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 29:sc= 0.376 USER MOD Single : A 540 SER OG : rot 180:sc= 0.158 USER MOD Single : A 544 THR OG1 : rot -130:sc= -1.11 USER MOD Single : A 570 SER OG : rot -57:sc= 0.363 USER MOD Single : B 536 SER OG : rot -12:sc= 0.563 USER MOD Single : B 540 SER OG : rot 180:sc= 0 USER MOD Single : B 544 THR OG1 : rot 180:sc= -1.13 USER MOD Single : B 570 SER OG : rot 42:sc= 0.67 USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 536 15.882 13.333 2.564 1.00 0.00 N ATOM 2 CA SER A 536 14.491 13.732 2.745 1.00 0.00 C ATOM 3 C SER A 536 14.399 15.182 3.210 1.00 0.00 C ATOM 4 O SER A 536 14.098 15.471 4.368 1.00 0.00 O ATOM 5 CB SER A 536 13.804 12.815 3.759 1.00 0.00 C ATOM 6 OG SER A 536 14.196 11.466 3.574 1.00 0.00 O ATOM 0 HA SER A 536 13.984 13.644 1.784 1.00 0.00 H new ATOM 0 HB2 SER A 536 14.054 13.134 4.771 1.00 0.00 H new ATOM 0 HB3 SER A 536 12.722 12.900 3.656 1.00 0.00 H new ATOM 0 HG SER A 536 15.104 11.437 3.205 1.00 0.00 H new ATOM 12 N PRO A 537 14.662 16.117 2.284 1.00 0.00 N ATOM 13 CA PRO A 537 14.614 17.553 2.574 1.00 0.00 C ATOM 14 C PRO A 537 13.192 18.050 2.811 1.00 0.00 C ATOM 15 O PRO A 537 12.213 17.356 2.537 1.00 0.00 O ATOM 16 CB PRO A 537 15.198 18.189 1.310 1.00 0.00 C ATOM 17 CG PRO A 537 14.940 17.195 0.231 1.00 0.00 C ATOM 18 CD PRO A 537 15.026 15.843 0.884 1.00 0.00 C ATOM 0 HA PRO A 537 15.158 17.803 3.485 1.00 0.00 H new ATOM 0 HB2 PRO A 537 14.721 19.144 1.091 1.00 0.00 H new ATOM 0 HB3 PRO A 537 16.265 18.384 1.422 1.00 0.00 H new ATOM 0 HG2 PRO A 537 13.958 17.351 -0.216 1.00 0.00 H new ATOM 0 HG3 PRO A 537 15.674 17.289 -0.570 1.00 0.00 H new ATOM 0 HD2 PRO A 537 14.342 15.130 0.423 1.00 0.00 H new ATOM 0 HD3 PRO A 537 16.028 15.421 0.804 1.00 0.00 H new ATOM 26 N PRO A 538 13.073 19.279 3.333 1.00 0.00 N ATOM 27 CA PRO A 538 11.774 19.896 3.619 1.00 0.00 C ATOM 28 C PRO A 538 11.011 20.255 2.347 1.00 0.00 C ATOM 29 O PRO A 538 9.785 20.165 2.302 1.00 0.00 O ATOM 30 CB PRO A 538 12.145 21.162 4.395 1.00 0.00 C ATOM 31 CG PRO A 538 13.532 21.484 3.954 1.00 0.00 C ATOM 32 CD PRO A 538 14.198 20.162 3.684 1.00 0.00 C ATOM 0 HA PRO A 538 11.114 19.223 4.166 1.00 0.00 H new ATOM 0 HB2 PRO A 538 11.459 21.979 4.171 1.00 0.00 H new ATOM 0 HB3 PRO A 538 12.101 20.994 5.471 1.00 0.00 H new ATOM 0 HG2 PRO A 538 13.522 22.106 3.059 1.00 0.00 H new ATOM 0 HG3 PRO A 538 14.067 22.041 4.724 1.00 0.00 H new ATOM 0 HD2 PRO A 538 14.921 20.235 2.871 1.00 0.00 H new ATOM 0 HD3 PRO A 538 14.737 19.798 4.558 1.00 0.00 H new ATOM 40 N VAL A 539 11.746 20.662 1.317 1.00 0.00 N ATOM 41 CA VAL A 539 11.138 21.033 0.044 1.00 0.00 C ATOM 42 C VAL A 539 12.122 20.855 -1.107 1.00 0.00 C ATOM 43 O VAL A 539 13.308 20.610 -0.890 1.00 0.00 O ATOM 44 CB VAL A 539 10.644 22.492 0.064 1.00 0.00 C ATOM 45 CG1 VAL A 539 9.343 22.605 0.842 1.00 0.00 C ATOM 46 CG2 VAL A 539 11.708 23.407 0.651 1.00 0.00 C ATOM 0 H VAL A 539 12.763 20.743 1.339 1.00 0.00 H new ATOM 0 HA VAL A 539 10.285 20.371 -0.106 1.00 0.00 H new ATOM 0 HB VAL A 539 10.453 22.807 -0.962 1.00 0.00 H new ATOM 0 HG11 VAL A 539 9.010 23.643 0.845 1.00 0.00 H new ATOM 0 HG12 VAL A 539 8.583 21.981 0.372 1.00 0.00 H new ATOM 0 HG13 VAL A 539 9.502 22.272 1.868 1.00 0.00 H new ATOM 0 HG21 VAL A 539 11.342 24.434 0.657 1.00 0.00 H new ATOM 0 HG22 VAL A 539 11.933 23.096 1.671 1.00 0.00 H new ATOM 0 HG23 VAL A 539 12.613 23.348 0.046 1.00 0.00 H new ATOM 56 N SER A 540 11.622 20.984 -2.331 1.00 0.00 N ATOM 57 CA SER A 540 12.455 20.834 -3.518 1.00 0.00 C ATOM 58 C SER A 540 13.266 19.544 -3.453 1.00 0.00 C ATOM 59 O SER A 540 12.976 18.655 -2.651 1.00 0.00 O ATOM 60 CB SER A 540 13.395 22.034 -3.661 1.00 0.00 C ATOM 61 OG SER A 540 13.792 22.211 -5.009 1.00 0.00 O ATOM 0 H SER A 540 10.643 21.192 -2.527 1.00 0.00 H new ATOM 0 HA SER A 540 11.800 20.787 -4.388 1.00 0.00 H new ATOM 0 HB2 SER A 540 12.897 22.935 -3.304 1.00 0.00 H new ATOM 0 HB3 SER A 540 14.275 21.887 -3.035 1.00 0.00 H new ATOM 0 HG SER A 540 14.390 22.984 -5.075 1.00 0.00 H new ATOM 67 N ARG A 541 14.284 19.448 -4.302 1.00 0.00 N ATOM 68 CA ARG A 541 15.136 18.266 -4.344 1.00 0.00 C ATOM 69 C ARG A 541 14.321 17.019 -4.677 1.00 0.00 C ATOM 70 O ARG A 541 14.654 15.915 -4.249 1.00 0.00 O ATOM 71 CB ARG A 541 15.849 18.078 -3.003 1.00 0.00 C ATOM 72 CG ARG A 541 17.114 18.910 -2.865 1.00 0.00 C ATOM 73 CD ARG A 541 18.154 18.518 -3.901 1.00 0.00 C ATOM 74 NE ARG A 541 18.563 19.654 -4.723 1.00 0.00 N ATOM 75 CZ ARG A 541 19.529 19.595 -5.633 1.00 0.00 C ATOM 76 NH1 ARG A 541 20.181 18.458 -5.837 1.00 0.00 N ATOM 77 NH2 ARG A 541 19.844 20.672 -6.340 1.00 0.00 N ATOM 0 H ARG A 541 14.539 20.175 -4.970 1.00 0.00 H new ATOM 0 HA ARG A 541 15.880 18.413 -5.127 1.00 0.00 H new ATOM 0 HB2 ARG A 541 15.163 18.338 -2.197 1.00 0.00 H new ATOM 0 HB3 ARG A 541 16.101 17.025 -2.880 1.00 0.00 H new ATOM 0 HG2 ARG A 541 16.870 19.967 -2.975 1.00 0.00 H new ATOM 0 HG3 ARG A 541 17.528 18.781 -1.865 1.00 0.00 H new ATOM 0 HD2 ARG A 541 19.027 18.101 -3.399 1.00 0.00 H new ATOM 0 HD3 ARG A 541 17.750 17.734 -4.541 1.00 0.00 H new ATOM 0 HE ARG A 541 18.080 20.542 -4.591 1.00 0.00 H new ATOM 0 HH11 ARG A 541 19.941 17.628 -5.295 1.00 0.00 H new ATOM 0 HH12 ARG A 541 20.923 18.414 -6.536 1.00 0.00 H new ATOM 0 HH21 ARG A 541 19.344 21.548 -6.185 1.00 0.00 H new ATOM 0 HH22 ARG A 541 20.586 20.625 -7.038 1.00 0.00 H new ATOM 91 N GLY A 542 13.251 17.205 -5.444 1.00 0.00 N ATOM 92 CA GLY A 542 12.406 16.088 -5.822 1.00 0.00 C ATOM 93 C GLY A 542 11.848 15.351 -4.621 1.00 0.00 C ATOM 94 O GLY A 542 11.423 14.200 -4.731 1.00 0.00 O ATOM 0 H GLY A 542 12.955 18.110 -5.810 1.00 0.00 H new ATOM 0 HA2 GLY A 542 11.582 16.451 -6.436 1.00 0.00 H new ATOM 0 HA3 GLY A 542 12.980 15.394 -6.436 1.00 0.00 H new ATOM 98 N LEU A 543 11.850 16.015 -3.469 1.00 0.00 N ATOM 99 CA LEU A 543 11.342 15.415 -2.240 1.00 0.00 C ATOM 100 C LEU A 543 10.618 16.451 -1.387 1.00 0.00 C ATOM 101 O LEU A 543 11.188 17.481 -1.025 1.00 0.00 O ATOM 102 CB LEU A 543 12.487 14.790 -1.441 1.00 0.00 C ATOM 103 CG LEU A 543 12.084 14.004 -0.193 1.00 0.00 C ATOM 104 CD1 LEU A 543 11.766 14.950 0.954 1.00 0.00 C ATOM 105 CD2 LEU A 543 10.894 13.103 -0.491 1.00 0.00 C ATOM 0 H LEU A 543 12.197 16.968 -3.361 1.00 0.00 H new ATOM 0 HA LEU A 543 10.631 14.635 -2.514 1.00 0.00 H new ATOM 0 HB2 LEU A 543 13.043 14.124 -2.101 1.00 0.00 H new ATOM 0 HB3 LEU A 543 13.170 15.585 -1.141 1.00 0.00 H new ATOM 0 HG LEU A 543 12.924 13.376 0.104 1.00 0.00 H new ATOM 0 HD11 LEU A 543 11.481 14.373 1.834 1.00 0.00 H new ATOM 0 HD12 LEU A 543 12.645 15.552 1.184 1.00 0.00 H new ATOM 0 HD13 LEU A 543 10.943 15.605 0.668 1.00 0.00 H new ATOM 0 HD21 LEU A 543 10.621 12.551 0.409 1.00 0.00 H new ATOM 0 HD22 LEU A 543 10.049 13.711 -0.814 1.00 0.00 H new ATOM 0 HD23 LEU A 543 11.158 12.400 -1.281 1.00 0.00 H new ATOM 117 N THR A 544 9.358 16.172 -1.067 1.00 0.00 N ATOM 118 CA THR A 544 8.556 17.079 -0.255 1.00 0.00 C ATOM 119 C THR A 544 7.681 16.311 0.728 1.00 0.00 C ATOM 120 O THR A 544 7.423 15.122 0.546 1.00 0.00 O ATOM 121 CB THR A 544 7.660 17.974 -1.132 1.00 0.00 C ATOM 122 OG1 THR A 544 6.342 17.419 -1.212 1.00 0.00 O ATOM 123 CG2 THR A 544 8.241 18.116 -2.531 1.00 0.00 C ATOM 0 H THR A 544 8.871 15.324 -1.358 1.00 0.00 H new ATOM 0 HA THR A 544 9.254 17.707 0.299 1.00 0.00 H new ATOM 0 HB THR A 544 7.611 18.962 -0.674 1.00 0.00 H new ATOM 0 HG1 THR A 544 6.062 17.374 -2.150 1.00 0.00 H new ATOM 0 HG21 THR A 544 7.591 18.752 -3.132 1.00 0.00 H new ATOM 0 HG22 THR A 544 9.232 18.565 -2.469 1.00 0.00 H new ATOM 0 HG23 THR A 544 8.316 17.133 -2.995 1.00 0.00 H new ATOM 131 N GLY A 545 7.227 16.998 1.772 1.00 0.00 N ATOM 132 CA GLY A 545 6.384 16.363 2.768 1.00 0.00 C ATOM 133 C GLY A 545 5.216 15.619 2.151 1.00 0.00 C ATOM 134 O GLY A 545 4.926 14.485 2.527 1.00 0.00 O ATOM 0 H GLY A 545 7.428 17.983 1.946 1.00 0.00 H new ATOM 0 HA2 GLY A 545 6.983 15.668 3.357 1.00 0.00 H new ATOM 0 HA3 GLY A 545 6.006 17.120 3.455 1.00 0.00 H new ATOM 138 N GLY A 546 4.544 16.261 1.201 1.00 0.00 N ATOM 139 CA GLY A 546 3.407 15.638 0.548 1.00 0.00 C ATOM 140 C GLY A 546 3.786 14.371 -0.193 1.00 0.00 C ATOM 141 O GLY A 546 2.990 13.438 -0.287 1.00 0.00 O ATOM 0 H GLY A 546 4.766 17.201 0.872 1.00 0.00 H new ATOM 0 HA2 GLY A 546 2.646 15.405 1.293 1.00 0.00 H new ATOM 0 HA3 GLY A 546 2.962 16.345 -0.152 1.00 0.00 H new ATOM 145 N GLU A 547 5.005 14.339 -0.721 1.00 0.00 N ATOM 146 CA GLU A 547 5.487 13.177 -1.460 1.00 0.00 C ATOM 147 C GLU A 547 5.670 11.980 -0.532 1.00 0.00 C ATOM 148 O GLU A 547 5.333 10.850 -0.885 1.00 0.00 O ATOM 149 CB GLU A 547 6.809 13.501 -2.159 1.00 0.00 C ATOM 150 CG GLU A 547 6.831 14.873 -2.813 1.00 0.00 C ATOM 151 CD GLU A 547 7.702 14.913 -4.054 1.00 0.00 C ATOM 152 OE1 GLU A 547 8.920 15.154 -3.916 1.00 0.00 O ATOM 153 OE2 GLU A 547 7.167 14.704 -5.163 1.00 0.00 O ATOM 0 H GLU A 547 5.677 15.103 -0.651 1.00 0.00 H new ATOM 0 HA GLU A 547 4.740 12.922 -2.212 1.00 0.00 H new ATOM 0 HB2 GLU A 547 7.619 13.441 -1.432 1.00 0.00 H new ATOM 0 HB3 GLU A 547 7.005 12.743 -2.917 1.00 0.00 H new ATOM 0 HG2 GLU A 547 5.814 15.162 -3.078 1.00 0.00 H new ATOM 0 HG3 GLU A 547 7.194 15.608 -2.095 1.00 0.00 H new ATOM 160 N ILE A 548 6.207 12.237 0.657 1.00 0.00 N ATOM 161 CA ILE A 548 6.435 11.181 1.636 1.00 0.00 C ATOM 162 C ILE A 548 5.115 10.609 2.144 1.00 0.00 C ATOM 163 O ILE A 548 4.880 9.403 2.072 1.00 0.00 O ATOM 164 CB ILE A 548 7.255 11.693 2.834 1.00 0.00 C ATOM 165 CG1 ILE A 548 8.704 11.952 2.415 1.00 0.00 C ATOM 166 CG2 ILE A 548 7.201 10.693 3.979 1.00 0.00 C ATOM 167 CD1 ILE A 548 9.021 13.417 2.211 1.00 0.00 C ATOM 0 H ILE A 548 6.492 13.167 0.965 1.00 0.00 H new ATOM 0 HA ILE A 548 6.998 10.396 1.130 1.00 0.00 H new ATOM 0 HB ILE A 548 6.822 12.633 3.177 1.00 0.00 H new ATOM 0 HG12 ILE A 548 9.372 11.547 3.175 1.00 0.00 H new ATOM 0 HG13 ILE A 548 8.908 11.412 1.490 1.00 0.00 H new ATOM 0 HG21 ILE A 548 7.786 11.069 4.819 1.00 0.00 H new ATOM 0 HG22 ILE A 548 6.166 10.553 4.291 1.00 0.00 H new ATOM 0 HG23 ILE A 548 7.613 9.739 3.649 1.00 0.00 H new ATOM 0 HD11 ILE A 548 10.065 13.526 1.915 1.00 0.00 H new ATOM 0 HD12 ILE A 548 8.378 13.823 1.430 1.00 0.00 H new ATOM 0 HD13 ILE A 548 8.849 13.959 3.141 1.00 0.00 H new ATOM 179 N VAL A 549 4.257 11.484 2.657 1.00 0.00 N ATOM 180 CA VAL A 549 2.959 11.067 3.175 1.00 0.00 C ATOM 181 C VAL A 549 2.131 10.379 2.094 1.00 0.00 C ATOM 182 O VAL A 549 1.330 9.491 2.383 1.00 0.00 O ATOM 183 CB VAL A 549 2.165 12.265 3.731 1.00 0.00 C ATOM 184 CG1 VAL A 549 3.061 13.150 4.583 1.00 0.00 C ATOM 185 CG2 VAL A 549 1.539 13.060 2.595 1.00 0.00 C ATOM 0 H VAL A 549 4.437 12.486 2.725 1.00 0.00 H new ATOM 0 HA VAL A 549 3.152 10.362 3.984 1.00 0.00 H new ATOM 0 HB VAL A 549 1.363 11.886 4.364 1.00 0.00 H new ATOM 0 HG11 VAL A 549 2.483 13.991 4.967 1.00 0.00 H new ATOM 0 HG12 VAL A 549 3.457 12.571 5.417 1.00 0.00 H new ATOM 0 HG13 VAL A 549 3.886 13.524 3.977 1.00 0.00 H new ATOM 0 HG21 VAL A 549 0.982 13.903 3.004 1.00 0.00 H new ATOM 0 HG22 VAL A 549 2.323 13.430 1.935 1.00 0.00 H new ATOM 0 HG23 VAL A 549 0.863 12.418 2.031 1.00 0.00 H new ATOM 195 N ALA A 550 2.331 10.797 0.849 1.00 0.00 N ATOM 196 CA ALA A 550 1.605 10.220 -0.276 1.00 0.00 C ATOM 197 C ALA A 550 2.023 8.773 -0.515 1.00 0.00 C ATOM 198 O ALA A 550 1.181 7.890 -0.673 1.00 0.00 O ATOM 199 CB ALA A 550 1.828 11.051 -1.530 1.00 0.00 C ATOM 0 H ALA A 550 2.989 11.533 0.594 1.00 0.00 H new ATOM 0 HA ALA A 550 0.542 10.228 -0.033 1.00 0.00 H new ATOM 0 HB1 ALA A 550 1.280 10.609 -2.362 1.00 0.00 H new ATOM 0 HB2 ALA A 550 1.472 12.067 -1.361 1.00 0.00 H new ATOM 0 HB3 ALA A 550 2.892 11.074 -1.767 1.00 0.00 H new ATOM 205 N VAL A 551 3.331 8.538 -0.542 1.00 0.00 N ATOM 206 CA VAL A 551 3.862 7.197 -0.762 1.00 0.00 C ATOM 207 C VAL A 551 3.379 6.231 0.314 1.00 0.00 C ATOM 208 O VAL A 551 2.906 5.135 0.010 1.00 0.00 O ATOM 209 CB VAL A 551 5.403 7.199 -0.780 1.00 0.00 C ATOM 210 CG1 VAL A 551 5.939 5.776 -0.780 1.00 0.00 C ATOM 211 CG2 VAL A 551 5.920 7.974 -1.981 1.00 0.00 C ATOM 0 H VAL A 551 4.042 9.258 -0.414 1.00 0.00 H new ATOM 0 HA VAL A 551 3.495 6.867 -1.734 1.00 0.00 H new ATOM 0 HB VAL A 551 5.759 7.695 0.123 1.00 0.00 H new ATOM 0 HG11 VAL A 551 7.029 5.798 -0.793 1.00 0.00 H new ATOM 0 HG12 VAL A 551 5.597 5.258 0.116 1.00 0.00 H new ATOM 0 HG13 VAL A 551 5.576 5.251 -1.663 1.00 0.00 H new ATOM 0 HG21 VAL A 551 7.010 7.965 -1.978 1.00 0.00 H new ATOM 0 HG22 VAL A 551 5.556 7.510 -2.898 1.00 0.00 H new ATOM 0 HG23 VAL A 551 5.565 9.003 -1.930 1.00 0.00 H new ATOM 221 N ILE A 552 3.499 6.644 1.570 1.00 0.00 N ATOM 222 CA ILE A 552 3.072 5.815 2.691 1.00 0.00 C ATOM 223 C ILE A 552 1.564 5.596 2.669 1.00 0.00 C ATOM 224 O ILE A 552 1.070 4.566 3.130 1.00 0.00 O ATOM 225 CB ILE A 552 3.469 6.445 4.040 1.00 0.00 C ATOM 226 CG1 ILE A 552 3.014 5.553 5.197 1.00 0.00 C ATOM 227 CG2 ILE A 552 2.870 7.838 4.170 1.00 0.00 C ATOM 228 CD1 ILE A 552 3.425 6.072 6.556 1.00 0.00 C ATOM 0 H ILE A 552 3.888 7.548 1.838 1.00 0.00 H new ATOM 0 HA ILE A 552 3.577 4.855 2.585 1.00 0.00 H new ATOM 0 HB ILE A 552 4.555 6.533 4.079 1.00 0.00 H new ATOM 0 HG12 ILE A 552 1.929 5.457 5.166 1.00 0.00 H new ATOM 0 HG13 ILE A 552 3.426 4.553 5.059 1.00 0.00 H new ATOM 0 HG21 ILE A 552 3.159 8.270 5.128 1.00 0.00 H new ATOM 0 HG22 ILE A 552 3.238 8.469 3.361 1.00 0.00 H new ATOM 0 HG23 ILE A 552 1.783 7.773 4.114 1.00 0.00 H new ATOM 0 HD11 ILE A 552 3.069 5.390 7.329 1.00 0.00 H new ATOM 0 HD12 ILE A 552 4.512 6.141 6.606 1.00 0.00 H new ATOM 0 HD13 ILE A 552 2.991 7.059 6.715 1.00 0.00 H new ATOM 240 N PHE A 553 0.838 6.568 2.128 1.00 0.00 N ATOM 241 CA PHE A 553 -0.616 6.481 2.044 1.00 0.00 C ATOM 242 C PHE A 553 -1.039 5.350 1.112 1.00 0.00 C ATOM 243 O PHE A 553 -1.832 4.486 1.485 1.00 0.00 O ATOM 244 CB PHE A 553 -1.200 7.808 1.555 1.00 0.00 C ATOM 245 CG PHE A 553 -2.657 7.977 1.880 1.00 0.00 C ATOM 246 CD1 PHE A 553 -3.608 7.143 1.315 1.00 0.00 C ATOM 247 CD2 PHE A 553 -3.075 8.970 2.751 1.00 0.00 C ATOM 248 CE1 PHE A 553 -4.949 7.297 1.612 1.00 0.00 C ATOM 249 CE2 PHE A 553 -4.415 9.129 3.053 1.00 0.00 C ATOM 250 CZ PHE A 553 -5.352 8.290 2.483 1.00 0.00 C ATOM 0 H PHE A 553 1.232 7.425 1.741 1.00 0.00 H new ATOM 0 HA PHE A 553 -1.002 6.269 3.041 1.00 0.00 H new ATOM 0 HB2 PHE A 553 -0.639 8.629 2.001 1.00 0.00 H new ATOM 0 HB3 PHE A 553 -1.066 7.879 0.476 1.00 0.00 H new ATOM 0 HD1 PHE A 553 -3.298 6.364 0.635 1.00 0.00 H new ATOM 0 HD2 PHE A 553 -2.345 9.628 3.200 1.00 0.00 H new ATOM 0 HE1 PHE A 553 -5.681 6.642 1.163 1.00 0.00 H new ATOM 0 HE2 PHE A 553 -4.728 9.907 3.733 1.00 0.00 H new ATOM 0 HZ PHE A 553 -6.399 8.410 2.718 1.00 0.00 H new ATOM 260 N GLY A 554 -0.506 5.363 -0.106 1.00 0.00 N ATOM 261 CA GLY A 554 -0.840 4.336 -1.074 1.00 0.00 C ATOM 262 C GLY A 554 -0.154 3.017 -0.781 1.00 0.00 C ATOM 263 O GLY A 554 -0.679 1.950 -1.101 1.00 0.00 O ATOM 0 H GLY A 554 0.152 6.068 -0.439 1.00 0.00 H new ATOM 0 HA2 GLY A 554 -1.920 4.186 -1.082 1.00 0.00 H new ATOM 0 HA3 GLY A 554 -0.558 4.675 -2.071 1.00 0.00 H new ATOM 267 N LEU A 555 1.025 3.088 -0.172 1.00 0.00 N ATOM 268 CA LEU A 555 1.786 1.890 0.164 1.00 0.00 C ATOM 269 C LEU A 555 1.120 1.121 1.301 1.00 0.00 C ATOM 270 O LEU A 555 1.026 -0.106 1.263 1.00 0.00 O ATOM 271 CB LEU A 555 3.217 2.264 0.556 1.00 0.00 C ATOM 272 CG LEU A 555 3.995 1.208 1.343 1.00 0.00 C ATOM 273 CD1 LEU A 555 4.129 -0.071 0.532 1.00 0.00 C ATOM 274 CD2 LEU A 555 5.366 1.739 1.736 1.00 0.00 C ATOM 0 H LEU A 555 1.474 3.963 0.099 1.00 0.00 H new ATOM 0 HA LEU A 555 1.812 1.248 -0.717 1.00 0.00 H new ATOM 0 HB2 LEU A 555 3.773 2.494 -0.353 1.00 0.00 H new ATOM 0 HB3 LEU A 555 3.183 3.178 1.149 1.00 0.00 H new ATOM 0 HG LEU A 555 3.441 0.980 2.254 1.00 0.00 H new ATOM 0 HD11 LEU A 555 4.685 -0.810 1.108 1.00 0.00 H new ATOM 0 HD12 LEU A 555 3.138 -0.461 0.302 1.00 0.00 H new ATOM 0 HD13 LEU A 555 4.660 0.141 -0.396 1.00 0.00 H new ATOM 0 HD21 LEU A 555 5.906 0.975 2.295 1.00 0.00 H new ATOM 0 HD22 LEU A 555 5.928 1.996 0.838 1.00 0.00 H new ATOM 0 HD23 LEU A 555 5.248 2.627 2.357 1.00 0.00 H new ATOM 286 N LEU A 556 0.657 1.852 2.309 1.00 0.00 N ATOM 287 CA LEU A 556 -0.004 1.240 3.457 1.00 0.00 C ATOM 288 C LEU A 556 -1.358 0.661 3.060 1.00 0.00 C ATOM 289 O LEU A 556 -1.627 -0.523 3.272 1.00 0.00 O ATOM 290 CB LEU A 556 -0.184 2.268 4.575 1.00 0.00 C ATOM 291 CG LEU A 556 1.047 2.539 5.441 1.00 0.00 C ATOM 292 CD1 LEU A 556 0.736 3.591 6.495 1.00 0.00 C ATOM 293 CD2 LEU A 556 1.534 1.254 6.095 1.00 0.00 C ATOM 0 H LEU A 556 0.727 2.869 2.355 1.00 0.00 H new ATOM 0 HA LEU A 556 0.627 0.427 3.818 1.00 0.00 H new ATOM 0 HB2 LEU A 556 -0.504 3.209 4.128 1.00 0.00 H new ATOM 0 HB3 LEU A 556 -0.993 1.932 5.224 1.00 0.00 H new ATOM 0 HG LEU A 556 1.842 2.920 4.800 1.00 0.00 H new ATOM 0 HD11 LEU A 556 1.623 3.771 7.102 1.00 0.00 H new ATOM 0 HD12 LEU A 556 0.436 4.518 6.006 1.00 0.00 H new ATOM 0 HD13 LEU A 556 -0.075 3.238 7.133 1.00 0.00 H new ATOM 0 HD21 LEU A 556 2.410 1.467 6.707 1.00 0.00 H new ATOM 0 HD22 LEU A 556 0.744 0.843 6.723 1.00 0.00 H new ATOM 0 HD23 LEU A 556 1.797 0.530 5.324 1.00 0.00 H new ATOM 305 N LEU A 557 -2.209 1.502 2.481 1.00 0.00 N ATOM 306 CA LEU A 557 -3.536 1.073 2.052 1.00 0.00 C ATOM 307 C LEU A 557 -3.440 0.075 0.904 1.00 0.00 C ATOM 308 O LEU A 557 -4.329 -0.755 0.714 1.00 0.00 O ATOM 309 CB LEU A 557 -4.369 2.283 1.623 1.00 0.00 C ATOM 310 CG LEU A 557 -5.008 3.092 2.752 1.00 0.00 C ATOM 311 CD1 LEU A 557 -5.793 4.267 2.188 1.00 0.00 C ATOM 312 CD2 LEU A 557 -5.910 2.204 3.599 1.00 0.00 C ATOM 0 H LEU A 557 -2.004 2.484 2.298 1.00 0.00 H new ATOM 0 HA LEU A 557 -4.024 0.583 2.895 1.00 0.00 H new ATOM 0 HB2 LEU A 557 -3.732 2.949 1.041 1.00 0.00 H new ATOM 0 HB3 LEU A 557 -5.160 1.937 0.958 1.00 0.00 H new ATOM 0 HG LEU A 557 -4.214 3.483 3.388 1.00 0.00 H new ATOM 0 HD11 LEU A 557 -6.241 4.831 3.006 1.00 0.00 H new ATOM 0 HD12 LEU A 557 -5.122 4.915 1.624 1.00 0.00 H new ATOM 0 HD13 LEU A 557 -6.579 3.897 1.529 1.00 0.00 H new ATOM 0 HD21 LEU A 557 -6.357 2.796 4.398 1.00 0.00 H new ATOM 0 HD22 LEU A 557 -6.698 1.784 2.974 1.00 0.00 H new ATOM 0 HD23 LEU A 557 -5.321 1.395 4.032 1.00 0.00 H new ATOM 324 N GLY A 558 -2.355 0.159 0.141 1.00 0.00 N ATOM 325 CA GLY A 558 -2.162 -0.745 -0.978 1.00 0.00 C ATOM 326 C GLY A 558 -1.960 -2.181 -0.535 1.00 0.00 C ATOM 327 O GLY A 558 -2.750 -3.060 -0.876 1.00 0.00 O ATOM 0 H GLY A 558 -1.606 0.837 0.278 1.00 0.00 H new ATOM 0 HA2 GLY A 558 -3.027 -0.690 -1.639 1.00 0.00 H new ATOM 0 HA3 GLY A 558 -1.297 -0.422 -1.557 1.00 0.00 H new ATOM 331 N ALA A 559 -0.896 -2.419 0.226 1.00 0.00 N ATOM 332 CA ALA A 559 -0.593 -3.759 0.716 1.00 0.00 C ATOM 333 C ALA A 559 -1.661 -4.242 1.690 1.00 0.00 C ATOM 334 O ALA A 559 -2.106 -5.387 1.620 1.00 0.00 O ATOM 335 CB ALA A 559 0.777 -3.780 1.378 1.00 0.00 C ATOM 0 H ALA A 559 -0.230 -1.703 0.516 1.00 0.00 H new ATOM 0 HA ALA A 559 -0.584 -4.438 -0.137 1.00 0.00 H new ATOM 0 HB1 ALA A 559 0.991 -4.786 1.739 1.00 0.00 H new ATOM 0 HB2 ALA A 559 1.536 -3.486 0.653 1.00 0.00 H new ATOM 0 HB3 ALA A 559 0.787 -3.084 2.216 1.00 0.00 H new ATOM 341 N ALA A 560 -2.069 -3.362 2.599 1.00 0.00 N ATOM 342 CA ALA A 560 -3.086 -3.699 3.587 1.00 0.00 C ATOM 343 C ALA A 560 -4.322 -4.295 2.920 1.00 0.00 C ATOM 344 O ALA A 560 -4.713 -5.426 3.212 1.00 0.00 O ATOM 345 CB ALA A 560 -3.462 -2.468 4.398 1.00 0.00 C ATOM 0 H ALA A 560 -1.710 -2.410 2.671 1.00 0.00 H new ATOM 0 HA ALA A 560 -2.671 -4.450 4.259 1.00 0.00 H new ATOM 0 HB1 ALA A 560 -4.222 -2.734 5.132 1.00 0.00 H new ATOM 0 HB2 ALA A 560 -2.579 -2.087 4.912 1.00 0.00 H new ATOM 0 HB3 ALA A 560 -3.854 -1.699 3.732 1.00 0.00 H new ATOM 351 N LEU A 561 -4.934 -3.527 2.025 1.00 0.00 N ATOM 352 CA LEU A 561 -6.126 -3.978 1.319 1.00 0.00 C ATOM 353 C LEU A 561 -5.842 -5.251 0.529 1.00 0.00 C ATOM 354 O LEU A 561 -6.692 -6.137 0.432 1.00 0.00 O ATOM 355 CB LEU A 561 -6.631 -2.883 0.377 1.00 0.00 C ATOM 356 CG LEU A 561 -7.797 -3.265 -0.534 1.00 0.00 C ATOM 357 CD1 LEU A 561 -9.016 -3.649 0.291 1.00 0.00 C ATOM 358 CD2 LEU A 561 -8.131 -2.122 -1.482 1.00 0.00 C ATOM 0 H LEU A 561 -4.624 -2.589 1.772 1.00 0.00 H new ATOM 0 HA LEU A 561 -6.896 -4.195 2.060 1.00 0.00 H new ATOM 0 HB2 LEU A 561 -6.932 -2.025 0.978 1.00 0.00 H new ATOM 0 HB3 LEU A 561 -5.799 -2.558 -0.248 1.00 0.00 H new ATOM 0 HG LEU A 561 -7.500 -4.129 -1.129 1.00 0.00 H new ATOM 0 HD11 LEU A 561 -9.836 -3.918 -0.375 1.00 0.00 H new ATOM 0 HD12 LEU A 561 -8.771 -4.500 0.927 1.00 0.00 H new ATOM 0 HD13 LEU A 561 -9.315 -2.805 0.913 1.00 0.00 H new ATOM 0 HD21 LEU A 561 -8.964 -2.412 -2.123 1.00 0.00 H new ATOM 0 HD22 LEU A 561 -8.408 -1.240 -0.905 1.00 0.00 H new ATOM 0 HD23 LEU A 561 -7.261 -1.894 -2.098 1.00 0.00 H new ATOM 370 N LEU A 562 -4.642 -5.338 -0.032 1.00 0.00 N ATOM 371 CA LEU A 562 -4.243 -6.505 -0.811 1.00 0.00 C ATOM 372 C LEU A 562 -4.278 -7.768 0.043 1.00 0.00 C ATOM 373 O LEU A 562 -4.930 -8.752 -0.310 1.00 0.00 O ATOM 374 CB LEU A 562 -2.841 -6.303 -1.388 1.00 0.00 C ATOM 375 CG LEU A 562 -2.495 -7.140 -2.621 1.00 0.00 C ATOM 376 CD1 LEU A 562 -1.105 -6.791 -3.128 1.00 0.00 C ATOM 377 CD2 LEU A 562 -2.591 -8.624 -2.301 1.00 0.00 C ATOM 0 H LEU A 562 -3.927 -4.614 0.038 1.00 0.00 H new ATOM 0 HA LEU A 562 -4.952 -6.624 -1.630 1.00 0.00 H new ATOM 0 HB2 LEU A 562 -2.723 -5.250 -1.644 1.00 0.00 H new ATOM 0 HB3 LEU A 562 -2.113 -6.525 -0.607 1.00 0.00 H new ATOM 0 HG LEU A 562 -3.215 -6.911 -3.407 1.00 0.00 H new ATOM 0 HD11 LEU A 562 -0.875 -7.396 -4.005 1.00 0.00 H new ATOM 0 HD12 LEU A 562 -1.070 -5.735 -3.396 1.00 0.00 H new ATOM 0 HD13 LEU A 562 -0.372 -6.992 -2.347 1.00 0.00 H new ATOM 0 HD21 LEU A 562 -2.342 -9.205 -3.189 1.00 0.00 H new ATOM 0 HD22 LEU A 562 -1.894 -8.869 -1.500 1.00 0.00 H new ATOM 0 HD23 LEU A 562 -3.606 -8.863 -1.984 1.00 0.00 H new ATOM 389 N LEU A 563 -3.575 -7.733 1.169 1.00 0.00 N ATOM 390 CA LEU A 563 -3.526 -8.876 2.076 1.00 0.00 C ATOM 391 C LEU A 563 -4.931 -9.290 2.504 1.00 0.00 C ATOM 392 O LEU A 563 -5.233 -10.478 2.607 1.00 0.00 O ATOM 393 CB LEU A 563 -2.684 -8.538 3.308 1.00 0.00 C ATOM 394 CG LEU A 563 -2.145 -9.731 4.099 1.00 0.00 C ATOM 395 CD1 LEU A 563 -0.797 -10.171 3.549 1.00 0.00 C ATOM 396 CD2 LEU A 563 -2.032 -9.382 5.576 1.00 0.00 C ATOM 0 H LEU A 563 -3.031 -6.927 1.477 1.00 0.00 H new ATOM 0 HA LEU A 563 -3.066 -9.710 1.547 1.00 0.00 H new ATOM 0 HB2 LEU A 563 -1.839 -7.927 2.990 1.00 0.00 H new ATOM 0 HB3 LEU A 563 -3.286 -7.925 3.978 1.00 0.00 H new ATOM 0 HG LEU A 563 -2.845 -10.560 3.993 1.00 0.00 H new ATOM 0 HD11 LEU A 563 -0.429 -11.021 4.124 1.00 0.00 H new ATOM 0 HD12 LEU A 563 -0.907 -10.461 2.504 1.00 0.00 H new ATOM 0 HD13 LEU A 563 -0.087 -9.347 3.624 1.00 0.00 H new ATOM 0 HD21 LEU A 563 -1.647 -10.242 6.125 1.00 0.00 H new ATOM 0 HD22 LEU A 563 -1.353 -8.539 5.700 1.00 0.00 H new ATOM 0 HD23 LEU A 563 -3.015 -9.115 5.963 1.00 0.00 H new ATOM 408 N GLY A 564 -5.784 -8.302 2.752 1.00 0.00 N ATOM 409 CA GLY A 564 -7.147 -8.584 3.163 1.00 0.00 C ATOM 410 C GLY A 564 -7.911 -9.388 2.130 1.00 0.00 C ATOM 411 O GLY A 564 -8.372 -10.493 2.411 1.00 0.00 O ATOM 0 H GLY A 564 -5.556 -7.311 2.676 1.00 0.00 H new ATOM 0 HA2 GLY A 564 -7.133 -9.130 4.106 1.00 0.00 H new ATOM 0 HA3 GLY A 564 -7.669 -7.645 3.347 1.00 0.00 H new ATOM 415 N ILE A 565 -8.046 -8.830 0.931 1.00 0.00 N ATOM 416 CA ILE A 565 -8.759 -9.503 -0.147 1.00 0.00 C ATOM 417 C ILE A 565 -8.241 -10.923 -0.348 1.00 0.00 C ATOM 418 O ILE A 565 -9.015 -11.850 -0.584 1.00 0.00 O ATOM 419 CB ILE A 565 -8.633 -8.730 -1.474 1.00 0.00 C ATOM 420 CG1 ILE A 565 -9.189 -7.312 -1.318 1.00 0.00 C ATOM 421 CG2 ILE A 565 -9.357 -9.469 -2.589 1.00 0.00 C ATOM 422 CD1 ILE A 565 -10.671 -7.274 -1.024 1.00 0.00 C ATOM 0 H ILE A 565 -7.671 -7.915 0.682 1.00 0.00 H new ATOM 0 HA ILE A 565 -9.809 -9.540 0.145 1.00 0.00 H new ATOM 0 HB ILE A 565 -7.578 -8.660 -1.738 1.00 0.00 H new ATOM 0 HG12 ILE A 565 -8.654 -6.807 -0.514 1.00 0.00 H new ATOM 0 HG13 ILE A 565 -8.994 -6.751 -2.232 1.00 0.00 H new ATOM 0 HG21 ILE A 565 -9.259 -8.910 -3.520 1.00 0.00 H new ATOM 0 HG22 ILE A 565 -8.920 -10.460 -2.713 1.00 0.00 H new ATOM 0 HG23 ILE A 565 -10.412 -9.568 -2.335 1.00 0.00 H new ATOM 0 HD11 ILE A 565 -10.996 -6.238 -0.926 1.00 0.00 H new ATOM 0 HD12 ILE A 565 -11.216 -7.750 -1.839 1.00 0.00 H new ATOM 0 HD13 ILE A 565 -10.871 -7.807 -0.094 1.00 0.00 H new ATOM 434 N LEU A 566 -6.926 -11.086 -0.251 1.00 0.00 N ATOM 435 CA LEU A 566 -6.302 -12.394 -0.420 1.00 0.00 C ATOM 436 C LEU A 566 -6.750 -13.356 0.676 1.00 0.00 C ATOM 437 O LEU A 566 -6.902 -14.554 0.440 1.00 0.00 O ATOM 438 CB LEU A 566 -4.778 -12.260 -0.405 1.00 0.00 C ATOM 439 CG LEU A 566 -4.124 -11.897 -1.739 1.00 0.00 C ATOM 440 CD1 LEU A 566 -2.621 -11.737 -1.571 1.00 0.00 C ATOM 441 CD2 LEU A 566 -4.435 -12.952 -2.791 1.00 0.00 C ATOM 0 H LEU A 566 -6.271 -10.329 -0.056 1.00 0.00 H new ATOM 0 HA LEU A 566 -6.615 -12.797 -1.383 1.00 0.00 H new ATOM 0 HB2 LEU A 566 -4.507 -11.501 0.328 1.00 0.00 H new ATOM 0 HB3 LEU A 566 -4.354 -13.203 -0.059 1.00 0.00 H new ATOM 0 HG LEU A 566 -4.535 -10.945 -2.075 1.00 0.00 H new ATOM 0 HD11 LEU A 566 -2.173 -11.479 -2.531 1.00 0.00 H new ATOM 0 HD12 LEU A 566 -2.418 -10.945 -0.851 1.00 0.00 H new ATOM 0 HD13 LEU A 566 -2.193 -12.673 -1.211 1.00 0.00 H new ATOM 0 HD21 LEU A 566 -3.961 -12.677 -3.733 1.00 0.00 H new ATOM 0 HD22 LEU A 566 -4.053 -13.918 -2.461 1.00 0.00 H new ATOM 0 HD23 LEU A 566 -5.514 -13.018 -2.933 1.00 0.00 H new ATOM 453 N VAL A 567 -6.961 -12.822 1.874 1.00 0.00 N ATOM 454 CA VAL A 567 -7.395 -13.633 3.006 1.00 0.00 C ATOM 455 C VAL A 567 -8.892 -13.912 2.941 1.00 0.00 C ATOM 456 O VAL A 567 -9.367 -14.931 3.442 1.00 0.00 O ATOM 457 CB VAL A 567 -7.071 -12.945 4.346 1.00 0.00 C ATOM 458 CG1 VAL A 567 -7.563 -13.788 5.513 1.00 0.00 C ATOM 459 CG2 VAL A 567 -5.577 -12.680 4.462 1.00 0.00 C ATOM 0 H VAL A 567 -6.839 -11.832 2.086 1.00 0.00 H new ATOM 0 HA VAL A 567 -6.850 -14.575 2.947 1.00 0.00 H new ATOM 0 HB VAL A 567 -7.590 -11.987 4.377 1.00 0.00 H new ATOM 0 HG11 VAL A 567 -7.325 -13.286 6.451 1.00 0.00 H new ATOM 0 HG12 VAL A 567 -8.642 -13.921 5.436 1.00 0.00 H new ATOM 0 HG13 VAL A 567 -7.075 -14.762 5.489 1.00 0.00 H new ATOM 0 HG21 VAL A 567 -5.367 -12.194 5.415 1.00 0.00 H new ATOM 0 HG22 VAL A 567 -5.035 -13.624 4.409 1.00 0.00 H new ATOM 0 HG23 VAL A 567 -5.258 -12.032 3.646 1.00 0.00 H new ATOM 469 N PHE A 568 -9.631 -13.001 2.318 1.00 0.00 N ATOM 470 CA PHE A 568 -11.076 -13.149 2.185 1.00 0.00 C ATOM 471 C PHE A 568 -11.426 -14.032 0.991 1.00 0.00 C ATOM 472 O PHE A 568 -12.498 -14.637 0.946 1.00 0.00 O ATOM 473 CB PHE A 568 -11.739 -11.778 2.032 1.00 0.00 C ATOM 474 CG PHE A 568 -11.911 -11.046 3.332 1.00 0.00 C ATOM 475 CD1 PHE A 568 -12.675 -11.589 4.352 1.00 0.00 C ATOM 476 CD2 PHE A 568 -11.309 -9.814 3.533 1.00 0.00 C ATOM 477 CE1 PHE A 568 -12.835 -10.918 5.550 1.00 0.00 C ATOM 478 CE2 PHE A 568 -11.465 -9.139 4.729 1.00 0.00 C ATOM 479 CZ PHE A 568 -12.230 -9.691 5.739 1.00 0.00 C ATOM 0 H PHE A 568 -9.254 -12.152 1.897 1.00 0.00 H new ATOM 0 HA PHE A 568 -11.451 -13.627 3.090 1.00 0.00 H new ATOM 0 HB2 PHE A 568 -11.140 -11.167 1.357 1.00 0.00 H new ATOM 0 HB3 PHE A 568 -12.715 -11.906 1.564 1.00 0.00 H new ATOM 0 HD1 PHE A 568 -13.151 -12.548 4.210 1.00 0.00 H new ATOM 0 HD2 PHE A 568 -10.712 -9.377 2.747 1.00 0.00 H new ATOM 0 HE1 PHE A 568 -13.433 -11.353 6.337 1.00 0.00 H new ATOM 0 HE2 PHE A 568 -10.989 -8.180 4.874 1.00 0.00 H new ATOM 0 HZ PHE A 568 -12.354 -9.164 6.674 1.00 0.00 H new ATOM 489 N ARG A 569 -10.515 -14.101 0.027 1.00 0.00 N ATOM 490 CA ARG A 569 -10.726 -14.908 -1.168 1.00 0.00 C ATOM 491 C ARG A 569 -11.117 -16.336 -0.798 1.00 0.00 C ATOM 492 O ARG A 569 -12.216 -16.792 -1.115 1.00 0.00 O ATOM 493 CB ARG A 569 -9.462 -14.921 -2.031 1.00 0.00 C ATOM 494 CG ARG A 569 -9.744 -14.885 -3.525 1.00 0.00 C ATOM 495 CD ARG A 569 -9.704 -13.465 -4.065 1.00 0.00 C ATOM 496 NE ARG A 569 -9.997 -13.415 -5.495 1.00 0.00 N ATOM 497 CZ ARG A 569 -10.277 -12.293 -6.149 1.00 0.00 C ATOM 498 NH1 ARG A 569 -10.302 -11.135 -5.505 1.00 0.00 N ATOM 499 NH2 ARG A 569 -10.534 -12.330 -7.450 1.00 0.00 N ATOM 0 H ARG A 569 -9.623 -13.607 0.050 1.00 0.00 H new ATOM 0 HA ARG A 569 -11.542 -14.462 -1.737 1.00 0.00 H new ATOM 0 HB2 ARG A 569 -8.842 -14.064 -1.766 1.00 0.00 H new ATOM 0 HB3 ARG A 569 -8.884 -15.816 -1.800 1.00 0.00 H new ATOM 0 HG2 ARG A 569 -9.009 -15.496 -4.050 1.00 0.00 H new ATOM 0 HG3 ARG A 569 -10.722 -15.323 -3.722 1.00 0.00 H new ATOM 0 HD2 ARG A 569 -10.426 -12.851 -3.525 1.00 0.00 H new ATOM 0 HD3 ARG A 569 -8.719 -13.035 -3.881 1.00 0.00 H new ATOM 0 HE ARG A 569 -9.986 -14.289 -6.020 1.00 0.00 H new ATOM 0 HH11 ARG A 569 -10.106 -11.104 -4.505 1.00 0.00 H new ATOM 0 HH12 ARG A 569 -10.517 -10.275 -6.010 1.00 0.00 H new ATOM 0 HH21 ARG A 569 -10.517 -13.220 -7.948 1.00 0.00 H new ATOM 0 HH22 ARG A 569 -10.749 -11.469 -7.952 1.00 0.00 H new ATOM 513 N SER A 570 -10.209 -17.037 -0.126 1.00 0.00 N ATOM 514 CA SER A 570 -10.457 -18.414 0.283 1.00 0.00 C ATOM 515 C SER A 570 -9.302 -18.947 1.126 1.00 0.00 C ATOM 516 O SER A 570 -8.660 -19.933 0.766 1.00 0.00 O ATOM 517 CB SER A 570 -10.660 -19.305 -0.943 1.00 0.00 C ATOM 518 OG SER A 570 -10.913 -20.646 -0.564 1.00 0.00 O ATOM 0 H SER A 570 -9.296 -16.674 0.146 1.00 0.00 H new ATOM 0 HA SER A 570 -11.364 -18.428 0.888 1.00 0.00 H new ATOM 0 HB2 SER A 570 -11.493 -18.928 -1.536 1.00 0.00 H new ATOM 0 HB3 SER A 570 -9.774 -19.264 -1.577 1.00 0.00 H new ATOM 0 HG SER A 570 -10.171 -20.977 -0.016 1.00 0.00 H new ATOM 524 N ARG A 571 -9.044 -18.285 2.250 1.00 0.00 N ATOM 525 CA ARG A 571 -7.966 -18.690 3.144 1.00 0.00 C ATOM 526 C ARG A 571 -7.984 -17.863 4.427 1.00 0.00 C ATOM 527 O ARG A 571 -6.944 -17.394 4.890 1.00 0.00 O ATOM 528 CB ARG A 571 -6.613 -18.540 2.447 1.00 0.00 C ATOM 529 CG ARG A 571 -6.511 -17.299 1.574 1.00 0.00 C ATOM 530 CD ARG A 571 -5.168 -17.225 0.865 1.00 0.00 C ATOM 531 NE ARG A 571 -4.305 -16.193 1.433 1.00 0.00 N ATOM 532 CZ ARG A 571 -3.114 -15.876 0.938 1.00 0.00 C ATOM 533 NH1 ARG A 571 -2.647 -16.510 -0.129 1.00 0.00 N ATOM 534 NH2 ARG A 571 -2.387 -14.925 1.510 1.00 0.00 N ATOM 0 H ARG A 571 -9.567 -17.467 2.563 1.00 0.00 H new ATOM 0 HA ARG A 571 -8.118 -19.737 3.405 1.00 0.00 H new ATOM 0 HB2 ARG A 571 -5.827 -18.509 3.201 1.00 0.00 H new ATOM 0 HB3 ARG A 571 -6.431 -19.422 1.833 1.00 0.00 H new ATOM 0 HG2 ARG A 571 -7.313 -17.305 0.836 1.00 0.00 H new ATOM 0 HG3 ARG A 571 -6.649 -16.409 2.188 1.00 0.00 H new ATOM 0 HD2 ARG A 571 -4.669 -18.192 0.932 1.00 0.00 H new ATOM 0 HD3 ARG A 571 -5.328 -17.021 -0.194 1.00 0.00 H new ATOM 0 HE ARG A 571 -4.635 -15.688 2.255 1.00 0.00 H new ATOM 0 HH11 ARG A 571 -3.203 -17.242 -0.571 1.00 0.00 H new ATOM 0 HH12 ARG A 571 -1.732 -16.265 -0.508 1.00 0.00 H new ATOM 0 HH21 ARG A 571 -2.742 -14.436 2.331 1.00 0.00 H new ATOM 0 HH22 ARG A 571 -1.473 -14.683 1.128 1.00 0.00 H new ATOM 548 N ARG A 572 -9.172 -17.687 4.994 1.00 0.00 N ATOM 549 CA ARG A 572 -9.326 -16.916 6.222 1.00 0.00 C ATOM 550 C ARG A 572 -8.939 -17.749 7.440 1.00 0.00 C ATOM 551 O ARG A 572 -9.780 -18.069 8.278 1.00 0.00 O ATOM 552 CB ARG A 572 -10.768 -16.425 6.364 1.00 0.00 C ATOM 553 CG ARG A 572 -10.920 -15.246 7.311 1.00 0.00 C ATOM 554 CD ARG A 572 -11.798 -15.597 8.502 1.00 0.00 C ATOM 555 NE ARG A 572 -11.496 -14.770 9.668 1.00 0.00 N ATOM 556 CZ ARG A 572 -12.319 -14.628 10.700 1.00 0.00 C ATOM 557 NH1 ARG A 572 -13.488 -15.253 10.712 1.00 0.00 N ATOM 558 NH2 ARG A 572 -11.973 -13.858 11.724 1.00 0.00 N ATOM 0 H ARG A 572 -10.043 -18.068 4.623 1.00 0.00 H new ATOM 0 HA ARG A 572 -8.660 -16.055 6.166 1.00 0.00 H new ATOM 0 HB2 ARG A 572 -11.145 -16.142 5.381 1.00 0.00 H new ATOM 0 HB3 ARG A 572 -11.390 -17.247 6.719 1.00 0.00 H new ATOM 0 HG2 ARG A 572 -9.937 -14.931 7.662 1.00 0.00 H new ATOM 0 HG3 ARG A 572 -11.353 -14.401 6.775 1.00 0.00 H new ATOM 0 HD2 ARG A 572 -12.846 -15.471 8.230 1.00 0.00 H new ATOM 0 HD3 ARG A 572 -11.660 -16.648 8.757 1.00 0.00 H new ATOM 0 HE ARG A 572 -10.604 -14.275 9.690 1.00 0.00 H new ATOM 0 HH11 ARG A 572 -13.758 -15.845 9.927 1.00 0.00 H new ATOM 0 HH12 ARG A 572 -14.118 -15.142 11.507 1.00 0.00 H new ATOM 0 HH21 ARG A 572 -11.075 -13.375 11.718 1.00 0.00 H new ATOM 0 HH22 ARG A 572 -12.606 -13.749 12.517 1.00 0.00 H new ATOM 572 N ALA A 573 -7.659 -18.096 7.530 1.00 0.00 N ATOM 573 CA ALA A 573 -7.160 -18.890 8.645 1.00 0.00 C ATOM 574 C ALA A 573 -6.225 -18.070 9.528 1.00 0.00 C ATOM 575 O ALA A 573 -5.424 -18.651 10.259 1.00 0.00 O ATOM 576 CB ALA A 573 -6.448 -20.133 8.132 1.00 0.00 C ATOM 0 H ALA A 573 -6.949 -17.839 6.844 1.00 0.00 H new ATOM 0 HA ALA A 573 -8.013 -19.197 9.250 1.00 0.00 H new ATOM 0 HB1 ALA A 573 -6.081 -20.716 8.976 1.00 0.00 H new ATOM 0 HB2 ALA A 573 -7.144 -20.737 7.549 1.00 0.00 H new ATOM 0 HB3 ALA A 573 -5.609 -19.838 7.502 1.00 0.00 H new TER 582 ALA A 573 ATOM 583 N SER B 536 -8.408 19.928 -11.107 1.00 0.00 N ATOM 584 CA SER B 536 -7.842 20.250 -9.803 1.00 0.00 C ATOM 585 C SER B 536 -6.775 21.334 -9.926 1.00 0.00 C ATOM 586 O SER B 536 -6.228 21.584 -11.000 1.00 0.00 O ATOM 587 CB SER B 536 -7.240 18.998 -9.161 1.00 0.00 C ATOM 588 OG SER B 536 -6.778 18.092 -10.148 1.00 0.00 O ATOM 0 HA SER B 536 -8.645 20.625 -9.169 1.00 0.00 H new ATOM 0 HB2 SER B 536 -6.415 19.281 -8.508 1.00 0.00 H new ATOM 0 HB3 SER B 536 -7.988 18.510 -8.536 1.00 0.00 H new ATOM 0 HG SER B 536 -7.113 18.367 -11.027 1.00 0.00 H new ATOM 594 N PRO B 537 -6.473 21.996 -8.799 1.00 0.00 N ATOM 595 CA PRO B 537 -5.468 23.064 -8.753 1.00 0.00 C ATOM 596 C PRO B 537 -4.051 22.536 -8.941 1.00 0.00 C ATOM 597 O PRO B 537 -3.782 21.344 -8.792 1.00 0.00 O ATOM 598 CB PRO B 537 -5.640 23.651 -7.350 1.00 0.00 C ATOM 599 CG PRO B 537 -6.216 22.540 -6.542 1.00 0.00 C ATOM 600 CD PRO B 537 -7.085 21.752 -7.483 1.00 0.00 C ATOM 0 HA PRO B 537 -5.607 23.790 -9.554 1.00 0.00 H new ATOM 0 HB2 PRO B 537 -4.686 23.985 -6.941 1.00 0.00 H new ATOM 0 HB3 PRO B 537 -6.302 24.517 -7.362 1.00 0.00 H new ATOM 0 HG2 PRO B 537 -5.429 21.914 -6.121 1.00 0.00 H new ATOM 0 HG3 PRO B 537 -6.797 22.927 -5.705 1.00 0.00 H new ATOM 0 HD2 PRO B 537 -7.089 20.691 -7.233 1.00 0.00 H new ATOM 0 HD3 PRO B 537 -8.121 22.091 -7.453 1.00 0.00 H new ATOM 608 N PRO B 538 -3.121 23.443 -9.276 1.00 0.00 N ATOM 609 CA PRO B 538 -1.714 23.091 -9.489 1.00 0.00 C ATOM 610 C PRO B 538 -1.009 22.701 -8.194 1.00 0.00 C ATOM 611 O PRO B 538 -0.371 21.652 -8.113 1.00 0.00 O ATOM 612 CB PRO B 538 -1.109 24.376 -10.062 1.00 0.00 C ATOM 613 CG PRO B 538 -1.987 25.466 -9.552 1.00 0.00 C ATOM 614 CD PRO B 538 -3.370 24.880 -9.470 1.00 0.00 C ATOM 0 HA PRO B 538 -1.606 22.225 -10.142 1.00 0.00 H new ATOM 0 HB2 PRO B 538 -0.079 24.510 -9.732 1.00 0.00 H new ATOM 0 HB3 PRO B 538 -1.095 24.356 -11.152 1.00 0.00 H new ATOM 0 HG2 PRO B 538 -1.651 25.812 -8.574 1.00 0.00 H new ATOM 0 HG3 PRO B 538 -1.967 26.328 -10.219 1.00 0.00 H new ATOM 0 HD2 PRO B 538 -3.938 25.305 -8.642 1.00 0.00 H new ATOM 0 HD3 PRO B 538 -3.941 25.070 -10.379 1.00 0.00 H new ATOM 622 N VAL B 539 -1.130 23.554 -7.182 1.00 0.00 N ATOM 623 CA VAL B 539 -0.506 23.299 -5.888 1.00 0.00 C ATOM 624 C VAL B 539 -1.129 24.162 -4.798 1.00 0.00 C ATOM 625 O VAL B 539 -2.015 24.974 -5.064 1.00 0.00 O ATOM 626 CB VAL B 539 1.011 23.564 -5.935 1.00 0.00 C ATOM 627 CG1 VAL B 539 1.760 22.308 -6.353 1.00 0.00 C ATOM 628 CG2 VAL B 539 1.321 24.718 -6.876 1.00 0.00 C ATOM 0 H VAL B 539 -1.654 24.428 -7.233 1.00 0.00 H new ATOM 0 HA VAL B 539 -0.676 22.248 -5.656 1.00 0.00 H new ATOM 0 HB VAL B 539 1.345 23.841 -4.935 1.00 0.00 H new ATOM 0 HG11 VAL B 539 2.830 22.515 -6.381 1.00 0.00 H new ATOM 0 HG12 VAL B 539 1.563 21.511 -5.636 1.00 0.00 H new ATOM 0 HG13 VAL B 539 1.425 21.997 -7.342 1.00 0.00 H new ATOM 0 HG21 VAL B 539 2.397 24.891 -6.897 1.00 0.00 H new ATOM 0 HG22 VAL B 539 0.973 24.473 -7.880 1.00 0.00 H new ATOM 0 HG23 VAL B 539 0.815 25.618 -6.527 1.00 0.00 H new ATOM 638 N SER B 540 -0.660 23.981 -3.567 1.00 0.00 N ATOM 639 CA SER B 540 -1.173 24.741 -2.434 1.00 0.00 C ATOM 640 C SER B 540 -2.666 24.493 -2.245 1.00 0.00 C ATOM 641 O SER B 540 -3.432 25.419 -1.973 1.00 0.00 O ATOM 642 CB SER B 540 -0.915 26.236 -2.637 1.00 0.00 C ATOM 643 OG SER B 540 -0.890 26.921 -1.396 1.00 0.00 O ATOM 0 H SER B 540 0.075 23.314 -3.330 1.00 0.00 H new ATOM 0 HA SER B 540 -0.650 24.407 -1.538 1.00 0.00 H new ATOM 0 HB2 SER B 540 0.034 26.378 -3.154 1.00 0.00 H new ATOM 0 HB3 SER B 540 -1.691 26.659 -3.274 1.00 0.00 H new ATOM 0 HG SER B 540 -0.722 27.874 -1.552 1.00 0.00 H new ATOM 649 N ARG B 541 -3.074 23.236 -2.389 1.00 0.00 N ATOM 650 CA ARG B 541 -4.475 22.864 -2.234 1.00 0.00 C ATOM 651 C ARG B 541 -4.606 21.419 -1.764 1.00 0.00 C ATOM 652 O ARG B 541 -5.504 20.696 -2.190 1.00 0.00 O ATOM 653 CB ARG B 541 -5.222 23.051 -3.557 1.00 0.00 C ATOM 654 CG ARG B 541 -5.592 24.496 -3.849 1.00 0.00 C ATOM 655 CD ARG B 541 -6.539 25.052 -2.799 1.00 0.00 C ATOM 656 NE ARG B 541 -6.025 26.276 -2.190 1.00 0.00 N ATOM 657 CZ ARG B 541 -6.727 27.032 -1.353 1.00 0.00 C ATOM 658 NH1 ARG B 541 -7.967 26.691 -1.027 1.00 0.00 N ATOM 659 NH2 ARG B 541 -6.190 28.131 -0.840 1.00 0.00 N ATOM 0 H ARG B 541 -2.454 22.458 -2.613 1.00 0.00 H new ATOM 0 HA ARG B 541 -4.916 23.514 -1.479 1.00 0.00 H new ATOM 0 HB2 ARG B 541 -4.603 22.672 -4.370 1.00 0.00 H new ATOM 0 HB3 ARG B 541 -6.130 22.449 -3.540 1.00 0.00 H new ATOM 0 HG2 ARG B 541 -4.688 25.104 -3.884 1.00 0.00 H new ATOM 0 HG3 ARG B 541 -6.058 24.562 -4.832 1.00 0.00 H new ATOM 0 HD2 ARG B 541 -7.508 25.254 -3.256 1.00 0.00 H new ATOM 0 HD3 ARG B 541 -6.701 24.303 -2.024 1.00 0.00 H new ATOM 0 HE ARG B 541 -5.075 26.566 -2.420 1.00 0.00 H new ATOM 0 HH11 ARG B 541 -8.384 25.847 -1.419 1.00 0.00 H new ATOM 0 HH12 ARG B 541 -8.504 27.273 -0.384 1.00 0.00 H new ATOM 0 HH21 ARG B 541 -5.237 28.397 -1.088 1.00 0.00 H new ATOM 0 HH22 ARG B 541 -6.730 28.711 -0.198 1.00 0.00 H new ATOM 673 N GLY B 542 -3.701 21.005 -0.881 1.00 0.00 N ATOM 674 CA GLY B 542 -3.732 19.649 -0.368 1.00 0.00 C ATOM 675 C GLY B 542 -3.590 18.610 -1.463 1.00 0.00 C ATOM 676 O GLY B 542 -3.912 17.438 -1.263 1.00 0.00 O ATOM 0 H GLY B 542 -2.947 21.585 -0.513 1.00 0.00 H new ATOM 0 HA2 GLY B 542 -2.928 19.520 0.357 1.00 0.00 H new ATOM 0 HA3 GLY B 542 -4.670 19.486 0.163 1.00 0.00 H new ATOM 680 N LEU B 543 -3.111 19.040 -2.625 1.00 0.00 N ATOM 681 CA LEU B 543 -2.929 18.139 -3.758 1.00 0.00 C ATOM 682 C LEU B 543 -1.889 18.689 -4.729 1.00 0.00 C ATOM 683 O LEU B 543 -2.028 19.800 -5.241 1.00 0.00 O ATOM 684 CB LEU B 543 -4.259 17.926 -4.483 1.00 0.00 C ATOM 685 CG LEU B 543 -4.244 16.912 -5.628 1.00 0.00 C ATOM 686 CD1 LEU B 543 -3.626 17.525 -6.875 1.00 0.00 C ATOM 687 CD2 LEU B 543 -3.489 15.656 -5.218 1.00 0.00 C ATOM 0 H LEU B 543 -2.842 20.007 -2.808 1.00 0.00 H new ATOM 0 HA LEU B 543 -2.573 17.182 -3.377 1.00 0.00 H new ATOM 0 HB2 LEU B 543 -5.002 17.607 -3.752 1.00 0.00 H new ATOM 0 HB3 LEU B 543 -4.592 18.886 -4.878 1.00 0.00 H new ATOM 0 HG LEU B 543 -5.273 16.635 -5.856 1.00 0.00 H new ATOM 0 HD11 LEU B 543 -3.624 16.789 -7.679 1.00 0.00 H new ATOM 0 HD12 LEU B 543 -4.209 18.394 -7.180 1.00 0.00 H new ATOM 0 HD13 LEU B 543 -2.602 17.831 -6.661 1.00 0.00 H new ATOM 0 HD21 LEU B 543 -3.488 14.946 -6.045 1.00 0.00 H new ATOM 0 HD22 LEU B 543 -2.462 15.916 -4.962 1.00 0.00 H new ATOM 0 HD23 LEU B 543 -3.975 15.205 -4.353 1.00 0.00 H new ATOM 699 N THR B 544 -0.847 17.902 -4.981 1.00 0.00 N ATOM 700 CA THR B 544 0.215 18.309 -5.891 1.00 0.00 C ATOM 701 C THR B 544 0.702 17.132 -6.729 1.00 0.00 C ATOM 702 O THR B 544 0.494 15.974 -6.369 1.00 0.00 O ATOM 703 CB THR B 544 1.410 18.910 -5.128 1.00 0.00 C ATOM 704 OG1 THR B 544 2.420 17.913 -4.935 1.00 0.00 O ATOM 705 CG2 THR B 544 0.970 19.459 -3.778 1.00 0.00 C ATOM 0 H THR B 544 -0.717 16.979 -4.567 1.00 0.00 H new ATOM 0 HA THR B 544 -0.207 19.070 -6.548 1.00 0.00 H new ATOM 0 HB THR B 544 1.816 19.729 -5.722 1.00 0.00 H new ATOM 0 HG1 THR B 544 3.177 18.304 -4.450 1.00 0.00 H new ATOM 0 HG21 THR B 544 1.831 19.878 -3.258 1.00 0.00 H new ATOM 0 HG22 THR B 544 0.222 20.238 -3.928 1.00 0.00 H new ATOM 0 HG23 THR B 544 0.541 18.655 -3.180 1.00 0.00 H new ATOM 713 N GLY B 545 1.351 17.436 -7.848 1.00 0.00 N ATOM 714 CA GLY B 545 1.858 16.392 -8.719 1.00 0.00 C ATOM 715 C GLY B 545 2.676 15.359 -7.971 1.00 0.00 C ATOM 716 O GLY B 545 2.506 14.157 -8.172 1.00 0.00 O ATOM 0 H GLY B 545 1.535 18.387 -8.167 1.00 0.00 H new ATOM 0 HA2 GLY B 545 1.022 15.899 -9.215 1.00 0.00 H new ATOM 0 HA3 GLY B 545 2.472 16.841 -9.500 1.00 0.00 H new ATOM 720 N GLY B 546 3.569 15.828 -7.103 1.00 0.00 N ATOM 721 CA GLY B 546 4.405 14.923 -6.337 1.00 0.00 C ATOM 722 C GLY B 546 3.597 14.015 -5.431 1.00 0.00 C ATOM 723 O GLY B 546 3.983 12.874 -5.180 1.00 0.00 O ATOM 0 H GLY B 546 3.728 16.818 -6.917 1.00 0.00 H new ATOM 0 HA2 GLY B 546 4.998 14.315 -7.020 1.00 0.00 H new ATOM 0 HA3 GLY B 546 5.106 15.502 -5.735 1.00 0.00 H new ATOM 727 N GLU B 547 2.470 14.522 -4.938 1.00 0.00 N ATOM 728 CA GLU B 547 1.608 13.748 -4.054 1.00 0.00 C ATOM 729 C GLU B 547 0.958 12.589 -4.804 1.00 0.00 C ATOM 730 O GLU B 547 0.857 11.477 -4.283 1.00 0.00 O ATOM 731 CB GLU B 547 0.528 14.645 -3.445 1.00 0.00 C ATOM 732 CG GLU B 547 1.044 16.003 -3.000 1.00 0.00 C ATOM 733 CD GLU B 547 0.289 16.551 -1.805 1.00 0.00 C ATOM 734 OE1 GLU B 547 -0.751 17.210 -2.013 1.00 0.00 O ATOM 735 OE2 GLU B 547 0.738 16.322 -0.662 1.00 0.00 O ATOM 0 H GLU B 547 2.134 15.464 -5.136 1.00 0.00 H new ATOM 0 HA GLU B 547 2.225 13.339 -3.254 1.00 0.00 H new ATOM 0 HB2 GLU B 547 -0.267 14.790 -4.176 1.00 0.00 H new ATOM 0 HB3 GLU B 547 0.085 14.136 -2.589 1.00 0.00 H new ATOM 0 HG2 GLU B 547 2.102 15.922 -2.750 1.00 0.00 H new ATOM 0 HG3 GLU B 547 0.965 16.707 -3.829 1.00 0.00 H new ATOM 742 N ILE B 548 0.520 12.856 -6.029 1.00 0.00 N ATOM 743 CA ILE B 548 -0.119 11.836 -6.851 1.00 0.00 C ATOM 744 C ILE B 548 0.871 10.742 -7.237 1.00 0.00 C ATOM 745 O ILE B 548 0.638 9.560 -6.980 1.00 0.00 O ATOM 746 CB ILE B 548 -0.723 12.442 -8.132 1.00 0.00 C ATOM 747 CG1 ILE B 548 -1.948 13.292 -7.792 1.00 0.00 C ATOM 748 CG2 ILE B 548 -1.091 11.341 -9.115 1.00 0.00 C ATOM 749 CD1 ILE B 548 -1.677 14.780 -7.815 1.00 0.00 C ATOM 0 H ILE B 548 0.596 13.770 -6.475 1.00 0.00 H new ATOM 0 HA ILE B 548 -0.920 11.403 -6.251 1.00 0.00 H new ATOM 0 HB ILE B 548 0.023 13.085 -8.599 1.00 0.00 H new ATOM 0 HG12 ILE B 548 -2.745 13.065 -8.500 1.00 0.00 H new ATOM 0 HG13 ILE B 548 -2.311 13.012 -6.803 1.00 0.00 H new ATOM 0 HG21 ILE B 548 -1.517 11.784 -10.015 1.00 0.00 H new ATOM 0 HG22 ILE B 548 -0.198 10.774 -9.377 1.00 0.00 H new ATOM 0 HG23 ILE B 548 -1.823 10.675 -8.658 1.00 0.00 H new ATOM 0 HD11 ILE B 548 -2.590 15.320 -7.565 1.00 0.00 H new ATOM 0 HD12 ILE B 548 -0.902 15.020 -7.087 1.00 0.00 H new ATOM 0 HD13 ILE B 548 -1.343 15.074 -8.810 1.00 0.00 H new ATOM 761 N VAL B 549 1.977 11.143 -7.855 1.00 0.00 N ATOM 762 CA VAL B 549 3.005 10.197 -8.273 1.00 0.00 C ATOM 763 C VAL B 549 3.538 9.403 -7.087 1.00 0.00 C ATOM 764 O VAL B 549 3.941 8.249 -7.230 1.00 0.00 O ATOM 765 CB VAL B 549 4.179 10.915 -8.966 1.00 0.00 C ATOM 766 CG1 VAL B 549 3.663 11.943 -9.962 1.00 0.00 C ATOM 767 CG2 VAL B 549 5.087 11.567 -7.935 1.00 0.00 C ATOM 0 H VAL B 549 2.184 12.117 -8.077 1.00 0.00 H new ATOM 0 HA VAL B 549 2.537 9.514 -8.981 1.00 0.00 H new ATOM 0 HB VAL B 549 4.763 10.175 -9.514 1.00 0.00 H new ATOM 0 HG11 VAL B 549 4.506 12.440 -10.442 1.00 0.00 H new ATOM 0 HG12 VAL B 549 3.057 11.444 -10.719 1.00 0.00 H new ATOM 0 HG13 VAL B 549 3.055 12.682 -9.440 1.00 0.00 H new ATOM 0 HG21 VAL B 549 5.911 12.070 -8.442 1.00 0.00 H new ATOM 0 HG22 VAL B 549 4.518 12.295 -7.358 1.00 0.00 H new ATOM 0 HG23 VAL B 549 5.484 10.804 -7.266 1.00 0.00 H new ATOM 777 N ALA B 550 3.537 10.029 -5.914 1.00 0.00 N ATOM 778 CA ALA B 550 4.019 9.380 -4.701 1.00 0.00 C ATOM 779 C ALA B 550 3.090 8.247 -4.280 1.00 0.00 C ATOM 780 O ALA B 550 3.538 7.138 -3.990 1.00 0.00 O ATOM 781 CB ALA B 550 4.158 10.397 -3.578 1.00 0.00 C ATOM 0 H ALA B 550 3.208 10.985 -5.779 1.00 0.00 H new ATOM 0 HA ALA B 550 4.999 8.952 -4.911 1.00 0.00 H new ATOM 0 HB1 ALA B 550 4.519 9.899 -2.678 1.00 0.00 H new ATOM 0 HB2 ALA B 550 4.867 11.171 -3.873 1.00 0.00 H new ATOM 0 HB3 ALA B 550 3.188 10.852 -3.377 1.00 0.00 H new ATOM 787 N VAL B 551 1.792 8.533 -4.247 1.00 0.00 N ATOM 788 CA VAL B 551 0.799 7.537 -3.861 1.00 0.00 C ATOM 789 C VAL B 551 0.853 6.323 -4.779 1.00 0.00 C ATOM 790 O VAL B 551 0.881 5.182 -4.315 1.00 0.00 O ATOM 791 CB VAL B 551 -0.625 8.125 -3.888 1.00 0.00 C ATOM 792 CG1 VAL B 551 -1.662 7.022 -3.736 1.00 0.00 C ATOM 793 CG2 VAL B 551 -0.789 9.175 -2.799 1.00 0.00 C ATOM 0 H VAL B 551 1.404 9.446 -4.483 1.00 0.00 H new ATOM 0 HA VAL B 551 1.038 7.229 -2.843 1.00 0.00 H new ATOM 0 HB VAL B 551 -0.781 8.607 -4.853 1.00 0.00 H new ATOM 0 HG11 VAL B 551 -2.661 7.457 -3.757 1.00 0.00 H new ATOM 0 HG12 VAL B 551 -1.558 6.310 -4.555 1.00 0.00 H new ATOM 0 HG13 VAL B 551 -1.510 6.508 -2.787 1.00 0.00 H new ATOM 0 HG21 VAL B 551 -1.801 9.579 -2.833 1.00 0.00 H new ATOM 0 HG22 VAL B 551 -0.613 8.719 -1.825 1.00 0.00 H new ATOM 0 HG23 VAL B 551 -0.071 9.980 -2.958 1.00 0.00 H new ATOM 803 N ILE B 552 0.868 6.574 -6.083 1.00 0.00 N ATOM 804 CA ILE B 552 0.920 5.500 -7.068 1.00 0.00 C ATOM 805 C ILE B 552 2.231 4.727 -6.968 1.00 0.00 C ATOM 806 O ILE B 552 2.281 3.530 -7.253 1.00 0.00 O ATOM 807 CB ILE B 552 0.764 6.041 -8.501 1.00 0.00 C ATOM 808 CG1 ILE B 552 0.817 4.893 -9.511 1.00 0.00 C ATOM 809 CG2 ILE B 552 1.847 7.068 -8.799 1.00 0.00 C ATOM 810 CD1 ILE B 552 0.603 5.337 -10.941 1.00 0.00 C ATOM 0 H ILE B 552 0.845 7.512 -6.483 1.00 0.00 H new ATOM 0 HA ILE B 552 0.088 4.831 -6.850 1.00 0.00 H new ATOM 0 HB ILE B 552 -0.206 6.530 -8.587 1.00 0.00 H new ATOM 0 HG12 ILE B 552 1.784 4.396 -9.434 1.00 0.00 H new ATOM 0 HG13 ILE B 552 0.058 4.155 -9.251 1.00 0.00 H new ATOM 0 HG21 ILE B 552 1.724 7.442 -9.816 1.00 0.00 H new ATOM 0 HG22 ILE B 552 1.766 7.897 -8.095 1.00 0.00 H new ATOM 0 HG23 ILE B 552 2.827 6.602 -8.700 1.00 0.00 H new ATOM 0 HD11 ILE B 552 0.654 4.472 -11.602 1.00 0.00 H new ATOM 0 HD12 ILE B 552 -0.376 5.807 -11.033 1.00 0.00 H new ATOM 0 HD13 ILE B 552 1.377 6.052 -11.220 1.00 0.00 H new ATOM 822 N PHE B 553 3.290 5.418 -6.559 1.00 0.00 N ATOM 823 CA PHE B 553 4.601 4.796 -6.420 1.00 0.00 C ATOM 824 C PHE B 553 4.600 3.767 -5.294 1.00 0.00 C ATOM 825 O PHE B 553 5.002 2.619 -5.486 1.00 0.00 O ATOM 826 CB PHE B 553 5.667 5.860 -6.152 1.00 0.00 C ATOM 827 CG PHE B 553 7.062 5.406 -6.475 1.00 0.00 C ATOM 828 CD1 PHE B 553 7.630 4.335 -5.803 1.00 0.00 C ATOM 829 CD2 PHE B 553 7.806 6.049 -7.451 1.00 0.00 C ATOM 830 CE1 PHE B 553 8.913 3.916 -6.098 1.00 0.00 C ATOM 831 CE2 PHE B 553 9.090 5.633 -7.751 1.00 0.00 C ATOM 832 CZ PHE B 553 9.644 4.565 -7.073 1.00 0.00 C ATOM 0 H PHE B 553 3.266 6.409 -6.318 1.00 0.00 H new ATOM 0 HA PHE B 553 4.833 4.285 -7.354 1.00 0.00 H new ATOM 0 HB2 PHE B 553 5.438 6.749 -6.740 1.00 0.00 H new ATOM 0 HB3 PHE B 553 5.622 6.151 -5.103 1.00 0.00 H new ATOM 0 HD1 PHE B 553 7.063 3.822 -5.040 1.00 0.00 H new ATOM 0 HD2 PHE B 553 7.378 6.885 -7.984 1.00 0.00 H new ATOM 0 HE1 PHE B 553 9.344 3.081 -5.566 1.00 0.00 H new ATOM 0 HE2 PHE B 553 9.659 6.143 -8.515 1.00 0.00 H new ATOM 0 HZ PHE B 553 10.647 4.238 -7.305 1.00 0.00 H new ATOM 842 N GLY B 554 4.143 4.186 -4.118 1.00 0.00 N ATOM 843 CA GLY B 554 4.097 3.289 -2.978 1.00 0.00 C ATOM 844 C GLY B 554 2.985 2.264 -3.090 1.00 0.00 C ATOM 845 O GLY B 554 3.114 1.141 -2.602 1.00 0.00 O ATOM 0 H GLY B 554 3.804 5.130 -3.934 1.00 0.00 H new ATOM 0 HA2 GLY B 554 5.053 2.774 -2.886 1.00 0.00 H new ATOM 0 HA3 GLY B 554 3.960 3.871 -2.067 1.00 0.00 H new ATOM 849 N LEU B 555 1.889 2.652 -3.733 1.00 0.00 N ATOM 850 CA LEU B 555 0.748 1.760 -3.906 1.00 0.00 C ATOM 851 C LEU B 555 1.075 0.642 -4.890 1.00 0.00 C ATOM 852 O LEU B 555 0.743 -0.522 -4.660 1.00 0.00 O ATOM 853 CB LEU B 555 -0.470 2.546 -4.395 1.00 0.00 C ATOM 854 CG LEU B 555 -1.581 1.723 -5.049 1.00 0.00 C ATOM 855 CD1 LEU B 555 -2.126 0.691 -4.075 1.00 0.00 C ATOM 856 CD2 LEU B 555 -2.696 2.632 -5.545 1.00 0.00 C ATOM 0 H LEU B 555 1.766 3.578 -4.143 1.00 0.00 H new ATOM 0 HA LEU B 555 0.519 1.312 -2.939 1.00 0.00 H new ATOM 0 HB2 LEU B 555 -0.895 3.084 -3.547 1.00 0.00 H new ATOM 0 HB3 LEU B 555 -0.131 3.295 -5.110 1.00 0.00 H new ATOM 0 HG LEU B 555 -1.160 1.196 -5.905 1.00 0.00 H new ATOM 0 HD11 LEU B 555 -2.915 0.116 -4.559 1.00 0.00 H new ATOM 0 HD12 LEU B 555 -1.323 0.020 -3.769 1.00 0.00 H new ATOM 0 HD13 LEU B 555 -2.531 1.196 -3.198 1.00 0.00 H new ATOM 0 HD21 LEU B 555 -3.478 2.030 -6.007 1.00 0.00 H new ATOM 0 HD22 LEU B 555 -3.114 3.187 -4.705 1.00 0.00 H new ATOM 0 HD23 LEU B 555 -2.296 3.332 -6.278 1.00 0.00 H new ATOM 868 N LEU B 556 1.731 1.001 -5.989 1.00 0.00 N ATOM 869 CA LEU B 556 2.107 0.029 -7.008 1.00 0.00 C ATOM 870 C LEU B 556 3.228 -0.878 -6.510 1.00 0.00 C ATOM 871 O LEU B 556 3.041 -2.084 -6.351 1.00 0.00 O ATOM 872 CB LEU B 556 2.545 0.745 -8.288 1.00 0.00 C ATOM 873 CG LEU B 556 1.422 1.316 -9.155 1.00 0.00 C ATOM 874 CD1 LEU B 556 1.995 2.003 -10.385 1.00 0.00 C ATOM 875 CD2 LEU B 556 0.451 0.217 -9.561 1.00 0.00 C ATOM 0 H LEU B 556 2.013 1.959 -6.196 1.00 0.00 H new ATOM 0 HA LEU B 556 1.235 -0.588 -7.224 1.00 0.00 H new ATOM 0 HB2 LEU B 556 3.215 1.560 -8.014 1.00 0.00 H new ATOM 0 HB3 LEU B 556 3.124 0.046 -8.892 1.00 0.00 H new ATOM 0 HG LEU B 556 0.878 2.057 -8.570 1.00 0.00 H new ATOM 0 HD11 LEU B 556 1.182 2.403 -10.990 1.00 0.00 H new ATOM 0 HD12 LEU B 556 2.651 2.816 -10.075 1.00 0.00 H new ATOM 0 HD13 LEU B 556 2.564 1.282 -10.973 1.00 0.00 H new ATOM 0 HD21 LEU B 556 -0.342 0.641 -10.177 1.00 0.00 H new ATOM 0 HD22 LEU B 556 0.983 -0.547 -10.128 1.00 0.00 H new ATOM 0 HD23 LEU B 556 0.015 -0.232 -8.668 1.00 0.00 H new ATOM 887 N LEU B 557 4.393 -0.288 -6.263 1.00 0.00 N ATOM 888 CA LEU B 557 5.545 -1.042 -5.781 1.00 0.00 C ATOM 889 C LEU B 557 5.205 -1.791 -4.496 1.00 0.00 C ATOM 890 O LEU B 557 5.766 -2.850 -4.216 1.00 0.00 O ATOM 891 CB LEU B 557 6.728 -0.104 -5.539 1.00 0.00 C ATOM 892 CG LEU B 557 7.541 0.284 -6.775 1.00 0.00 C ATOM 893 CD1 LEU B 557 8.078 -0.957 -7.471 1.00 0.00 C ATOM 894 CD2 LEU B 557 6.694 1.111 -7.732 1.00 0.00 C ATOM 0 H LEU B 557 4.564 0.710 -6.389 1.00 0.00 H new ATOM 0 HA LEU B 557 5.817 -1.771 -6.545 1.00 0.00 H new ATOM 0 HB2 LEU B 557 6.354 0.808 -5.074 1.00 0.00 H new ATOM 0 HB3 LEU B 557 7.399 -0.576 -4.821 1.00 0.00 H new ATOM 0 HG LEU B 557 8.388 0.891 -6.454 1.00 0.00 H new ATOM 0 HD11 LEU B 557 8.654 -0.662 -8.348 1.00 0.00 H new ATOM 0 HD12 LEU B 557 8.720 -1.510 -6.785 1.00 0.00 H new ATOM 0 HD13 LEU B 557 7.246 -1.590 -7.779 1.00 0.00 H new ATOM 0 HD21 LEU B 557 7.288 1.378 -8.606 1.00 0.00 H new ATOM 0 HD22 LEU B 557 5.828 0.529 -8.047 1.00 0.00 H new ATOM 0 HD23 LEU B 557 6.359 2.018 -7.230 1.00 0.00 H new ATOM 906 N GLY B 558 4.280 -1.236 -3.720 1.00 0.00 N ATOM 907 CA GLY B 558 3.879 -1.867 -2.475 1.00 0.00 C ATOM 908 C GLY B 558 3.161 -3.183 -2.697 1.00 0.00 C ATOM 909 O GLY B 558 3.651 -4.240 -2.301 1.00 0.00 O ATOM 0 H GLY B 558 3.801 -0.361 -3.930 1.00 0.00 H new ATOM 0 HA2 GLY B 558 4.761 -2.037 -1.857 1.00 0.00 H new ATOM 0 HA3 GLY B 558 3.228 -1.190 -1.922 1.00 0.00 H new ATOM 913 N ALA B 559 1.994 -3.118 -3.330 1.00 0.00 N ATOM 914 CA ALA B 559 1.206 -4.313 -3.605 1.00 0.00 C ATOM 915 C ALA B 559 1.941 -5.248 -4.559 1.00 0.00 C ATOM 916 O ALA B 559 1.994 -6.457 -4.340 1.00 0.00 O ATOM 917 CB ALA B 559 -0.151 -3.932 -4.176 1.00 0.00 C ATOM 0 H ALA B 559 1.574 -2.250 -3.662 1.00 0.00 H new ATOM 0 HA ALA B 559 1.055 -4.842 -2.664 1.00 0.00 H new ATOM 0 HB1 ALA B 559 -0.728 -4.835 -4.376 1.00 0.00 H new ATOM 0 HB2 ALA B 559 -0.687 -3.311 -3.458 1.00 0.00 H new ATOM 0 HB3 ALA B 559 -0.012 -3.377 -5.104 1.00 0.00 H new ATOM 923 N ALA B 560 2.506 -4.679 -5.619 1.00 0.00 N ATOM 924 CA ALA B 560 3.239 -5.462 -6.606 1.00 0.00 C ATOM 925 C ALA B 560 4.279 -6.353 -5.938 1.00 0.00 C ATOM 926 O ALA B 560 4.238 -7.578 -6.066 1.00 0.00 O ATOM 927 CB ALA B 560 3.901 -4.543 -7.622 1.00 0.00 C ATOM 0 H ALA B 560 2.470 -3.679 -5.816 1.00 0.00 H new ATOM 0 HA ALA B 560 2.528 -6.106 -7.124 1.00 0.00 H new ATOM 0 HB1 ALA B 560 4.445 -5.141 -8.353 1.00 0.00 H new ATOM 0 HB2 ALA B 560 3.138 -3.953 -8.131 1.00 0.00 H new ATOM 0 HB3 ALA B 560 4.595 -3.875 -7.111 1.00 0.00 H new ATOM 933 N LEU B 561 5.213 -5.732 -5.225 1.00 0.00 N ATOM 934 CA LEU B 561 6.267 -6.470 -4.536 1.00 0.00 C ATOM 935 C LEU B 561 5.675 -7.465 -3.544 1.00 0.00 C ATOM 936 O LEU B 561 6.219 -8.551 -3.337 1.00 0.00 O ATOM 937 CB LEU B 561 7.202 -5.503 -3.809 1.00 0.00 C ATOM 938 CG LEU B 561 8.315 -6.142 -2.978 1.00 0.00 C ATOM 939 CD1 LEU B 561 9.172 -7.052 -3.844 1.00 0.00 C ATOM 940 CD2 LEU B 561 9.170 -5.071 -2.318 1.00 0.00 C ATOM 0 H LEU B 561 5.262 -4.720 -5.109 1.00 0.00 H new ATOM 0 HA LEU B 561 6.836 -7.024 -5.282 1.00 0.00 H new ATOM 0 HB2 LEU B 561 7.660 -4.847 -4.549 1.00 0.00 H new ATOM 0 HB3 LEU B 561 6.602 -4.873 -3.152 1.00 0.00 H new ATOM 0 HG LEU B 561 7.856 -6.746 -2.195 1.00 0.00 H new ATOM 0 HD11 LEU B 561 9.959 -7.498 -3.236 1.00 0.00 H new ATOM 0 HD12 LEU B 561 8.551 -7.841 -4.269 1.00 0.00 H new ATOM 0 HD13 LEU B 561 9.621 -6.471 -4.649 1.00 0.00 H new ATOM 0 HD21 LEU B 561 9.957 -5.544 -1.731 1.00 0.00 H new ATOM 0 HD22 LEU B 561 9.619 -4.440 -3.085 1.00 0.00 H new ATOM 0 HD23 LEU B 561 8.547 -4.460 -1.665 1.00 0.00 H new ATOM 952 N LEU B 562 4.556 -7.090 -2.932 1.00 0.00 N ATOM 953 CA LEU B 562 3.888 -7.950 -1.962 1.00 0.00 C ATOM 954 C LEU B 562 3.395 -9.234 -2.622 1.00 0.00 C ATOM 955 O LEU B 562 3.766 -10.336 -2.217 1.00 0.00 O ATOM 956 CB LEU B 562 2.714 -7.210 -1.319 1.00 0.00 C ATOM 957 CG LEU B 562 2.260 -7.730 0.046 1.00 0.00 C ATOM 958 CD1 LEU B 562 1.143 -6.862 0.604 1.00 0.00 C ATOM 959 CD2 LEU B 562 1.811 -9.180 -0.058 1.00 0.00 C ATOM 0 H LEU B 562 4.093 -6.195 -3.091 1.00 0.00 H new ATOM 0 HA LEU B 562 4.610 -8.215 -1.189 1.00 0.00 H new ATOM 0 HB2 LEU B 562 2.986 -6.160 -1.213 1.00 0.00 H new ATOM 0 HB3 LEU B 562 1.866 -7.252 -2.002 1.00 0.00 H new ATOM 0 HG LEU B 562 3.106 -7.681 0.732 1.00 0.00 H new ATOM 0 HD11 LEU B 562 0.833 -7.248 1.575 1.00 0.00 H new ATOM 0 HD12 LEU B 562 1.500 -5.838 0.717 1.00 0.00 H new ATOM 0 HD13 LEU B 562 0.294 -6.877 -0.080 1.00 0.00 H new ATOM 0 HD21 LEU B 562 1.492 -9.533 0.922 1.00 0.00 H new ATOM 0 HD22 LEU B 562 0.980 -9.254 -0.759 1.00 0.00 H new ATOM 0 HD23 LEU B 562 2.640 -9.793 -0.412 1.00 0.00 H new ATOM 971 N LEU B 563 2.557 -9.084 -3.642 1.00 0.00 N ATOM 972 CA LEU B 563 2.013 -10.232 -4.360 1.00 0.00 C ATOM 973 C LEU B 563 3.130 -11.157 -4.833 1.00 0.00 C ATOM 974 O LEU B 563 2.990 -12.379 -4.807 1.00 0.00 O ATOM 975 CB LEU B 563 1.184 -9.763 -5.557 1.00 0.00 C ATOM 976 CG LEU B 563 0.182 -10.774 -6.117 1.00 0.00 C ATOM 977 CD1 LEU B 563 -1.121 -10.724 -5.334 1.00 0.00 C ATOM 978 CD2 LEU B 563 -0.071 -10.511 -7.594 1.00 0.00 C ATOM 0 H LEU B 563 2.240 -8.179 -3.990 1.00 0.00 H new ATOM 0 HA LEU B 563 1.371 -10.787 -3.676 1.00 0.00 H new ATOM 0 HB2 LEU B 563 0.639 -8.865 -5.267 1.00 0.00 H new ATOM 0 HB3 LEU B 563 1.867 -9.477 -6.357 1.00 0.00 H new ATOM 0 HG LEU B 563 0.606 -11.773 -6.013 1.00 0.00 H new ATOM 0 HD11 LEU B 563 -1.822 -11.450 -5.747 1.00 0.00 H new ATOM 0 HD12 LEU B 563 -0.926 -10.962 -4.288 1.00 0.00 H new ATOM 0 HD13 LEU B 563 -1.550 -9.725 -5.405 1.00 0.00 H new ATOM 0 HD21 LEU B 563 -0.786 -11.239 -7.976 1.00 0.00 H new ATOM 0 HD22 LEU B 563 -0.474 -9.506 -7.721 1.00 0.00 H new ATOM 0 HD23 LEU B 563 0.865 -10.599 -8.145 1.00 0.00 H new ATOM 990 N GLY B 564 4.241 -10.565 -5.262 1.00 0.00 N ATOM 991 CA GLY B 564 5.367 -11.351 -5.731 1.00 0.00 C ATOM 992 C GLY B 564 5.927 -12.261 -4.656 1.00 0.00 C ATOM 993 O GLY B 564 5.950 -13.482 -4.817 1.00 0.00 O ATOM 0 H GLY B 564 4.381 -9.555 -5.293 1.00 0.00 H new ATOM 0 HA2 GLY B 564 5.056 -11.952 -6.585 1.00 0.00 H new ATOM 0 HA3 GLY B 564 6.153 -10.682 -6.081 1.00 0.00 H new ATOM 997 N ILE B 565 6.381 -11.666 -3.558 1.00 0.00 N ATOM 998 CA ILE B 565 6.945 -12.432 -2.453 1.00 0.00 C ATOM 999 C ILE B 565 5.959 -13.482 -1.952 1.00 0.00 C ATOM 1000 O ILE B 565 6.356 -14.512 -1.407 1.00 0.00 O ATOM 1001 CB ILE B 565 7.344 -11.517 -1.280 1.00 0.00 C ATOM 1002 CG1 ILE B 565 8.394 -10.500 -1.731 1.00 0.00 C ATOM 1003 CG2 ILE B 565 7.867 -12.345 -0.116 1.00 0.00 C ATOM 1004 CD1 ILE B 565 8.193 -9.122 -1.141 1.00 0.00 C ATOM 0 H ILE B 565 6.369 -10.657 -3.410 1.00 0.00 H new ATOM 0 HA ILE B 565 7.837 -12.928 -2.836 1.00 0.00 H new ATOM 0 HB ILE B 565 6.460 -10.974 -0.946 1.00 0.00 H new ATOM 0 HG12 ILE B 565 9.383 -10.864 -1.454 1.00 0.00 H new ATOM 0 HG13 ILE B 565 8.374 -10.427 -2.818 1.00 0.00 H new ATOM 0 HG21 ILE B 565 8.145 -11.684 0.705 1.00 0.00 H new ATOM 0 HG22 ILE B 565 7.091 -13.033 0.219 1.00 0.00 H new ATOM 0 HG23 ILE B 565 8.741 -12.912 -0.437 1.00 0.00 H new ATOM 0 HD11 ILE B 565 8.973 -8.453 -1.504 1.00 0.00 H new ATOM 0 HD12 ILE B 565 7.218 -8.737 -1.439 1.00 0.00 H new ATOM 0 HD13 ILE B 565 8.243 -9.181 -0.054 1.00 0.00 H new ATOM 1016 N LEU B 566 4.671 -13.214 -2.142 1.00 0.00 N ATOM 1017 CA LEU B 566 3.627 -14.137 -1.711 1.00 0.00 C ATOM 1018 C LEU B 566 3.644 -15.409 -2.553 1.00 0.00 C ATOM 1019 O LEU B 566 3.569 -16.518 -2.022 1.00 0.00 O ATOM 1020 CB LEU B 566 2.255 -13.466 -1.807 1.00 0.00 C ATOM 1021 CG LEU B 566 1.835 -12.622 -0.603 1.00 0.00 C ATOM 1022 CD1 LEU B 566 0.482 -11.975 -0.851 1.00 0.00 C ATOM 1023 CD2 LEU B 566 1.798 -13.474 0.658 1.00 0.00 C ATOM 0 H LEU B 566 4.325 -12.366 -2.591 1.00 0.00 H new ATOM 0 HA LEU B 566 3.820 -14.408 -0.673 1.00 0.00 H new ATOM 0 HB2 LEU B 566 2.245 -12.830 -2.692 1.00 0.00 H new ATOM 0 HB3 LEU B 566 1.504 -14.241 -1.962 1.00 0.00 H new ATOM 0 HG LEU B 566 2.572 -11.832 -0.462 1.00 0.00 H new ATOM 0 HD11 LEU B 566 0.200 -11.378 0.016 1.00 0.00 H new ATOM 0 HD12 LEU B 566 0.541 -11.333 -1.730 1.00 0.00 H new ATOM 0 HD13 LEU B 566 -0.267 -12.750 -1.018 1.00 0.00 H new ATOM 0 HD21 LEU B 566 1.497 -12.857 1.505 1.00 0.00 H new ATOM 0 HD22 LEU B 566 1.082 -14.286 0.528 1.00 0.00 H new ATOM 0 HD23 LEU B 566 2.788 -13.890 0.845 1.00 0.00 H new ATOM 1035 N VAL B 567 3.743 -15.242 -3.868 1.00 0.00 N ATOM 1036 CA VAL B 567 3.773 -16.376 -4.782 1.00 0.00 C ATOM 1037 C VAL B 567 5.149 -17.033 -4.799 1.00 0.00 C ATOM 1038 O VAL B 567 5.266 -18.252 -4.923 1.00 0.00 O ATOM 1039 CB VAL B 567 3.402 -15.952 -6.216 1.00 0.00 C ATOM 1040 CG1 VAL B 567 3.477 -17.141 -7.162 1.00 0.00 C ATOM 1041 CG2 VAL B 567 2.016 -15.326 -6.243 1.00 0.00 C ATOM 0 H VAL B 567 3.804 -14.331 -4.324 1.00 0.00 H new ATOM 0 HA VAL B 567 3.036 -17.093 -4.420 1.00 0.00 H new ATOM 0 HB VAL B 567 4.121 -15.205 -6.553 1.00 0.00 H new ATOM 0 HG11 VAL B 567 3.212 -16.821 -8.170 1.00 0.00 H new ATOM 0 HG12 VAL B 567 4.491 -17.541 -7.163 1.00 0.00 H new ATOM 0 HG13 VAL B 567 2.782 -17.913 -6.832 1.00 0.00 H new ATOM 0 HG21 VAL B 567 1.769 -15.032 -7.263 1.00 0.00 H new ATOM 0 HG22 VAL B 567 1.283 -16.050 -5.887 1.00 0.00 H new ATOM 0 HG23 VAL B 567 2.001 -14.447 -5.599 1.00 0.00 H new ATOM 1051 N PHE B 568 6.190 -16.216 -4.673 1.00 0.00 N ATOM 1052 CA PHE B 568 7.560 -16.717 -4.674 1.00 0.00 C ATOM 1053 C PHE B 568 7.743 -17.800 -3.616 1.00 0.00 C ATOM 1054 O PHE B 568 8.613 -18.664 -3.740 1.00 0.00 O ATOM 1055 CB PHE B 568 8.544 -15.572 -4.424 1.00 0.00 C ATOM 1056 CG PHE B 568 8.840 -14.757 -5.650 1.00 0.00 C ATOM 1057 CD1 PHE B 568 9.231 -15.372 -6.829 1.00 0.00 C ATOM 1058 CD2 PHE B 568 8.728 -13.376 -5.625 1.00 0.00 C ATOM 1059 CE1 PHE B 568 9.503 -14.625 -7.960 1.00 0.00 C ATOM 1060 CE2 PHE B 568 8.999 -12.625 -6.752 1.00 0.00 C ATOM 1061 CZ PHE B 568 9.389 -13.250 -7.921 1.00 0.00 C ATOM 0 H PHE B 568 6.111 -15.204 -4.569 1.00 0.00 H new ATOM 0 HA PHE B 568 7.761 -17.152 -5.653 1.00 0.00 H new ATOM 0 HB2 PHE B 568 8.139 -14.918 -3.652 1.00 0.00 H new ATOM 0 HB3 PHE B 568 9.476 -15.983 -4.037 1.00 0.00 H new ATOM 0 HD1 PHE B 568 9.324 -16.447 -6.865 1.00 0.00 H new ATOM 0 HD2 PHE B 568 8.425 -12.881 -4.714 1.00 0.00 H new ATOM 0 HE1 PHE B 568 9.804 -15.117 -8.873 1.00 0.00 H new ATOM 0 HE2 PHE B 568 8.906 -11.549 -6.720 1.00 0.00 H new ATOM 0 HZ PHE B 568 9.604 -12.664 -8.802 1.00 0.00 H new ATOM 1071 N ARG B 569 6.918 -17.749 -2.575 1.00 0.00 N ATOM 1072 CA ARG B 569 6.990 -18.724 -1.494 1.00 0.00 C ATOM 1073 C ARG B 569 5.768 -19.638 -1.505 1.00 0.00 C ATOM 1074 O ARG B 569 5.750 -20.675 -0.841 1.00 0.00 O ATOM 1075 CB ARG B 569 7.096 -18.013 -0.144 1.00 0.00 C ATOM 1076 CG ARG B 569 8.214 -16.985 -0.083 1.00 0.00 C ATOM 1077 CD ARG B 569 9.566 -17.614 -0.389 1.00 0.00 C ATOM 1078 NE ARG B 569 10.603 -17.153 0.530 1.00 0.00 N ATOM 1079 CZ ARG B 569 11.903 -17.313 0.309 1.00 0.00 C ATOM 1080 NH1 ARG B 569 12.323 -17.918 -0.794 1.00 0.00 N ATOM 1081 NH2 ARG B 569 12.788 -16.867 1.192 1.00 0.00 N ATOM 0 H ARG B 569 6.192 -17.042 -2.458 1.00 0.00 H new ATOM 0 HA ARG B 569 7.880 -19.334 -1.647 1.00 0.00 H new ATOM 0 HB2 ARG B 569 6.148 -17.520 0.073 1.00 0.00 H new ATOM 0 HB3 ARG B 569 7.255 -18.756 0.637 1.00 0.00 H new ATOM 0 HG2 ARG B 569 8.014 -16.185 -0.796 1.00 0.00 H new ATOM 0 HG3 ARG B 569 8.239 -16.531 0.907 1.00 0.00 H new ATOM 0 HD2 ARG B 569 9.483 -18.699 -0.328 1.00 0.00 H new ATOM 0 HD3 ARG B 569 9.855 -17.373 -1.412 1.00 0.00 H new ATOM 0 HE ARG B 569 10.314 -16.683 1.388 1.00 0.00 H new ATOM 0 HH11 ARG B 569 11.647 -18.262 -1.476 1.00 0.00 H new ATOM 0 HH12 ARG B 569 13.322 -18.039 -0.960 1.00 0.00 H new ATOM 0 HH21 ARG B 569 12.470 -16.401 2.042 1.00 0.00 H new ATOM 0 HH22 ARG B 569 13.786 -16.991 1.021 1.00 0.00 H new ATOM 1095 N SER B 570 4.748 -19.246 -2.262 1.00 0.00 N ATOM 1096 CA SER B 570 3.521 -20.028 -2.355 1.00 0.00 C ATOM 1097 C SER B 570 3.826 -21.476 -2.729 1.00 0.00 C ATOM 1098 O SER B 570 3.479 -22.403 -1.997 1.00 0.00 O ATOM 1099 CB SER B 570 2.576 -19.411 -3.389 1.00 0.00 C ATOM 1100 OG SER B 570 1.878 -18.304 -2.846 1.00 0.00 O ATOM 0 H SER B 570 4.747 -18.392 -2.820 1.00 0.00 H new ATOM 0 HA SER B 570 3.038 -20.017 -1.378 1.00 0.00 H new ATOM 0 HB2 SER B 570 3.145 -19.093 -4.262 1.00 0.00 H new ATOM 0 HB3 SER B 570 1.864 -20.163 -3.729 1.00 0.00 H new ATOM 0 HG SER B 570 2.493 -17.759 -2.312 1.00 0.00 H new ATOM 1106 N ARG B 571 4.478 -21.661 -3.872 1.00 0.00 N ATOM 1107 CA ARG B 571 4.830 -22.995 -4.344 1.00 0.00 C ATOM 1108 C ARG B 571 3.598 -23.729 -4.865 1.00 0.00 C ATOM 1109 O ARG B 571 3.526 -24.081 -6.043 1.00 0.00 O ATOM 1110 CB ARG B 571 5.479 -23.802 -3.218 1.00 0.00 C ATOM 1111 CG ARG B 571 6.469 -23.002 -2.387 1.00 0.00 C ATOM 1112 CD ARG B 571 7.804 -23.718 -2.270 1.00 0.00 C ATOM 1113 NE ARG B 571 7.809 -24.694 -1.184 1.00 0.00 N ATOM 1114 CZ ARG B 571 8.909 -25.290 -0.736 1.00 0.00 C ATOM 1115 NH1 ARG B 571 10.086 -25.011 -1.278 1.00 0.00 N ATOM 1116 NH2 ARG B 571 8.832 -26.168 0.256 1.00 0.00 N ATOM 0 H ARG B 571 4.773 -20.904 -4.489 1.00 0.00 H new ATOM 0 HA ARG B 571 5.542 -22.888 -5.163 1.00 0.00 H new ATOM 0 HB2 ARG B 571 4.698 -24.190 -2.564 1.00 0.00 H new ATOM 0 HB3 ARG B 571 5.991 -24.663 -3.648 1.00 0.00 H new ATOM 0 HG2 ARG B 571 6.619 -22.022 -2.841 1.00 0.00 H new ATOM 0 HG3 ARG B 571 6.057 -22.833 -1.392 1.00 0.00 H new ATOM 0 HD2 ARG B 571 8.029 -24.221 -3.210 1.00 0.00 H new ATOM 0 HD3 ARG B 571 8.594 -22.986 -2.103 1.00 0.00 H new ATOM 0 HE ARG B 571 6.919 -24.931 -0.745 1.00 0.00 H new ATOM 0 HH11 ARG B 571 10.149 -24.337 -2.041 1.00 0.00 H new ATOM 0 HH12 ARG B 571 10.929 -25.470 -0.932 1.00 0.00 H new ATOM 0 HH21 ARG B 571 7.928 -26.386 0.675 1.00 0.00 H new ATOM 0 HH22 ARG B 571 9.677 -26.625 0.599 1.00 0.00 H new ATOM 1130 N ARG B 572 2.631 -23.956 -3.981 1.00 0.00 N ATOM 1131 CA ARG B 572 1.404 -24.649 -4.353 1.00 0.00 C ATOM 1132 C ARG B 572 1.714 -26.006 -4.976 1.00 0.00 C ATOM 1133 O ARG B 572 0.934 -26.527 -5.773 1.00 0.00 O ATOM 1134 CB ARG B 572 0.589 -23.800 -5.331 1.00 0.00 C ATOM 1135 CG ARG B 572 -0.841 -23.558 -4.881 1.00 0.00 C ATOM 1136 CD ARG B 572 -0.931 -22.386 -3.915 1.00 0.00 C ATOM 1137 NE ARG B 572 -1.795 -21.324 -4.423 1.00 0.00 N ATOM 1138 CZ ARG B 572 -2.082 -20.220 -3.741 1.00 0.00 C ATOM 1139 NH1 ARG B 572 -1.576 -20.037 -2.529 1.00 0.00 N ATOM 1140 NH2 ARG B 572 -2.876 -19.299 -4.271 1.00 0.00 N ATOM 0 H ARG B 572 2.674 -23.670 -3.003 1.00 0.00 H new ATOM 0 HA ARG B 572 0.818 -24.809 -3.448 1.00 0.00 H new ATOM 0 HB2 ARG B 572 1.086 -22.839 -5.466 1.00 0.00 H new ATOM 0 HB3 ARG B 572 0.577 -24.292 -6.303 1.00 0.00 H new ATOM 0 HG2 ARG B 572 -1.469 -23.363 -5.750 1.00 0.00 H new ATOM 0 HG3 ARG B 572 -1.230 -24.457 -4.402 1.00 0.00 H new ATOM 0 HD2 ARG B 572 -1.312 -22.735 -2.955 1.00 0.00 H new ATOM 0 HD3 ARG B 572 0.067 -21.987 -3.735 1.00 0.00 H new ATOM 0 HE ARG B 572 -2.200 -21.436 -5.352 1.00 0.00 H new ATOM 0 HH11 ARG B 572 -0.966 -20.744 -2.119 1.00 0.00 H new ATOM 0 HH12 ARG B 572 -1.797 -19.189 -2.007 1.00 0.00 H new ATOM 0 HH21 ARG B 572 -3.267 -19.438 -5.203 1.00 0.00 H new ATOM 0 HH22 ARG B 572 -3.096 -18.452 -3.747 1.00 0.00 H new ATOM 1154 N ALA B 573 2.857 -26.574 -4.607 1.00 0.00 N ATOM 1155 CA ALA B 573 3.269 -27.872 -5.129 1.00 0.00 C ATOM 1156 C ALA B 573 4.171 -28.600 -4.138 1.00 0.00 C ATOM 1157 O ALA B 573 4.792 -29.610 -4.475 1.00 0.00 O ATOM 1158 CB ALA B 573 3.978 -27.702 -6.464 1.00 0.00 C ATOM 0 H ALA B 573 3.515 -26.156 -3.949 1.00 0.00 H new ATOM 0 HA ALA B 573 2.375 -28.477 -5.279 1.00 0.00 H new ATOM 0 HB1 ALA B 573 4.280 -28.679 -6.842 1.00 0.00 H new ATOM 0 HB2 ALA B 573 3.302 -27.230 -7.177 1.00 0.00 H new ATOM 0 HB3 ALA B 573 4.860 -27.076 -6.330 1.00 0.00 H new TER 1164 ALA B 573