 12.637 19.647 3.341 1.00 0.00 C ATOM 14 C PRO A 537 12.548 21.061 2.778 1.00 0.00 C ATOM 15 O PRO A 537 11.561 21.771 2.974 1.00 0.00 O ATOM 16 CB PRO A 537 12.373 18.616 2.240 1.00 0.00 C ATOM 17 CG PRO A 537 10.922 18.301 2.356 1.00 0.00 C ATOM 18 CD PRO A 537 10.591 18.409 3.819 1.00 0.00 C ATOM 0 HA PRO A 537 13.632 19.579 3.780 1.00 0.00 H new ATOM 0 HB2 PRO A 537 12.613 19.018 1.256 1.00 0.00 H new ATOM 0 HB3 PRO A 537 12.984 17.724 2.378 1.00 0.00 H new ATOM 0 HG2 PRO A 537 10.323 18.997 1.768 1.00 0.00 H new ATOM 0 HG3 PRO A 537 10.709 17.300 1.980 1.00 0.00 H new ATOM 0 HD2 PRO A 537 9.573 18.765 3.975 1.00 0.00 H new ATOM 0 HD3 PRO A 537 10.673 17.445 4.322 1.00 0.00 H new ATOM 26 N PRO A 538 13.602 21.481 2.063 1.00 0.00 N ATOM 27 CA PRO A 538 13.666 22.815 1.456 1.00 0.00 C ATOM 28 C PRO A 538 12.689 22.971 0.295 1.00 0.00 C ATOM 29 O PRO A 538 12.544 24.057 -0.265 1.00 0.00 O ATOM 30 CB PRO A 538 15.109 22.909 0.957 1.00 0.00 C ATOM 31 CG PRO A 538 15.529 21.496 0.745 1.00 0.00 C ATOM 32 CD PRO A 538 14.811 20.688 1.790 1.00 0.00 C ATOM 0 HA PRO A 538 13.394 23.598 2.164 1.00 0.00 H new ATOM 0 HB2 PRO A 538 15.172 23.484 0.033 1.00 0.00 H new ATOM 0 HB3 PRO A 538 15.748 23.407 1.686 1.00 0.00 H new ATOM 0 HG2 PRO A 538 15.267 21.158 -0.258 1.00 0.00 H new ATOM 0 HG3 PRO A 538 16.609 21.391 0.845 1.00 0.00 H new ATOM 0 HD2 PRO A 538 14.564 19.690 1.427 1.00 0.00 H new ATOM 0 HD3 PRO A 538 15.418 20.560 2.686 1.00 0.00 H new ATOM 40 N VAL A 539 12.022 21.878 -0.063 1.00 0.00 N ATOM 41 CA VAL A 539 11.059 21.894 -1.156 1.00 0.00 C ATOM 42 C VAL A 539 11.752 22.123 -2.496 1.00 0.00 C ATOM 43 O VAL A 539 12.839 22.696 -2.553 1.00 0.00 O ATOM 44 CB VAL A 539 9.992 22.985 -0.949 1.00 0.00 C ATOM 45 CG1 VAL A 539 8.831 22.786 -1.912 1.00 0.00 C ATOM 46 CG2 VAL A 539 9.506 22.988 0.491 1.00 0.00 C ATOM 0 H VAL A 539 12.132 20.970 0.389 1.00 0.00 H new ATOM 0 HA VAL A 539 10.573 20.918 -1.163 1.00 0.00 H new ATOM 0 HB VAL A 539 10.444 23.955 -1.158 1.00 0.00 H new ATOM 0 HG11 VAL A 539 8.087 23.566 -1.751 1.00 0.00 H new ATOM 0 HG12 VAL A 539 9.196 22.839 -2.938 1.00 0.00 H new ATOM 0 HG13 VAL A 539 8.377 21.810 -1.738 1.00 0.00 H new ATOM 0 HG21 VAL A 539 8.753 23.765 0.619 1.00 0.00 H new ATOM 0 HG22 VAL A 539 9.071 22.018 0.730 1.00 0.00 H new ATOM 0 HG23 VAL A 539 10.346 23.183 1.158 1.00 0.00 H new ATOM 56 N SER A 540 11.113 21.673 -3.571 1.00 0.00 N ATOM 57 CA SER A 540 11.670 21.825 -4.910 1.00 0.00 C ATOM 58 C SER A 540 12.964 21.032 -5.054 1.00 0.00 C ATOM 59 O SER A 540 13.800 21.337 -5.906 1.00 0.00 O ATOM 60 CB SER A 540 11.927 23.303 -5.213 1.00 0.00 C ATOM 61 OG SER A 540 11.977 23.537 -6.610 1.00 0.00 O ATOM 0 H SER A 540 10.210 21.200 -3.541 1.00 0.00 H new ATOM 0 HA SER A 540 10.945 21.435 -5.625 1.00 0.00 H new ATOM 0 HB2 SER A 540 11.140 23.911 -4.767 1.00 0.00 H new ATOM 0 HB3 SER A 540 12.866 23.613 -4.755 1.00 0.00 H new ATOM 0 HG SER A 540 12.609 22.913 -7.024 1.00 0.00 H new ATOM 67 N ARG A 541 13.124 20.013 -4.215 1.00 0.00 N ATOM 68 CA ARG A 541 14.316 19.176 -4.248 1.00 0.00 C ATOM 69 C ARG A 541 13.950 17.717 -4.505 1.00 0.00 C ATOM 70 O ARG A 541 14.567 16.805 -3.958 1.00 0.00 O ATOM 71 CB ARG A 541 15.084 19.295 -2.930 1.00 0.00 C ATOM 72 CG ARG A 541 15.838 20.606 -2.781 1.00 0.00 C ATOM 73 CD ARG A 541 16.883 20.776 -3.872 1.00 0.00 C ATOM 74 NE ARG A 541 16.679 21.999 -4.642 1.00 0.00 N ATOM 75 CZ ARG A 541 16.985 23.211 -4.192 1.00 0.00 C ATOM 76 NH1 ARG A 541 17.509 23.360 -2.982 1.00 0.00 N ATOM 77 NH2 ARG A 541 16.769 24.277 -4.952 1.00 0.00 N ATOM 0 H ARG A 541 12.442 19.748 -3.504 1.00 0.00 H new ATOM 0 HA ARG A 541 14.950 19.522 -5.064 1.00 0.00 H new ATOM 0 HB2 ARG A 541 14.384 19.192 -2.101 1.00 0.00 H new ATOM 0 HB3 ARG A 541 15.791 18.469 -2.855 1.00 0.00 H new ATOM 0 HG2 ARG A 541 15.134 21.438 -2.817 1.00 0.00 H new ATOM 0 HG3 ARG A 541 16.321 20.640 -1.805 1.00 0.00 H new ATOM 0 HD2 ARG A 541 17.876 20.792 -3.423 1.00 0.00 H new ATOM 0 HD3 ARG A 541 16.850 19.917 -4.542 1.00 0.00 H new ATOM 0 HE ARG A 541 16.280 21.919 -5.577 1.00 0.00 H new ATOM 0 HH11 ARG A 541 17.678 22.543 -2.395 1.00 0.00 H new ATOM 0 HH12 ARG A 541 17.743 24.292 -2.639 1.00 0.00 H new ATOM 0 HH21 ARG A 541 16.367 24.167 -5.883 1.00 0.00 H new ATOM 0 HH22 ARG A 541 17.004 25.207 -4.605 1.00 0.00 H new ATOM 91 N GLY A 542 12.940 17.505 -5.345 1.00 0.00 N ATOM 92 CA GLY A 542 12.508 16.156 -5.659 1.00 0.00 C ATOM 93 C GLY A 542 12.034 15.398 -4.436 1.00 0.00 C ATOM 94 O GLY A 542 11.927 14.172 -4.458 1.00 0.00 O ATOM 0 H GLY A 542 12.414 18.243 -5.813 1.00 0.00 H new ATOM 0 HA2 GLY A 542 11.702 16.198 -6.391 1.00 0.00 H new ATOM 0 HA3 GLY A 542 13.332 15.613 -6.122 1.00 0.00 H new ATOM 98 N LEU A 543 11.749 16.129 -3.363 1.00 0.00 N ATOM 99 CA LEU A 543 11.285 15.518 -2.122 1.00 0.00 C ATOM 100 C LEU A 543 10.544 16.534 -1.259 1.00 0.00 C ATOM 101 O LEU A 543 11.092 17.576 -0.897 1.00 0.00 O ATOM 102 CB LEU A 543 12.466 14.936 -1.344 1.00 0.00 C ATOM 103 CG LEU A 543 12.116 14.157 -0.076 1.00 0.00 C ATOM 104 CD1 LEU A 543 11.794 15.109 1.065 1.00 0.00 C ATOM 105 CD2 LEU A 543 10.946 13.216 -0.333 1.00 0.00 C ATOM 0 H LEU A 543 11.831 17.145 -3.328 1.00 0.00 H new ATOM 0 HA LEU A 543 10.595 14.714 -2.378 1.00 0.00 H new ATOM 0 HB2 LEU A 543 13.024 14.277 -2.009 1.00 0.00 H new ATOM 0 HB3 LEU A 543 13.134 15.753 -1.072 1.00 0.00 H new ATOM 0 HG LEU A 543 12.982 13.560 0.210 1.00 0.00 H new ATOM 0 HD11 LEU A 543 11.547 14.536 1.959 1.00 0.00 H new ATOM 0 HD12 LEU A 543 12.659 15.741 1.267 1.00 0.00 H new ATOM 0 HD13 LEU A 543 10.945 15.734 0.789 1.00 0.00 H new ATOM 0 HD21 LEU A 543 10.711 12.670 0.581 1.00 0.00 H new ATOM 0 HD22 LEU A 543 10.076 13.794 -0.644 1.00 0.00 H new ATOM 0 HD23 LEU A 543 11.213 12.510 -1.119 1.00 0.00 H new ATOM 117 N THR A 544 9.294 16.223 -0.929 1.00 0.00 N ATOM 118 CA THR A 544 8.478 17.109 -0.108 1.00 0.00 C ATOM 119 C THR A 544 7.618 16.314 0.868 1.00 0.00 C ATOM 120 O THR A 544 7.375 15.124 0.671 1.00 0.00 O ATOM 121 CB THR A 544 7.565 17.996 -0.975 1.00 0.00 C ATOM 122 OG1 THR A 544 6.254 17.424 -1.050 1.00 0.00 O ATOM 123 CG2 THR A 544 8.135 18.154 -2.376 1.00 0.00 C ATOM 0 H THR A 544 8.825 15.364 -1.218 1.00 0.00 H new ATOM 0 HA THR A 544 9.164 17.745 0.451 1.00 0.00 H new ATOM 0 HB THR A 544 7.506 18.981 -0.511 1.00 0.00 H new ATOM 0 HG1 THR A 544 5.969 17.380 -1.987 1.00 0.00 H new ATOM 0 HG21 THR A 544 7.473 18.784 -2.969 1.00 0.00 H new ATOM 0 HG22 THR A 544 9.120 18.616 -2.318 1.00 0.00 H new ATOM 0 HG23 THR A 544 8.221 17.174 -2.846 1.00 0.00 H new ATOM 131 N GLY A 545 7.157 16.982 1.922 1.00 0.00 N ATOM 132 CA GLY A 545 6.328 16.321 2.914 1.00 0.00 C ATOM 133 C GLY A 545 5.165 15.574 2.292 1.00 0.00 C ATOM 134 O GLY A 545 4.882 14.435 2.660 1.00 0.00 O ATOM 0 H GLY A 545 7.343 17.968 2.106 1.00 0.00 H new ATOM 0 HA2 GLY A 545 6.939 15.624 3.487 1.00 0.00 H new ATOM 0 HA3 GLY A 545 5.946 17.062 3.616 1.00 0.00 H new ATOM 138 N GLY A 546 4.486 16.219 1.347 1.00 0.00 N ATOM 139 CA GLY A 546 3.354 15.593 0.689 1.00 0.00 C ATOM 140 C GLY A 546 3.743 14.339 -0.067 1.00 0.00 C ATOM 141 O GLY A 546 2.953 13.402 -0.177 1.00 0.00 O ATOM 0 H GLY A 546 4.700 17.163 1.026 1.00 0.00 H new ATOM 0 HA2 GLY A 546 2.597 15.345 1.433 1.00 0.00 H new ATOM 0 HA3 GLY A 546 2.901 16.304 -0.002 1.00 0.00 H new ATOM 145 N GLU A 547 4.964 14.320 -0.592 1.00 0.00 N ATOM 146 CA GLU A 547 5.456 13.172 -1.345 1.00 0.00 C ATOM 147 C GLU A 547 5.653 11.967 -0.431 1.00 0.00 C ATOM 148 O GLU A 547 5.312 10.840 -0.790 1.00 0.00 O ATOM 149 CB GLU A 547 6.772 13.517 -2.044 1.00 0.00 C ATOM 150 CG GLU A 547 6.779 14.897 -2.681 1.00 0.00 C ATOM 151 CD GLU A 547 7.652 14.963 -3.919 1.00 0.00 C ATOM 152 OE1 GLU A 547 8.868 15.213 -3.775 1.00 0.00 O ATOM 153 OE2 GLU A 547 7.122 14.765 -5.032 1.00 0.00 O ATOM 0 H GLU A 547 5.631 15.087 -0.510 1.00 0.00 H new ATOM 0 HA GLU A 547 4.710 12.917 -2.098 1.00 0.00 H new ATOM 0 HB2 GLU A 547 7.585 13.456 -1.320 1.00 0.00 H new ATOM 0 HB3 GLU A 547 6.972 12.770 -2.812 1.00 0.00 H new ATOM 0 HG2 GLU A 547 5.759 15.177 -2.945 1.00 0.00 H new ATOM 0 HG3 GLU A 547 7.132 15.628 -1.953 1.00 0.00 H new ATOM 160 N ILE A 548 6.207 12.213 0.752 1.00 0.00 N ATOM 161 CA ILE A 548 6.451 11.148 1.718 1.00 0.00 C ATOM 162 C ILE A 548 5.140 10.551 2.219 1.00 0.00 C ATOM 163 O ILE A 548 4.923 9.342 2.132 1.00 0.00 O ATOM 164 CB ILE A 548 7.264 11.657 2.923 1.00 0.00 C ATOM 165 CG1 ILE A 548 8.707 11.948 2.506 1.00 0.00 C ATOM 166 CG2 ILE A 548 7.228 10.639 4.053 1.00 0.00 C ATOM 167 CD1 ILE A 548 8.995 13.420 2.315 1.00 0.00 C ATOM 0 H ILE A 548 6.495 13.140 1.065 1.00 0.00 H new ATOM 0 HA ILE A 548 7.025 10.378 1.202 1.00 0.00 H new ATOM 0 HB ILE A 548 6.816 12.584 3.280 1.00 0.00 H new ATOM 0 HG12 ILE A 548 9.383 11.549 3.262 1.00 0.00 H new ATOM 0 HG13 ILE A 548 8.922 11.420 1.577 1.00 0.00 H new ATOM 0 HG21 ILE A 548 7.807 11.012 4.898 1.00 0.00 H new ATOM 0 HG22 ILE A 548 6.196 10.477 4.364 1.00 0.00 H new ATOM 0 HG23 ILE A 548 7.655 9.697 3.708 1.00 0.00 H new ATOM 0 HD11 ILE A 548 10.036 13.552 2.020 1.00 0.00 H new ATOM 0 HD12 ILE A 548 8.344 13.820 1.538 1.00 0.00 H new ATOM 0 HD13 ILE A 548 8.813 13.951 3.249 1.00 0.00 H new ATOM 179 N VAL A 549 4.267 11.407 2.741 1.00 0.00 N ATOM 180 CA VAL A 549 2.976 10.965 3.254 1.00 0.00 C ATOM 181 C VAL A 549 2.161 10.273 2.166 1.00 0.00 C ATOM 182 O VAL A 549 1.363 9.379 2.447 1.00 0.00 O ATOM 183 CB VAL A 549 2.163 12.143 3.818 1.00 0.00 C ATOM 184 CG1 VAL A 549 3.041 13.030 4.688 1.00 0.00 C ATOM 185 CG2 VAL A 549 1.533 12.945 2.690 1.00 0.00 C ATOM 0 H VAL A 549 4.431 12.411 2.820 1.00 0.00 H new ATOM 0 HA VAL A 549 3.180 10.257 4.058 1.00 0.00 H new ATOM 0 HB VAL A 549 1.362 11.744 4.440 1.00 0.00 H new ATOM 0 HG11 VAL A 549 2.449 13.858 5.078 1.00 0.00 H new ATOM 0 HG12 VAL A 549 3.439 12.446 5.518 1.00 0.00 H new ATOM 0 HG13 VAL A 549 3.865 13.423 4.092 1.00 0.00 H new ATOM 0 HG21 VAL A 549 0.962 13.774 3.108 1.00 0.00 H new ATOM 0 HG22 VAL A 549 2.316 13.335 2.040 1.00 0.00 H new ATOM 0 HG23 VAL A 549 0.869 12.302 2.113 1.00 0.00 H new ATOM 195 N ALA A 550 2.367 10.695 0.923 1.00 0.00 N ATOM 196 CA ALA A 550 1.653 10.115 -0.209 1.00 0.00 C ATOM 197 C ALA A 550 2.096 8.678 -0.459 1.00 0.00 C ATOM 198 O ALA A 550 1.267 7.780 -0.614 1.00 0.00 O ATOM 199 CB ALA A 550 1.866 10.959 -1.456 1.00 0.00 C ATOM 0 H ALA A 550 3.022 11.436 0.674 1.00 0.00 H new ATOM 0 HA ALA A 550 0.590 10.104 0.031 1.00 0.00 H new ATOM 0 HB1 ALA A 550 1.327 10.514 -2.293 1.00 0.00 H new ATOM 0 HB2 ALA A 550 1.494 11.968 -1.280 1.00 0.00 H new ATOM 0 HB3 ALA A 550 2.930 11.000 -1.690 1.00 0.00 H new ATOM 205 N VAL A 551 3.407 8.465 -0.497 1.00 0.00 N ATOM 206 CA VAL A 551 3.960 7.136 -0.728 1.00 0.00 C ATOM 207 C VAL A 551 3.490 6.151 0.338 1.00 0.00 C ATOM 208 O VAL A 551 3.054 5.044 0.024 1.00 0.00 O ATOM 209 CB VAL A 551 5.501 7.163 -0.740 1.00 0.00 C ATOM 210 CG1 VAL A 551 6.060 5.748 -0.736 1.00 0.00 C ATOM 211 CG2 VAL A 551 6.010 7.943 -1.943 1.00 0.00 C ATOM 0 H VAL A 551 4.107 9.196 -0.371 1.00 0.00 H new ATOM 0 HA VAL A 551 3.601 6.810 -1.704 1.00 0.00 H new ATOM 0 HB VAL A 551 5.846 7.666 0.163 1.00 0.00 H new ATOM 0 HG11 VAL A 551 7.149 5.787 -0.745 1.00 0.00 H new ATOM 0 HG12 VAL A 551 5.723 5.226 0.159 1.00 0.00 H new ATOM 0 HG13 VAL A 551 5.709 5.216 -1.620 1.00 0.00 H new ATOM 0 HG21 VAL A 551 7.100 7.952 -1.936 1.00 0.00 H new ATOM 0 HG22 VAL A 551 5.657 7.470 -2.859 1.00 0.00 H new ATOM 0 HG23 VAL A 551 5.638 8.967 -1.897 1.00 0.00 H new ATOM 221 N ILE A 552 3.579 6.564 1.598 1.00 0.00 N ATOM 222 CA ILE A 552 3.160 5.719 2.709 1.00 0.00 C ATOM 223 C ILE A 552 1.655 5.478 2.679 1.00 0.00 C ATOM 224 O ILE A 552 1.175 4.433 3.119 1.00 0.00 O ATOM 225 CB ILE A 552 3.542 6.343 4.065 1.00 0.00 C ATOM 226 CG1 ILE A 552 3.104 5.430 5.211 1.00 0.00 C ATOM 227 CG2 ILE A 552 2.915 7.721 4.209 1.00 0.00 C ATOM 228 CD1 ILE A 552 3.492 5.949 6.578 1.00 0.00 C ATOM 0 H ILE A 552 3.937 7.478 1.875 1.00 0.00 H new ATOM 0 HA ILE A 552 3.680 4.768 2.596 1.00 0.00 H new ATOM 0 HB ILE A 552 4.626 6.453 4.106 1.00 0.00 H new ATOM 0 HG12 ILE A 552 2.022 5.305 5.172 1.00 0.00 H new ATOM 0 HG13 ILE A 552 3.544 4.443 5.067 1.00 0.00 H new ATOM 0 HG21 ILE A 552 3.194 8.149 5.172 1.00 0.00 H new ATOM 0 HG22 ILE A 552 3.271 8.368 3.407 1.00 0.00 H new ATOM 0 HG23 ILE A 552 1.830 7.635 4.151 1.00 0.00 H new ATOM 0 HD11 ILE A 552 3.150 5.252 7.343 1.00 0.00 H new ATOM 0 HD12 ILE A 552 4.576 6.047 6.636 1.00 0.00 H new ATOM 0 HD13 ILE A 552 3.030 6.923 6.742 1.00 0.00 H new ATOM 240 N PHE A 553 0.916 6.450 2.156 1.00 0.00 N ATOM 241 CA PHE A 553 -0.536 6.342 2.066 1.00 0.00 C ATOM 242 C PHE A 553 -0.941 5.232 1.102 1.00 0.00 C ATOM 243 O PHE A 553 -1.738 4.359 1.443 1.00 0.00 O ATOM 244 CB PHE A 553 -1.140 7.672 1.613 1.00 0.00 C ATOM 245 CG PHE A 553 -2.598 7.813 1.945 1.00 0.00 C ATOM 246 CD1 PHE A 553 -3.533 6.950 1.395 1.00 0.00 C ATOM 247 CD2 PHE A 553 -3.035 8.807 2.806 1.00 0.00 C ATOM 248 CE1 PHE A 553 -4.876 7.078 1.699 1.00 0.00 C ATOM 249 CE2 PHE A 553 -4.376 8.939 3.112 1.00 0.00 C ATOM 250 CZ PHE A 553 -5.297 8.073 2.559 1.00 0.00 C ATOM 0 H PHE A 553 1.298 7.321 1.788 1.00 0.00 H new ATOM 0 HA PHE A 553 -0.919 6.095 3.056 1.00 0.00 H new ATOM 0 HB2 PHE A 553 -0.589 8.489 2.078 1.00 0.00 H new ATOM 0 HB3 PHE A 553 -1.010 7.773 0.536 1.00 0.00 H new ATOM 0 HD1 PHE A 553 -3.209 6.170 0.722 1.00 0.00 H new ATOM 0 HD2 PHE A 553 -2.319 9.487 3.243 1.00 0.00 H new ATOM 0 HE1 PHE A 553 -5.595 6.400 1.264 1.00 0.00 H new ATOM 0 HE2 PHE A 553 -4.703 9.719 3.783 1.00 0.00 H new ATOM 0 HZ PHE A 553 -6.345 8.173 2.798 1.00 0.00 H new ATOM 260 N GLY A 554 -0.385 5.273 -0.106 1.00 0.00 N ATOM 261 CA GLY A 554 -0.701 4.266 -1.102 1.00 0.00 C ATOM 262 C GLY A 554 -0.020 2.941 -0.823 1.00 0.00 C ATOM 263 O GLY A 554 -0.543 1.881 -1.168 1.00 0.00 O ATOM 0 H GLY A 554 0.278 5.985 -0.412 1.00 0.00 H new ATOM 0 HA2 GLY A 554 -1.780 4.117 -1.134 1.00 0.00 H new ATOM 0 HA3 GLY A 554 -0.400 4.626 -2.086 1.00 0.00 H new ATOM 267 N LEU A 555 1.151 2.999 -0.198 1.00 0.00 N ATOM 268 CA LEU A 555 1.906 1.794 0.126 1.00 0.00 C ATOM 269 C LEU A 555 1.227 1.010 1.244 1.00 0.00 C ATOM 270 O LEU A 555 1.097 -0.213 1.169 1.00 0.00 O ATOM 271 CB LEU A 555 3.334 2.158 0.538 1.00 0.00 C ATOM 272 CG LEU A 555 4.107 1.082 1.300 1.00 0.00 C ATOM 273 CD1 LEU A 555 4.217 -0.186 0.468 1.00 0.00 C ATOM 274 CD2 LEU A 555 5.489 1.591 1.684 1.00 0.00 C ATOM 0 H LEU A 555 1.598 3.868 0.094 1.00 0.00 H new ATOM 0 HA LEU A 555 1.940 1.166 -0.764 1.00 0.00 H new ATOM 0 HB2 LEU A 555 3.896 2.413 -0.360 1.00 0.00 H new ATOM 0 HB3 LEU A 555 3.295 3.055 1.156 1.00 0.00 H new ATOM 0 HG LEU A 555 3.561 0.847 2.213 1.00 0.00 H new ATOM 0 HD11 LEU A 555 4.770 -0.941 1.027 1.00 0.00 H new ATOM 0 HD12 LEU A 555 3.219 -0.561 0.242 1.00 0.00 H new ATOM 0 HD13 LEU A 555 4.741 0.034 -0.462 1.00 0.00 H new ATOM 0 HD21 LEU A 555 6.026 0.812 2.226 1.00 0.00 H new ATOM 0 HD22 LEU A 555 6.043 1.854 0.783 1.00 0.00 H new ATOM 0 HD23 LEU A 555 5.389 2.472 2.319 1.00 0.00 H new ATOM 286 N LEU A 556 0.792 1.721 2.278 1.00 0.00 N ATOM 287 CA LEU A 556 0.123 1.091 3.412 1.00 0.00 C ATOM 288 C LEU A 556 -1.257 0.578 3.013 1.00 0.00 C ATOM 289 O LEU A 556 -1.538 -0.617 3.109 1.00 0.00 O ATOM 290 CB LEU A 556 -0.005 2.084 4.569 1.00 0.00 C ATOM 291 CG LEU A 556 1.263 2.322 5.392 1.00 0.00 C ATOM 292 CD1 LEU A 556 0.999 3.333 6.497 1.00 0.00 C ATOM 293 CD2 LEU A 556 1.773 1.011 5.976 1.00 0.00 C ATOM 0 H LEU A 556 0.890 2.733 2.355 1.00 0.00 H new ATOM 0 HA LEU A 556 0.727 0.243 3.734 1.00 0.00 H new ATOM 0 HB2 LEU A 556 -0.337 3.041 4.166 1.00 0.00 H new ATOM 0 HB3 LEU A 556 -0.789 1.731 5.239 1.00 0.00 H new ATOM 0 HG LEU A 556 2.031 2.727 4.733 1.00 0.00 H new ATOM 0 HD11 LEU A 556 1.912 3.490 7.072 1.00 0.00 H new ATOM 0 HD12 LEU A 556 0.680 4.278 6.057 1.00 0.00 H new ATOM 0 HD13 LEU A 556 0.216 2.957 7.155 1.00 0.00 H new ATOM 0 HD21 LEU A 556 2.675 1.199 6.558 1.00 0.00 H new ATOM 0 HD22 LEU A 556 1.008 0.578 6.621 1.00 0.00 H new ATOM 0 HD23 LEU A 556 2.001 0.317 5.167 1.00 0.00 H new ATOM 305 N LEU A 557 -2.114 1.489 2.565 1.00 0.00 N ATOM 306 CA LEU A 557 -3.465 1.128 2.149 1.00 0.00 C ATOM 307 C LEU A 557 -3.431 0.155 0.975 1.00 0.00 C ATOM 308 O LEU A 557 -4.339 -0.657 0.802 1.00 0.00 O ATOM 309 CB LEU A 557 -4.253 2.381 1.764 1.00 0.00 C ATOM 310 CG LEU A 557 -4.839 3.187 2.924 1.00 0.00 C ATOM 311 CD1 LEU A 557 -3.765 4.047 3.573 1.00 0.00 C ATOM 312 CD2 LEU A 557 -5.997 4.049 2.443 1.00 0.00 C ATOM 0 H LEU A 557 -1.898 2.482 2.481 1.00 0.00 H new ATOM 0 HA LEU A 557 -3.959 0.639 2.989 1.00 0.00 H new ATOM 0 HB2 LEU A 557 -3.599 3.035 1.187 1.00 0.00 H new ATOM 0 HB3 LEU A 557 -5.069 2.085 1.105 1.00 0.00 H new ATOM 0 HG LEU A 557 -5.217 2.490 3.671 1.00 0.00 H new ATOM 0 HD11 LEU A 557 -4.201 4.613 4.396 1.00 0.00 H new ATOM 0 HD12 LEU A 557 -2.968 3.408 3.954 1.00 0.00 H new ATOM 0 HD13 LEU A 557 -3.356 4.737 2.835 1.00 0.00 H new ATOM 0 HD21 LEU A 557 -6.402 4.616 3.282 1.00 0.00 H new ATOM 0 HD22 LEU A 557 -5.643 4.738 1.676 1.00 0.00 H new ATOM 0 HD23 LEU A 557 -6.777 3.411 2.026 1.00 0.00 H new ATOM 324 N GLY A 558 -2.375 0.242 0.170 1.00 0.00 N ATOM 325 CA GLY A 558 -2.242 -0.638 -0.976 1.00 0.00 C ATOM 326 C GLY A 558 -2.067 -2.089 -0.576 1.00 0.00 C ATOM 327 O GLY A 558 -2.909 -2.932 -0.884 1.00 0.00 O ATOM 0 H GLY A 558 -1.610 0.906 0.292 1.00 0.00 H new ATOM 0 HA2 GLY A 558 -3.125 -0.543 -1.608 1.00 0.00 H new ATOM 0 HA3 GLY A 558 -1.387 -0.324 -1.574 1.00 0.00 H new ATOM 331 N ALA A 559 -0.967 -2.383 0.111 1.00 0.00 N ATOM 332 CA ALA A 559 -0.683 -3.743 0.553 1.00 0.00 C ATOM 333 C ALA A 559 -1.725 -4.220 1.561 1.00 0.00 C ATOM 334 O ALA A 559 -2.170 -5.367 1.511 1.00 0.00 O ATOM 335 CB ALA A 559 0.711 -3.821 1.157 1.00 0.00 C ATOM 0 H ALA A 559 -0.259 -1.698 0.373 1.00 0.00 H new ATOM 0 HA ALA A 559 -0.728 -4.399 -0.316 1.00 0.00 H new ATOM 0 HB1 ALA A 559 0.910 -4.842 1.483 1.00 0.00 H new ATOM 0 HB2 ALA A 559 1.448 -3.529 0.409 1.00 0.00 H new ATOM 0 HB3 ALA A 559 0.775 -3.148 2.012 1.00 0.00 H new ATOM 341 N ALA A 560 -2.109 -3.334 2.473 1.00 0.00 N ATOM 342 CA ALA A 560 -3.099 -3.665 3.490 1.00 0.00 C ATOM 343 C ALA A 560 -4.354 -4.262 2.862 1.00 0.00 C ATOM 344 O ALA A 560 -4.735 -5.394 3.164 1.00 0.00 O ATOM 345 CB ALA A 560 -3.452 -2.430 4.306 1.00 0.00 C ATOM 0 H ALA A 560 -1.750 -2.381 2.529 1.00 0.00 H new ATOM 0 HA ALA A 560 -2.665 -4.413 4.153 1.00 0.00 H new ATOM 0 HB1 ALA A 560 -4.192 -2.693 5.062 1.00 0.00 H new ATOM 0 HB2 ALA A 560 -2.555 -2.048 4.794 1.00 0.00 H new ATOM 0 HB3 ALA A 560 -3.861 -1.664 3.648 1.00 0.00 H new ATOM 351 N LEU A 561 -4.994 -3.495 1.986 1.00 0.00 N ATOM 352 CA LEU A 561 -6.206 -3.948 1.314 1.00 0.00 C ATOM 353 C LEU A 561 -5.940 -5.209 0.500 1.00 0.00 C ATOM 354 O LEU A 561 -6.788 -6.099 0.417 1.00 0.00 O ATOM 355 CB LEU A 561 -6.752 -2.845 0.405 1.00 0.00 C ATOM 356 CG LEU A 561 -8.224 -2.967 0.012 1.00 0.00 C ATOM 357 CD1 LEU A 561 -9.120 -2.723 1.216 1.00 0.00 C ATOM 358 CD2 LEU A 561 -8.559 -1.993 -1.109 1.00 0.00 C ATOM 0 H LEU A 561 -4.693 -2.556 1.725 1.00 0.00 H new ATOM 0 HA LEU A 561 -6.948 -4.182 2.077 1.00 0.00 H new ATOM 0 HB2 LEU A 561 -6.608 -1.886 0.904 1.00 0.00 H new ATOM 0 HB3 LEU A 561 -6.154 -2.823 -0.506 1.00 0.00 H new ATOM 0 HG LEU A 561 -8.401 -3.980 -0.348 1.00 0.00 H new ATOM 0 HD11 LEU A 561 -10.164 -2.814 0.917 1.00 0.00 H new ATOM 0 HD12 LEU A 561 -8.899 -3.459 1.989 1.00 0.00 H new ATOM 0 HD13 LEU A 561 -8.940 -1.721 1.606 1.00 0.00 H new ATOM 0 HD21 LEU A 561 -9.611 -2.094 -1.376 1.00 0.00 H new ATOM 0 HD22 LEU A 561 -8.365 -0.974 -0.775 1.00 0.00 H new ATOM 0 HD23 LEU A 561 -7.941 -2.213 -1.979 1.00 0.00 H new ATOM 370 N LEU A 562 -4.756 -5.281 -0.098 1.00 0.00 N ATOM 371 CA LEU A 562 -4.375 -6.436 -0.904 1.00 0.00 C ATOM 372 C LEU A 562 -4.365 -7.709 -0.063 1.00 0.00 C ATOM 373 O LEU A 562 -5.085 -8.664 -0.356 1.00 0.00 O ATOM 374 CB LEU A 562 -2.997 -6.214 -1.529 1.00 0.00 C ATOM 375 CG LEU A 562 -2.688 -7.036 -2.781 1.00 0.00 C ATOM 376 CD1 LEU A 562 -1.331 -6.650 -3.352 1.00 0.00 C ATOM 377 CD2 LEU A 562 -2.731 -8.524 -2.467 1.00 0.00 C ATOM 0 H LEU A 562 -4.043 -4.554 -0.040 1.00 0.00 H new ATOM 0 HA LEU A 562 -5.113 -6.553 -1.697 1.00 0.00 H new ATOM 0 HB2 LEU A 562 -2.899 -5.158 -1.779 1.00 0.00 H new ATOM 0 HB3 LEU A 562 -2.239 -6.435 -0.777 1.00 0.00 H new ATOM 0 HG LEU A 562 -3.450 -6.821 -3.530 1.00 0.00 H new ATOM 0 HD11 LEU A 562 -1.128 -7.245 -4.242 1.00 0.00 H new ATOM 0 HD12 LEU A 562 -1.335 -5.592 -3.616 1.00 0.00 H new ATOM 0 HD13 LEU A 562 -0.557 -6.836 -2.607 1.00 0.00 H new ATOM 0 HD21 LEU A 562 -2.509 -9.093 -3.370 1.00 0.00 H new ATOM 0 HD22 LEU A 562 -1.991 -8.756 -1.701 1.00 0.00 H new ATOM 0 HD23 LEU A 562 -3.724 -8.791 -2.105 1.00 0.00 H new ATOM 389 N LEU A 563 -3.547 -7.713 0.984 1.00 0.00 N ATOM 390 CA LEU A 563 -3.446 -8.868 1.869 1.00 0.00 C ATOM 391 C LEU A 563 -4.824 -9.304 2.356 1.00 0.00 C ATOM 392 O LEU A 563 -5.123 -10.496 2.417 1.00 0.00 O ATOM 393 CB LEU A 563 -2.549 -8.540 3.065 1.00 0.00 C ATOM 394 CG LEU A 563 -2.084 -9.732 3.901 1.00 0.00 C ATOM 395 CD1 LEU A 563 -0.732 -10.230 3.417 1.00 0.00 C ATOM 396 CD2 LEU A 563 -2.019 -9.357 5.375 1.00 0.00 C ATOM 0 H LEU A 563 -2.945 -6.931 1.240 1.00 0.00 H new ATOM 0 HA LEU A 563 -3.005 -9.690 1.305 1.00 0.00 H new ATOM 0 HB2 LEU A 563 -1.668 -8.012 2.699 1.00 0.00 H new ATOM 0 HB3 LEU A 563 -3.085 -7.851 3.718 1.00 0.00 H new ATOM 0 HG LEU A 563 -2.808 -10.538 3.782 1.00 0.00 H new ATOM 0 HD11 LEU A 563 -0.418 -11.079 4.025 1.00 0.00 H new ATOM 0 HD12 LEU A 563 -0.810 -10.539 2.375 1.00 0.00 H new ATOM 0 HD13 LEU A 563 0.003 -9.430 3.504 1.00 0.00 H new ATOM 0 HD21 LEU A 563 -1.686 -10.218 5.955 1.00 0.00 H new ATOM 0 HD22 LEU A 563 -1.317 -8.534 5.511 1.00 0.00 H new ATOM 0 HD23 LEU A 563 -3.008 -9.050 5.716 1.00 0.00 H new ATOM 408 N GLY A 564 -5.660 -8.329 2.701 1.00 0.00 N ATOM 409 CA GLY A 564 -6.997 -8.633 3.176 1.00 0.00 C ATOM 410 C GLY A 564 -7.789 -9.465 2.187 1.00 0.00 C ATOM 411 O GLY A 564 -8.258 -10.554 2.519 1.00 0.00 O ATOM 0 H GLY A 564 -5.435 -7.335 2.660 1.00 0.00 H new ATOM 0 HA2 GLY A 564 -6.930 -9.167 4.124 1.00 0.00 H new ATOM 0 HA3 GLY A 564 -7.530 -7.703 3.372 1.00 0.00 H new ATOM 415 N ILE A 565 -7.939 -8.952 0.971 1.00 0.00 N ATOM 416 CA ILE A 565 -8.680 -9.655 -0.069 1.00 0.00 C ATOM 417 C ILE A 565 -8.144 -11.069 -0.265 1.00 0.00 C ATOM 418 O ILE A 565 -8.911 -12.030 -0.351 1.00 0.00 O ATOM 419 CB ILE A 565 -8.616 -8.904 -1.412 1.00 0.00 C ATOM 420 CG1 ILE A 565 -9.193 -7.495 -1.260 1.00 0.00 C ATOM 421 CG2 ILE A 565 -9.367 -9.677 -2.487 1.00 0.00 C ATOM 422 CD1 ILE A 565 -8.395 -6.434 -1.988 1.00 0.00 C ATOM 0 H ILE A 565 -7.557 -8.052 0.681 1.00 0.00 H new ATOM 0 HA ILE A 565 -9.718 -9.704 0.261 1.00 0.00 H new ATOM 0 HB ILE A 565 -7.573 -8.819 -1.715 1.00 0.00 H new ATOM 0 HG12 ILE A 565 -10.217 -7.488 -1.633 1.00 0.00 H new ATOM 0 HG13 ILE A 565 -9.238 -7.242 -0.201 1.00 0.00 H new ATOM 0 HG21 ILE A 565 -9.313 -9.134 -3.430 1.00 0.00 H new ATOM 0 HG22 ILE A 565 -8.916 -10.662 -2.609 1.00 0.00 H new ATOM 0 HG23 ILE A 565 -10.410 -9.790 -2.192 1.00 0.00 H new ATOM 0 HD11 ILE A 565 -8.861 -5.460 -1.837 1.00 0.00 H new ATOM 0 HD12 ILE A 565 -7.377 -6.413 -1.599 1.00 0.00 H new ATOM 0 HD13 ILE A 565 -8.371 -6.663 -3.053 1.00 0.00 H new ATOM 434 N LEU A 566 -6.822 -11.191 -0.331 1.00 0.00 N ATOM 435 CA LEU A 566 -6.182 -12.489 -0.514 1.00 0.00 C ATOM 436 C LEU A 566 -6.607 -13.465 0.579 1.00 0.00 C ATOM 437 O LEU A 566 -6.835 -14.646 0.316 1.00 0.00 O ATOM 438 CB LEU A 566 -4.661 -12.334 -0.512 1.00 0.00 C ATOM 439 CG LEU A 566 -4.029 -11.894 -1.834 1.00 0.00 C ATOM 440 CD1 LEU A 566 -2.533 -11.682 -1.665 1.00 0.00 C ATOM 441 CD2 LEU A 566 -4.305 -12.919 -2.924 1.00 0.00 C ATOM 0 H LEU A 566 -6.173 -10.407 -0.261 1.00 0.00 H new ATOM 0 HA LEU A 566 -6.499 -12.890 -1.477 1.00 0.00 H new ATOM 0 HB2 LEU A 566 -4.391 -11.609 0.256 1.00 0.00 H new ATOM 0 HB3 LEU A 566 -4.219 -13.287 -0.220 1.00 0.00 H new ATOM 0 HG LEU A 566 -4.478 -10.947 -2.132 1.00 0.00 H new ATOM 0 HD11 LEU A 566 -2.100 -11.369 -2.615 1.00 0.00 H new ATOM 0 HD12 LEU A 566 -2.357 -10.911 -0.915 1.00 0.00 H new ATOM 0 HD13 LEU A 566 -2.068 -12.614 -1.343 1.00 0.00 H new ATOM 0 HD21 LEU A 566 -3.848 -12.590 -3.857 1.00 0.00 H new ATOM 0 HD22 LEU A 566 -3.884 -13.881 -2.634 1.00 0.00 H new ATOM 0 HD23 LEU A 566 -5.381 -13.021 -3.063 1.00 0.00 H new ATOM 453 N VAL A 567 -6.712 -12.963 1.805 1.00 0.00 N ATOM 454 CA VAL A 567 -7.113 -13.790 2.937 1.00 0.00 C ATOM 455 C VAL A 567 -8.614 -14.052 2.921 1.00 0.00 C ATOM 456 O VAL A 567 -9.072 -15.124 3.319 1.00 0.00 O ATOM 457 CB VAL A 567 -6.732 -13.130 4.276 1.00 0.00 C ATOM 458 CG1 VAL A 567 -7.152 -14.009 5.444 1.00 0.00 C ATOM 459 CG2 VAL A 567 -5.239 -12.845 4.323 1.00 0.00 C ATOM 0 H VAL A 567 -6.525 -11.988 2.040 1.00 0.00 H new ATOM 0 HA VAL A 567 -6.581 -14.737 2.842 1.00 0.00 H new ATOM 0 HB VAL A 567 -7.263 -12.182 4.357 1.00 0.00 H new ATOM 0 HG11 VAL A 567 -6.874 -13.526 6.381 1.00 0.00 H new ATOM 0 HG12 VAL A 567 -8.232 -14.157 5.418 1.00 0.00 H new ATOM 0 HG13 VAL A 567 -6.651 -14.974 5.371 1.00 0.00 H new ATOM 0 HG21 VAL A 567 -4.987 -12.379 5.276 1.00 0.00 H new ATOM 0 HG22 VAL A 567 -4.687 -13.779 4.219 1.00 0.00 H new ATOM 0 HG23 VAL A 567 -4.971 -12.173 3.508 1.00 0.00 H new ATOM 469 N PHE A 568 -9.377 -13.067 2.460 1.00 0.00 N ATOM 470 CA PHE A 568 -10.828 -13.192 2.392 1.00 0.00 C ATOM 471 C PHE A 568 -11.236 -14.278 1.401 1.00 0.00 C ATOM 472 O PHE A 568 -12.252 -14.949 1.581 1.00 0.00 O ATOM 473 CB PHE A 568 -11.458 -11.856 1.991 1.00 0.00 C ATOM 474 CG PHE A 568 -11.537 -10.868 3.119 1.00 0.00 C ATOM 475 CD1 PHE A 568 -12.129 -11.216 4.323 1.00 0.00 C ATOM 476 CD2 PHE A 568 -11.018 -9.591 2.977 1.00 0.00 C ATOM 477 CE1 PHE A 568 -12.203 -10.307 5.361 1.00 0.00 C ATOM 478 CE2 PHE A 568 -11.088 -8.679 4.013 1.00 0.00 C ATOM 479 CZ PHE A 568 -11.681 -9.037 5.207 1.00 0.00 C ATOM 0 H PHE A 568 -9.015 -12.173 2.128 1.00 0.00 H new ATOM 0 HA PHE A 568 -11.190 -13.474 3.381 1.00 0.00 H new ATOM 0 HB2 PHE A 568 -10.879 -11.420 1.177 1.00 0.00 H new ATOM 0 HB3 PHE A 568 -12.462 -12.038 1.607 1.00 0.00 H new ATOM 0 HD1 PHE A 568 -12.537 -12.208 4.451 1.00 0.00 H new ATOM 0 HD2 PHE A 568 -10.553 -9.305 2.045 1.00 0.00 H new ATOM 0 HE1 PHE A 568 -12.669 -10.589 6.293 1.00 0.00 H new ATOM 0 HE2 PHE A 568 -10.679 -7.687 3.889 1.00 0.00 H new ATOM 0 HZ PHE A 568 -11.737 -8.326 6.018 1.00 0.00 H new ATOM 489 N ARG A 569 -10.437 -14.442 0.352 1.00 0.00 N ATOM 490 CA ARG A 569 -10.715 -15.444 -0.670 1.00 0.00 C ATOM 491 C ARG A 569 -10.933 -16.817 -0.041 1.00 0.00 C ATOM 492 O ARG A 569 -12.042 -17.350 -0.059 1.00 0.00 O ATOM 493 CB ARG A 569 -9.564 -15.509 -1.677 1.00 0.00 C ATOM 494 CG ARG A 569 -9.990 -15.976 -3.059 1.00 0.00 C ATOM 495 CD ARG A 569 -10.965 -15.001 -3.701 1.00 0.00 C ATOM 496 NE ARG A 569 -11.097 -15.226 -5.138 1.00 0.00 N ATOM 497 CZ ARG A 569 -11.871 -16.167 -5.667 1.00 0.00 C ATOM 498 NH1 ARG A 569 -12.578 -16.968 -4.880 1.00 0.00 N ATOM 499 NH2 ARG A 569 -11.938 -16.310 -6.984 1.00 0.00 N ATOM 0 H ARG A 569 -9.592 -13.894 0.187 1.00 0.00 H new ATOM 0 HA ARG A 569 -11.628 -15.153 -1.190 1.00 0.00 H new ATOM 0 HB2 ARG A 569 -9.109 -14.522 -1.760 1.00 0.00 H new ATOM 0 HB3 ARG A 569 -8.796 -16.182 -1.296 1.00 0.00 H new ATOM 0 HG2 ARG A 569 -9.111 -16.085 -3.694 1.00 0.00 H new ATOM 0 HG3 ARG A 569 -10.453 -16.960 -2.985 1.00 0.00 H new ATOM 0 HD2 ARG A 569 -11.942 -15.100 -3.227 1.00 0.00 H new ATOM 0 HD3 ARG A 569 -10.627 -13.980 -3.523 1.00 0.00 H new ATOM 0 HE ARG A 569 -10.566 -14.628 -5.770 1.00 0.00 H new ATOM 0 HH11 ARG A 569 -12.528 -16.862 -3.867 1.00 0.00 H new ATOM 0 HH12 ARG A 569 -13.172 -17.690 -5.288 1.00 0.00 H new ATOM 0 HH21 ARG A 569 -11.395 -15.697 -7.592 1.00 0.00 H new ATOM 0 HH22 ARG A 569 -12.533 -17.033 -7.389 1.00 0.00 H new ATOM 513 N SER A 570 -9.866 -17.384 0.514 1.00 0.00 N ATOM 514 CA SER A 570 -9.939 -18.697 1.145 1.00 0.00 C ATOM 515 C SER A 570 -8.581 -19.105 1.708 1.00 0.00 C ATOM 516 O SER A 570 -7.972 -20.071 1.249 1.00 0.00 O ATOM 517 CB SER A 570 -10.423 -19.743 0.140 1.00 0.00 C ATOM 518 OG SER A 570 -10.300 -21.052 0.667 1.00 0.00 O ATOM 0 H SER A 570 -8.941 -16.955 0.539 1.00 0.00 H new ATOM 0 HA SER A 570 -10.651 -18.638 1.968 1.00 0.00 H new ATOM 0 HB2 SER A 570 -11.464 -19.548 -0.119 1.00 0.00 H new ATOM 0 HB3 SER A 570 -9.845 -19.662 -0.780 1.00 0.00 H new ATOM 0 HG SER A 570 -9.352 -21.263 0.800 1.00 0.00 H new ATOM 524 N ARG A 571 -8.113 -18.361 2.706 1.00 0.00 N ATOM 525 CA ARG A 571 -6.828 -18.645 3.331 1.00 0.00 C ATOM 526 C ARG A 571 -6.933 -18.565 4.851 1.00 0.00 C ATOM 527 O ARG A 571 -6.784 -17.493 5.439 1.00 0.00 O ATOM 528 CB ARG A 571 -5.766 -17.663 2.831 1.00 0.00 C ATOM 529 CG ARG A 571 -5.136 -18.070 1.510 1.00 0.00 C ATOM 530 CD ARG A 571 -4.013 -17.123 1.114 1.00 0.00 C ATOM 531 NE ARG A 571 -3.298 -17.589 -0.072 1.00 0.00 N ATOM 532 CZ ARG A 571 -2.343 -16.889 -0.676 1.00 0.00 C ATOM 533 NH1 ARG A 571 -1.990 -15.701 -0.207 1.00 0.00 N ATOM 534 NH2 ARG A 571 -1.739 -17.380 -1.750 1.00 0.00 N ATOM 0 H ARG A 571 -8.605 -17.558 3.098 1.00 0.00 H new ATOM 0 HA ARG A 571 -6.535 -19.658 3.057 1.00 0.00 H new ATOM 0 HB2 ARG A 571 -6.218 -16.677 2.720 1.00 0.00 H new ATOM 0 HB3 ARG A 571 -4.984 -17.572 3.584 1.00 0.00 H new ATOM 0 HG2 ARG A 571 -4.747 -19.085 1.588 1.00 0.00 H new ATOM 0 HG3 ARG A 571 -5.897 -18.080 0.730 1.00 0.00 H new ATOM 0 HD2 ARG A 571 -4.425 -16.132 0.923 1.00 0.00 H new ATOM 0 HD3 ARG A 571 -3.313 -17.023 1.944 1.00 0.00 H new ATOM 0 HE ARG A 571 -3.545 -18.501 -0.457 1.00 0.00 H new ATOM 0 HH11 ARG A 571 -2.451 -15.321 0.620 1.00 0.00 H new ATOM 0 HH12 ARG A 571 -1.257 -15.166 -0.673 1.00 0.00 H new ATOM 0 HH21 ARG A 571 -2.007 -18.295 -2.113 1.00 0.00 H new ATOM 0 HH22 ARG A 571 -1.006 -16.843 -2.213 1.00 0.00 H new ATOM 548 N ARG A 572 -7.193 -19.706 5.482 1.00 0.00 N ATOM 549 CA ARG A 572 -7.319 -19.764 6.934 1.00 0.00 C ATOM 550 C ARG A 572 -7.004 -21.164 7.451 1.00 0.00 C ATOM 551 O ARG A 572 -7.491 -21.571 8.505 1.00 0.00 O ATOM 552 CB ARG A 572 -8.731 -19.357 7.360 1.00 0.00 C ATOM 553 CG ARG A 572 -8.775 -18.596 8.675 1.00 0.00 C ATOM 554 CD ARG A 572 -8.539 -17.109 8.466 1.00 0.00 C ATOM 555 NE ARG A 572 -7.704 -16.534 9.517 1.00 0.00 N ATOM 556 CZ ARG A 572 -8.100 -16.397 10.778 1.00 0.00 C ATOM 557 NH1 ARG A 572 -9.313 -16.793 11.142 1.00 0.00 N ATOM 558 NH2 ARG A 572 -7.283 -15.865 11.678 1.00 0.00 N ATOM 0 H ARG A 572 -7.320 -20.602 5.011 1.00 0.00 H new ATOM 0 HA ARG A 572 -6.601 -19.066 7.365 1.00 0.00 H new ATOM 0 HB2 ARG A 572 -9.174 -18.740 6.578 1.00 0.00 H new ATOM 0 HB3 ARG A 572 -9.347 -20.252 7.447 1.00 0.00 H new ATOM 0 HG2 ARG A 572 -9.743 -18.748 9.153 1.00 0.00 H new ATOM 0 HG3 ARG A 572 -8.019 -18.994 9.352 1.00 0.00 H new ATOM 0 HD2 ARG A 572 -8.064 -16.950 7.498 1.00 0.00 H new ATOM 0 HD3 ARG A 572 -9.497 -16.590 8.440 1.00 0.00 H new ATOM 0 HE ARG A 572 -6.765 -16.220 9.270 1.00 0.00 H new ATOM 0 HH11 ARG A 572 -9.944 -17.204 10.453 1.00 0.00 H new ATOM 0 HH12 ARG A 572 -9.615 -16.687 12.111 1.00 0.00 H new ATOM 0 HH21 ARG A 572 -6.349 -15.560 11.402 1.00 0.00 H new ATOM 0 HH22 ARG A 572 -7.589 -15.761 12.646 1.00 0.00 H new ATOM 572 N ALA A 573 -6.189 -21.898 6.700 1.00 0.00 N ATOM 573 CA ALA A 573 -5.807 -23.251 7.084 1.00 0.00 C ATOM 574 C ALA A 573 -4.365 -23.297 7.574 1.00 0.00 C ATOM 575 O ALA A 573 -3.854 -22.279 8.040 1.00 0.00 O ATOM 576 CB ALA A 573 -5.999 -24.204 5.913 1.00 0.00 C ATOM 0 H ALA A 573 -5.781 -21.578 5.822 1.00 0.00 H new ATOM 0 HA ALA A 573 -6.451 -23.565 7.905 1.00 0.00 H new ATOM 0 HB1 ALA A 573 -5.710 -25.211 6.213 1.00 0.00 H new ATOM 0 HB2 ALA A 573 -7.046 -24.202 5.610 1.00 0.00 H new ATOM 0 HB3 ALA A 573 -5.378 -23.882 5.077 1.00 0.00 H new TER 582 ALA A 573 ATOM 583 N SER B 536 -1.370 22.686 -13.811 1.00 0.00 N ATOM 584 CA SER B 536 -0.859 22.207 -12.531 1.00 0.00 C ATOM 585 C SER B 536 -1.387 23.061 -11.383 1.00 0.00 C ATOM 586 O SER B 536 -1.836 24.192 -11.571 1.00 0.00 O ATOM 587 CB SER B 536 0.670 22.220 -12.531 1.00 0.00 C ATOM 588 OG SER B 536 1.191 20.941 -12.849 1.00 0.00 O ATOM 0 HA SER B 536 -1.205 21.183 -12.389 1.00 0.00 H new ATOM 0 HB2 SER B 536 1.031 22.953 -13.253 1.00 0.00 H new ATOM 0 HB3 SER B 536 1.034 22.531 -11.552 1.00 0.00 H new ATOM 0 HG SER B 536 2.170 20.976 -12.844 1.00 0.00 H new ATOM 594 N PRO B 537 -1.333 22.507 -10.162 1.00 0.00 N ATOM 595 CA PRO B 537 -1.801 23.200 -8.957 1.00 0.00 C ATOM 596 C PRO B 537 -0.900 24.369 -8.575 1.00 0.00 C ATOM 597 O PRO B 537 0.203 24.531 -9.098 1.00 0.00 O ATOM 598 CB PRO B 537 -1.752 22.112 -7.881 1.00 0.00 C ATOM 599 CG PRO B 537 -0.722 21.149 -8.363 1.00 0.00 C ATOM 600 CD PRO B 537 -0.811 21.163 -9.864 1.00 0.00 C ATOM 0 HA PRO B 537 -2.790 23.637 -9.095 1.00 0.00 H new ATOM 0 HB2 PRO B 537 -1.482 22.527 -6.910 1.00 0.00 H new ATOM 0 HB3 PRO B 537 -2.722 21.628 -7.763 1.00 0.00 H new ATOM 0 HG2 PRO B 537 0.273 21.442 -8.028 1.00 0.00 H new ATOM 0 HG3 PRO B 537 -0.909 20.149 -7.970 1.00 0.00 H new ATOM 0 HD2 PRO B 537 0.163 20.998 -10.326 1.00 0.00 H new ATOM 0 HD3 PRO B 537 -1.476 20.382 -10.234 1.00 0.00 H new ATOM 608 N PRO B 538 -1.378 25.204 -7.640 1.00 0.00 N ATOM 609 CA PRO B 538 -0.630 26.373 -7.166 1.00 0.00 C ATOM 610 C PRO B 538 0.588 25.984 -6.335 1.00 0.00 C ATOM 611 O PRO B 538 1.381 26.839 -5.939 1.00 0.00 O ATOM 612 CB PRO B 538 -1.649 27.120 -6.302 1.00 0.00 C ATOM 613 CG PRO B 538 -2.605 26.070 -5.852 1.00 0.00 C ATOM 614 CD PRO B 538 -2.684 25.072 -6.974 1.00 0.00 C ATOM 0 HA PRO B 538 -0.234 26.965 -7.991 1.00 0.00 H new ATOM 0 HB2 PRO B 538 -1.168 27.607 -5.454 1.00 0.00 H new ATOM 0 HB3 PRO B 538 -2.156 27.899 -6.872 1.00 0.00 H new ATOM 0 HG2 PRO B 538 -2.260 25.597 -4.933 1.00 0.00 H new ATOM 0 HG3 PRO B 538 -3.585 26.499 -5.642 1.00 0.00 H new ATOM 0 HD2 PRO B 538 -2.845 24.060 -6.601 1.00 0.00 H new ATOM 0 HD3 PRO B 538 -3.506 25.296 -7.654 1.00 0.00 H new ATOM 622 N VAL B 539 0.732 24.688 -6.074 1.00 0.00 N ATOM 623 CA VAL B 539 1.855 24.186 -5.292 1.00 0.00 C ATOM 624 C VAL B 539 1.773 24.661 -3.846 1.00 0.00 C ATOM 625 O VAL B 539 2.603 25.448 -3.393 1.00 0.00 O ATOM 626 CB VAL B 539 3.201 24.632 -5.893 1.00 0.00 C ATOM 627 CG1 VAL B 539 4.352 23.882 -5.239 1.00 0.00 C ATOM 628 CG2 VAL B 539 3.207 24.424 -7.400 1.00 0.00 C ATOM 0 H VAL B 539 0.085 23.967 -6.393 1.00 0.00 H new ATOM 0 HA VAL B 539 1.798 23.098 -5.317 1.00 0.00 H new ATOM 0 HB VAL B 539 3.332 25.696 -5.696 1.00 0.00 H new ATOM 0 HG11 VAL B 539 5.295 24.210 -5.676 1.00 0.00 H new ATOM 0 HG12 VAL B 539 4.358 24.086 -4.168 1.00 0.00 H new ATOM 0 HG13 VAL B 539 4.229 22.812 -5.403 1.00 0.00 H new ATOM 0 HG21 VAL B 539 4.166 24.745 -7.808 1.00 0.00 H new ATOM 0 HG22 VAL B 539 3.053 23.368 -7.622 1.00 0.00 H new ATOM 0 HG23 VAL B 539 2.407 25.010 -7.851 1.00 0.00 H new ATOM 638 N SER B 540 0.767 24.176 -3.125 1.00 0.00 N ATOM 639 CA SER B 540 0.574 24.552 -1.730 1.00 0.00 C ATOM 640 C SER B 540 -0.654 23.864 -1.146 1.00 0.00 C ATOM 641 O SER B 540 -0.684 23.519 0.036 1.00 0.00 O ATOM 642 CB SER B 540 0.430 26.071 -1.606 1.00 0.00 C ATOM 643 OG SER B 540 1.517 26.629 -0.890 1.00 0.00 O ATOM 0 H SER B 540 0.073 23.521 -3.485 1.00 0.00 H new ATOM 0 HA SER B 540 1.450 24.229 -1.167 1.00 0.00 H new ATOM 0 HB2 SER B 540 0.378 26.517 -2.599 1.00 0.00 H new ATOM 0 HB3 SER B 540 -0.505 26.311 -1.099 1.00 0.00 H new ATOM 0 HG SER B 540 2.347 26.487 -1.392 1.00 0.00 H new ATOM 649 N ARG B 541 -1.667 23.664 -1.982 1.00 0.00 N ATOM 650 CA ARG B 541 -2.899 23.018 -1.549 1.00 0.00 C ATOM 651 C ARG B 541 -2.621 21.612 -1.023 1.00 0.00 C ATOM 652 O ARG B 541 -1.468 21.204 -0.897 1.00 0.00 O ATOM 653 CB ARG B 541 -3.900 22.952 -2.705 1.00 0.00 C ATOM 654 CG ARG B 541 -4.327 24.317 -3.219 1.00 0.00 C ATOM 655 CD ARG B 541 -5.013 25.131 -2.132 1.00 0.00 C ATOM 656 NE ARG B 541 -4.341 26.407 -1.899 1.00 0.00 N ATOM 657 CZ ARG B 541 -4.894 27.419 -1.240 1.00 0.00 C ATOM 658 NH1 ARG B 541 -6.121 27.304 -0.751 1.00 0.00 N ATOM 659 NH2 ARG B 541 -4.220 28.549 -1.068 1.00 0.00 N ATOM 0 H ARG B 541 -1.658 23.940 -2.964 1.00 0.00 H new ATOM 0 HA ARG B 541 -3.326 23.612 -0.741 1.00 0.00 H new ATOM 0 HB2 ARG B 541 -3.458 22.386 -3.525 1.00 0.00 H new ATOM 0 HB3 ARG B 541 -4.783 22.403 -2.379 1.00 0.00 H new ATOM 0 HG2 ARG B 541 -3.455 24.859 -3.585 1.00 0.00 H new ATOM 0 HG3 ARG B 541 -5.004 24.193 -4.065 1.00 0.00 H new ATOM 0 HD2 ARG B 541 -6.050 25.313 -2.415 1.00 0.00 H new ATOM 0 HD3 ARG B 541 -5.032 24.556 -1.206 1.00 0.00 H new ATOM 0 HE ARG B 541 -3.395 26.527 -2.262 1.00 0.00 H new ATOM 0 HH11 ARG B 541 -6.642 26.437 -0.880 1.00 0.00 H new ATOM 0 HH12 ARG B 541 -6.543 28.083 -0.245 1.00 0.00 H new ATOM 0 HH21 ARG B 541 -3.276 28.642 -1.442 1.00 0.00 H new ATOM 0 HH22 ARG B 541 -4.646 29.325 -0.562 1.00 0.00 H new ATOM 673 N GLY B 542 -3.687 20.878 -0.719 1.00 0.00 N ATOM 674 CA GLY B 542 -3.535 19.527 -0.210 1.00 0.00 C ATOM 675 C GLY B 542 -3.357 18.507 -1.317 1.00 0.00 C ATOM 676 O GLY B 542 -3.404 17.300 -1.073 1.00 0.00 O ATOM 0 H GLY B 542 -4.652 21.194 -0.816 1.00 0.00 H new ATOM 0 HA2 GLY B 542 -2.674 19.488 0.457 1.00 0.00 H new ATOM 0 HA3 GLY B 542 -4.411 19.265 0.384 1.00 0.00 H new ATOM 680 N LEU B 543 -3.156 18.990 -2.537 1.00 0.00 N ATOM 681 CA LEU B 543 -2.973 18.111 -3.688 1.00 0.00 C ATOM 682 C LEU B 543 -1.932 18.680 -4.646 1.00 0.00 C ATOM 683 O LEU B 543 -2.073 19.799 -5.143 1.00 0.00 O ATOM 684 CB LEU B 543 -4.302 17.911 -4.418 1.00 0.00 C ATOM 685 CG LEU B 543 -4.282 16.923 -5.585 1.00 0.00 C ATOM 686 CD1 LEU B 543 -3.665 17.564 -6.817 1.00 0.00 C ATOM 687 CD2 LEU B 543 -3.525 15.660 -5.202 1.00 0.00 C ATOM 0 H LEU B 543 -3.115 19.985 -2.756 1.00 0.00 H new ATOM 0 HA LEU B 543 -2.617 17.146 -3.326 1.00 0.00 H new ATOM 0 HB2 LEU B 543 -5.044 17.574 -3.695 1.00 0.00 H new ATOM 0 HB3 LEU B 543 -4.638 18.878 -4.792 1.00 0.00 H new ATOM 0 HG LEU B 543 -5.310 16.648 -5.821 1.00 0.00 H new ATOM 0 HD11 LEU B 543 -3.660 16.846 -7.637 1.00 0.00 H new ATOM 0 HD12 LEU B 543 -4.250 18.438 -7.104 1.00 0.00 H new ATOM 0 HD13 LEU B 543 -2.642 17.869 -6.595 1.00 0.00 H new ATOM 0 HD21 LEU B 543 -3.521 14.969 -6.045 1.00 0.00 H new ATOM 0 HD22 LEU B 543 -2.499 15.917 -4.938 1.00 0.00 H new ATOM 0 HD23 LEU B 543 -4.012 15.189 -4.348 1.00 0.00 H new ATOM 699 N THR B 544 -0.885 17.903 -4.907 1.00 0.00 N ATOM 700 CA THR B 544 0.178 18.328 -5.807 1.00 0.00 C ATOM 701 C THR B 544 0.671 17.167 -6.663 1.00 0.00 C ATOM 702 O THR B 544 0.471 16.001 -6.322 1.00 0.00 O ATOM 703 CB THR B 544 1.370 18.919 -5.030 1.00 0.00 C ATOM 704 OG1 THR B 544 2.385 17.924 -4.858 1.00 0.00 O ATOM 705 CG2 THR B 544 0.925 19.436 -3.670 1.00 0.00 C ATOM 0 H THR B 544 -0.751 16.975 -4.506 1.00 0.00 H new ATOM 0 HA THR B 544 -0.244 19.099 -6.452 1.00 0.00 H new ATOM 0 HB THR B 544 1.773 19.753 -5.605 1.00 0.00 H new ATOM 0 HG1 THR B 544 3.140 18.308 -4.365 1.00 0.00 H new ATOM 0 HG21 THR B 544 1.783 19.849 -3.139 1.00 0.00 H new ATOM 0 HG22 THR B 544 0.173 20.214 -3.805 1.00 0.00 H new ATOM 0 HG23 THR B 544 0.500 18.617 -3.091 1.00 0.00 H new ATOM 713 N GLY B 545 1.318 17.493 -7.779 1.00 0.00 N ATOM 714 CA GLY B 545 1.829 16.465 -8.666 1.00 0.00 C ATOM 715 C GLY B 545 2.655 15.425 -7.935 1.00 0.00 C ATOM 716 O GLY B 545 2.498 14.226 -8.161 1.00 0.00 O ATOM 0 H GLY B 545 1.497 18.450 -8.084 1.00 0.00 H new ATOM 0 HA2 GLY B 545 0.995 15.975 -9.167 1.00 0.00 H new ATOM 0 HA3 GLY B 545 2.439 16.929 -9.441 1.00 0.00 H new ATOM 720 N GLY B 546 3.540 15.885 -7.055 1.00 0.00 N ATOM 721 CA GLY B 546 4.381 14.974 -6.303 1.00 0.00 C ATOM 722 C GLY B 546 3.580 14.045 -5.413 1.00 0.00 C ATOM 723 O GLY B 546 3.979 12.905 -5.176 1.00 0.00 O ATOM 0 H GLY B 546 3.689 16.873 -6.850 1.00 0.00 H new ATOM 0 HA2 GLY B 546 4.980 14.382 -6.995 1.00 0.00 H new ATOM 0 HA3 GLY B 546 5.076 15.548 -5.691 1.00 0.00 H new ATOM 727 N GLU B 547 2.447 14.534 -4.918 1.00 0.00 N ATOM 728 CA GLU B 547 1.590 13.739 -4.046 1.00 0.00 C ATOM 729 C GLU B 547 0.947 12.589 -4.817 1.00 0.00 C ATOM 730 O GLU B 547 0.862 11.466 -4.319 1.00 0.00 O ATOM 731 CB GLU B 547 0.504 14.619 -3.423 1.00 0.00 C ATOM 732 CG GLU B 547 1.012 15.971 -2.952 1.00 0.00 C ATOM 733 CD GLU B 547 0.250 16.496 -1.752 1.00 0.00 C ATOM 734 OE1 GLU B 547 -0.797 17.148 -1.953 1.00 0.00 O ATOM 735 OE2 GLU B 547 0.698 16.255 -0.612 1.00 0.00 O ATOM 0 H GLU B 547 2.102 15.475 -5.106 1.00 0.00 H new ATOM 0 HA GLU B 547 2.209 13.321 -3.253 1.00 0.00 H new ATOM 0 HB2 GLU B 547 -0.290 14.773 -4.153 1.00 0.00 H new ATOM 0 HB3 GLU B 547 0.062 14.092 -2.578 1.00 0.00 H new ATOM 0 HG2 GLU B 547 2.069 15.889 -2.699 1.00 0.00 H new ATOM 0 HG3 GLU B 547 0.934 16.688 -3.769 1.00 0.00 H new ATOM 742 N ILE B 548 0.496 12.878 -6.032 1.00 0.00 N ATOM 743 CA ILE B 548 -0.137 11.869 -6.872 1.00 0.00 C ATOM 744 C ILE B 548 0.855 10.782 -7.269 1.00 0.00 C ATOM 745 O ILE B 548 0.619 9.596 -7.037 1.00 0.00 O ATOM 746 CB ILE B 548 -0.736 12.492 -8.147 1.00 0.00 C ATOM 747 CG1 ILE B 548 -1.965 13.335 -7.801 1.00 0.00 C ATOM 748 CG2 ILE B 548 -1.096 11.405 -9.148 1.00 0.00 C ATOM 749 CD1 ILE B 548 -1.696 14.823 -7.794 1.00 0.00 C ATOM 0 H ILE B 548 0.557 13.803 -6.457 1.00 0.00 H new ATOM 0 HA ILE B 548 -0.940 11.427 -6.282 1.00 0.00 H new ATOM 0 HB ILE B 548 0.011 13.144 -8.601 1.00 0.00 H new ATOM 0 HG12 ILE B 548 -2.756 13.121 -8.519 1.00 0.00 H new ATOM 0 HG13 ILE B 548 -2.336 13.037 -6.820 1.00 0.00 H new ATOM 0 HG21 ILE B 548 -1.518 11.861 -10.044 1.00 0.00 H new ATOM 0 HG22 ILE B 548 -0.200 10.844 -9.414 1.00 0.00 H new ATOM 0 HG23 ILE B 548 -1.828 10.730 -8.705 1.00 0.00 H new ATOM 0 HD11 ILE B 548 -2.612 15.357 -7.541 1.00 0.00 H new ATOM 0 HD12 ILE B 548 -0.927 15.050 -7.055 1.00 0.00 H new ATOM 0 HD13 ILE B 548 -1.355 15.136 -8.781 1.00 0.00 H new ATOM 761 N VAL B 549 1.969 11.194 -7.866 1.00 0.00 N ATOM 762 CA VAL B 549 3.000 10.255 -8.293 1.00 0.00 C ATOM 763 C VAL B 549 3.532 9.450 -7.112 1.00 0.00 C ATOM 764 O VAL B 549 3.947 8.302 -7.268 1.00 0.00 O ATOM 765 CB VAL B 549 4.174 10.982 -8.974 1.00 0.00 C ATOM 766 CG1 VAL B 549 3.659 12.016 -9.964 1.00 0.00 C ATOM 767 CG2 VAL B 549 5.075 11.631 -7.935 1.00 0.00 C ATOM 0 H VAL B 549 2.181 12.172 -8.065 1.00 0.00 H new ATOM 0 HA VAL B 549 2.535 9.579 -9.011 1.00 0.00 H new ATOM 0 HB VAL B 549 4.763 10.248 -9.524 1.00 0.00 H new ATOM 0 HG11 VAL B 549 4.503 12.520 -10.436 1.00 0.00 H new ATOM 0 HG12 VAL B 549 3.059 11.521 -10.728 1.00 0.00 H new ATOM 0 HG13 VAL B 549 3.046 12.749 -9.439 1.00 0.00 H new ATOM 0 HG21 VAL B 549 5.899 12.140 -8.435 1.00 0.00 H new ATOM 0 HG22 VAL B 549 4.500 12.354 -7.355 1.00 0.00 H new ATOM 0 HG23 VAL B 549 5.472 10.865 -7.269 1.00 0.00 H new ATOM 777 N ALA B 550 3.518 10.060 -5.932 1.00 0.00 N ATOM 778 CA ALA B 550 3.996 9.399 -4.725 1.00 0.00 C ATOM 779 C ALA B 550 3.065 8.263 -4.314 1.00 0.00 C ATOM 780 O ALA B 550 3.514 7.155 -4.021 1.00 0.00 O ATOM 781 CB ALA B 550 4.135 10.405 -3.591 1.00 0.00 C ATOM 0 H ALA B 550 3.181 11.011 -5.786 1.00 0.00 H new ATOM 0 HA ALA B 550 4.975 8.972 -4.940 1.00 0.00 H new ATOM 0 HB1 ALA B 550 4.493 9.897 -2.696 1.00 0.00 H new ATOM 0 HB2 ALA B 550 4.846 11.180 -3.877 1.00 0.00 H new ATOM 0 HB3 ALA B 550 3.166 10.860 -3.387 1.00 0.00 H new ATOM 787 N VAL B 551 1.767 8.545 -4.297 1.00 0.00 N ATOM 788 CA VAL B 551 0.772 7.546 -3.924 1.00 0.00 C ATOM 789 C VAL B 551 0.830 6.340 -4.852 1.00 0.00 C ATOM 790 O VAL B 551 0.816 5.194 -4.400 1.00 0.00 O ATOM 791 CB VAL B 551 -0.651 8.134 -3.951 1.00 0.00 C ATOM 792 CG1 VAL B 551 -1.687 7.032 -3.798 1.00 0.00 C ATOM 793 CG2 VAL B 551 -0.814 9.185 -2.863 1.00 0.00 C ATOM 0 H VAL B 551 1.379 9.457 -4.537 1.00 0.00 H new ATOM 0 HA VAL B 551 1.007 7.230 -2.908 1.00 0.00 H new ATOM 0 HB VAL B 551 -0.808 8.616 -4.916 1.00 0.00 H new ATOM 0 HG11 VAL B 551 -2.686 7.467 -3.819 1.00 0.00 H new ATOM 0 HG12 VAL B 551 -1.584 6.319 -4.616 1.00 0.00 H new ATOM 0 HG13 VAL B 551 -1.535 6.519 -2.848 1.00 0.00 H new ATOM 0 HG21 VAL B 551 -1.825 9.590 -2.897 1.00 0.00 H new ATOM 0 HG22 VAL B 551 -0.638 8.730 -1.888 1.00 0.00 H new ATOM 0 HG23 VAL B 551 -0.096 9.989 -3.023 1.00 0.00 H new ATOM 803 N ILE B 552 0.895 6.603 -6.153 1.00 0.00 N ATOM 804 CA ILE B 552 0.957 5.539 -7.147 1.00 0.00 C ATOM 805 C ILE B 552 2.275 4.777 -7.054 1.00 0.00 C ATOM 806 O ILE B 552 2.340 3.587 -7.368 1.00 0.00 O ATOM 807 CB ILE B 552 0.795 6.090 -8.575 1.00 0.00 C ATOM 808 CG1 ILE B 552 0.843 4.950 -9.595 1.00 0.00 C ATOM 809 CG2 ILE B 552 1.875 7.119 -8.871 1.00 0.00 C ATOM 810 CD1 ILE B 552 0.657 5.409 -11.024 1.00 0.00 C ATOM 0 H ILE B 552 0.906 7.545 -6.543 1.00 0.00 H new ATOM 0 HA ILE B 552 0.131 4.860 -6.934 1.00 0.00 H new ATOM 0 HB ILE B 552 -0.176 6.579 -8.651 1.00 0.00 H new ATOM 0 HG12 ILE B 552 1.801 4.436 -9.509 1.00 0.00 H new ATOM 0 HG13 ILE B 552 0.068 4.223 -9.352 1.00 0.00 H new ATOM 0 HG21 ILE B 552 1.747 7.499 -9.884 1.00 0.00 H new ATOM 0 HG22 ILE B 552 1.797 7.943 -8.162 1.00 0.00 H new ATOM 0 HG23 ILE B 552 2.856 6.653 -8.779 1.00 0.00 H new ATOM 0 HD11 ILE B 552 0.703 4.548 -11.691 1.00 0.00 H new ATOM 0 HD12 ILE B 552 -0.312 5.897 -11.126 1.00 0.00 H new ATOM 0 HD13 ILE B 552 1.447 6.113 -11.286 1.00 0.00 H new ATOM 822 N PHE B 553 3.323 5.470 -6.622 1.00 0.00 N ATOM 823 CA PHE B 553 4.640 4.858 -6.488 1.00 0.00 C ATOM 824 C PHE B 553 4.639 3.798 -5.391 1.00 0.00 C ATOM 825 O PHE B 553 5.085 2.671 -5.600 1.00 0.00 O ATOM 826 CB PHE B 553 5.692 5.926 -6.179 1.00 0.00 C ATOM 827 CG PHE B 553 7.096 5.491 -6.490 1.00 0.00 C ATOM 828 CD1 PHE B 553 7.670 4.425 -5.818 1.00 0.00 C ATOM 829 CD2 PHE B 553 7.841 6.150 -7.455 1.00 0.00 C ATOM 830 CE1 PHE B 553 8.962 4.022 -6.102 1.00 0.00 C ATOM 831 CE2 PHE B 553 9.133 5.751 -7.744 1.00 0.00 C ATOM 832 CZ PHE B 553 9.694 4.688 -7.066 1.00 0.00 C ATOM 0 H PHE B 553 3.286 6.455 -6.359 1.00 0.00 H new ATOM 0 HA PHE B 553 4.887 4.376 -7.434 1.00 0.00 H new ATOM 0 HB2 PHE B 553 5.464 6.826 -6.750 1.00 0.00 H new ATOM 0 HB3 PHE B 553 5.628 6.193 -5.124 1.00 0.00 H new ATOM 0 HD1 PHE B 553 7.102 3.902 -5.063 1.00 0.00 H new ATOM 0 HD2 PHE B 553 7.408 6.984 -7.987 1.00 0.00 H new ATOM 0 HE1 PHE B 553 9.398 3.188 -5.571 1.00 0.00 H new ATOM 0 HE2 PHE B 553 9.703 6.271 -8.500 1.00 0.00 H new ATOM 0 HZ PHE B 553 10.704 4.377 -7.289 1.00 0.00 H new ATOM 842 N GLY B 554 4.133 4.169 -4.218 1.00 0.00 N ATOM 843 CA GLY B 554 4.083 3.240 -3.104 1.00 0.00 C ATOM 844 C GLY B 554 2.957 2.233 -3.239 1.00 0.00 C ATOM 845 O GLY B 554 3.061 1.106 -2.755 1.00 0.00 O ATOM 0 H GLY B 554 3.757 5.096 -4.020 1.00 0.00 H new ATOM 0 HA2 GLY B 554 5.033 2.711 -3.033 1.00 0.00 H new ATOM 0 HA3 GLY B 554 3.959 3.797 -2.175 1.00 0.00 H new ATOM 849 N LEU B 555 1.877 2.641 -3.896 1.00 0.00 N ATOM 850 CA LEU B 555 0.725 1.767 -4.091 1.00 0.00 C ATOM 851 C LEU B 555 1.044 0.661 -5.093 1.00 0.00 C ATOM 852 O LEU B 555 0.676 -0.498 -4.892 1.00 0.00 O ATOM 853 CB LEU B 555 -0.479 2.578 -4.576 1.00 0.00 C ATOM 854 CG LEU B 555 -1.609 1.778 -5.224 1.00 0.00 C ATOM 855 CD1 LEU B 555 -2.161 0.747 -4.250 1.00 0.00 C ATOM 856 CD2 LEU B 555 -2.715 2.709 -5.701 1.00 0.00 C ATOM 0 H LEU B 555 1.775 3.571 -4.303 1.00 0.00 H new ATOM 0 HA LEU B 555 0.483 1.306 -3.133 1.00 0.00 H new ATOM 0 HB2 LEU B 555 -0.889 3.126 -3.727 1.00 0.00 H new ATOM 0 HB3 LEU B 555 -0.127 3.319 -5.294 1.00 0.00 H new ATOM 0 HG LEU B 555 -1.206 1.251 -6.089 1.00 0.00 H new ATOM 0 HD11 LEU B 555 -2.964 0.187 -4.729 1.00 0.00 H new ATOM 0 HD12 LEU B 555 -1.366 0.061 -3.957 1.00 0.00 H new ATOM 0 HD13 LEU B 555 -2.549 1.253 -3.366 1.00 0.00 H new ATOM 0 HD21 LEU B 555 -3.511 2.123 -6.160 1.00 0.00 H new ATOM 0 HD22 LEU B 555 -3.115 3.263 -4.852 1.00 0.00 H new ATOM 0 HD23 LEU B 555 -2.311 3.408 -6.433 1.00 0.00 H new ATOM 868 N LEU B 556 1.732 1.026 -6.169 1.00 0.00 N ATOM 869 CA LEU B 556 2.103 0.064 -7.201 1.00 0.00 C ATOM 870 C LEU B 556 3.211 -0.862 -6.710 1.00 0.00 C ATOM 871 O LEU B 556 3.055 -2.084 -6.701 1.00 0.00 O ATOM 872 CB LEU B 556 2.556 0.794 -8.467 1.00 0.00 C ATOM 873 CG LEU B 556 1.445 1.368 -9.346 1.00 0.00 C ATOM 874 CD1 LEU B 556 2.034 2.082 -10.552 1.00 0.00 C ATOM 875 CD2 LEU B 556 0.492 0.267 -9.788 1.00 0.00 C ATOM 0 H LEU B 556 2.044 1.980 -6.350 1.00 0.00 H new ATOM 0 HA LEU B 556 1.226 -0.541 -7.432 1.00 0.00 H new ATOM 0 HB2 LEU B 556 3.218 1.609 -8.175 1.00 0.00 H new ATOM 0 HB3 LEU B 556 3.147 0.103 -9.068 1.00 0.00 H new ATOM 0 HG LEU B 556 0.882 2.094 -8.759 1.00 0.00 H new ATOM 0 HD11 LEU B 556 1.228 2.484 -11.166 1.00 0.00 H new ATOM 0 HD12 LEU B 556 2.675 2.897 -10.215 1.00 0.00 H new ATOM 0 HD13 LEU B 556 2.622 1.378 -11.141 1.00 0.00 H new ATOM 0 HD21 LEU B 556 -0.292 0.694 -10.413 1.00 0.00 H new ATOM 0 HD22 LEU B 556 1.041 -0.483 -10.357 1.00 0.00 H new ATOM 0 HD23 LEU B 556 0.044 -0.200 -8.911 1.00 0.00 H new ATOM 887 N LEU B 557 4.329 -0.273 -6.301 1.00 0.00 N ATOM 888 CA LEU B 557 5.463 -1.045 -5.805 1.00 0.00 C ATOM 889 C LEU B 557 5.104 -1.770 -4.512 1.00 0.00 C ATOM 890 O LEU B 557 5.664 -2.822 -4.202 1.00 0.00 O ATOM 891 CB LEU B 557 6.666 -0.130 -5.573 1.00 0.00 C ATOM 892 CG LEU B 557 7.476 0.242 -6.816 1.00 0.00 C ATOM 893 CD1 LEU B 557 6.788 1.356 -7.589 1.00 0.00 C ATOM 894 CD2 LEU B 557 8.889 0.653 -6.428 1.00 0.00 C ATOM 0 H LEU B 557 4.475 0.737 -6.303 1.00 0.00 H new ATOM 0 HA LEU B 557 5.721 -1.790 -6.558 1.00 0.00 H new ATOM 0 HB2 LEU B 557 6.313 0.789 -5.105 1.00 0.00 H new ATOM 0 HB3 LEU B 557 7.334 -0.614 -4.860 1.00 0.00 H new ATOM 0 HG LEU B 557 7.538 -0.634 -7.461 1.00 0.00 H new ATOM 0 HD11 LEU B 557 7.379 1.607 -8.470 1.00 0.00 H new ATOM 0 HD12 LEU B 557 5.797 1.025 -7.899 1.00 0.00 H new ATOM 0 HD13 LEU B 557 6.694 2.236 -6.953 1.00 0.00 H new ATOM 0 HD21 LEU B 557 9.451 0.914 -7.325 1.00 0.00 H new ATOM 0 HD22 LEU B 557 8.847 1.515 -5.762 1.00 0.00 H new ATOM 0 HD23 LEU B 557 9.382 -0.175 -5.919 1.00 0.00 H new ATOM 906 N GLY B 558 4.166 -1.201 -3.761 1.00 0.00 N ATOM 907 CA GLY B 558 3.748 -1.808 -2.511 1.00 0.00 C ATOM 908 C GLY B 558 3.003 -3.111 -2.720 1.00 0.00 C ATOM 909 O GLY B 558 3.414 -4.157 -2.218 1.00 0.00 O ATOM 0 H GLY B 558 3.688 -0.331 -3.996 1.00 0.00 H new ATOM 0 HA2 GLY B 558 4.624 -1.990 -1.888 1.00 0.00 H new ATOM 0 HA3 GLY B 558 3.110 -1.111 -1.968 1.00 0.00 H new ATOM 913 N ALA B 559 1.902 -3.048 -3.461 1.00 0.00 N ATOM 914 CA ALA B 559 1.097 -4.233 -3.735 1.00 0.00 C ATOM 915 C ALA B 559 1.855 -5.220 -4.616 1.00 0.00 C ATOM 916 O ALA B 559 1.823 -6.428 -4.381 1.00 0.00 O ATOM 917 CB ALA B 559 -0.217 -3.838 -4.393 1.00 0.00 C ATOM 0 H ALA B 559 1.547 -2.190 -3.882 1.00 0.00 H new ATOM 0 HA ALA B 559 0.883 -4.723 -2.785 1.00 0.00 H new ATOM 0 HB1 ALA B 559 -0.808 -4.732 -4.592 1.00 0.00 H new ATOM 0 HB2 ALA B 559 -0.773 -3.177 -3.728 1.00 0.00 H new ATOM 0 HB3 ALA B 559 -0.013 -3.322 -5.331 1.00 0.00 H new ATOM 923 N ALA B 560 2.538 -4.698 -5.630 1.00 0.00 N ATOM 924 CA ALA B 560 3.305 -5.534 -6.544 1.00 0.00 C ATOM 925 C ALA B 560 4.288 -6.420 -5.785 1.00 0.00 C ATOM 926 O ALA B 560 4.233 -7.647 -5.879 1.00 0.00 O ATOM 927 CB ALA B 560 4.044 -4.670 -7.555 1.00 0.00 C ATOM 0 H ALA B 560 2.575 -3.700 -5.839 1.00 0.00 H new ATOM 0 HA ALA B 560 2.608 -6.182 -7.076 1.00 0.00 H new ATOM 0 HB1 ALA B 560 4.613 -5.308 -8.232 1.00 0.00 H new ATOM 0 HB2 ALA B 560 3.325 -4.084 -8.127 1.00 0.00 H new ATOM 0 HB3 ALA B 560 4.724 -3.998 -7.031 1.00 0.00 H new ATOM 933 N LEU B 561 5.184 -5.792 -5.033 1.00 0.00 N ATOM 934 CA LEU B 561 6.180 -6.523 -4.258 1.00 0.00 C ATOM 935 C LEU B 561 5.510 -7.488 -3.285 1.00 0.00 C ATOM 936 O LEU B 561 5.978 -8.610 -3.086 1.00 0.00 O ATOM 937 CB LEU B 561 7.075 -5.548 -3.492 1.00 0.00 C ATOM 938 CG LEU B 561 8.226 -6.173 -2.702 1.00 0.00 C ATOM 939 CD1 LEU B 561 9.262 -6.764 -3.645 1.00 0.00 C ATOM 940 CD2 LEU B 561 8.865 -5.140 -1.784 1.00 0.00 C ATOM 0 H LEU B 561 5.242 -4.778 -4.943 1.00 0.00 H new ATOM 0 HA LEU B 561 6.792 -7.100 -4.951 1.00 0.00 H new ATOM 0 HB2 LEU B 561 7.493 -4.835 -4.203 1.00 0.00 H new ATOM 0 HB3 LEU B 561 6.452 -4.981 -2.801 1.00 0.00 H new ATOM 0 HG LEU B 561 7.824 -6.978 -2.087 1.00 0.00 H new ATOM 0 HD11 LEU B 561 10.073 -7.204 -3.065 1.00 0.00 H new ATOM 0 HD12 LEU B 561 8.797 -7.534 -4.260 1.00 0.00 H new ATOM 0 HD13 LEU B 561 9.660 -5.978 -4.287 1.00 0.00 H new ATOM 0 HD21 LEU B 561 9.682 -5.602 -1.230 1.00 0.00 H new ATOM 0 HD22 LEU B 561 9.252 -4.314 -2.380 1.00 0.00 H new ATOM 0 HD23 LEU B 561 8.119 -4.764 -1.084 1.00 0.00 H new ATOM 952 N LEU B 562 4.412 -7.046 -2.683 1.00 0.00 N ATOM 953 CA LEU B 562 3.676 -7.871 -1.731 1.00 0.00 C ATOM 954 C LEU B 562 3.182 -9.154 -2.392 1.00 0.00 C ATOM 955 O LEU B 562 3.512 -10.257 -1.956 1.00 0.00 O ATOM 956 CB LEU B 562 2.492 -7.091 -1.157 1.00 0.00 C ATOM 957 CG LEU B 562 1.563 -7.869 -0.225 1.00 0.00 C ATOM 958 CD1 LEU B 562 2.006 -7.711 1.221 1.00 0.00 C ATOM 959 CD2 LEU B 562 0.125 -7.406 -0.398 1.00 0.00 C ATOM 0 H LEU B 562 4.011 -6.121 -2.837 1.00 0.00 H new ATOM 0 HA LEU B 562 4.353 -8.138 -0.920 1.00 0.00 H new ATOM 0 HB2 LEU B 562 2.880 -6.229 -0.614 1.00 0.00 H new ATOM 0 HB3 LEU B 562 1.901 -6.705 -1.987 1.00 0.00 H new ATOM 0 HG LEU B 562 1.617 -8.926 -0.487 1.00 0.00 H new ATOM 0 HD11 LEU B 562 1.334 -8.271 1.871 1.00 0.00 H new ATOM 0 HD12 LEU B 562 3.021 -8.092 1.334 1.00 0.00 H new ATOM 0 HD13 LEU B 562 1.981 -6.657 1.496 1.00 0.00 H new ATOM 0 HD21 LEU B 562 -0.522 -7.971 0.273 1.00 0.00 H new ATOM 0 HD22 LEU B 562 0.054 -6.344 -0.163 1.00 0.00 H new ATOM 0 HD23 LEU B 562 -0.189 -7.571 -1.429 1.00 0.00 H new ATOM 971 N LEU B 563 2.389 -9.002 -3.448 1.00 0.00 N ATOM 972 CA LEU B 563 1.851 -10.149 -4.171 1.00 0.00 C ATOM 973 C LEU B 563 2.973 -11.053 -4.673 1.00 0.00 C ATOM 974 O LEU B 563 2.859 -12.277 -4.639 1.00 0.00 O ATOM 975 CB LEU B 563 0.995 -9.677 -5.349 1.00 0.00 C ATOM 976 CG LEU B 563 0.061 -10.723 -5.959 1.00 0.00 C ATOM 977 CD1 LEU B 563 -1.332 -10.608 -5.359 1.00 0.00 C ATOM 978 CD2 LEU B 563 0.005 -10.570 -7.472 1.00 0.00 C ATOM 0 H LEU B 563 2.105 -8.097 -3.822 1.00 0.00 H new ATOM 0 HA LEU B 563 1.229 -10.722 -3.483 1.00 0.00 H new ATOM 0 HB2 LEU B 563 0.394 -8.830 -5.019 1.00 0.00 H new ATOM 0 HB3 LEU B 563 1.659 -9.311 -6.132 1.00 0.00 H new ATOM 0 HG LEU B 563 0.454 -11.713 -5.728 1.00 0.00 H new ATOM 0 HD11 LEU B 563 -1.983 -11.360 -5.805 1.00 0.00 H new ATOM 0 HD12 LEU B 563 -1.278 -10.767 -4.282 1.00 0.00 H new ATOM 0 HD13 LEU B 563 -1.734 -9.615 -5.560 1.00 0.00 H new ATOM 0 HD21 LEU B 563 -0.664 -11.322 -7.889 1.00 0.00 H new ATOM 0 HD22 LEU B 563 -0.365 -9.576 -7.724 1.00 0.00 H new ATOM 0 HD23 LEU B 563 1.004 -10.702 -7.888 1.00 0.00 H new ATOM 990 N GLY B 564 4.057 -10.439 -5.136 1.00 0.00 N ATOM 991 CA GLY B 564 5.185 -11.203 -5.636 1.00 0.00 C ATOM 992 C GLY B 564 5.757 -12.142 -4.593 1.00 0.00 C ATOM 993 O GLY B 564 5.631 -13.362 -4.710 1.00 0.00 O ATOM 0 H GLY B 564 4.174 -9.426 -5.174 1.00 0.00 H new ATOM 0 HA2 GLY B 564 4.872 -11.779 -6.507 1.00 0.00 H new ATOM 0 HA3 GLY B 564 5.964 -10.518 -5.970 1.00 0.00 H new ATOM 997 N ILE B 565 6.389 -11.575 -3.571 1.00 0.00 N ATOM 998 CA ILE B 565 6.983 -12.370 -2.504 1.00 0.00 C ATOM 999 C ILE B 565 5.980 -13.372 -1.943 1.00 0.00 C ATOM 1000 O ILE B 565 6.359 -14.430 -1.436 1.00 0.00 O ATOM 1001 CB ILE B 565 7.498 -11.480 -1.358 1.00 0.00 C ATOM 1002 CG1 ILE B 565 8.566 -10.514 -1.875 1.00 0.00 C ATOM 1003 CG2 ILE B 565 8.054 -12.337 -0.229 1.00 0.00 C ATOM 1004 CD1 ILE B 565 9.797 -11.206 -2.417 1.00 0.00 C ATOM 0 H ILE B 565 6.503 -10.568 -3.460 1.00 0.00 H new ATOM 0 HA ILE B 565 7.825 -12.907 -2.942 1.00 0.00 H new ATOM 0 HB ILE B 565 6.664 -10.897 -0.968 1.00 0.00 H new ATOM 0 HG12 ILE B 565 8.133 -9.893 -2.660 1.00 0.00 H new ATOM 0 HG13 ILE B 565 8.862 -9.846 -1.066 1.00 0.00 H new ATOM 0 HG21 ILE B 565 8.414 -11.693 0.573 1.00 0.00 H new ATOM 0 HG22 ILE B 565 7.269 -12.989 0.154 1.00 0.00 H new ATOM 0 HG23 ILE B 565 8.878 -12.944 -0.605 1.00 0.00 H new ATOM 0 HD11 ILE B 565 10.510 -10.459 -2.765 1.00 0.00 H new ATOM 0 HD12 ILE B 565 10.254 -11.805 -1.629 1.00 0.00 H new ATOM 0 HD13 ILE B 565 9.515 -11.853 -3.247 1.00 0.00 H new ATOM 1016 N LEU B 566 4.698 -13.035 -2.037 1.00 0.00 N ATOM 1017 CA LEU B 566 3.639 -13.905 -1.540 1.00 0.00 C ATOM 1018 C LEU B 566 3.547 -15.180 -2.373 1.00 0.00 C ATOM 1019 O LEU B 566 3.339 -16.270 -1.839 1.00 0.00 O ATOM 1020 CB LEU B 566 2.297 -13.171 -1.559 1.00 0.00 C ATOM 1021 CG LEU B 566 1.988 -12.305 -0.338 1.00 0.00 C ATOM 1022 CD1 LEU B 566 0.701 -11.524 -0.551 1.00 0.00 C ATOM 1023 CD2 LEU B 566 1.892 -13.163 0.914 1.00 0.00 C ATOM 0 H LEU B 566 4.367 -12.165 -2.453 1.00 0.00 H new ATOM 0 HA LEU B 566 3.880 -14.180 -0.513 1.00 0.00 H new ATOM 0 HB2 LEU B 566 2.264 -12.538 -2.446 1.00 0.00 H new ATOM 0 HB3 LEU B 566 1.503 -13.910 -1.665 1.00 0.00 H new ATOM 0 HG LEU B 566 2.803 -11.594 -0.205 1.00 0.00 H new ATOM 0 HD11 LEU B 566 0.496 -10.913 0.328 1.00 0.00 H new ATOM 0 HD12 LEU B 566 0.806 -10.880 -1.424 1.00 0.00 H new ATOM 0 HD13 LEU B 566 -0.124 -12.218 -0.710 1.00 0.00 H new ATOM 0 HD21 LEU B 566 1.672 -12.530 1.773 1.00 0.00 H new ATOM 0 HD22 LEU B 566 1.096 -13.898 0.791 1.00 0.00 H new ATOM 0 HD23 LEU B 566 2.839 -13.677 1.076 1.00 0.00 H new ATOM 1035 N VAL B 567 3.704 -15.037 -3.685 1.00 0.00 N ATOM 1036 CA VAL B 567 3.643 -16.176 -4.591 1.00 0.00 C ATOM 1037 C VAL B 567 4.964 -16.938 -4.608 1.00 0.00 C ATOM 1038 O VAL B 567 5.005 -18.123 -4.940 1.00 0.00 O ATOM 1039 CB VAL B 567 3.298 -15.735 -6.026 1.00 0.00 C ATOM 1040 CG1 VAL B 567 3.049 -16.945 -6.912 1.00 0.00 C ATOM 1041 CG2 VAL B 567 2.093 -14.807 -6.023 1.00 0.00 C ATOM 0 H VAL B 567 3.875 -14.142 -4.144 1.00 0.00 H new ATOM 0 HA VAL B 567 2.854 -16.831 -4.221 1.00 0.00 H new ATOM 0 HB VAL B 567 4.148 -15.187 -6.433 1.00 0.00 H new ATOM 0 HG11 VAL B 567 2.807 -16.613 -7.922 1.00 0.00 H new ATOM 0 HG12 VAL B 567 3.944 -17.566 -6.939 1.00 0.00 H new ATOM 0 HG13 VAL B 567 2.217 -17.524 -6.511 1.00 0.00 H new ATOM 0 HG21 VAL B 567 1.864 -14.505 -7.045 1.00 0.00 H new ATOM 0 HG22 VAL B 567 1.235 -15.326 -5.597 1.00 0.00 H new ATOM 0 HG23 VAL B 567 2.316 -13.923 -5.425 1.00 0.00 H new ATOM 1051 N PHE B 568 6.042 -16.249 -4.250 1.00 0.00 N ATOM 1052 CA PHE B 568 7.366 -16.859 -4.224 1.00 0.00 C ATOM 1053 C PHE B 568 7.347 -18.166 -3.437 1.00 0.00 C ATOM 1054 O PHE B 568 7.381 -19.253 -4.015 1.00 0.00 O ATOM 1055 CB PHE B 568 8.384 -15.896 -3.610 1.00 0.00 C ATOM 1056 CG PHE B 568 8.935 -14.901 -4.591 1.00 0.00 C ATOM 1057 CD1 PHE B 568 8.149 -14.421 -5.626 1.00 0.00 C ATOM 1058 CD2 PHE B 568 10.238 -14.447 -4.477 1.00 0.00 C ATOM 1059 CE1 PHE B 568 8.655 -13.506 -6.531 1.00 0.00 C ATOM 1060 CE2 PHE B 568 10.750 -13.532 -5.379 1.00 0.00 C ATOM 1061 CZ PHE B 568 9.956 -13.060 -6.406 1.00 0.00 C ATOM 0 H PHE B 568 6.025 -15.267 -3.974 1.00 0.00 H new ATOM 0 HA PHE B 568 7.657 -17.077 -5.251 1.00 0.00 H new ATOM 0 HB2 PHE B 568 7.914 -15.360 -2.786 1.00 0.00 H new ATOM 0 HB3 PHE B 568 9.207 -16.471 -3.187 1.00 0.00 H new ATOM 0 HD1 PHE B 568 7.130 -14.765 -5.727 1.00 0.00 H new ATOM 0 HD2 PHE B 568 10.862 -14.812 -3.674 1.00 0.00 H new ATOM 0 HE1 PHE B 568 8.033 -13.140 -7.335 1.00 0.00 H new ATOM 0 HE2 PHE B 568 11.769 -13.187 -5.281 1.00 0.00 H new ATOM 0 HZ PHE B 568 10.352 -12.343 -7.110 1.00 0.00 H new ATOM 1071 N ARG B 569 7.292 -18.052 -2.113 1.00 0.00 N ATOM 1072 CA ARG B 569 7.270 -19.224 -1.246 1.00 0.00 C ATOM 1073 C ARG B 569 6.117 -19.142 -0.249 1.00 0.00 C ATOM 1074 O ARG B 569 5.840 -20.097 0.474 1.00 0.00 O ATOM 1075 CB ARG B 569 8.597 -19.356 -0.497 1.00 0.00 C ATOM 1076 CG ARG B 569 8.912 -18.166 0.397 1.00 0.00 C ATOM 1077 CD ARG B 569 8.185 -18.262 1.729 1.00 0.00 C ATOM 1078 NE ARG B 569 8.865 -17.509 2.779 1.00 0.00 N ATOM 1079 CZ ARG B 569 8.614 -17.664 4.075 1.00 0.00 C ATOM 1080 NH1 ARG B 569 7.706 -18.542 4.476 1.00 0.00 N ATOM 1081 NH2 ARG B 569 9.275 -16.942 4.970 1.00 0.00 N ATOM 0 H ARG B 569 7.262 -17.160 -1.618 1.00 0.00 H new ATOM 0 HA ARG B 569 7.125 -20.105 -1.872 1.00 0.00 H new ATOM 0 HB2 ARG B 569 8.573 -20.260 0.111 1.00 0.00 H new ATOM 0 HB3 ARG B 569 9.403 -19.480 -1.221 1.00 0.00 H new ATOM 0 HG2 ARG B 569 9.987 -18.115 0.571 1.00 0.00 H new ATOM 0 HG3 ARG B 569 8.626 -17.244 -0.109 1.00 0.00 H new ATOM 0 HD2 ARG B 569 7.168 -17.887 1.615 1.00 0.00 H new ATOM 0 HD3 ARG B 569 8.108 -19.308 2.025 1.00 0.00 H new ATOM 0 HE ARG B 569 9.571 -16.827 2.503 1.00 0.00 H new ATOM 0 HH11 ARG B 569 7.198 -19.100 3.790 1.00 0.00 H new ATOM 0 HH12 ARG B 569 7.515 -18.660 5.471 1.00 0.00 H new ATOM 0 HH21 ARG B 569 9.976 -16.268 4.664 1.00 0.00 H new ATOM 0 HH22 ARG B 569 9.082 -17.061 5.964 1.00 0.00 H new ATOM 1095 N SER B 570 5.451 -17.992 -0.218 1.00 0.00 N ATOM 1096 CA SER B 570 4.330 -17.783 0.692 1.00 0.00 C ATOM 1097 C SER B 570 3.048 -18.380 0.122 1.00 0.00 C ATOM 1098 O SER B 570 2.038 -17.690 -0.022 1.00 0.00 O ATOM 1099 CB SER B 570 4.137 -16.289 0.960 1.00 0.00 C ATOM 1100 OG SER B 570 5.304 -15.556 0.634 1.00 0.00 O ATOM 0 H SER B 570 5.668 -17.191 -0.812 1.00 0.00 H new ATOM 0 HA SER B 570 4.557 -18.287 1.631 1.00 0.00 H new ATOM 0 HB2 SER B 570 3.296 -15.918 0.375 1.00 0.00 H new ATOM 0 HB3 SER B 570 3.888 -16.134 2.010 1.00 0.00 H new ATOM 0 HG SER B 570 5.376 -15.471 -0.340 1.00 0.00 H new ATOM 1106 N ARG B 571 3.095 -19.668 -0.203 1.00 0.00 N ATOM 1107 CA ARG B 571 1.939 -20.360 -0.759 1.00 0.00 C ATOM 1108 C ARG B 571 1.247 -21.207 0.305 1.00 0.00 C ATOM 1109 O ARG B 571 0.516 -22.144 -0.012 1.00 0.00 O ATOM 1110 CB ARG B 571 2.362 -21.243 -1.934 1.00 0.00 C ATOM 1111 CG ARG B 571 3.764 -20.951 -2.441 1.00 0.00 C ATOM 1112 CD ARG B 571 4.113 -21.814 -3.644 1.00 0.00 C ATOM 1113 NE ARG B 571 5.542 -22.102 -3.715 1.00 0.00 N ATOM 1114 CZ ARG B 571 6.062 -23.064 -4.471 1.00 0.00 C ATOM 1115 NH1 ARG B 571 5.272 -23.825 -5.215 1.00 0.00 N ATOM 1116 NH2 ARG B 571 7.373 -23.265 -4.481 1.00 0.00 N ATOM 0 H ARG B 571 3.922 -20.254 -0.091 1.00 0.00 H new ATOM 0 HA ARG B 571 1.234 -19.608 -1.114 1.00 0.00 H new ATOM 0 HB2 ARG B 571 2.305 -22.288 -1.631 1.00 0.00 H new ATOM 0 HB3 ARG B 571 1.654 -21.109 -2.752 1.00 0.00 H new ATOM 0 HG2 ARG B 571 3.842 -19.898 -2.712 1.00 0.00 H new ATOM 0 HG3 ARG B 571 4.485 -21.129 -1.643 1.00 0.00 H new ATOM 0 HD2 ARG B 571 3.557 -22.750 -3.592 1.00 0.00 H new ATOM 0 HD3 ARG B 571 3.800 -21.307 -4.557 1.00 0.00 H new ATOM 0 HE ARG B 571 6.177 -21.534 -3.154 1.00 0.00 H new ATOM 0 HH11 ARG B 571 4.263 -23.673 -5.208 1.00 0.00 H new ATOM 0 HH12 ARG B 571 5.673 -24.563 -5.794 1.00 0.00 H new ATOM 0 HH21 ARG B 571 7.983 -22.681 -3.908 1.00 0.00 H new ATOM 0 HH22 ARG B 571 7.771 -24.003 -5.061 1.00 0.00 H new ATOM 1130 N ARG B 572 1.487 -20.871 1.568 1.00 0.00 N ATOM 1131 CA ARG B 572 0.889 -21.602 2.680 1.00 0.00 C ATOM 1132 C ARG B 572 1.315 -21.002 4.016 1.00 0.00 C ATOM 1133 O ARG B 572 0.544 -20.987 4.976 1.00 0.00 O ATOM 1134 CB ARG B 572 1.287 -23.077 2.620 1.00 0.00 C ATOM 1135 CG ARG B 572 0.119 -24.012 2.350 1.00 0.00 C ATOM 1136 CD ARG B 572 -0.951 -23.891 3.424 1.00 0.00 C ATOM 1137 NE ARG B 572 -1.986 -24.912 3.281 1.00 0.00 N ATOM 1138 CZ ARG B 572 -2.792 -25.284 4.269 1.00 0.00 C ATOM 1139 NH1 ARG B 572 -2.681 -24.725 5.467 1.00 0.00 N ATOM 1140 NH2 ARG B 572 -3.709 -26.220 4.062 1.00 0.00 N ATOM 0 H ARG B 572 2.091 -20.098 1.847 1.00 0.00 H new ATOM 0 HA ARG B 572 -0.195 -21.522 2.595 1.00 0.00 H new ATOM 0 HB2 ARG B 572 2.037 -23.211 1.840 1.00 0.00 H new ATOM 0 HB3 ARG B 572 1.755 -23.357 3.564 1.00 0.00 H new ATOM 0 HG2 ARG B 572 -0.314 -23.783 1.376 1.00 0.00 H new ATOM 0 HG3 ARG B 572 0.477 -25.040 2.306 1.00 0.00 H new ATOM 0 HD2 ARG B 572 -0.489 -23.978 4.408 1.00 0.00 H new ATOM 0 HD3 ARG B 572 -1.407 -22.902 3.372 1.00 0.00 H new ATOM 0 HE ARG B 572 -2.096 -25.364 2.373 1.00 0.00 H new ATOM 0 HH11 ARG B 572 -1.975 -24.007 5.631 1.00 0.00 H new ATOM 0 HH12 ARG B 572 -3.302 -25.013 6.224 1.00 0.00 H new ATOM 0 HH21 ARG B 572 -3.796 -26.655 3.143 1.00 0.00 H new ATOM 0 HH22 ARG B 572 -4.327 -26.505 4.821 1.00 0.00 H new ATOM 1154 N ALA B 573 2.549 -20.509 4.072 1.00 0.00 N ATOM 1155 CA ALA B 573 3.077 -19.908 5.290 1.00 0.00 C ATOM 1156 C ALA B 573 2.375 -18.590 5.601 1.00 0.00 C ATOM 1157 O ALA B 573 1.949 -18.356 6.733 1.00 0.00 O ATOM 1158 CB ALA B 573 4.577 -19.692 5.163 1.00 0.00 C ATOM 0 H ALA B 573 3.201 -20.514 3.288 1.00 0.00 H new ATOM 0 HA ALA B 573 2.888 -20.593 6.116 1.00 0.00 H new ATOM 0 HB1 ALA B 573 4.959 -19.242 6.080 1.00 0.00 H new ATOM 0 HB2 ALA B 573 5.070 -20.650 4.996 1.00 0.00 H new ATOM 0 HB3 ALA B 573 4.779 -19.029 4.322 1.00 0.00 H new TER 1164 ALA B 573