USER MOD reduce.3.24.130724 H: found=0, std=0, add=848, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 844 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 22 SER OG : rot 180:sc= 0 USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 31 SER OG : rot 68:sc= 0.362 USER MOD Single : A 37 HIS : no HD1:sc= -2.98! C(o=-3!,f=-3.9!) USER MOD Single : B 22 SER OG : rot 180:sc= 0 USER MOD Single : B 23 SER OG : rot 180:sc= 0 USER MOD Single : B 31 SER OG : rot 68:sc= 0.367 USER MOD Single : B 37 HIS : no HD1:sc= -2.93! C(o=-2.9!,f=-3.8!) USER MOD Single : C 22 SER OG : rot 180:sc= 0 USER MOD Single : C 23 SER OG : rot 180:sc= 0 USER MOD Single : C 31 SER OG : rot 68:sc= 0.365 USER MOD Single : C 37 HIS : no HD1:sc= -3.01! C(o=-3!,f=-3.9!) USER MOD Single : D 22 SER OG : rot 180:sc= 0 USER MOD Single : D 23 SER OG : rot 180:sc= 0 USER MOD Single : D 31 SER OG : rot 68:sc= 0.363 USER MOD Single : D 37 HIS : no HD1:sc= -3.1! C(o=-3.1!,f=-3.9!) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 22 0.598 10.410 18.983 1.00 99.99 N ATOM 2 CA SER A 22 1.253 10.116 17.676 1.00 99.99 C ATOM 3 C SER A 22 1.594 8.656 17.532 1.00 99.99 C ATOM 4 O SER A 22 1.456 7.871 18.471 1.00 99.99 O ATOM 5 CB SER A 22 2.515 11.011 17.458 1.00 99.99 C ATOM 6 OG SER A 22 3.540 10.781 18.422 1.00 99.99 O ATOM 0 HA SER A 22 0.530 10.358 16.897 1.00 99.99 H new ATOM 0 HB2 SER A 22 2.915 10.827 16.461 1.00 99.99 H new ATOM 0 HB3 SER A 22 2.220 12.060 17.494 1.00 99.99 H new ATOM 0 HG SER A 22 4.303 11.367 18.234 1.00 99.99 H new ATOM 11 N SER A 23 2.059 8.271 16.320 1.00 99.99 N ATOM 12 CA SER A 23 2.535 6.940 16.024 1.00 99.99 C ATOM 13 C SER A 23 3.958 7.111 15.557 1.00 99.99 C ATOM 14 O SER A 23 4.552 8.174 15.741 1.00 99.99 O ATOM 15 CB SER A 23 1.678 6.223 14.953 1.00 99.99 C ATOM 16 OG SER A 23 0.349 6.044 15.424 1.00 99.99 O ATOM 0 H SER A 23 2.106 8.903 15.521 1.00 99.99 H new ATOM 0 HA SER A 23 2.468 6.306 16.908 1.00 99.99 H new ATOM 0 HB2 SER A 23 1.669 6.808 14.033 1.00 99.99 H new ATOM 0 HB3 SER A 23 2.119 5.256 14.712 1.00 99.99 H new ATOM 0 HG SER A 23 -0.183 5.591 14.737 1.00 99.99 H new ATOM 22 N ASP A 24 4.556 6.046 14.963 1.00 99.99 N ATOM 23 CA ASP A 24 5.959 6.008 14.593 1.00 99.99 C ATOM 24 C ASP A 24 6.101 6.542 13.184 1.00 99.99 C ATOM 25 O ASP A 24 5.154 6.407 12.417 1.00 99.99 O ATOM 26 CB ASP A 24 6.535 4.565 14.631 1.00 99.99 C ATOM 27 CG ASP A 24 6.479 3.972 16.042 1.00 99.99 C ATOM 28 OD1 ASP A 24 6.392 4.749 17.032 1.00 99.99 O ATOM 29 OD2 ASP A 24 6.533 2.717 16.146 1.00 99.99 O ATOM 0 H ASP A 24 4.054 5.188 14.733 1.00 99.99 H new ATOM 0 HA ASP A 24 6.512 6.613 15.311 1.00 99.99 H new ATOM 0 HB2 ASP A 24 5.973 3.930 13.946 1.00 99.99 H new ATOM 0 HB3 ASP A 24 7.567 4.575 14.281 1.00 99.99 H new ATOM 34 N PRO A 25 7.208 7.165 12.774 1.00 99.99 N ATOM 35 CA PRO A 25 7.248 7.988 11.574 1.00 99.99 C ATOM 36 C PRO A 25 7.255 7.172 10.301 1.00 99.99 C ATOM 37 O PRO A 25 6.875 7.727 9.281 1.00 99.99 O ATOM 38 CB PRO A 25 8.542 8.807 11.706 1.00 99.99 C ATOM 39 CG PRO A 25 9.421 7.978 12.646 1.00 99.99 C ATOM 40 CD PRO A 25 8.399 7.362 13.598 1.00 99.99 C ATOM 0 HA PRO A 25 6.357 8.611 11.500 1.00 99.99 H new ATOM 0 HB2 PRO A 25 9.021 8.952 10.738 1.00 99.99 H new ATOM 0 HB3 PRO A 25 8.346 9.798 12.116 1.00 99.99 H new ATOM 0 HG2 PRO A 25 9.985 7.216 12.108 1.00 99.99 H new ATOM 0 HG3 PRO A 25 10.146 8.597 13.174 1.00 99.99 H new ATOM 0 HD2 PRO A 25 8.758 6.419 14.010 1.00 99.99 H new ATOM 0 HD3 PRO A 25 8.194 8.021 14.442 1.00 99.99 H new ATOM 48 N LEU A 26 7.686 5.890 10.339 1.00 99.99 N ATOM 49 CA LEU A 26 7.659 4.910 9.261 1.00 99.99 C ATOM 50 C LEU A 26 6.220 4.496 8.992 1.00 99.99 C ATOM 51 O LEU A 26 5.845 4.389 7.852 1.00 99.99 O ATOM 52 CB LEU A 26 8.422 3.623 9.603 1.00 99.99 C ATOM 53 CG LEU A 26 8.260 2.447 8.612 1.00 99.99 C ATOM 54 CD1 LEU A 26 8.828 2.760 7.226 1.00 99.99 C ATOM 55 CD2 LEU A 26 8.904 1.177 9.186 1.00 99.99 C ATOM 0 H LEU A 26 8.088 5.499 11.191 1.00 99.99 H new ATOM 0 HA LEU A 26 8.129 5.389 8.402 1.00 99.99 H new ATOM 0 HB2 LEU A 26 9.482 3.864 9.678 1.00 99.99 H new ATOM 0 HB3 LEU A 26 8.101 3.287 10.589 1.00 99.99 H new ATOM 0 HG LEU A 26 7.190 2.282 8.482 1.00 99.99 H new ATOM 0 HD11 LEU A 26 8.687 1.899 6.572 1.00 99.99 H new ATOM 0 HD12 LEU A 26 8.310 3.623 6.807 1.00 99.99 H new ATOM 0 HD13 LEU A 26 9.892 2.981 7.310 1.00 99.99 H new ATOM 0 HD21 LEU A 26 8.783 0.356 8.479 1.00 99.99 H new ATOM 0 HD22 LEU A 26 9.966 1.354 9.359 1.00 99.99 H new ATOM 0 HD23 LEU A 26 8.421 0.918 10.128 1.00 99.99 H new ATOM 67 N VAL A 27 5.497 4.281 10.005 1.00 99.99 N ATOM 68 CA VAL A 27 4.106 3.855 9.894 1.00 99.99 C ATOM 69 C VAL A 27 3.269 5.003 9.350 1.00 99.99 C ATOM 70 O VAL A 27 2.479 4.784 8.467 1.00 99.99 O ATOM 71 CB VAL A 27 3.490 3.473 11.247 1.00 99.99 C ATOM 72 CG1 VAL A 27 1.991 3.148 11.092 1.00 99.99 C ATOM 73 CG2 VAL A 27 4.225 2.240 11.818 1.00 99.99 C ATOM 0 H VAL A 27 5.825 4.387 10.965 1.00 99.99 H new ATOM 0 HA VAL A 27 4.104 2.984 9.239 1.00 99.99 H new ATOM 0 HB VAL A 27 3.596 4.318 11.928 1.00 99.99 H new ATOM 0 HG11 VAL A 27 1.575 2.880 12.063 1.00 99.99 H new ATOM 0 HG12 VAL A 27 1.468 4.021 10.701 1.00 99.99 H new ATOM 0 HG13 VAL A 27 1.869 2.313 10.402 1.00 99.99 H new ATOM 0 HG21 VAL A 27 3.788 1.968 12.779 1.00 99.99 H new ATOM 0 HG22 VAL A 27 4.126 1.404 11.125 1.00 99.99 H new ATOM 0 HG23 VAL A 27 5.280 2.476 11.953 1.00 99.99 H new ATOM 83 N VAL A 28 3.454 6.136 9.876 1.00 99.99 N ATOM 84 CA VAL A 28 2.703 7.318 9.470 1.00 99.99 C ATOM 85 C VAL A 28 3.127 7.727 8.068 1.00 99.99 C ATOM 86 O VAL A 28 2.281 8.029 7.265 1.00 99.99 O ATOM 87 CB VAL A 28 2.964 8.530 10.374 1.00 99.99 C ATOM 88 CG1 VAL A 28 2.293 9.801 9.813 1.00 99.99 C ATOM 89 CG2 VAL A 28 2.444 8.240 11.796 1.00 99.99 C ATOM 0 H VAL A 28 4.134 6.310 10.616 1.00 99.99 H new ATOM 0 HA VAL A 28 1.649 7.047 9.529 1.00 99.99 H new ATOM 0 HB VAL A 28 4.039 8.706 10.409 1.00 99.99 H new ATOM 0 HG11 VAL A 28 2.496 10.642 10.476 1.00 99.99 H new ATOM 0 HG12 VAL A 28 2.692 10.015 8.821 1.00 99.99 H new ATOM 0 HG13 VAL A 28 1.216 9.644 9.745 1.00 99.99 H new ATOM 0 HG21 VAL A 28 2.631 9.103 12.435 1.00 99.99 H new ATOM 0 HG22 VAL A 28 1.373 8.042 11.758 1.00 99.99 H new ATOM 0 HG23 VAL A 28 2.960 7.370 12.202 1.00 99.99 H new ATOM 99 N ALA A 29 4.366 7.731 7.832 1.00 99.99 N ATOM 100 CA ALA A 29 4.914 8.129 6.539 1.00 99.99 C ATOM 101 C ALA A 29 4.389 7.191 5.462 1.00 99.99 C ATOM 102 O ALA A 29 4.053 7.653 4.399 1.00 99.99 O ATOM 103 CB ALA A 29 6.444 8.034 6.485 1.00 99.99 C ATOM 0 H ALA A 29 5.071 7.460 8.517 1.00 99.99 H new ATOM 0 HA ALA A 29 4.612 9.165 6.383 1.00 99.99 H new ATOM 0 HB1 ALA A 29 6.793 8.342 5.500 1.00 99.99 H new ATOM 0 HB2 ALA A 29 6.876 8.687 7.244 1.00 99.99 H new ATOM 0 HB3 ALA A 29 6.752 7.005 6.673 1.00 99.99 H new ATOM 109 N ALA A 30 4.344 5.964 5.752 1.00 99.99 N ATOM 110 CA ALA A 30 3.886 4.954 4.806 1.00 99.99 C ATOM 111 C ALA A 30 2.419 5.192 4.484 1.00 99.99 C ATOM 112 O ALA A 30 2.025 4.984 3.362 1.00 99.99 O ATOM 113 CB ALA A 30 3.978 3.528 5.365 1.00 99.99 C ATOM 0 H ALA A 30 4.621 5.589 6.659 1.00 99.99 H new ATOM 0 HA ALA A 30 4.530 5.041 3.931 1.00 99.99 H new ATOM 0 HB1 ALA A 30 3.623 2.820 4.616 1.00 99.99 H new ATOM 0 HB2 ALA A 30 5.014 3.302 5.616 1.00 99.99 H new ATOM 0 HB3 ALA A 30 3.362 3.448 6.260 1.00 99.99 H new ATOM 119 N SER A 31 1.693 5.599 5.430 1.00 99.99 N ATOM 120 CA SER A 31 0.264 5.844 5.269 1.00 99.99 C ATOM 121 C SER A 31 0.056 6.934 4.228 1.00 99.99 C ATOM 122 O SER A 31 -0.766 6.769 3.361 1.00 99.99 O ATOM 123 CB SER A 31 -0.407 6.339 6.556 1.00 99.99 C ATOM 124 OG SER A 31 -0.383 5.329 7.562 1.00 99.99 O ATOM 0 H SER A 31 2.044 5.786 6.369 1.00 99.99 H new ATOM 0 HA SER A 31 -0.179 4.891 4.979 1.00 99.99 H new ATOM 0 HB2 SER A 31 0.104 7.231 6.918 1.00 99.99 H new ATOM 0 HB3 SER A 31 -1.438 6.625 6.347 1.00 99.99 H new ATOM 0 HG SER A 31 0.541 5.177 7.851 1.00 99.99 H new ATOM 130 N ILE A 32 0.767 7.970 4.345 1.00 99.99 N ATOM 131 CA ILE A 32 0.654 9.103 3.435 1.00 99.99 C ATOM 132 C ILE A 32 1.071 8.671 2.036 1.00 99.99 C ATOM 133 O ILE A 32 0.479 9.111 1.086 1.00 99.99 O ATOM 134 CB ILE A 32 1.571 10.272 3.819 1.00 99.99 C ATOM 135 CG1 ILE A 32 1.129 10.873 5.172 1.00 99.99 C ATOM 136 CG2 ILE A 32 1.560 11.362 2.728 1.00 99.99 C ATOM 137 CD1 ILE A 32 2.186 11.795 5.793 1.00 99.99 C ATOM 0 H ILE A 32 1.467 8.093 5.076 1.00 99.99 H new ATOM 0 HA ILE A 32 -0.384 9.431 3.484 1.00 99.99 H new ATOM 0 HB ILE A 32 2.588 9.891 3.913 1.00 99.99 H new ATOM 0 HG12 ILE A 32 0.205 11.433 5.030 1.00 99.99 H new ATOM 0 HG13 ILE A 32 0.907 10.064 5.868 1.00 99.99 H new ATOM 0 HG21 ILE A 32 2.218 12.179 3.024 1.00 99.99 H new ATOM 0 HG22 ILE A 32 1.909 10.938 1.787 1.00 99.99 H new ATOM 0 HG23 ILE A 32 0.545 11.740 2.602 1.00 99.99 H new ATOM 0 HD11 ILE A 32 1.816 12.185 6.741 1.00 99.99 H new ATOM 0 HD12 ILE A 32 3.104 11.232 5.965 1.00 99.99 H new ATOM 0 HD13 ILE A 32 2.390 12.623 5.114 1.00 99.99 H new ATOM 149 N ILE A 33 2.039 7.865 1.963 1.00 99.99 N ATOM 150 CA ILE A 33 2.564 7.388 0.688 1.00 99.99 C ATOM 151 C ILE A 33 1.475 6.619 -0.048 1.00 99.99 C ATOM 152 O ILE A 33 1.288 6.845 -1.216 1.00 99.99 O ATOM 153 CB ILE A 33 3.742 6.417 0.850 1.00 99.99 C ATOM 154 CG1 ILE A 33 5.036 7.244 1.056 1.00 99.99 C ATOM 155 CG2 ILE A 33 3.881 5.467 -0.352 1.00 99.99 C ATOM 156 CD1 ILE A 33 6.225 6.446 1.602 1.00 99.99 C ATOM 0 H ILE A 33 2.523 7.490 2.779 1.00 99.99 H new ATOM 0 HA ILE A 33 2.900 8.273 0.147 1.00 99.99 H new ATOM 0 HB ILE A 33 3.560 5.785 1.719 1.00 99.99 H new ATOM 0 HG12 ILE A 33 5.322 7.690 0.103 1.00 99.99 H new ATOM 0 HG13 ILE A 33 4.822 8.065 1.740 1.00 99.99 H new ATOM 0 HG21 ILE A 33 4.727 4.799 -0.192 1.00 99.99 H new ATOM 0 HG22 ILE A 33 2.970 4.879 -0.458 1.00 99.99 H new ATOM 0 HG23 ILE A 33 4.045 6.049 -1.259 1.00 99.99 H new ATOM 0 HD11 ILE A 33 7.085 7.106 1.714 1.00 99.99 H new ATOM 0 HD12 ILE A 33 5.964 6.022 2.572 1.00 99.99 H new ATOM 0 HD13 ILE A 33 6.472 5.642 0.909 1.00 99.99 H new ATOM 168 N GLY A 34 0.825 5.776 0.629 1.00 99.99 N ATOM 169 CA GLY A 34 -0.230 4.953 0.044 1.00 99.99 C ATOM 170 C GLY A 34 -1.386 5.843 -0.380 1.00 99.99 C ATOM 171 O GLY A 34 -1.975 5.590 -1.400 1.00 99.99 O ATOM 0 H GLY A 34 0.983 5.606 1.622 1.00 99.99 H new ATOM 0 HA2 GLY A 34 0.156 4.404 -0.815 1.00 99.99 H new ATOM 0 HA3 GLY A 34 -0.572 4.213 0.767 1.00 99.99 H new ATOM 175 N ILE A 35 -1.347 7.107 0.011 1.00 99.99 N ATOM 176 CA ILE A 35 -2.381 7.993 -0.515 1.00 99.99 C ATOM 177 C ILE A 35 -1.846 8.722 -1.737 1.00 99.99 C ATOM 178 O ILE A 35 -2.540 8.802 -2.719 1.00 99.99 O ATOM 179 CB ILE A 35 -2.803 9.077 0.485 1.00 99.99 C ATOM 180 CG1 ILE A 35 -3.354 8.430 1.781 1.00 99.99 C ATOM 181 CG2 ILE A 35 -3.868 9.993 -0.154 1.00 99.99 C ATOM 182 CD1 ILE A 35 -3.514 9.390 2.963 1.00 99.99 C ATOM 0 H ILE A 35 -0.665 7.524 0.644 1.00 99.99 H new ATOM 0 HA ILE A 35 -3.239 7.360 -0.743 1.00 99.99 H new ATOM 0 HB ILE A 35 -1.931 9.677 0.745 1.00 99.99 H new ATOM 0 HG12 ILE A 35 -4.323 7.981 1.562 1.00 99.99 H new ATOM 0 HG13 ILE A 35 -2.687 7.620 2.077 1.00 99.99 H new ATOM 0 HG21 ILE A 35 -4.164 10.761 0.561 1.00 99.99 H new ATOM 0 HG22 ILE A 35 -3.454 10.466 -1.044 1.00 99.99 H new ATOM 0 HG23 ILE A 35 -4.740 9.400 -0.431 1.00 99.99 H new ATOM 0 HD11 ILE A 35 -3.905 8.846 3.823 1.00 99.99 H new ATOM 0 HD12 ILE A 35 -2.545 9.821 3.216 1.00 99.99 H new ATOM 0 HD13 ILE A 35 -4.206 10.188 2.693 1.00 99.99 H new ATOM 194 N LEU A 36 -0.686 9.208 -1.642 1.00 99.99 N ATOM 195 CA LEU A 36 -0.062 9.956 -2.728 1.00 99.99 C ATOM 196 C LEU A 36 0.062 9.057 -3.950 1.00 99.99 C ATOM 197 O LEU A 36 -0.235 9.496 -5.031 1.00 99.99 O ATOM 198 CB LEU A 36 1.359 10.424 -2.389 1.00 99.99 C ATOM 199 CG LEU A 36 2.125 11.107 -3.543 1.00 99.99 C ATOM 200 CD1 LEU A 36 1.429 12.403 -3.981 1.00 99.99 C ATOM 201 CD2 LEU A 36 3.584 11.375 -3.151 1.00 99.99 C ATOM 0 H LEU A 36 -0.102 9.117 -0.810 1.00 99.99 H new ATOM 0 HA LEU A 36 -0.694 10.826 -2.905 1.00 99.99 H new ATOM 0 HB2 LEU A 36 1.304 11.119 -1.551 1.00 99.99 H new ATOM 0 HB3 LEU A 36 1.936 9.563 -2.052 1.00 99.99 H new ATOM 0 HG LEU A 36 2.123 10.424 -4.392 1.00 99.99 H new ATOM 0 HD11 LEU A 36 1.991 12.861 -4.795 1.00 99.99 H new ATOM 0 HD12 LEU A 36 0.419 12.176 -4.321 1.00 99.99 H new ATOM 0 HD13 LEU A 36 1.382 13.093 -3.139 1.00 99.99 H new ATOM 0 HD21 LEU A 36 4.101 11.856 -3.981 1.00 99.99 H new ATOM 0 HD22 LEU A 36 3.612 12.028 -2.278 1.00 99.99 H new ATOM 0 HD23 LEU A 36 4.076 10.432 -2.915 1.00 99.99 H new ATOM 213 N HIS A 37 0.522 7.797 -3.782 1.00 99.99 N ATOM 214 CA HIS A 37 0.744 6.852 -4.849 1.00 99.99 C ATOM 215 C HIS A 37 -0.557 6.526 -5.530 1.00 99.99 C ATOM 216 O HIS A 37 -0.580 6.189 -6.712 1.00 99.99 O ATOM 217 CB HIS A 37 1.379 5.542 -4.323 1.00 99.99 C ATOM 218 CG HIS A 37 1.818 4.590 -5.406 1.00 99.99 C ATOM 219 ND1 HIS A 37 2.090 3.271 -5.159 1.00 99.99 N ATOM 220 CD2 HIS A 37 2.074 4.810 -6.717 1.00 99.99 C ATOM 221 CE1 HIS A 37 2.489 2.708 -6.291 1.00 99.99 C ATOM 222 NE2 HIS A 37 2.488 3.621 -7.252 1.00 99.99 N ATOM 0 H HIS A 37 0.750 7.418 -2.863 1.00 99.99 H new ATOM 0 HA HIS A 37 1.432 7.313 -5.558 1.00 99.99 H new ATOM 0 HB2 HIS A 37 2.240 5.792 -3.704 1.00 99.99 H new ATOM 0 HB3 HIS A 37 0.660 5.036 -3.679 1.00 99.99 H new ATOM 0 HD2 HIS A 37 1.971 5.748 -7.242 1.00 99.99 H new ATOM 0 HE1 HIS A 37 2.770 1.672 -6.411 1.00 99.99 H new ATOM 0 HE2 HIS A 37 2.751 3.464 -8.225 1.00 99.99 H new ATOM 230 N LEU A 38 -1.682 6.666 -4.787 1.00 99.99 N ATOM 231 CA LEU A 38 -3.018 6.412 -5.311 1.00 99.99 C ATOM 232 C LEU A 38 -3.404 7.528 -6.270 1.00 99.99 C ATOM 233 O LEU A 38 -3.932 7.247 -7.316 1.00 99.99 O ATOM 234 CB LEU A 38 -4.096 6.388 -4.219 1.00 99.99 C ATOM 235 CG LEU A 38 -5.524 6.143 -4.766 1.00 99.99 C ATOM 236 CD1 LEU A 38 -5.625 4.808 -5.516 1.00 99.99 C ATOM 237 CD2 LEU A 38 -6.583 6.218 -3.666 1.00 99.99 C ATOM 0 H LEU A 38 -1.673 6.959 -3.810 1.00 99.99 H new ATOM 0 HA LEU A 38 -2.975 5.435 -5.793 1.00 99.99 H new ATOM 0 HB2 LEU A 38 -3.853 5.608 -3.497 1.00 99.99 H new ATOM 0 HB3 LEU A 38 -4.079 7.336 -3.682 1.00 99.99 H new ATOM 0 HG LEU A 38 -5.722 6.947 -5.475 1.00 99.99 H new ATOM 0 HD11 LEU A 38 -6.642 4.673 -5.884 1.00 99.99 H new ATOM 0 HD12 LEU A 38 -4.932 4.810 -6.357 1.00 99.99 H new ATOM 0 HD13 LEU A 38 -5.373 3.991 -4.840 1.00 99.99 H new ATOM 0 HD21 LEU A 38 -7.568 6.040 -4.097 1.00 99.99 H new ATOM 0 HD22 LEU A 38 -6.376 5.461 -2.909 1.00 99.99 H new ATOM 0 HD23 LEU A 38 -6.561 7.206 -3.207 1.00 99.99 H new ATOM 249 N ILE A 39 -3.145 8.704 -5.899 1.00 99.99 N ATOM 250 CA ILE A 39 -3.484 9.872 -6.705 1.00 99.99 C ATOM 251 C ILE A 39 -2.695 9.829 -8.005 1.00 99.99 C ATOM 252 O ILE A 39 -3.256 10.095 -9.040 1.00 99.99 O ATOM 253 CB ILE A 39 -3.121 11.197 -6.022 1.00 99.99 C ATOM 254 CG1 ILE A 39 -4.013 11.409 -4.779 1.00 99.99 C ATOM 255 CG2 ILE A 39 -3.282 12.371 -7.010 1.00 99.99 C ATOM 256 CD1 ILE A 39 -3.606 12.616 -3.923 1.00 99.99 C ATOM 0 H ILE A 39 -2.684 8.928 -5.017 1.00 99.99 H new ATOM 0 HA ILE A 39 -4.562 9.834 -6.861 1.00 99.99 H new ATOM 0 HB ILE A 39 -2.079 11.158 -5.704 1.00 99.99 H new ATOM 0 HG12 ILE A 39 -5.046 11.537 -5.102 1.00 99.99 H new ATOM 0 HG13 ILE A 39 -3.980 10.511 -4.163 1.00 99.99 H new ATOM 0 HG21 ILE A 39 -3.021 13.305 -6.511 1.00 99.99 H new ATOM 0 HG22 ILE A 39 -2.623 12.220 -7.865 1.00 99.99 H new ATOM 0 HG23 ILE A 39 -4.316 12.419 -7.352 1.00 99.99 H new ATOM 0 HD11 ILE A 39 -4.278 12.700 -3.069 1.00 99.99 H new ATOM 0 HD12 ILE A 39 -2.584 12.483 -3.568 1.00 99.99 H new ATOM 0 HD13 ILE A 39 -3.666 13.524 -4.523 1.00 99.99 H new ATOM 268 N LEU A 40 -1.477 9.521 -7.917 1.00 99.99 N ATOM 269 CA LEU A 40 -0.597 9.467 -9.078 1.00 99.99 C ATOM 270 C LEU A 40 -1.108 8.413 -10.049 1.00 99.99 C ATOM 271 O LEU A 40 -1.130 8.665 -11.228 1.00 99.99 O ATOM 272 CB LEU A 40 0.840 9.065 -8.723 1.00 99.99 C ATOM 273 CG LEU A 40 1.655 10.124 -7.948 1.00 99.99 C ATOM 274 CD1 LEU A 40 3.029 9.541 -7.562 1.00 99.99 C ATOM 275 CD2 LEU A 40 1.843 11.419 -8.751 1.00 99.99 C ATOM 0 H LEU A 40 -1.017 9.288 -7.037 1.00 99.99 H new ATOM 0 HA LEU A 40 -0.594 10.470 -9.504 1.00 99.99 H new ATOM 0 HB2 LEU A 40 0.807 8.151 -8.129 1.00 99.99 H new ATOM 0 HB3 LEU A 40 1.370 8.827 -9.645 1.00 99.99 H new ATOM 0 HG LEU A 40 1.092 10.379 -7.051 1.00 99.99 H new ATOM 0 HD11 LEU A 40 3.602 10.290 -7.015 1.00 99.99 H new ATOM 0 HD12 LEU A 40 2.888 8.662 -6.933 1.00 99.99 H new ATOM 0 HD13 LEU A 40 3.571 9.258 -8.465 1.00 99.99 H new ATOM 0 HD21 LEU A 40 2.422 12.131 -8.163 1.00 99.99 H new ATOM 0 HD22 LEU A 40 2.372 11.199 -9.678 1.00 99.99 H new ATOM 0 HD23 LEU A 40 0.868 11.848 -8.983 1.00 99.99 H new ATOM 287 N TRP A 41 -1.481 7.317 -9.548 1.00 99.99 N ATOM 288 CA TRP A 41 -1.967 6.210 -10.363 1.00 99.99 C ATOM 289 C TRP A 41 -3.287 6.605 -11.009 1.00 99.99 C ATOM 290 O TRP A 41 -3.482 6.324 -12.165 1.00 99.99 O ATOM 291 CB TRP A 41 -2.246 4.943 -9.544 1.00 99.99 C ATOM 292 CG TRP A 41 -2.652 3.743 -10.381 1.00 99.99 C ATOM 293 CD1 TRP A 41 -1.835 2.940 -11.116 1.00 99.99 C ATOM 294 CD2 TRP A 41 -3.998 3.305 -10.637 1.00 99.99 C ATOM 295 NE1 TRP A 41 -2.565 1.976 -11.750 1.00 99.99 N ATOM 296 CE2 TRP A 41 -3.898 2.203 -11.507 1.00 99.99 C ATOM 297 CE3 TRP A 41 -5.235 3.769 -10.180 1.00 99.99 C ATOM 298 CZ2 TRP A 41 -5.034 1.527 -11.927 1.00 99.99 C ATOM 299 CZ3 TRP A 41 -6.376 3.093 -10.618 1.00 99.99 C ATOM 300 CH2 TRP A 41 -6.284 1.985 -11.478 1.00 99.99 C ATOM 0 H TRP A 41 -1.472 7.123 -8.547 1.00 99.99 H new ATOM 0 HA TRP A 41 -1.185 5.999 -11.093 1.00 99.99 H new ATOM 0 HB2 TRP A 41 -1.354 4.689 -8.972 1.00 99.99 H new ATOM 0 HB3 TRP A 41 -3.036 5.155 -8.824 1.00 99.99 H new ATOM 0 HD1 TRP A 41 -0.763 3.050 -11.187 1.00 99.99 H new ATOM 0 HE1 TRP A 41 -2.184 1.214 -12.311 1.00 99.99 H new ATOM 0 HE3 TRP A 41 -5.306 4.617 -9.515 1.00 99.99 H new ATOM 0 HZ2 TRP A 41 -4.960 0.671 -12.582 1.00 99.99 H new ATOM 0 HZ3 TRP A 41 -7.349 3.428 -10.289 1.00 99.99 H new ATOM 0 HH2 TRP A 41 -7.184 1.480 -11.797 1.00 99.99 H new ATOM 311 N ILE A 42 -4.117 7.207 -10.272 1.00 99.99 N ATOM 312 CA ILE A 42 -5.432 7.620 -10.752 1.00 99.99 C ATOM 313 C ILE A 42 -5.263 8.705 -11.806 1.00 99.99 C ATOM 314 O ILE A 42 -5.936 8.660 -12.805 1.00 99.99 O ATOM 315 CB ILE A 42 -6.308 8.222 -9.649 1.00 99.99 C ATOM 316 CG1 ILE A 42 -6.763 7.116 -8.668 1.00 99.99 C ATOM 317 CG2 ILE A 42 -7.537 8.939 -10.251 1.00 99.99 C ATOM 318 CD1 ILE A 42 -7.569 7.646 -7.472 1.00 99.99 C ATOM 0 H ILE A 42 -3.935 7.448 -9.298 1.00 99.99 H new ATOM 0 HA ILE A 42 -5.912 6.722 -11.141 1.00 99.99 H new ATOM 0 HB ILE A 42 -5.716 8.958 -9.105 1.00 99.99 H new ATOM 0 HG12 ILE A 42 -7.368 6.389 -9.209 1.00 99.99 H new ATOM 0 HG13 ILE A 42 -5.885 6.587 -8.298 1.00 99.99 H new ATOM 0 HG21 ILE A 42 -8.143 9.358 -9.448 1.00 99.99 H new ATOM 0 HG22 ILE A 42 -7.204 9.741 -10.910 1.00 99.99 H new ATOM 0 HG23 ILE A 42 -8.132 8.225 -10.820 1.00 99.99 H new ATOM 0 HD11 ILE A 42 -7.854 6.814 -6.828 1.00 99.99 H new ATOM 0 HD12 ILE A 42 -6.960 8.351 -6.906 1.00 99.99 H new ATOM 0 HD13 ILE A 42 -8.466 8.149 -7.832 1.00 99.99 H new ATOM 330 N LEU A 43 -4.417 9.607 -11.558 1.00 99.99 N ATOM 331 CA LEU A 43 -4.174 10.720 -12.467 1.00 99.99 C ATOM 332 C LEU A 43 -3.608 10.187 -13.776 1.00 99.99 C ATOM 333 O LEU A 43 -3.928 10.716 -14.810 1.00 99.99 O ATOM 334 CB LEU A 43 -3.144 11.719 -11.925 1.00 99.99 C ATOM 335 CG LEU A 43 -3.632 12.544 -10.712 1.00 99.99 C ATOM 336 CD1 LEU A 43 -2.455 13.310 -10.080 1.00 99.99 C ATOM 337 CD2 LEU A 43 -4.752 13.524 -11.094 1.00 99.99 C ATOM 0 H LEU A 43 -3.845 9.627 -10.714 1.00 99.99 H new ATOM 0 HA LEU A 43 -5.131 11.225 -12.595 1.00 99.99 H new ATOM 0 HB2 LEU A 43 -2.243 11.175 -11.640 1.00 99.99 H new ATOM 0 HB3 LEU A 43 -2.864 12.404 -12.726 1.00 99.99 H new ATOM 0 HG LEU A 43 -4.041 11.842 -9.985 1.00 99.99 H new ATOM 0 HD11 LEU A 43 -2.812 13.887 -9.227 1.00 99.99 H new ATOM 0 HD12 LEU A 43 -1.697 12.601 -9.747 1.00 99.99 H new ATOM 0 HD13 LEU A 43 -2.022 13.985 -10.818 1.00 99.99 H new ATOM 0 HD21 LEU A 43 -5.064 14.082 -10.211 1.00 99.99 H new ATOM 0 HD22 LEU A 43 -4.386 14.217 -11.851 1.00 99.99 H new ATOM 0 HD23 LEU A 43 -5.602 12.969 -11.491 1.00 99.99 H new ATOM 349 N ASP A 44 -2.814 9.211 -13.691 1.00 99.99 N ATOM 350 CA ASP A 44 -2.179 8.618 -14.860 1.00 99.99 C ATOM 351 C ASP A 44 -3.238 7.947 -15.724 1.00 99.99 C ATOM 352 O ASP A 44 -3.165 8.046 -16.924 1.00 99.99 O ATOM 353 CB ASP A 44 -1.160 7.527 -14.500 1.00 99.99 C ATOM 354 CG ASP A 44 -0.430 6.971 -15.738 1.00 99.99 C ATOM 355 OD1 ASP A 44 0.342 7.734 -16.366 1.00 99.99 O ATOM 356 OD2 ASP A 44 -0.590 5.755 -16.056 1.00 99.99 O ATOM 0 H ASP A 44 -2.558 8.767 -12.809 1.00 99.99 H new ATOM 0 HA ASP A 44 -1.667 9.432 -15.374 1.00 99.99 H new ATOM 0 HB2 ASP A 44 -0.428 7.934 -13.803 1.00 99.99 H new ATOM 0 HB3 ASP A 44 -1.671 6.712 -13.987 1.00 99.99 H new ATOM 361 N ARG A 45 -4.141 7.310 -15.117 1.00 99.99 N ATOM 362 CA ARG A 45 -5.204 6.600 -15.819 1.00 99.99 C ATOM 363 C ARG A 45 -6.065 7.600 -16.576 1.00 99.99 C ATOM 364 O ARG A 45 -6.414 7.340 -17.700 1.00 99.99 O ATOM 365 CB ARG A 45 -6.148 5.849 -14.871 1.00 99.99 C ATOM 366 CG ARG A 45 -5.468 4.698 -14.101 1.00 99.99 C ATOM 367 CD ARG A 45 -5.219 3.457 -14.968 1.00 99.99 C ATOM 368 NE ARG A 45 -3.827 3.541 -15.539 1.00 99.99 N ATOM 369 CZ ARG A 45 -3.483 2.856 -16.646 1.00 99.99 C ATOM 370 NH1 ARG A 45 -4.357 2.050 -17.275 1.00 99.99 N ATOM 371 NH2 ARG A 45 -2.224 2.968 -17.099 1.00 99.99 N ATOM 0 H ARG A 45 -4.197 7.243 -14.101 1.00 99.99 H new ATOM 0 HA ARG A 45 -4.710 5.885 -16.476 1.00 99.99 H new ATOM 0 HB2 ARG A 45 -6.567 6.556 -14.155 1.00 99.99 H new ATOM 0 HB3 ARG A 45 -6.982 5.447 -15.446 1.00 99.99 H new ATOM 0 HG2 ARG A 45 -4.518 5.050 -13.699 1.00 99.99 H new ATOM 0 HG3 ARG A 45 -6.091 4.420 -13.250 1.00 99.99 H new ATOM 0 HD2 ARG A 45 -5.329 2.551 -14.372 1.00 99.99 H new ATOM 0 HD3 ARG A 45 -5.954 3.402 -15.771 1.00 99.99 H new ATOM 0 HE ARG A 45 -3.132 4.128 -15.078 1.00 99.99 H new ATOM 0 HH11 ARG A 45 -5.306 1.947 -16.915 1.00 99.99 H new ATOM 0 HH12 ARG A 45 -4.071 1.542 -18.112 1.00 99.99 H new ATOM 0 HH21 ARG A 45 -1.556 3.561 -16.607 1.00 99.99 H new ATOM 0 HH22 ARG A 45 -1.936 2.460 -17.935 1.00 99.99 H new ATOM 385 N LEU A 46 -6.370 8.660 -15.963 1.00 99.99 N ATOM 386 CA LEU A 46 -7.209 9.693 -16.559 1.00 99.99 C ATOM 387 C LEU A 46 -6.466 10.339 -17.718 1.00 99.99 C ATOM 388 O LEU A 46 -5.458 11.017 -17.525 1.00 99.99 O ATOM 389 CB LEU A 46 -7.551 10.824 -15.580 1.00 99.99 C ATOM 390 CG LEU A 46 -8.311 10.440 -14.286 1.00 99.99 C ATOM 391 CD1 LEU A 46 -8.331 11.666 -13.353 1.00 99.99 C ATOM 392 CD2 LEU A 46 -9.739 9.947 -14.543 1.00 99.99 C ATOM 0 H LEU A 46 -6.057 8.873 -15.016 1.00 99.99 H new ATOM 0 HA LEU A 46 -8.129 9.197 -16.870 1.00 99.99 H new ATOM 0 HB2 LEU A 46 -6.621 11.313 -15.292 1.00 99.99 H new ATOM 0 HB3 LEU A 46 -8.148 11.563 -16.114 1.00 99.99 H new ATOM 0 HG LEU A 46 -7.785 9.604 -13.826 1.00 99.99 H new ATOM 0 HD11 LEU A 46 -8.862 11.416 -12.435 1.00 99.99 H new ATOM 0 HD12 LEU A 46 -7.308 11.957 -13.113 1.00 99.99 H new ATOM 0 HD13 LEU A 46 -8.836 12.494 -13.851 1.00 99.99 H new ATOM 0 HD21 LEU A 46 -10.213 9.695 -13.594 1.00 99.99 H new ATOM 0 HD22 LEU A 46 -10.311 10.732 -15.038 1.00 99.99 H new ATOM 0 HD23 LEU A 46 -9.710 9.063 -15.180 1.00 99.99 H new ATOM 405 N SER B 22 -10.410 0.598 18.983 1.00 99.99 N ATOM 406 CA SER B 22 -10.116 1.253 17.676 1.00 99.99 C ATOM 407 C SER B 22 -8.656 1.594 17.532 1.00 99.99 C ATOM 408 O SER B 22 -7.871 1.456 18.471 1.00 99.99 O ATOM 409 CB SER B 22 -11.011 2.515 17.458 1.00 99.99 C ATOM 410 OG SER B 22 -10.781 3.540 18.422 1.00 99.99 O ATOM 0 HA SER B 22 -10.358 0.530 16.897 1.00 99.99 H new ATOM 0 HB2 SER B 22 -10.827 2.915 16.461 1.00 99.99 H new ATOM 0 HB3 SER B 22 -12.060 2.220 17.494 1.00 99.99 H new ATOM 0 HG SER B 22 -11.367 4.303 18.234 1.00 99.99 H new ATOM 415 N SER B 23 -8.271 2.059 16.320 1.00 99.99 N ATOM 416 CA SER B 23 -6.940 2.535 16.024 1.00 99.99 C ATOM 417 C SER B 23 -7.111 3.958 15.557 1.00 99.99 C ATOM 418 O SER B 23 -8.174 4.552 15.741 1.00 99.99 O ATOM 419 CB SER B 23 -6.223 1.678 14.953 1.00 99.99 C ATOM 420 OG SER B 23 -6.044 0.349 15.424 1.00 99.99 O ATOM 0 H SER B 23 -8.903 2.106 15.521 1.00 99.99 H new ATOM 0 HA SER B 23 -6.306 2.468 16.908 1.00 99.99 H new ATOM 0 HB2 SER B 23 -6.808 1.669 14.033 1.00 99.99 H new ATOM 0 HB3 SER B 23 -5.256 2.119 14.712 1.00 99.99 H new ATOM 0 HG SER B 23 -5.591 -0.183 14.737 1.00 99.99 H new ATOM 426 N ASP B 24 -6.046 4.556 14.963 1.00 99.99 N ATOM 427 CA ASP B 24 -6.008 5.959 14.593 1.00 99.99 C ATOM 428 C ASP B 24 -6.542 6.101 13.184 1.00 99.99 C ATOM 429 O ASP B 24 -6.407 5.154 12.417 1.00 99.99 O ATOM 430 CB ASP B 24 -4.565 6.535 14.631 1.00 99.99 C ATOM 431 CG ASP B 24 -3.972 6.479 16.042 1.00 99.99 C ATOM 432 OD1 ASP B 24 -4.749 6.392 17.032 1.00 99.99 O ATOM 433 OD2 ASP B 24 -2.717 6.533 16.146 1.00 99.99 O ATOM 0 H ASP B 24 -5.188 4.054 14.733 1.00 99.99 H new ATOM 0 HA ASP B 24 -6.613 6.512 15.311 1.00 99.99 H new ATOM 0 HB2 ASP B 24 -3.930 5.973 13.946 1.00 99.99 H new ATOM 0 HB3 ASP B 24 -4.575 7.567 14.281 1.00 99.99 H new ATOM 438 N PRO B 25 -7.165 7.208 12.774 1.00 99.99 N ATOM 439 CA PRO B 25 -7.988 7.248 11.574 1.00 99.99 C ATOM 440 C PRO B 25 -7.172 7.255 10.301 1.00 99.99 C ATOM 441 O PRO B 25 -7.727 6.875 9.281 1.00 99.99 O ATOM 442 CB PRO B 25 -8.807 8.542 11.706 1.00 99.99 C ATOM 443 CG PRO B 25 -7.978 9.421 12.646 1.00 99.99 C ATOM 444 CD PRO B 25 -7.362 8.399 13.598 1.00 99.99 C ATOM 0 HA PRO B 25 -8.611 6.357 11.500 1.00 99.99 H new ATOM 0 HB2 PRO B 25 -8.952 9.021 10.738 1.00 99.99 H new ATOM 0 HB3 PRO B 25 -9.798 8.346 12.116 1.00 99.99 H new ATOM 0 HG2 PRO B 25 -7.216 9.985 12.108 1.00 99.99 H new ATOM 0 HG3 PRO B 25 -8.597 10.146 13.174 1.00 99.99 H new ATOM 0 HD2 PRO B 25 -6.419 8.758 14.010 1.00 99.99 H new ATOM 0 HD3 PRO B 25 -8.021 8.194 14.442 1.00 99.99 H new ATOM 452 N LEU B 26 -5.890 7.686 10.339 1.00 99.99 N ATOM 453 CA LEU B 26 -4.910 7.659 9.261 1.00 99.99 C ATOM 454 C LEU B 26 -4.496 6.220 8.992 1.00 99.99 C ATOM 455 O LEU B 26 -4.389 5.845 7.852 1.00 99.99 O ATOM 456 CB LEU B 26 -3.623 8.422 9.603 1.00 99.99 C ATOM 457 CG LEU B 26 -2.447 8.260 8.612 1.00 99.99 C ATOM 458 CD1 LEU B 26 -2.760 8.828 7.226 1.00 99.99 C ATOM 459 CD2 LEU B 26 -1.177 8.904 9.186 1.00 99.99 C ATOM 0 H LEU B 26 -5.499 8.088 11.191 1.00 99.99 H new ATOM 0 HA LEU B 26 -5.389 8.129 8.402 1.00 99.99 H new ATOM 0 HB2 LEU B 26 -3.864 9.482 9.678 1.00 99.99 H new ATOM 0 HB3 LEU B 26 -3.287 8.101 10.589 1.00 99.99 H new ATOM 0 HG LEU B 26 -2.282 7.190 8.482 1.00 99.99 H new ATOM 0 HD11 LEU B 26 -1.899 8.687 6.572 1.00 99.99 H new ATOM 0 HD12 LEU B 26 -3.623 8.310 6.807 1.00 99.99 H new ATOM 0 HD13 LEU B 26 -2.981 9.892 7.310 1.00 99.99 H new ATOM 0 HD21 LEU B 26 -0.356 8.783 8.479 1.00 99.99 H new ATOM 0 HD22 LEU B 26 -1.354 9.966 9.359 1.00 99.99 H new ATOM 0 HD23 LEU B 26 -0.918 8.421 10.128 1.00 99.99 H new ATOM 471 N VAL B 27 -4.281 5.497 10.005 1.00 99.99 N ATOM 472 CA VAL B 27 -3.855 4.106 9.894 1.00 99.99 C ATOM 473 C VAL B 27 -5.003 3.269 9.350 1.00 99.99 C ATOM 474 O VAL B 27 -4.784 2.479 8.467 1.00 99.99 O ATOM 475 CB VAL B 27 -3.473 3.490 11.247 1.00 99.99 C ATOM 476 CG1 VAL B 27 -3.148 1.991 11.092 1.00 99.99 C ATOM 477 CG2 VAL B 27 -2.240 4.225 11.818 1.00 99.99 C ATOM 0 H VAL B 27 -4.387 5.825 10.965 1.00 99.99 H new ATOM 0 HA VAL B 27 -2.984 4.104 9.239 1.00 99.99 H new ATOM 0 HB VAL B 27 -4.318 3.596 11.928 1.00 99.99 H new ATOM 0 HG11 VAL B 27 -2.880 1.575 12.063 1.00 99.99 H new ATOM 0 HG12 VAL B 27 -4.021 1.468 10.701 1.00 99.99 H new ATOM 0 HG13 VAL B 27 -2.313 1.869 10.402 1.00 99.99 H new ATOM 0 HG21 VAL B 27 -1.968 3.788 12.779 1.00 99.99 H new ATOM 0 HG22 VAL B 27 -1.404 4.126 11.125 1.00 99.99 H new ATOM 0 HG23 VAL B 27 -2.476 5.280 11.953 1.00 99.99 H new ATOM 487 N VAL B 28 -6.136 3.454 9.876 1.00 99.99 N ATOM 488 CA VAL B 28 -7.318 2.703 9.470 1.00 99.99 C ATOM 489 C VAL B 28 -7.727 3.127 8.068 1.00 99.99 C ATOM 490 O VAL B 28 -8.029 2.281 7.265 1.00 99.99 O ATOM 491 CB VAL B 28 -8.530 2.964 10.374 1.00 99.99 C ATOM 492 CG1 VAL B 28 -9.801 2.293 9.813 1.00 99.99 C ATOM 493 CG2 VAL B 28 -8.240 2.444 11.796 1.00 99.99 C ATOM 0 H VAL B 28 -6.310 4.134 10.616 1.00 99.99 H new ATOM 0 HA VAL B 28 -7.047 1.649 9.529 1.00 99.99 H new ATOM 0 HB VAL B 28 -8.706 4.039 10.409 1.00 99.99 H new ATOM 0 HG11 VAL B 28 -10.642 2.496 10.476 1.00 99.99 H new ATOM 0 HG12 VAL B 28 -10.015 2.692 8.821 1.00 99.99 H new ATOM 0 HG13 VAL B 28 -9.644 1.216 9.745 1.00 99.99 H new ATOM 0 HG21 VAL B 28 -9.103 2.631 12.435 1.00 99.99 H new ATOM 0 HG22 VAL B 28 -8.042 1.373 11.758 1.00 99.99 H new ATOM 0 HG23 VAL B 28 -7.370 2.960 12.202 1.00 99.99 H new ATOM 503 N ALA B 29 -7.731 4.366 7.832 1.00 99.99 N ATOM 504 CA ALA B 29 -8.129 4.914 6.539 1.00 99.99 C ATOM 505 C ALA B 29 -7.191 4.389 5.462 1.00 99.99 C ATOM 506 O ALA B 29 -7.653 4.053 4.399 1.00 99.99 O ATOM 507 CB ALA B 29 -8.034 6.444 6.485 1.00 99.99 C ATOM 0 H ALA B 29 -7.460 5.071 8.517 1.00 99.99 H new ATOM 0 HA ALA B 29 -9.165 4.612 6.383 1.00 99.99 H new ATOM 0 HB1 ALA B 29 -8.342 6.793 5.500 1.00 99.99 H new ATOM 0 HB2 ALA B 29 -8.687 6.876 7.244 1.00 99.99 H new ATOM 0 HB3 ALA B 29 -7.005 6.752 6.673 1.00 99.99 H new ATOM 513 N ALA B 30 -5.964 4.344 5.752 1.00 99.99 N ATOM 514 CA ALA B 30 -4.954 3.886 4.806 1.00 99.99 C ATOM 515 C ALA B 30 -5.192 2.419 4.484 1.00 99.99 C ATOM 516 O ALA B 30 -4.984 2.025 3.362 1.00 99.99 O ATOM 517 CB ALA B 30 -3.528 3.978 5.365 1.00 99.99 C ATOM 0 H ALA B 30 -5.589 4.621 6.659 1.00 99.99 H new ATOM 0 HA ALA B 30 -5.041 4.530 3.931 1.00 99.99 H new ATOM 0 HB1 ALA B 30 -2.820 3.623 4.616 1.00 99.99 H new ATOM 0 HB2 ALA B 30 -3.302 5.014 5.616 1.00 99.99 H new ATOM 0 HB3 ALA B 30 -3.448 3.362 6.260 1.00 99.99 H new ATOM 523 N SER B 31 -5.599 1.693 5.430 1.00 99.99 N ATOM 524 CA SER B 31 -5.844 0.264 5.269 1.00 99.99 C ATOM 525 C SER B 31 -6.934 0.056 4.228 1.00 99.99 C ATOM 526 O SER B 31 -6.769 -0.766 3.361 1.00 99.99 O ATOM 527 CB SER B 31 -6.339 -0.407 6.556 1.00 99.99 C ATOM 528 OG SER B 31 -5.329 -0.383 7.562 1.00 99.99 O ATOM 0 H SER B 31 -5.786 2.044 6.369 1.00 99.99 H new ATOM 0 HA SER B 31 -4.891 -0.179 4.979 1.00 99.99 H new ATOM 0 HB2 SER B 31 -7.231 0.104 6.918 1.00 99.99 H new ATOM 0 HB3 SER B 31 -6.625 -1.438 6.347 1.00 99.99 H new ATOM 0 HG SER B 31 -5.177 0.541 7.851 1.00 99.99 H new ATOM 534 N ILE B 32 -7.970 0.767 4.345 1.00 99.99 N ATOM 535 CA ILE B 32 -9.103 0.654 3.435 1.00 99.99 C ATOM 536 C ILE B 32 -8.671 1.071 2.036 1.00 99.99 C ATOM 537 O ILE B 32 -9.111 0.479 1.086 1.00 99.99 O ATOM 538 CB ILE B 32 -10.272 1.571 3.819 1.00 99.99 C ATOM 539 CG1 ILE B 32 -10.873 1.129 5.172 1.00 99.99 C ATOM 540 CG2 ILE B 32 -11.362 1.560 2.728 1.00 99.99 C ATOM 541 CD1 ILE B 32 -11.795 2.186 5.793 1.00 99.99 C ATOM 0 H ILE B 32 -8.093 1.467 5.076 1.00 99.99 H new ATOM 0 HA ILE B 32 -9.431 -0.384 3.484 1.00 99.99 H new ATOM 0 HB ILE B 32 -9.891 2.588 3.913 1.00 99.99 H new ATOM 0 HG12 ILE B 32 -11.433 0.205 5.030 1.00 99.99 H new ATOM 0 HG13 ILE B 32 -10.064 0.907 5.868 1.00 99.99 H new ATOM 0 HG21 ILE B 32 -12.179 2.218 3.024 1.00 99.99 H new ATOM 0 HG22 ILE B 32 -10.938 1.909 1.787 1.00 99.99 H new ATOM 0 HG23 ILE B 32 -11.740 0.545 2.602 1.00 99.99 H new ATOM 0 HD11 ILE B 32 -12.185 1.816 6.741 1.00 99.99 H new ATOM 0 HD12 ILE B 32 -11.232 3.104 5.965 1.00 99.99 H new ATOM 0 HD13 ILE B 32 -12.623 2.390 5.114 1.00 99.99 H new ATOM 553 N ILE B 33 -7.865 2.039 1.963 1.00 99.99 N ATOM 554 CA ILE B 33 -7.388 2.564 0.688 1.00 99.99 C ATOM 555 C ILE B 33 -6.619 1.475 -0.048 1.00 99.99 C ATOM 556 O ILE B 33 -6.845 1.288 -1.216 1.00 99.99 O ATOM 557 CB ILE B 33 -6.417 3.742 0.850 1.00 99.99 C ATOM 558 CG1 ILE B 33 -7.244 5.036 1.056 1.00 99.99 C ATOM 559 CG2 ILE B 33 -5.467 3.881 -0.352 1.00 99.99 C ATOM 560 CD1 ILE B 33 -6.446 6.225 1.602 1.00 99.99 C ATOM 0 H ILE B 33 -7.490 2.523 2.779 1.00 99.99 H new ATOM 0 HA ILE B 33 -8.273 2.900 0.147 1.00 99.99 H new ATOM 0 HB ILE B 33 -5.785 3.560 1.719 1.00 99.99 H new ATOM 0 HG12 ILE B 33 -7.690 5.322 0.103 1.00 99.99 H new ATOM 0 HG13 ILE B 33 -8.065 4.822 1.740 1.00 99.99 H new ATOM 0 HG21 ILE B 33 -4.799 4.727 -0.192 1.00 99.99 H new ATOM 0 HG22 ILE B 33 -4.879 2.970 -0.458 1.00 99.99 H new ATOM 0 HG23 ILE B 33 -6.049 4.045 -1.259 1.00 99.99 H new ATOM 0 HD11 ILE B 33 -7.106 7.085 1.714 1.00 99.99 H new ATOM 0 HD12 ILE B 33 -6.022 5.964 2.572 1.00 99.99 H new ATOM 0 HD13 ILE B 33 -5.642 6.472 0.909 1.00 99.99 H new ATOM 572 N GLY B 34 -5.776 0.825 0.629 1.00 99.99 N ATOM 573 CA GLY B 34 -4.953 -0.230 0.044 1.00 99.99 C ATOM 574 C GLY B 34 -5.843 -1.386 -0.380 1.00 99.99 C ATOM 575 O GLY B 34 -5.590 -1.975 -1.400 1.00 99.99 O ATOM 0 H GLY B 34 -5.606 0.983 1.622 1.00 99.99 H new ATOM 0 HA2 GLY B 34 -4.404 0.156 -0.815 1.00 99.99 H new ATOM 0 HA3 GLY B 34 -4.213 -0.572 0.767 1.00 99.99 H new ATOM 579 N ILE B 35 -7.107 -1.347 0.011 1.00 99.99 N ATOM 580 CA ILE B 35 -7.993 -2.381 -0.515 1.00 99.99 C ATOM 581 C ILE B 35 -8.722 -1.846 -1.737 1.00 99.99 C ATOM 582 O ILE B 35 -8.802 -2.540 -2.719 1.00 99.99 O ATOM 583 CB ILE B 35 -9.077 -2.803 0.485 1.00 99.99 C ATOM 584 CG1 ILE B 35 -8.430 -3.354 1.781 1.00 99.99 C ATOM 585 CG2 ILE B 35 -9.993 -3.868 -0.154 1.00 99.99 C ATOM 586 CD1 ILE B 35 -9.390 -3.514 2.963 1.00 99.99 C ATOM 0 H ILE B 35 -7.524 -0.665 0.644 1.00 99.99 H new ATOM 0 HA ILE B 35 -7.360 -3.239 -0.743 1.00 99.99 H new ATOM 0 HB ILE B 35 -9.677 -1.931 0.745 1.00 99.99 H new ATOM 0 HG12 ILE B 35 -7.981 -4.323 1.562 1.00 99.99 H new ATOM 0 HG13 ILE B 35 -7.620 -2.687 2.077 1.00 99.99 H new ATOM 0 HG21 ILE B 35 -10.761 -4.164 0.561 1.00 99.99 H new ATOM 0 HG22 ILE B 35 -10.466 -3.454 -1.044 1.00 99.99 H new ATOM 0 HG23 ILE B 35 -9.400 -4.740 -0.431 1.00 99.99 H new ATOM 0 HD11 ILE B 35 -8.846 -3.905 3.823 1.00 99.99 H new ATOM 0 HD12 ILE B 35 -9.821 -2.545 3.216 1.00 99.99 H new ATOM 0 HD13 ILE B 35 -10.188 -4.206 2.693 1.00 99.99 H new ATOM 598 N LEU B 36 -9.208 -0.686 -1.642 1.00 99.99 N ATOM 599 CA LEU B 36 -9.956 -0.062 -2.728 1.00 99.99 C ATOM 600 C LEU B 36 -9.057 0.062 -3.950 1.00 99.99 C ATOM 601 O LEU B 36 -9.496 -0.235 -5.031 1.00 99.99 O ATOM 602 CB LEU B 36 -10.424 1.359 -2.389 1.00 99.99 C ATOM 603 CG LEU B 36 -11.107 2.125 -3.543 1.00 99.99 C ATOM 604 CD1 LEU B 36 -12.403 1.429 -3.981 1.00 99.99 C ATOM 605 CD2 LEU B 36 -11.375 3.584 -3.151 1.00 99.99 C ATOM 0 H LEU B 36 -9.117 -0.102 -0.810 1.00 99.99 H new ATOM 0 HA LEU B 36 -10.826 -0.694 -2.905 1.00 99.99 H new ATOM 0 HB2 LEU B 36 -11.119 1.304 -1.551 1.00 99.99 H new ATOM 0 HB3 LEU B 36 -9.563 1.936 -2.052 1.00 99.99 H new ATOM 0 HG LEU B 36 -10.424 2.123 -4.392 1.00 99.99 H new ATOM 0 HD11 LEU B 36 -12.861 1.991 -4.795 1.00 99.99 H new ATOM 0 HD12 LEU B 36 -12.176 0.419 -4.321 1.00 99.99 H new ATOM 0 HD13 LEU B 36 -13.093 1.382 -3.139 1.00 99.99 H new ATOM 0 HD21 LEU B 36 -11.856 4.101 -3.981 1.00 99.99 H new ATOM 0 HD22 LEU B 36 -12.028 3.612 -2.278 1.00 99.99 H new ATOM 0 HD23 LEU B 36 -10.432 4.076 -2.915 1.00 99.99 H new ATOM 617 N HIS B 37 -7.797 0.522 -3.782 1.00 99.99 N ATOM 618 CA HIS B 37 -6.852 0.744 -4.849 1.00 99.99 C ATOM 619 C HIS B 37 -6.526 -0.557 -5.530 1.00 99.99 C ATOM 620 O HIS B 37 -6.189 -0.580 -6.712 1.00 99.99 O ATOM 621 CB HIS B 37 -5.542 1.379 -4.323 1.00 99.99 C ATOM 622 CG HIS B 37 -4.590 1.818 -5.406 1.00 99.99 C ATOM 623 ND1 HIS B 37 -3.271 2.090 -5.159 1.00 99.99 N ATOM 624 CD2 HIS B 37 -4.810 2.074 -6.717 1.00 99.99 C ATOM 625 CE1 HIS B 37 -2.708 2.489 -6.291 1.00 99.99 C ATOM 626 NE2 HIS B 37 -3.621 2.488 -7.252 1.00 99.99 N ATOM 0 H HIS B 37 -7.418 0.750 -2.863 1.00 99.99 H new ATOM 0 HA HIS B 37 -7.313 1.432 -5.558 1.00 99.99 H new ATOM 0 HB2 HIS B 37 -5.792 2.240 -3.704 1.00 99.99 H new ATOM 0 HB3 HIS B 37 -5.036 0.660 -3.679 1.00 99.99 H new ATOM 0 HD2 HIS B 37 -5.748 1.971 -7.242 1.00 99.99 H new ATOM 0 HE1 HIS B 37 -1.672 2.770 -6.411 1.00 99.99 H new ATOM 0 HE2 HIS B 37 -3.464 2.751 -8.225 1.00 99.99 H new ATOM 634 N LEU B 38 -6.666 -1.682 -4.787 1.00 99.99 N ATOM 635 CA LEU B 38 -6.412 -3.018 -5.311 1.00 99.99 C ATOM 636 C LEU B 38 -7.528 -3.404 -6.270 1.00 99.99 C ATOM 637 O LEU B 38 -7.247 -3.932 -7.316 1.00 99.99 O ATOM 638 CB LEU B 38 -6.388 -4.096 -4.219 1.00 99.99 C ATOM 639 CG LEU B 38 -6.143 -5.524 -4.766 1.00 99.99 C ATOM 640 CD1 LEU B 38 -4.808 -5.625 -5.516 1.00 99.99 C ATOM 641 CD2 LEU B 38 -6.218 -6.583 -3.666 1.00 99.99 C ATOM 0 H LEU B 38 -6.959 -1.673 -3.810 1.00 99.99 H new ATOM 0 HA LEU B 38 -5.435 -2.975 -5.793 1.00 99.99 H new ATOM 0 HB2 LEU B 38 -5.608 -3.853 -3.497 1.00 99.99 H new ATOM 0 HB3 LEU B 38 -7.336 -4.079 -3.682 1.00 99.99 H new ATOM 0 HG LEU B 38 -6.947 -5.722 -5.475 1.00 99.99 H new ATOM 0 HD11 LEU B 38 -4.673 -6.642 -5.884 1.00 99.99 H new ATOM 0 HD12 LEU B 38 -4.810 -4.932 -6.357 1.00 99.99 H new ATOM 0 HD13 LEU B 38 -3.991 -5.373 -4.840 1.00 99.99 H new ATOM 0 HD21 LEU B 38 -6.040 -7.568 -4.097 1.00 99.99 H new ATOM 0 HD22 LEU B 38 -5.461 -6.376 -2.909 1.00 99.99 H new ATOM 0 HD23 LEU B 38 -7.206 -6.561 -3.207 1.00 99.99 H new ATOM 653 N ILE B 39 -8.704 -3.145 -5.899 1.00 99.99 N ATOM 654 CA ILE B 39 -9.872 -3.484 -6.705 1.00 99.99 C ATOM 655 C ILE B 39 -9.829 -2.695 -8.005 1.00 99.99 C ATOM 656 O ILE B 39 -10.095 -3.256 -9.040 1.00 99.99 O ATOM 657 CB ILE B 39 -11.197 -3.121 -6.022 1.00 99.99 C ATOM 658 CG1 ILE B 39 -11.409 -4.013 -4.779 1.00 99.99 C ATOM 659 CG2 ILE B 39 -12.371 -3.282 -7.010 1.00 99.99 C ATOM 660 CD1 ILE B 39 -12.616 -3.606 -3.923 1.00 99.99 C ATOM 0 H ILE B 39 -8.928 -2.684 -5.017 1.00 99.99 H new ATOM 0 HA ILE B 39 -9.834 -4.562 -6.861 1.00 99.99 H new ATOM 0 HB ILE B 39 -11.158 -2.079 -5.704 1.00 99.99 H new ATOM 0 HG12 ILE B 39 -11.537 -5.046 -5.102 1.00 99.99 H new ATOM 0 HG13 ILE B 39 -10.511 -3.980 -4.163 1.00 99.99 H new ATOM 0 HG21 ILE B 39 -13.305 -3.021 -6.511 1.00 99.99 H new ATOM 0 HG22 ILE B 39 -12.220 -2.623 -7.865 1.00 99.99 H new ATOM 0 HG23 ILE B 39 -12.419 -4.316 -7.352 1.00 99.99 H new ATOM 0 HD11 ILE B 39 -12.700 -4.278 -3.069 1.00 99.99 H new ATOM 0 HD12 ILE B 39 -12.483 -2.584 -3.568 1.00 99.99 H new ATOM 0 HD13 ILE B 39 -13.524 -3.666 -4.523 1.00 99.99 H new ATOM 672 N LEU B 40 -9.521 -1.477 -7.917 1.00 99.99 N ATOM 673 CA LEU B 40 -9.467 -0.597 -9.078 1.00 99.99 C ATOM 674 C LEU B 40 -8.413 -1.108 -10.049 1.00 99.99 C ATOM 675 O LEU B 40 -8.665 -1.130 -11.228 1.00 99.99 O ATOM 676 CB LEU B 40 -9.065 0.840 -8.723 1.00 99.99 C ATOM 677 CG LEU B 40 -10.124 1.655 -7.948 1.00 99.99 C ATOM 678 CD1 LEU B 40 -9.541 3.029 -7.562 1.00 99.99 C ATOM 679 CD2 LEU B 40 -11.419 1.843 -8.751 1.00 99.99 C ATOM 0 H LEU B 40 -9.288 -1.017 -7.037 1.00 99.99 H new ATOM 0 HA LEU B 40 -10.470 -0.594 -9.504 1.00 99.99 H new ATOM 0 HB2 LEU B 40 -8.151 0.807 -8.129 1.00 99.99 H new ATOM 0 HB3 LEU B 40 -8.827 1.370 -9.645 1.00 99.99 H new ATOM 0 HG LEU B 40 -10.379 1.092 -7.051 1.00 99.99 H new ATOM 0 HD11 LEU B 40 -10.290 3.602 -7.015 1.00 99.99 H new ATOM 0 HD12 LEU B 40 -8.662 2.888 -6.933 1.00 99.99 H new ATOM 0 HD13 LEU B 40 -9.258 3.571 -8.465 1.00 99.99 H new ATOM 0 HD21 LEU B 40 -12.131 2.422 -8.163 1.00 99.99 H new ATOM 0 HD22 LEU B 40 -11.199 2.372 -9.678 1.00 99.99 H new ATOM 0 HD23 LEU B 40 -11.848 0.868 -8.983 1.00 99.99 H new ATOM 691 N TRP B 41 -7.317 -1.481 -9.548 1.00 99.99 N ATOM 692 CA TRP B 41 -6.210 -1.967 -10.363 1.00 99.99 C ATOM 693 C TRP B 41 -6.605 -3.287 -11.009 1.00 99.99 C ATOM 694 O TRP B 41 -6.324 -3.482 -12.165 1.00 99.99 O ATOM 695 CB TRP B 41 -4.943 -2.246 -9.544 1.00 99.99 C ATOM 696 CG TRP B 41 -3.743 -2.652 -10.381 1.00 99.99 C ATOM 697 CD1 TRP B 41 -2.940 -1.835 -11.116 1.00 99.99 C ATOM 698 CD2 TRP B 41 -3.305 -3.998 -10.637 1.00 99.99 C ATOM 699 NE1 TRP B 41 -1.976 -2.565 -11.750 1.00 99.99 N ATOM 700 CE2 TRP B 41 -2.203 -3.898 -11.507 1.00 99.99 C ATOM 701 CE3 TRP B 41 -3.769 -5.235 -10.180 1.00 99.99 C ATOM 702 CZ2 TRP B 41 -1.527 -5.034 -11.927 1.00 99.99 C ATOM 703 CZ3 TRP B 41 -3.093 -6.376 -10.618 1.00 99.99 C ATOM 704 CH2 TRP B 41 -1.985 -6.284 -11.478 1.00 99.99 C ATOM 0 H TRP B 41 -7.123 -1.472 -8.547 1.00 99.99 H new ATOM 0 HA TRP B 41 -5.999 -1.185 -11.093 1.00 99.99 H new ATOM 0 HB2 TRP B 41 -4.689 -1.354 -8.972 1.00 99.99 H new ATOM 0 HB3 TRP B 41 -5.155 -3.036 -8.824 1.00 99.99 H new ATOM 0 HD1 TRP B 41 -3.050 -0.763 -11.187 1.00 99.99 H new ATOM 0 HE1 TRP B 41 -1.214 -2.184 -12.311 1.00 99.99 H new ATOM 0 HE3 TRP B 41 -4.617 -5.306 -9.515 1.00 99.99 H new ATOM 0 HZ2 TRP B 41 -0.671 -4.960 -12.582 1.00 99.99 H new ATOM 0 HZ3 TRP B 41 -3.428 -7.349 -10.289 1.00 99.99 H new ATOM 0 HH2 TRP B 41 -1.480 -7.184 -11.797 1.00 99.99 H new ATOM 715 N ILE B 42 -7.207 -4.117 -10.272 1.00 99.99 N ATOM 716 CA ILE B 42 -7.620 -5.432 -10.752 1.00 99.99 C ATOM 717 C ILE B 42 -8.705 -5.263 -11.806 1.00 99.99 C ATOM 718 O ILE B 42 -8.660 -5.936 -12.805 1.00 99.99 O ATOM 719 CB ILE B 42 -8.222 -6.308 -9.649 1.00 99.99 C ATOM 720 CG1 ILE B 42 -7.116 -6.763 -8.668 1.00 99.99 C ATOM 721 CG2 ILE B 42 -8.939 -7.537 -10.251 1.00 99.99 C ATOM 722 CD1 ILE B 42 -7.646 -7.569 -7.472 1.00 99.99 C ATOM 0 H ILE B 42 -7.448 -3.935 -9.298 1.00 99.99 H new ATOM 0 HA ILE B 42 -6.722 -5.912 -11.141 1.00 99.99 H new ATOM 0 HB ILE B 42 -8.958 -5.716 -9.105 1.00 99.99 H new ATOM 0 HG12 ILE B 42 -6.389 -7.368 -9.209 1.00 99.99 H new ATOM 0 HG13 ILE B 42 -6.587 -5.885 -8.298 1.00 99.99 H new ATOM 0 HG21 ILE B 42 -9.358 -8.143 -9.448 1.00 99.99 H new ATOM 0 HG22 ILE B 42 -9.741 -7.204 -10.910 1.00 99.99 H new ATOM 0 HG23 ILE B 42 -8.225 -8.132 -10.820 1.00 99.99 H new ATOM 0 HD11 ILE B 42 -6.814 -7.854 -6.828 1.00 99.99 H new ATOM 0 HD12 ILE B 42 -8.351 -6.960 -6.906 1.00 99.99 H new ATOM 0 HD13 ILE B 42 -8.149 -8.466 -7.832 1.00 99.99 H new ATOM 734 N LEU B 43 -9.607 -4.417 -11.558 1.00 99.99 N ATOM 735 CA LEU B 43 -10.720 -4.174 -12.467 1.00 99.99 C ATOM 736 C LEU B 43 -10.187 -3.608 -13.776 1.00 99.99 C ATOM 737 O LEU B 43 -10.716 -3.928 -14.810 1.00 99.99 O ATOM 738 CB LEU B 43 -11.719 -3.144 -11.925 1.00 99.99 C ATOM 739 CG LEU B 43 -12.544 -3.632 -10.712 1.00 99.99 C ATOM 740 CD1 LEU B 43 -13.310 -2.455 -10.080 1.00 99.99 C ATOM 741 CD2 LEU B 43 -13.524 -4.752 -11.094 1.00 99.99 C ATOM 0 H LEU B 43 -9.627 -3.845 -10.714 1.00 99.99 H new ATOM 0 HA LEU B 43 -11.225 -5.131 -12.595 1.00 99.99 H new ATOM 0 HB2 LEU B 43 -11.175 -2.243 -11.640 1.00 99.99 H new ATOM 0 HB3 LEU B 43 -12.404 -2.864 -12.726 1.00 99.99 H new ATOM 0 HG LEU B 43 -11.842 -4.041 -9.985 1.00 99.99 H new ATOM 0 HD11 LEU B 43 -13.887 -2.812 -9.227 1.00 99.99 H new ATOM 0 HD12 LEU B 43 -12.601 -1.697 -9.747 1.00 99.99 H new ATOM 0 HD13 LEU B 43 -13.985 -2.022 -10.818 1.00 99.99 H new ATOM 0 HD21 LEU B 43 -14.082 -5.064 -10.211 1.00 99.99 H new ATOM 0 HD22 LEU B 43 -14.217 -4.386 -11.851 1.00 99.99 H new ATOM 0 HD23 LEU B 43 -12.969 -5.602 -11.491 1.00 99.99 H new ATOM 753 N ASP B 44 -9.211 -2.814 -13.691 1.00 99.99 N ATOM 754 CA ASP B 44 -8.618 -2.179 -14.860 1.00 99.99 C ATOM 755 C ASP B 44 -7.947 -3.238 -15.724 1.00 99.99 C ATOM 756 O ASP B 44 -8.046 -3.165 -16.924 1.00 99.99 O ATOM 757 CB ASP B 44 -7.527 -1.160 -14.500 1.00 99.99 C ATOM 758 CG ASP B 44 -6.971 -0.430 -15.738 1.00 99.99 C ATOM 759 OD1 ASP B 44 -7.734 0.342 -16.366 1.00 99.99 O ATOM 760 OD2 ASP B 44 -5.755 -0.590 -16.056 1.00 99.99 O ATOM 0 H ASP B 44 -8.767 -2.558 -12.809 1.00 99.99 H new ATOM 0 HA ASP B 44 -9.432 -1.667 -15.374 1.00 99.99 H new ATOM 0 HB2 ASP B 44 -7.934 -0.428 -13.803 1.00 99.99 H new ATOM 0 HB3 ASP B 44 -6.712 -1.671 -13.987 1.00 99.99 H new ATOM 765 N ARG B 45 -7.310 -4.141 -15.117 1.00 99.99 N ATOM 766 CA ARG B 45 -6.600 -5.204 -15.819 1.00 99.99 C ATOM 767 C ARG B 45 -7.600 -6.065 -16.576 1.00 99.99 C ATOM 768 O ARG B 45 -7.340 -6.414 -17.700 1.00 99.99 O ATOM 769 CB ARG B 45 -5.849 -6.148 -14.871 1.00 99.99 C ATOM 770 CG ARG B 45 -4.698 -5.468 -14.101 1.00 99.99 C ATOM 771 CD ARG B 45 -3.457 -5.219 -14.968 1.00 99.99 C ATOM 772 NE ARG B 45 -3.541 -3.827 -15.539 1.00 99.99 N ATOM 773 CZ ARG B 45 -2.856 -3.483 -16.646 1.00 99.99 C ATOM 774 NH1 ARG B 45 -2.050 -4.357 -17.275 1.00 99.99 N ATOM 775 NH2 ARG B 45 -2.968 -2.224 -17.099 1.00 99.99 N ATOM 0 H ARG B 45 -7.243 -4.197 -14.101 1.00 99.99 H new ATOM 0 HA ARG B 45 -5.885 -4.710 -16.476 1.00 99.99 H new ATOM 0 HB2 ARG B 45 -6.556 -6.567 -14.155 1.00 99.99 H new ATOM 0 HB3 ARG B 45 -5.447 -6.982 -15.446 1.00 99.99 H new ATOM 0 HG2 ARG B 45 -5.050 -4.518 -13.699 1.00 99.99 H new ATOM 0 HG3 ARG B 45 -4.420 -6.091 -13.250 1.00 99.99 H new ATOM 0 HD2 ARG B 45 -2.551 -5.329 -14.372 1.00 99.99 H new ATOM 0 HD3 ARG B 45 -3.402 -5.954 -15.771 1.00 99.99 H new ATOM 0 HE ARG B 45 -4.128 -3.132 -15.078 1.00 99.99 H new ATOM 0 HH11 ARG B 45 -1.947 -5.306 -16.915 1.00 99.99 H new ATOM 0 HH12 ARG B 45 -1.542 -4.071 -18.112 1.00 99.99 H new ATOM 0 HH21 ARG B 45 -3.561 -1.556 -16.607 1.00 99.99 H new ATOM 0 HH22 ARG B 45 -2.460 -1.936 -17.935 1.00 99.99 H new ATOM 789 N LEU B 46 -8.660 -6.370 -15.963 1.00 99.99 N ATOM 790 CA LEU B 46 -9.693 -7.209 -16.559 1.00 99.99 C ATOM 791 C LEU B 46 -10.339 -6.466 -17.718 1.00 99.99 C ATOM 792 O LEU B 46 -11.017 -5.458 -17.525 1.00 99.99 O ATOM 793 CB LEU B 46 -10.824 -7.551 -15.580 1.00 99.99 C ATOM 794 CG LEU B 46 -10.440 -8.311 -14.286 1.00 99.99 C ATOM 795 CD1 LEU B 46 -11.666 -8.331 -13.353 1.00 99.99 C ATOM 796 CD2 LEU B 46 -9.947 -9.739 -14.543 1.00 99.99 C ATOM 0 H LEU B 46 -8.873 -6.057 -15.016 1.00 99.99 H new ATOM 0 HA LEU B 46 -9.197 -8.129 -16.870 1.00 99.99 H new ATOM 0 HB2 LEU B 46 -11.313 -6.621 -15.292 1.00 99.99 H new ATOM 0 HB3 LEU B 46 -11.563 -8.148 -16.114 1.00 99.99 H new ATOM 0 HG LEU B 46 -9.604 -7.785 -13.826 1.00 99.99 H new ATOM 0 HD11 LEU B 46 -11.416 -8.862 -12.435 1.00 99.99 H new ATOM 0 HD12 LEU B 46 -11.957 -7.308 -13.113 1.00 99.99 H new ATOM 0 HD13 LEU B 46 -12.494 -8.836 -13.851 1.00 99.99 H new ATOM 0 HD21 LEU B 46 -9.695 -10.213 -13.594 1.00 99.99 H new ATOM 0 HD22 LEU B 46 -10.732 -10.311 -15.038 1.00 99.99 H new ATOM 0 HD23 LEU B 46 -9.063 -9.710 -15.180 1.00 99.99 H new ATOM 809 N SER C 22 -0.598 -10.410 18.983 1.00 99.99 N ATOM 810 CA SER C 22 -1.253 -10.116 17.676 1.00 99.99 C ATOM 811 C SER C 22 -1.594 -8.656 17.532 1.00 99.99 C ATOM 812 O SER C 22 -1.456 -7.871 18.471 1.00 99.99 O ATOM 813 CB SER C 22 -2.515 -11.011 17.458 1.00 99.99 C ATOM 814 OG SER C 22 -3.540 -10.781 18.422 1.00 99.99 O ATOM 0 HA SER C 22 -0.530 -10.358 16.897 1.00 99.99 H new ATOM 0 HB2 SER C 22 -2.915 -10.827 16.461 1.00 99.99 H new ATOM 0 HB3 SER C 22 -2.220 -12.060 17.494 1.00 99.99 H new ATOM 0 HG SER C 22 -4.303 -11.367 18.234 1.00 99.99 H new ATOM 819 N SER C 23 -2.059 -8.271 16.320 1.00 99.99 N ATOM 820 CA SER C 23 -2.535 -6.940 16.024 1.00 99.99 C ATOM 821 C SER C 23 -3.958 -7.111 15.557 1.00 99.99 C ATOM 822 O SER C 23 -4.552 -8.174 15.741 1.00 99.99 O ATOM 823 CB SER C 23 -1.678 -6.223 14.953 1.00 99.99 C ATOM 824 OG SER C 23 -0.349 -6.044 15.424 1.00 99.99 O ATOM 0 H SER C 23 -2.106 -8.903 15.521 1.00 99.99 H new ATOM 0 HA SER C 23 -2.468 -6.306 16.908 1.00 99.99 H new ATOM 0 HB2 SER C 23 -1.669 -6.808 14.033 1.00 99.99 H new ATOM 0 HB3 SER C 23 -2.119 -5.256 14.712 1.00 99.99 H new ATOM 0 HG SER C 23 0.183 -5.591 14.737 1.00 99.99 H new ATOM 830 N ASP C 24 -4.556 -6.046 14.963 1.00 99.99 N ATOM 831 CA ASP C 24 -5.959 -6.008 14.593 1.00 99.99 C ATOM 832 C ASP C 24 -6.101 -6.542 13.184 1.00 99.99 C ATOM 833 O ASP C 24 -5.154 -6.407 12.417 1.00 99.99 O ATOM 834 CB ASP C 24 -6.535 -4.565 14.631 1.00 99.99 C ATOM 835 CG ASP C 24 -6.479 -3.972 16.042 1.00 99.99 C ATOM 836 OD1 ASP C 24 -6.392 -4.749 17.032 1.00 99.99 O ATOM 837 OD2 ASP C 24 -6.533 -2.717 16.146 1.00 99.99 O ATOM 0 H ASP C 24 -4.054 -5.188 14.733 1.00 99.99 H new ATOM 0 HA ASP C 24 -6.512 -6.613 15.311 1.00 99.99 H new ATOM 0 HB2 ASP C 24 -5.973 -3.930 13.946 1.00 99.99 H new ATOM 0 HB3 ASP C 24 -7.567 -4.575 14.281 1.00 99.99 H new ATOM 842 N PRO C 25 -7.208 -7.165 12.774 1.00 99.99 N ATOM 843 CA PRO C 25 -7.248 -7.988 11.574 1.00 99.99 C ATOM 844 C PRO C 25 -7.255 -7.172 10.301 1.00 99.99 C ATOM 845 O PRO C 25 -6.875 -7.727 9.281 1.00 99.99 O ATOM 846 CB PRO C 25 -8.542 -8.807 11.706 1.00 99.99 C ATOM 847 CG PRO C 25 -9.421 -7.978 12.646 1.00 99.99 C ATOM 848 CD PRO C 25 -8.399 -7.362 13.598 1.00 99.99 C ATOM 0 HA PRO C 25 -6.357 -8.611 11.500 1.00 99.99 H new ATOM 0 HB2 PRO C 25 -9.021 -8.952 10.738 1.00 99.99 H new ATOM 0 HB3 PRO C 25 -8.346 -9.798 12.116 1.00 99.99 H new ATOM 0 HG2 PRO C 25 -9.985 -7.216 12.108 1.00 99.99 H new ATOM 0 HG3 PRO C 25 -10.146 -8.597 13.174 1.00 99.99 H new ATOM 0 HD2 PRO C 25 -8.758 -6.419 14.010 1.00 99.99 H new ATOM 0 HD3 PRO C 25 -8.194 -8.021 14.442 1.00 99.99 H new ATOM 856 N LEU C 26 -7.686 -5.890 10.339 1.00 99.99 N ATOM 857 CA LEU C 26 -7.659 -4.910 9.261 1.00 99.99 C ATOM 858 C LEU C 26 -6.220 -4.496 8.992 1.00 99.99 C ATOM 859 O LEU C 26 -5.845 -4.389 7.852 1.00 99.99 O ATOM 860 CB LEU C 26 -8.422 -3.623 9.603 1.00 99.99 C ATOM 861 CG LEU C 26 -8.260 -2.447 8.612 1.00 99.99 C ATOM 862 CD1 LEU C 26 -8.828 -2.760 7.226 1.00 99.99 C ATOM 863 CD2 LEU C 26 -8.904 -1.177 9.186 1.00 99.99 C ATOM 0 H LEU C 26 -8.088 -5.499 11.191 1.00 99.99 H new ATOM 0 HA LEU C 26 -8.129 -5.389 8.402 1.00 99.99 H new ATOM 0 HB2 LEU C 26 -9.482 -3.864 9.678 1.00 99.99 H new ATOM 0 HB3 LEU C 26 -8.101 -3.287 10.589 1.00 99.99 H new ATOM 0 HG LEU C 26 -7.190 -2.282 8.482 1.00 99.99 H new ATOM 0 HD11 LEU C 26 -8.687 -1.899 6.572 1.00 99.99 H new ATOM 0 HD12 LEU C 26 -8.310 -3.623 6.807 1.00 99.99 H new ATOM 0 HD13 LEU C 26 -9.892 -2.981 7.310 1.00 99.99 H new ATOM 0 HD21 LEU C 26 -8.783 -0.356 8.479 1.00 99.99 H new ATOM 0 HD22 LEU C 26 -9.966 -1.354 9.359 1.00 99.99 H new ATOM 0 HD23 LEU C 26 -8.421 -0.918 10.128 1.00 99.99 H new ATOM 875 N VAL C 27 -5.497 -4.281 10.005 1.00 99.99 N ATOM 876 CA VAL C 27 -4.106 -3.855 9.894 1.00 99.99 C ATOM 877 C VAL C 27 -3.269 -5.003 9.350 1.00 99.99 C ATOM 878 O VAL C 27 -2.479 -4.784 8.467 1.00 99.99 O ATOM 879 CB VAL C 27 -3.490 -3.473 11.247 1.00 99.99 C ATOM 880 CG1 VAL C 27 -1.991 -3.148 11.092 1.00 99.99 C ATOM 881 CG2 VAL C 27 -4.225 -2.240 11.818 1.00 99.99 C ATOM 0 H VAL C 27 -5.825 -4.387 10.965 1.00 99.99 H new ATOM 0 HA VAL C 27 -4.104 -2.984 9.239 1.00 99.99 H new ATOM 0 HB VAL C 27 -3.596 -4.318 11.928 1.00 99.99 H new ATOM 0 HG11 VAL C 27 -1.575 -2.880 12.063 1.00 99.99 H new ATOM 0 HG12 VAL C 27 -1.468 -4.021 10.701 1.00 99.99 H new ATOM 0 HG13 VAL C 27 -1.869 -2.313 10.402 1.00 99.99 H new ATOM 0 HG21 VAL C 27 -3.788 -1.968 12.779 1.00 99.99 H new ATOM 0 HG22 VAL C 27 -4.126 -1.404 11.125 1.00 99.99 H new ATOM 0 HG23 VAL C 27 -5.280 -2.476 11.953 1.00 99.99 H new ATOM 891 N VAL C 28 -3.454 -6.136 9.876 1.00 99.99 N ATOM 892 CA VAL C 28 -2.703 -7.318 9.470 1.00 99.99 C ATOM 893 C VAL C 28 -3.127 -7.727 8.068 1.00 99.99 C ATOM 894 O VAL C 28 -2.281 -8.029 7.265 1.00 99.99 O ATOM 895 CB VAL C 28 -2.964 -8.530 10.374 1.00 99.99 C ATOM 896 CG1 VAL C 28 -2.293 -9.801 9.813 1.00 99.99 C ATOM 897 CG2 VAL C 28 -2.444 -8.240 11.796 1.00 99.99 C ATOM 0 H VAL C 28 -4.134 -6.310 10.616 1.00 99.99 H new ATOM 0 HA VAL C 28 -1.649 -7.047 9.529 1.00 99.99 H new ATOM 0 HB VAL C 28 -4.039 -8.706 10.409 1.00 99.99 H new ATOM 0 HG11 VAL C 28 -2.496 -10.642 10.476 1.00 99.99 H new ATOM 0 HG12 VAL C 28 -2.692 -10.015 8.821 1.00 99.99 H new ATOM 0 HG13 VAL C 28 -1.216 -9.644 9.745 1.00 99.99 H new ATOM 0 HG21 VAL C 28 -2.631 -9.103 12.435 1.00 99.99 H new ATOM 0 HG22 VAL C 28 -1.373 -8.042 11.758 1.00 99.99 H new ATOM 0 HG23 VAL C 28 -2.960 -7.370 12.202 1.00 99.99 H new ATOM 907 N ALA C 29 -4.366 -7.731 7.832 1.00 99.99 N ATOM 908 CA ALA C 29 -4.914 -8.129 6.539 1.00 99.99 C ATOM 909 C ALA C 29 -4.389 -7.191 5.462 1.00 99.99 C ATOM 910 O ALA C 29 -4.053 -7.653 4.399 1.00 99.99 O ATOM 911 CB ALA C 29 -6.444 -8.034 6.485 1.00 99.99 C ATOM 0 H ALA C 29 -5.071 -7.460 8.517 1.00 99.99 H new ATOM 0 HA ALA C 29 -4.612 -9.165 6.383 1.00 99.99 H new ATOM 0 HB1 ALA C 29 -6.793 -8.342 5.500 1.00 99.99 H new ATOM 0 HB2 ALA C 29 -6.876 -8.687 7.244 1.00 99.99 H new ATOM 0 HB3 ALA C 29 -6.752 -7.005 6.673 1.00 99.99 H new ATOM 917 N ALA C 30 -4.344 -5.964 5.752 1.00 99.99 N ATOM 918 CA ALA C 30 -3.886 -4.954 4.806 1.00 99.99 C ATOM 919 C ALA C 30 -2.419 -5.192 4.484 1.00 99.99 C ATOM 920 O ALA C 30 -2.025 -4.984 3.362 1.00 99.99 O ATOM 921 CB ALA C 30 -3.978 -3.528 5.365 1.00 99.99 C ATOM 0 H ALA C 30 -4.621 -5.589 6.659 1.00 99.99 H new ATOM 0 HA ALA C 30 -4.530 -5.041 3.931 1.00 99.99 H new ATOM 0 HB1 ALA C 30 -3.623 -2.820 4.616 1.00 99.99 H new ATOM 0 HB2 ALA C 30 -5.014 -3.302 5.616 1.00 99.99 H new ATOM 0 HB3 ALA C 30 -3.362 -3.448 6.260 1.00 99.99 H new ATOM 927 N SER C 31 -1.693 -5.599 5.430 1.00 99.99 N ATOM 928 CA SER C 31 -0.264 -5.844 5.269 1.00 99.99 C ATOM 929 C SER C 31 -0.056 -6.934 4.228 1.00 99.99 C ATOM 930 O SER C 31 0.766 -6.769 3.361 1.00 99.99 O ATOM 931 CB SER C 31 0.407 -6.339 6.556 1.00 99.99 C ATOM 932 OG SER C 31 0.383 -5.329 7.562 1.00 99.99 O ATOM 0 H SER C 31 -2.044 -5.786 6.369 1.00 99.99 H new ATOM 0 HA SER C 31 0.179 -4.891 4.979 1.00 99.99 H new ATOM 0 HB2 SER C 31 -0.104 -7.231 6.918 1.00 99.99 H new ATOM 0 HB3 SER C 31 1.438 -6.625 6.347 1.00 99.99 H new ATOM 0 HG SER C 31 -0.541 -5.177 7.851 1.00 99.99 H new ATOM 938 N ILE C 32 -0.767 -7.970 4.345 1.00 99.99 N ATOM 939 CA ILE C 32 -0.654 -9.103 3.435 1.00 99.99 C ATOM 940 C ILE C 32 -1.071 -8.671 2.036 1.00 99.99 C ATOM 941 O ILE C 32 -0.479 -9.111 1.086 1.00 99.99 O ATOM 942 CB ILE C 32 -1.571 -10.272 3.819 1.00 99.99 C ATOM 943 CG1 ILE C 32 -1.129 -10.873 5.172 1.00 99.99 C ATOM 944 CG2 ILE C 32 -1.560 -11.362 2.728 1.00 99.99 C ATOM 945 CD1 ILE C 32 -2.186 -11.795 5.793 1.00 99.99 C ATOM 0 H ILE C 32 -1.467 -8.093 5.076 1.00 99.99 H new ATOM 0 HA ILE C 32 0.384 -9.431 3.484 1.00 99.99 H new ATOM 0 HB ILE C 32 -2.588 -9.891 3.913 1.00 99.99 H new ATOM 0 HG12 ILE C 32 -0.205 -11.433 5.030 1.00 99.99 H new ATOM 0 HG13 ILE C 32 -0.907 -10.064 5.868 1.00 99.99 H new ATOM 0 HG21 ILE C 32 -2.218 -12.179 3.024 1.00 99.99 H new ATOM 0 HG22 ILE C 32 -1.909 -10.938 1.787 1.00 99.99 H new ATOM 0 HG23 ILE C 32 -0.545 -11.740 2.602 1.00 99.99 H new ATOM 0 HD11 ILE C 32 -1.816 -12.185 6.741 1.00 99.99 H new ATOM 0 HD12 ILE C 32 -3.104 -11.232 5.965 1.00 99.99 H new ATOM 0 HD13 ILE C 32 -2.390 -12.623 5.114 1.00 99.99 H new ATOM 957 N ILE C 33 -2.039 -7.865 1.963 1.00 99.99 N ATOM 958 CA ILE C 33 -2.564 -7.388 0.688 1.00 99.99 C ATOM 959 C ILE C 33 -1.475 -6.619 -0.048 1.00 99.99 C ATOM 960 O ILE C 33 -1.288 -6.845 -1.216 1.00 99.99 O ATOM 961 CB ILE C 33 -3.742 -6.417 0.850 1.00 99.99 C ATOM 962 CG1 ILE C 33 -5.036 -7.244 1.056 1.00 99.99 C ATOM 963 CG2 ILE C 33 -3.881 -5.467 -0.352 1.00 99.99 C ATOM 964 CD1 ILE C 33 -6.225 -6.446 1.602 1.00 99.99 C ATOM 0 H ILE C 33 -2.523 -7.490 2.779 1.00 99.99 H new ATOM 0 HA ILE C 33 -2.900 -8.273 0.147 1.00 99.99 H new ATOM 0 HB ILE C 33 -3.560 -5.785 1.719 1.00 99.99 H new ATOM 0 HG12 ILE C 33 -5.322 -7.690 0.103 1.00 99.99 H new ATOM 0 HG13 ILE C 33 -4.822 -8.065 1.740 1.00 99.99 H new ATOM 0 HG21 ILE C 33 -4.727 -4.799 -0.192 1.00 99.99 H new ATOM 0 HG22 ILE C 33 -2.970 -4.879 -0.458 1.00 99.99 H new ATOM 0 HG23 ILE C 33 -4.045 -6.049 -1.259 1.00 99.99 H new ATOM 0 HD11 ILE C 33 -7.085 -7.106 1.714 1.00 99.99 H new ATOM 0 HD12 ILE C 33 -5.964 -6.022 2.572 1.00 99.99 H new ATOM 0 HD13 ILE C 33 -6.472 -5.642 0.909 1.00 99.99 H new ATOM 976 N GLY C 34 -0.825 -5.776 0.629 1.00 99.99 N ATOM 977 CA GLY C 34 0.230 -4.953 0.044 1.00 99.99 C ATOM 978 C GLY C 34 1.386 -5.843 -0.380 1.00 99.99 C ATOM 979 O GLY C 34 1.975 -5.590 -1.400 1.00 99.99 O ATOM 0 H GLY C 34 -0.983 -5.606 1.622 1.00 99.99 H new ATOM 0 HA2 GLY C 34 -0.156 -4.404 -0.815 1.00 99.99 H new ATOM 0 HA3 GLY C 34 0.572 -4.213 0.767 1.00 99.99 H new ATOM 983 N ILE C 35 1.347 -7.107 0.011 1.00 99.99 N ATOM 984 CA ILE C 35 2.381 -7.993 -0.515 1.00 99.99 C ATOM 985 C ILE C 35 1.846 -8.722 -1.737 1.00 99.99 C ATOM 986 O ILE C 35 2.540 -8.802 -2.719 1.00 99.99 O ATOM 987 CB ILE C 35 2.803 -9.077 0.485 1.00 99.99 C ATOM 988 CG1 ILE C 35 3.354 -8.430 1.781 1.00 99.99 C ATOM 989 CG2 ILE C 35 3.868 -9.993 -0.154 1.00 99.99 C ATOM 990 CD1 ILE C 35 3.514 -9.390 2.963 1.00 99.99 C ATOM 0 H ILE C 35 0.665 -7.524 0.644 1.00 99.99 H new ATOM 0 HA ILE C 35 3.239 -7.360 -0.743 1.00 99.99 H new ATOM 0 HB ILE C 35 1.931 -9.677 0.745 1.00 99.99 H new ATOM 0 HG12 ILE C 35 4.323 -7.981 1.562 1.00 99.99 H new ATOM 0 HG13 ILE C 35 2.687 -7.620 2.077 1.00 99.99 H new ATOM 0 HG21 ILE C 35 4.164 -10.761 0.561 1.00 99.99 H new ATOM 0 HG22 ILE C 35 3.454 -10.466 -1.044 1.00 99.99 H new ATOM 0 HG23 ILE C 35 4.740 -9.400 -0.431 1.00 99.99 H new ATOM 0 HD11 ILE C 35 3.905 -8.846 3.823 1.00 99.99 H new ATOM 0 HD12 ILE C 35 2.545 -9.821 3.216 1.00 99.99 H new ATOM 0 HD13 ILE C 35 4.206 -10.188 2.693 1.00 99.99 H new ATOM 1002 N LEU C 36 0.686 -9.208 -1.642 1.00 99.99 N ATOM 1003 CA LEU C 36 0.062 -9.956 -2.728 1.00 99.99 C ATOM 1004 C LEU C 36 -0.062 -9.057 -3.950 1.00 99.99 C ATOM 1005 O LEU C 36 0.235 -9.496 -5.031 1.00 99.99 O ATOM 1006 CB LEU C 36 -1.359 -10.424 -2.389 1.00 99.99 C ATOM 1007 CG LEU C 36 -2.125 -11.107 -3.543 1.00 99.99 C ATOM 1008 CD1 LEU C 36 -1.429 -12.403 -3.981 1.00 99.99 C ATOM 1009 CD2 LEU C 36 -3.584 -11.375 -3.151 1.00 99.99 C ATOM 0 H LEU C 36 0.102 -9.117 -0.810 1.00 99.99 H new ATOM 0 HA LEU C 36 0.694 -10.826 -2.905 1.00 99.99 H new ATOM 0 HB2 LEU C 36 -1.304 -11.119 -1.551 1.00 99.99 H new ATOM 0 HB3 LEU C 36 -1.936 -9.563 -2.052 1.00 99.99 H new ATOM 0 HG LEU C 36 -2.123 -10.424 -4.392 1.00 99.99 H new ATOM 0 HD11 LEU C 36 -1.991 -12.861 -4.795 1.00 99.99 H new ATOM 0 HD12 LEU C 36 -0.419 -12.176 -4.321 1.00 99.99 H new ATOM 0 HD13 LEU C 36 -1.382 -13.093 -3.139 1.00 99.99 H new ATOM 0 HD21 LEU C 36 -4.101 -11.856 -3.981 1.00 99.99 H new ATOM 0 HD22 LEU C 36 -3.612 -12.028 -2.278 1.00 99.99 H new ATOM 0 HD23 LEU C 36 -4.076 -10.432 -2.915 1.00 99.99 H new ATOM 1021 N HIS C 37 -0.522 -7.797 -3.782 1.00 99.99 N ATOM 1022 CA HIS C 37 -0.744 -6.852 -4.849 1.00 99.99 C ATOM 1023 C HIS C 37 0.557 -6.526 -5.530 1.00 99.99 C ATOM 1024 O HIS C 37 0.580 -6.189 -6.712 1.00 99.99 O ATOM 1025 CB HIS C 37 -1.379 -5.542 -4.323 1.00 99.99 C ATOM 1026 CG HIS C 37 -1.818 -4.590 -5.406 1.00 99.99 C ATOM 1027 ND1 HIS C 37 -2.090 -3.271 -5.159 1.00 99.99 N ATOM 1028 CD2 HIS C 37 -2.074 -4.810 -6.717 1.00 99.99 C ATOM 1029 CE1 HIS C 37 -2.489 -2.708 -6.291 1.00 99.99 C ATOM 1030 NE2 HIS C 37 -2.488 -3.621 -7.252 1.00 99.99 N ATOM 0 H HIS C 37 -0.750 -7.418 -2.863 1.00 99.99 H new ATOM 0 HA HIS C 37 -1.432 -7.313 -5.558 1.00 99.99 H new ATOM 0 HB2 HIS C 37 -2.240 -5.792 -3.704 1.00 99.99 H new ATOM 0 HB3 HIS C 37 -0.660 -5.036 -3.679 1.00 99.99 H new ATOM 0 HD2 HIS C 37 -1.971 -5.748 -7.242 1.00 99.99 H new ATOM 0 HE1 HIS C 37 -2.770 -1.672 -6.411 1.00 99.99 H new ATOM 0 HE2 HIS C 37 -2.751 -3.464 -8.225 1.00 99.99 H new ATOM 1038 N LEU C 38 1.682 -6.666 -4.787 1.00 99.99 N ATOM 1039 CA LEU C 38 3.018 -6.412 -5.311 1.00 99.99 C ATOM 1040 C LEU C 38 3.404 -7.528 -6.270 1.00 99.99 C ATOM 1041 O LEU C 38 3.932 -7.247 -7.316 1.00 99.99 O ATOM 1042 CB LEU C 38 4.096 -6.388 -4.219 1.00 99.99 C ATOM 1043 CG LEU C 38 5.524 -6.143 -4.766 1.00 99.99 C ATOM 1044 CD1 LEU C 38 5.625 -4.808 -5.516 1.00 99.99 C ATOM 1045 CD2 LEU C 38 6.583 -6.218 -3.666 1.00 99.99 C ATOM 0 H LEU C 38 1.673 -6.959 -3.810 1.00 99.99 H new ATOM 0 HA LEU C 38 2.975 -5.435 -5.793 1.00 99.99 H new ATOM 0 HB2 LEU C 38 3.853 -5.608 -3.497 1.00 99.99 H new ATOM 0 HB3 LEU C 38 4.079 -7.336 -3.682 1.00 99.99 H new ATOM 0 HG LEU C 38 5.722 -6.947 -5.475 1.00 99.99 H new ATOM 0 HD11 LEU C 38 6.642 -4.673 -5.884 1.00 99.99 H new ATOM 0 HD12 LEU C 38 4.932 -4.810 -6.357 1.00 99.99 H new ATOM 0 HD13 LEU C 38 5.373 -3.991 -4.840 1.00 99.99 H new ATOM 0 HD21 LEU C 38 7.568 -6.040 -4.097 1.00 99.99 H new ATOM 0 HD22 LEU C 38 6.376 -5.461 -2.909 1.00 99.99 H new ATOM 0 HD23 LEU C 38 6.561 -7.206 -3.207 1.00 99.99 H new ATOM 1057 N ILE C 39 3.145 -8.704 -5.899 1.00 99.99 N ATOM 1058 CA ILE C 39 3.484 -9.872 -6.705 1.00 99.99 C ATOM 1059 C ILE C 39 2.695 -9.829 -8.005 1.00 99.99 C ATOM 1060 O ILE C 39 3.256 -10.095 -9.040 1.00 99.99 O ATOM 1061 CB ILE C 39 3.121 -11.197 -6.022 1.00 99.99 C ATOM 1062 CG1 ILE C 39 4.013 -11.409 -4.779 1.00 99.99 C ATOM 1063 CG2 ILE C 39 3.282 -12.371 -7.010 1.00 99.99 C ATOM 1064 CD1 ILE C 39 3.606 -12.616 -3.923 1.00 99.99 C ATOM 0 H ILE C 39 2.684 -8.928 -5.017 1.00 99.99 H new ATOM 0 HA ILE C 39 4.562 -9.834 -6.861 1.00 99.99 H new ATOM 0 HB ILE C 39 2.079 -11.158 -5.704 1.00 99.99 H new ATOM 0 HG12 ILE C 39 5.046 -11.537 -5.102 1.00 99.99 H new ATOM 0 HG13 ILE C 39 3.980 -10.511 -4.163 1.00 99.99 H new ATOM 0 HG21 ILE C 39 3.021 -13.305 -6.511 1.00 99.99 H new ATOM 0 HG22 ILE C 39 2.623 -12.220 -7.865 1.00 99.99 H new ATOM 0 HG23 ILE C 39 4.316 -12.419 -7.352 1.00 99.99 H new ATOM 0 HD11 ILE C 39 4.278 -12.700 -3.069 1.00 99.99 H new ATOM 0 HD12 ILE C 39 2.584 -12.483 -3.568 1.00 99.99 H new ATOM 0 HD13 ILE C 39 3.666 -13.524 -4.523 1.00 99.99 H new ATOM 1076 N LEU C 40 1.477 -9.521 -7.917 1.00 99.99 N ATOM 1077 CA LEU C 40 0.597 -9.467 -9.078 1.00 99.99 C ATOM 1078 C LEU C 40 1.108 -8.413 -10.049 1.00 99.99 C ATOM 1079 O LEU C 40 1.130 -8.665 -11.228 1.00 99.99 O ATOM 1080 CB LEU C 40 -0.840 -9.065 -8.723 1.00 99.99 C ATOM 1081 CG LEU C 40 -1.655 -10.124 -7.948 1.00 99.99 C ATOM 1082 CD1 LEU C 40 -3.029 -9.541 -7.562 1.00 99.99 C ATOM 1083 CD2 LEU C 40 -1.843 -11.419 -8.751 1.00 99.99 C ATOM 0 H LEU C 40 1.017 -9.288 -7.037 1.00 99.99 H new ATOM 0 HA LEU C 40 0.594 -10.470 -9.504 1.00 99.99 H new ATOM 0 HB2 LEU C 40 -0.807 -8.151 -8.129 1.00 99.99 H new ATOM 0 HB3 LEU C 40 -1.370 -8.827 -9.645 1.00 99.99 H new ATOM 0 HG LEU C 40 -1.092 -10.379 -7.051 1.00 99.99 H new ATOM 0 HD11 LEU C 40 -3.602 -10.290 -7.015 1.00 99.99 H new ATOM 0 HD12 LEU C 40 -2.888 -8.662 -6.933 1.00 99.99 H new ATOM 0 HD13 LEU C 40 -3.571 -9.258 -8.465 1.00 99.99 H new ATOM 0 HD21 LEU C 40 -2.422 -12.131 -8.163 1.00 99.99 H new ATOM 0 HD22 LEU C 40 -2.372 -11.199 -9.678 1.00 99.99 H new ATOM 0 HD23 LEU C 40 -0.868 -11.848 -8.983 1.00 99.99 H new ATOM 1095 N TRP C 41 1.481 -7.317 -9.548 1.00 99.99 N ATOM 1096 CA TRP C 41 1.967 -6.210 -10.363 1.00 99.99 C ATOM 1097 C TRP C 41 3.287 -6.605 -11.009 1.00 99.99 C ATOM 1098 O TRP C 41 3.482 -6.324 -12.165 1.00 99.99 O ATOM 1099 CB TRP C 41 2.246 -4.943 -9.544 1.00 99.99 C ATOM 1100 CG TRP C 41 2.652 -3.743 -10.381 1.00 99.99 C ATOM 1101 CD1 TRP C 41 1.835 -2.940 -11.116 1.00 99.99 C ATOM 1102 CD2 TRP C 41 3.998 -3.305 -10.637 1.00 99.99 C ATOM 1103 NE1 TRP C 41 2.565 -1.976 -11.750 1.00 99.99 N ATOM 1104 CE2 TRP C 41 3.898 -2.203 -11.507 1.00 99.99 C ATOM 1105 CE3 TRP C 41 5.235 -3.769 -10.180 1.00 99.99 C ATOM 1106 CZ2 TRP C 41 5.034 -1.527 -11.927 1.00 99.99 C ATOM 1107 CZ3 TRP C 41 6.376 -3.093 -10.618 1.00 99.99 C ATOM 1108 CH2 TRP C 41 6.284 -1.985 -11.478 1.00 99.99 C ATOM 0 H TRP C 41 1.472 -7.123 -8.547 1.00 99.99 H new ATOM 0 HA TRP C 41 1.185 -5.999 -11.093 1.00 99.99 H new ATOM 0 HB2 TRP C 41 1.354 -4.689 -8.972 1.00 99.99 H new ATOM 0 HB3 TRP C 41 3.036 -5.155 -8.824 1.00 99.99 H new ATOM 0 HD1 TRP C 41 0.763 -3.050 -11.187 1.00 99.99 H new ATOM 0 HE1 TRP C 41 2.184 -1.214 -12.311 1.00 99.99 H new ATOM 0 HE3 TRP C 41 5.306 -4.617 -9.515 1.00 99.99 H new ATOM 0 HZ2 TRP C 41 4.960 -0.671 -12.582 1.00 99.99 H new ATOM 0 HZ3 TRP C 41 7.349 -3.428 -10.289 1.00 99.99 H new ATOM 0 HH2 TRP C 41 7.184 -1.480 -11.797 1.00 99.99 H new ATOM 1119 N ILE C 42 4.117 -7.207 -10.272 1.00 99.99 N ATOM 1120 CA ILE C 42 5.432 -7.620 -10.752 1.00 99.99 C ATOM 1121 C ILE C 42 5.263 -8.705 -11.806 1.00 99.99 C ATOM 1122 O ILE C 42 5.936 -8.660 -12.805 1.00 99.99 O ATOM 1123 CB ILE C 42 6.308 -8.222 -9.649 1.00 99.99 C ATOM 1124 CG1 ILE C 42 6.763 -7.116 -8.668 1.00 99.99 C ATOM 1125 CG2 ILE C 42 7.537 -8.939 -10.251 1.00 99.99 C ATOM 1126 CD1 ILE C 42 7.569 -7.646 -7.472 1.00 99.99 C ATOM 0 H ILE C 42 3.935 -7.448 -9.298 1.00 99.99 H new ATOM 0 HA ILE C 42 5.912 -6.722 -11.141 1.00 99.99 H new ATOM 0 HB ILE C 42 5.716 -8.958 -9.105 1.00 99.99 H new ATOM 0 HG12 ILE C 42 7.368 -6.389 -9.209 1.00 99.99 H new ATOM 0 HG13 ILE C 42 5.885 -6.587 -8.298 1.00 99.99 H new ATOM 0 HG21 ILE C 42 8.143 -9.358 -9.448 1.00 99.99 H new ATOM 0 HG22 ILE C 42 7.204 -9.741 -10.910 1.00 99.99 H new ATOM 0 HG23 ILE C 42 8.132 -8.225 -10.820 1.00 99.99 H new ATOM 0 HD11 ILE C 42 7.854 -6.814 -6.828 1.00 99.99 H new ATOM 0 HD12 ILE C 42 6.960 -8.351 -6.906 1.00 99.99 H new ATOM 0 HD13 ILE C 42 8.466 -8.149 -7.832 1.00 99.99 H new ATOM 1138 N LEU C 43 4.417 -9.607 -11.558 1.00 99.99 N ATOM 1139 CA LEU C 43 4.174 -10.720 -12.467 1.00 99.99 C ATOM 1140 C LEU C 43 3.608 -10.187 -13.776 1.00 99.99 C ATOM 1141 O LEU C 43 3.928 -10.716 -14.810 1.00 99.99 O ATOM 1142 CB LEU C 43 3.144 -11.719 -11.925 1.00 99.99 C ATOM 1143 CG LEU C 43 3.632 -12.544 -10.712 1.00 99.99 C ATOM 1144 CD1 LEU C 43 2.455 -13.310 -10.080 1.00 99.99 C ATOM 1145 CD2 LEU C 43 4.752 -13.524 -11.094 1.00 99.99 C ATOM 0 H LEU C 43 3.845 -9.627 -10.714 1.00 99.99 H new ATOM 0 HA LEU C 43 5.131 -11.225 -12.595 1.00 99.99 H new ATOM 0 HB2 LEU C 43 2.243 -11.175 -11.640 1.00 99.99 H new ATOM 0 HB3 LEU C 43 2.864 -12.404 -12.726 1.00 99.99 H new ATOM 0 HG LEU C 43 4.041 -11.842 -9.985 1.00 99.99 H new ATOM 0 HD11 LEU C 43 2.812 -13.887 -9.227 1.00 99.99 H new ATOM 0 HD12 LEU C 43 1.697 -12.601 -9.747 1.00 99.99 H new ATOM 0 HD13 LEU C 43 2.022 -13.985 -10.818 1.00 99.99 H new ATOM 0 HD21 LEU C 43 5.064 -14.082 -10.211 1.00 99.99 H new ATOM 0 HD22 LEU C 43 4.386 -14.217 -11.851 1.00 99.99 H new ATOM 0 HD23 LEU C 43 5.602 -12.969 -11.491 1.00 99.99 H new ATOM 1157 N ASP C 44 2.814 -9.211 -13.691 1.00 99.99 N ATOM 1158 CA ASP C 44 2.179 -8.618 -14.860 1.00 99.99 C ATOM 1159 C ASP C 44 3.238 -7.947 -15.724 1.00 99.99 C ATOM 1160 O ASP C 44 3.165 -8.046 -16.924 1.00 99.99 O ATOM 1161 CB ASP C 44 1.160 -7.527 -14.500 1.00 99.99 C ATOM 1162 CG ASP C 44 0.430 -6.971 -15.738 1.00 99.99 C ATOM 1163 OD1 ASP C 44 -0.342 -7.734 -16.366 1.00 99.99 O ATOM 1164 OD2 ASP C 44 0.590 -5.755 -16.056 1.00 99.99 O ATOM 0 H ASP C 44 2.558 -8.767 -12.809 1.00 99.99 H new ATOM 0 HA ASP C 44 1.667 -9.432 -15.374 1.00 99.99 H new ATOM 0 HB2 ASP C 44 0.428 -7.934 -13.803 1.00 99.99 H new ATOM 0 HB3 ASP C 44 1.671 -6.712 -13.987 1.00 99.99 H new ATOM 1169 N ARG C 45 4.141 -7.310 -15.117 1.00 99.99 N ATOM 1170 CA ARG C 45 5.204 -6.600 -15.819 1.00 99.99 C ATOM 1171 C ARG C 45 6.065 -7.600 -16.576 1.00 99.99 C ATOM 1172 O ARG C 45 6.414 -7.340 -17.700 1.00 99.99 O ATOM 1173 CB ARG C 45 6.148 -5.849 -14.871 1.00 99.99 C ATOM 1174 CG ARG C 45 5.468 -4.698 -14.101 1.00 99.99 C ATOM 1175 CD ARG C 45 5.219 -3.457 -14.968 1.00 99.99 C ATOM 1176 NE ARG C 45 3.827 -3.541 -15.539 1.00 99.99 N ATOM 1177 CZ ARG C 45 3.483 -2.856 -16.646 1.00 99.99 C ATOM 1178 NH1 ARG C 45 4.357 -2.050 -17.275 1.00 99.99 N ATOM 1179 NH2 ARG C 45 2.224 -2.968 -17.099 1.00 99.99 N ATOM 0 H ARG C 45 4.197 -7.243 -14.101 1.00 99.99 H new ATOM 0 HA ARG C 45 4.710 -5.885 -16.476 1.00 99.99 H new ATOM 0 HB2 ARG C 45 6.567 -6.556 -14.155 1.00 99.99 H new ATOM 0 HB3 ARG C 45 6.982 -5.447 -15.446 1.00 99.99 H new ATOM 0 HG2 ARG C 45 4.518 -5.050 -13.699 1.00 99.99 H new ATOM 0 HG3 ARG C 45 6.091 -4.420 -13.250 1.00 99.99 H new ATOM 0 HD2 ARG C 45 5.329 -2.551 -14.372 1.00 99.99 H new ATOM 0 HD3 ARG C 45 5.954 -3.402 -15.771 1.00 99.99 H new ATOM 0 HE ARG C 45 3.132 -4.128 -15.078 1.00 99.99 H new ATOM 0 HH11 ARG C 45 5.306 -1.947 -16.915 1.00 99.99 H new ATOM 0 HH12 ARG C 45 4.071 -1.542 -18.112 1.00 99.99 H new ATOM 0 HH21 ARG C 45 1.556 -3.561 -16.607 1.00 99.99 H new ATOM 0 HH22 ARG C 45 1.936 -2.460 -17.935 1.00 99.99 H new ATOM 1193 N LEU C 46 6.370 -8.660 -15.963 1.00 99.99 N ATOM 1194 CA LEU C 46 7.209 -9.693 -16.559 1.00 99.99 C ATOM 1195 C LEU C 46 6.466 -10.339 -17.718 1.00 99.99 C ATOM 1196 O LEU C 46 5.458 -11.017 -17.525 1.00 99.99 O ATOM 1197 CB LEU C 46 7.551 -10.824 -15.580 1.00 99.99 C ATOM 1198 CG LEU C 46 8.311 -10.440 -14.286 1.00 99.99 C ATOM 1199 CD1 LEU C 46 8.331 -11.666 -13.353 1.00 99.99 C ATOM 1200 CD2 LEU C 46 9.739 -9.947 -14.543 1.00 99.99 C ATOM 0 H LEU C 46 6.057 -8.873 -15.016 1.00 99.99 H new ATOM 0 HA LEU C 46 8.129 -9.197 -16.870 1.00 99.99 H new ATOM 0 HB2 LEU C 46 6.621 -11.313 -15.292 1.00 99.99 H new ATOM 0 HB3 LEU C 46 8.148 -11.563 -16.114 1.00 99.99 H new ATOM 0 HG LEU C 46 7.785 -9.604 -13.826 1.00 99.99 H new ATOM 0 HD11 LEU C 46 8.862 -11.416 -12.435 1.00 99.99 H new ATOM 0 HD12 LEU C 46 7.308 -11.957 -13.113 1.00 99.99 H new ATOM 0 HD13 LEU C 46 8.836 -12.494 -13.851 1.00 99.99 H new ATOM 0 HD21 LEU C 46 10.213 -9.695 -13.594 1.00 99.99 H new ATOM 0 HD22 LEU C 46 10.311 -10.732 -15.038 1.00 99.99 H new ATOM 0 HD23 LEU C 46 9.710 -9.063 -15.180 1.00 99.99 H new ATOM 1213 N SER D 22 10.410 -0.598 18.983 1.00 99.99 N ATOM 1214 CA SER D 22 10.116 -1.253 17.676 1.00 99.99 C ATOM 1215 C SER D 22 8.656 -1.594 17.532 1.00 99.99 C ATOM 1216 O SER D 22 7.871 -1.456 18.471 1.00 99.99 O ATOM 1217 CB SER D 22 11.011 -2.515 17.458 1.00 99.99 C ATOM 1218 OG SER D 22 10.781 -3.540 18.422 1.00 99.99 O ATOM 0 HA SER D 22 10.358 -0.530 16.897 1.00 99.99 H new ATOM 0 HB2 SER D 22 10.827 -2.915 16.461 1.00 99.99 H new ATOM 0 HB3 SER D 22 12.060 -2.220 17.494 1.00 99.99 H new ATOM 0 HG SER D 22 11.367 -4.303 18.234 1.00 99.99 H new ATOM 1223 N SER D 23 8.271 -2.059 16.320 1.00 99.99 N ATOM 1224 CA SER D 23 6.940 -2.535 16.024 1.00 99.99 C ATOM 1225 C SER D 23 7.111 -3.958 15.557 1.00 99.99 C ATOM 1226 O SER D 23 8.174 -4.552 15.741 1.00 99.99 O ATOM 1227 CB SER D 23 6.223 -1.678 14.953 1.00 99.99 C ATOM 1228 OG SER D 23 6.044 -0.349 15.424 1.00 99.99 O ATOM 0 H SER D 23 8.903 -2.106 15.521 1.00 99.99 H new ATOM 0 HA SER D 23 6.306 -2.468 16.908 1.00 99.99 H new ATOM 0 HB2 SER D 23 6.808 -1.669 14.033 1.00 99.99 H new ATOM 0 HB3 SER D 23 5.256 -2.119 14.712 1.00 99.99 H new ATOM 0 HG SER D 23 5.591 0.183 14.737 1.00 99.99 H new ATOM 1234 N ASP D 24 6.046 -4.556 14.963 1.00 99.99 N ATOM 1235 CA ASP D 24 6.008 -5.959 14.593 1.00 99.99 C ATOM 1236 C ASP D 24 6.542 -6.101 13.184 1.00 99.99 C ATOM 1237 O ASP D 24 6.407 -5.154 12.417 1.00 99.99 O ATOM 1238 CB ASP D 24 4.565 -6.535 14.631 1.00 99.99 C ATOM 1239 CG ASP D 24 3.972 -6.479 16.042 1.00 99.99 C ATOM 1240 OD1 ASP D 24 4.749 -6.392 17.032 1.00 99.99 O ATOM 1241 OD2 ASP D 24 2.717 -6.533 16.146 1.00 99.99 O ATOM 0 H ASP D 24 5.188 -4.054 14.733 1.00 99.99 H new ATOM 0 HA ASP D 24 6.613 -6.512 15.311 1.00 99.99 H new ATOM 0 HB2 ASP D 24 3.930 -5.973 13.946 1.00 99.99 H new ATOM 0 HB3 ASP D 24 4.575 -7.567 14.281 1.00 99.99 H new ATOM 1246 N PRO D 25 7.165 -7.208 12.774 1.00 99.99 N ATOM 1247 CA PRO D 25 7.988 -7.248 11.574 1.00 99.99 C ATOM 1248 C PRO D 25 7.172 -7.255 10.301 1.00 99.99 C ATOM 1249 O PRO D 25 7.727 -6.875 9.281 1.00 99.99 O ATOM 1250 CB PRO D 25 8.807 -8.542 11.706 1.00 99.99 C ATOM 1251 CG PRO D 25 7.978 -9.421 12.646 1.00 99.99 C ATOM 1252 CD PRO D 25 7.362 -8.399 13.598 1.00 99.99 C ATOM 0 HA PRO D 25 8.611 -6.357 11.500 1.00 99.99 H new ATOM 0 HB2 PRO D 25 8.952 -9.021 10.738 1.00 99.99 H new ATOM 0 HB3 PRO D 25 9.798 -8.346 12.116 1.00 99.99 H new ATOM 0 HG2 PRO D 25 7.216 -9.985 12.108 1.00 99.99 H new ATOM 0 HG3 PRO D 25 8.597 -10.146 13.174 1.00 99.99 H new ATOM 0 HD2 PRO D 25 6.419 -8.758 14.010 1.00 99.99 H new ATOM 0 HD3 PRO D 25 8.021 -8.194 14.442 1.00 99.99 H new ATOM 1260 N LEU D 26 5.890 -7.686 10.339 1.00 99.99 N ATOM 1261 CA LEU D 26 4.910 -7.659 9.261 1.00 99.99 C ATOM 1262 C LEU D 26 4.496 -6.220 8.992 1.00 99.99 C ATOM 1263 O LEU D 26 4.389 -5.845 7.852 1.00 99.99 O ATOM 1264 CB LEU D 26 3.623 -8.422 9.603 1.00 99.99 C ATOM 1265 CG LEU D 26 2.447 -8.260 8.612 1.00 99.99 C ATOM 1266 CD1 LEU D 26 2.760 -8.828 7.226 1.00 99.99 C ATOM 1267 CD2 LEU D 26 1.177 -8.904 9.186 1.00 99.99 C ATOM 0 H LEU D 26 5.499 -8.088 11.191 1.00 99.99 H new ATOM 0 HA LEU D 26 5.389 -8.129 8.402 1.00 99.99 H new ATOM 0 HB2 LEU D 26 3.864 -9.482 9.678 1.00 99.99 H new ATOM 0 HB3 LEU D 26 3.287 -8.101 10.589 1.00 99.99 H new ATOM 0 HG LEU D 26 2.282 -7.190 8.482 1.00 99.99 H new ATOM 0 HD11 LEU D 26 1.899 -8.687 6.572 1.00 99.99 H new ATOM 0 HD12 LEU D 26 3.623 -8.310 6.807 1.00 99.99 H new ATOM 0 HD13 LEU D 26 2.981 -9.892 7.310 1.00 99.99 H new ATOM 0 HD21 LEU D 26 0.356 -8.783 8.479 1.00 99.99 H new ATOM 0 HD22 LEU D 26 1.354 -9.966 9.359 1.00 99.99 H new ATOM 0 HD23 LEU D 26 0.918 -8.421 10.128 1.00 99.99 H new ATOM 1279 N VAL D 27 4.281 -5.497 10.005 1.00 99.99 N ATOM 1280 CA VAL D 27 3.855 -4.106 9.894 1.00 99.99 C ATOM 1281 C VAL D 27 5.003 -3.269 9.350 1.00 99.99 C ATOM 1282 O VAL D 27 4.784 -2.479 8.467 1.00 99.99 O ATOM 1283 CB VAL D 27 3.473 -3.490 11.247 1.00 99.99 C ATOM 1284 CG1 VAL D 27 3.148 -1.991 11.092 1.00 99.99 C ATOM 1285 CG2 VAL D 27 2.240 -4.225 11.818 1.00 99.99 C ATOM 0 H VAL D 27 4.387 -5.825 10.965 1.00 99.99 H new ATOM 0 HA VAL D 27 2.984 -4.104 9.239 1.00 99.99 H new ATOM 0 HB VAL D 27 4.318 -3.596 11.928 1.00 99.99 H new ATOM 0 HG11 VAL D 27 2.880 -1.575 12.063 1.00 99.99 H new ATOM 0 HG12 VAL D 27 4.021 -1.468 10.701 1.00 99.99 H new ATOM 0 HG13 VAL D 27 2.313 -1.869 10.402 1.00 99.99 H new ATOM 0 HG21 VAL D 27 1.968 -3.788 12.779 1.00 99.99 H new ATOM 0 HG22 VAL D 27 1.404 -4.126 11.125 1.00 99.99 H new ATOM 0 HG23 VAL D 27 2.476 -5.280 11.953 1.00 99.99 H new ATOM 1295 N VAL D 28 6.136 -3.454 9.876 1.00 99.99 N ATOM 1296 CA VAL D 28 7.318 -2.703 9.470 1.00 99.99 C ATOM 1297 C VAL D 28 7.727 -3.127 8.068 1.00 99.99 C ATOM 1298 O VAL D 28 8.029 -2.281 7.265 1.00 99.99 O ATOM 1299 CB VAL D 28 8.530 -2.964 10.374 1.00 99.99 C ATOM 1300 CG1 VAL D 28 9.801 -2.293 9.813 1.00 99.99 C ATOM 1301 CG2 VAL D 28 8.240 -2.444 11.796 1.00 99.99 C ATOM 0 H VAL D 28 6.310 -4.134 10.616 1.00 99.99 H new ATOM 0 HA VAL D 28 7.047 -1.649 9.529 1.00 99.99 H new ATOM 0 HB VAL D 28 8.706 -4.039 10.409 1.00 99.99 H new ATOM 0 HG11 VAL D 28 10.642 -2.496 10.476 1.00 99.99 H new ATOM 0 HG12 VAL D 28 10.015 -2.692 8.821 1.00 99.99 H new ATOM 0 HG13 VAL D 28 9.644 -1.216 9.745 1.00 99.99 H new ATOM 0 HG21 VAL D 28 9.103 -2.631 12.435 1.00 99.99 H new ATOM 0 HG22 VAL D 28 8.042 -1.373 11.758 1.00 99.99 H new ATOM 0 HG23 VAL D 28 7.370 -2.960 12.202 1.00 99.99 H new ATOM 1311 N ALA D 29 7.731 -4.366 7.832 1.00 99.99 N ATOM 1312 CA ALA D 29 8.129 -4.914 6.539 1.00 99.99 C ATOM 1313 C ALA D 29 7.191 -4.389 5.462 1.00 99.99 C ATOM 1314 O ALA D 29 7.653 -4.053 4.399 1.00 99.99 O ATOM 1315 CB ALA D 29 8.034 -6.444 6.485 1.00 99.99 C ATOM 0 H ALA D 29 7.460 -5.071 8.517 1.00 99.99 H new ATOM 0 HA ALA D 29 9.165 -4.612 6.383 1.00 99.99 H new ATOM 0 HB1 ALA D 29 8.342 -6.793 5.500 1.00 99.99 H new ATOM 0 HB2 ALA D 29 8.687 -6.876 7.244 1.00 99.99 H new ATOM 0 HB3 ALA D 29 7.005 -6.752 6.673 1.00 99.99 H new ATOM 1321 N ALA D 30 5.964 -4.344 5.752 1.00 99.99 N ATOM 1322 CA ALA D 30 4.954 -3.886 4.806 1.00 99.99 C ATOM 1323 C ALA D 30 5.192 -2.419 4.484 1.00 99.99 C ATOM 1324 O ALA D 30 4.984 -2.025 3.362 1.00 99.99 O ATOM 1325 CB ALA D 30 3.528 -3.978 5.365 1.00 99.99 C ATOM 0 H ALA D 30 5.589 -4.621 6.659 1.00 99.99 H new ATOM 0 HA ALA D 30 5.041 -4.530 3.931 1.00 99.99 H new ATOM 0 HB1 ALA D 30 2.820 -3.623 4.616 1.00 99.99 H new ATOM 0 HB2 ALA D 30 3.302 -5.014 5.616 1.00 99.99 H new ATOM 0 HB3 ALA D 30 3.448 -3.362 6.260 1.00 99.99 H new ATOM 1331 N SER D 31 5.599 -1.693 5.430 1.00 99.99 N ATOM 1332 CA SER D 31 5.844 -0.264 5.269 1.00 99.99 C ATOM 1333 C SER D 31 6.934 -0.056 4.228 1.00 99.99 C ATOM 1334 O SER D 31 6.769 0.766 3.361 1.00 99.99 O ATOM 1335 CB SER D 31 6.339 0.407 6.556 1.00 99.99 C ATOM 1336 OG SER D 31 5.329 0.383 7.562 1.00 99.99 O ATOM 0 H SER D 31 5.786 -2.044 6.369 1.00 99.99 H new ATOM 0 HA SER D 31 4.891 0.179 4.979 1.00 99.99 H new ATOM 0 HB2 SER D 31 7.231 -0.104 6.918 1.00 99.99 H new ATOM 0 HB3 SER D 31 6.625 1.438 6.347 1.00 99.99 H new ATOM 0 HG SER D 31 5.177 -0.541 7.851 1.00 99.99 H new ATOM 1342 N ILE D 32 7.970 -0.767 4.345 1.00 99.99 N ATOM 1343 CA ILE D 32 9.103 -0.654 3.435 1.00 99.99 C ATOM 1344 C ILE D 32 8.671 -1.071 2.036 1.00 99.99 C ATOM 1345 O ILE D 32 9.111 -0.479 1.086 1.00 99.99 O ATOM 1346 CB ILE D 32 10.272 -1.571 3.819 1.00 99.99 C ATOM 1347 CG1 ILE D 32 10.873 -1.129 5.172 1.00 99.99 C ATOM 1348 CG2 ILE D 32 11.362 -1.560 2.728 1.00 99.99 C ATOM 1349 CD1 ILE D 32 11.795 -2.186 5.793 1.00 99.99 C ATOM 0 H ILE D 32 8.093 -1.467 5.076 1.00 99.99 H new ATOM 0 HA ILE D 32 9.431 0.384 3.484 1.00 99.99 H new ATOM 0 HB ILE D 32 9.891 -2.588 3.913 1.00 99.99 H new ATOM 0 HG12 ILE D 32 11.433 -0.205 5.030 1.00 99.99 H new ATOM 0 HG13 ILE D 32 10.064 -0.907 5.868 1.00 99.99 H new ATOM 0 HG21 ILE D 32 12.179 -2.218 3.024 1.00 99.99 H new ATOM 0 HG22 ILE D 32 10.938 -1.909 1.787 1.00 99.99 H new ATOM 0 HG23 ILE D 32 11.740 -0.545 2.602 1.00 99.99 H new ATOM 0 HD11 ILE D 32 12.185 -1.816 6.741 1.00 99.99 H new ATOM 0 HD12 ILE D 32 11.232 -3.104 5.965 1.00 99.99 H new ATOM 0 HD13 ILE D 32 12.623 -2.390 5.114 1.00 99.99 H new ATOM 1361 N ILE D 33 7.865 -2.039 1.963 1.00 99.99 N ATOM 1362 CA ILE D 33 7.388 -2.564 0.688 1.00 99.99 C ATOM 1363 C ILE D 33 6.619 -1.475 -0.048 1.00 99.99 C ATOM 1364 O ILE D 33 6.845 -1.288 -1.216 1.00 99.99 O ATOM 1365 CB ILE D 33 6.417 -3.742 0.850 1.00 99.99 C ATOM 1366 CG1 ILE D 33 7.244 -5.036 1.056 1.00 99.99 C ATOM 1367 CG2 ILE D 33 5.467 -3.881 -0.352 1.00 99.99 C ATOM 1368 CD1 ILE D 33 6.446 -6.225 1.602 1.00 99.99 C ATOM 0 H ILE D 33 7.490 -2.523 2.779 1.00 99.99 H new ATOM 0 HA ILE D 33 8.273 -2.900 0.147 1.00 99.99 H new ATOM 0 HB ILE D 33 5.785 -3.560 1.719 1.00 99.99 H new ATOM 0 HG12 ILE D 33 7.690 -5.322 0.103 1.00 99.99 H new ATOM 0 HG13 ILE D 33 8.065 -4.822 1.740 1.00 99.99 H new ATOM 0 HG21 ILE D 33 4.799 -4.727 -0.192 1.00 99.99 H new ATOM 0 HG22 ILE D 33 4.879 -2.970 -0.458 1.00 99.99 H new ATOM 0 HG23 ILE D 33 6.049 -4.045 -1.259 1.00 99.99 H new ATOM 0 HD11 ILE D 33 7.106 -7.085 1.714 1.00 99.99 H new ATOM 0 HD12 ILE D 33 6.022 -5.964 2.572 1.00 99.99 H new ATOM 0 HD13 ILE D 33 5.642 -6.472 0.909 1.00 99.99 H new ATOM 1380 N GLY D 34 5.776 -0.825 0.629 1.00 99.99 N ATOM 1381 CA GLY D 34 4.953 0.230 0.044 1.00 99.99 C ATOM 1382 C GLY D 34 5.843 1.386 -0.380 1.00 99.99 C ATOM 1383 O GLY D 34 5.590 1.975 -1.400 1.00 99.99 O ATOM 0 H GLY D 34 5.606 -0.983 1.622 1.00 99.99 H new ATOM 0 HA2 GLY D 34 4.404 -0.156 -0.815 1.00 99.99 H new ATOM 0 HA3 GLY D 34 4.213 0.572 0.767 1.00 99.99 H new ATOM 1387 N ILE D 35 7.107 1.347 0.011 1.00 99.99 N ATOM 1388 CA ILE D 35 7.993 2.381 -0.515 1.00 99.99 C ATOM 1389 C ILE D 35 8.722 1.846 -1.737 1.00 99.99 C ATOM 1390 O ILE D 35 8.802 2.540 -2.719 1.00 99.99 O ATOM 1391 CB ILE D 35 9.077 2.803 0.485 1.00 99.99 C ATOM 1392 CG1 ILE D 35 8.430 3.354 1.781 1.00 99.99 C ATOM 1393 CG2 ILE D 35 9.993 3.868 -0.154 1.00 99.99 C ATOM 1394 CD1 ILE D 35 9.390 3.514 2.963 1.00 99.99 C ATOM 0 H ILE D 35 7.524 0.665 0.644 1.00 99.99 H new ATOM 0 HA ILE D 35 7.360 3.239 -0.743 1.00 99.99 H new ATOM 0 HB ILE D 35 9.677 1.931 0.745 1.00 99.99 H new ATOM 0 HG12 ILE D 35 7.981 4.323 1.562 1.00 99.99 H new ATOM 0 HG13 ILE D 35 7.620 2.687 2.077 1.00 99.99 H new ATOM 0 HG21 ILE D 35 10.761 4.164 0.561 1.00 99.99 H new ATOM 0 HG22 ILE D 35 10.466 3.454 -1.044 1.00 99.99 H new ATOM 0 HG23 ILE D 35 9.400 4.740 -0.431 1.00 99.99 H new ATOM 0 HD11 ILE D 35 8.846 3.905 3.823 1.00 99.99 H new ATOM 0 HD12 ILE D 35 9.821 2.545 3.216 1.00 99.99 H new ATOM 0 HD13 ILE D 35 10.188 4.206 2.693 1.00 99.99 H new ATOM 1406 N LEU D 36 9.208 0.686 -1.642 1.00 99.99 N ATOM 1407 CA LEU D 36 9.956 0.062 -2.728 1.00 99.99 C ATOM 1408 C LEU D 36 9.057 -0.062 -3.950 1.00 99.99 C ATOM 1409 O LEU D 36 9.496 0.235 -5.031 1.00 99.99 O ATOM 1410 CB LEU D 36 10.424 -1.359 -2.389 1.00 99.99 C ATOM 1411 CG LEU D 36 11.107 -2.125 -3.543 1.00 99.99 C ATOM 1412 CD1 LEU D 36 12.403 -1.429 -3.981 1.00 99.99 C ATOM 1413 CD2 LEU D 36 11.375 -3.584 -3.151 1.00 99.99 C ATOM 0 H LEU D 36 9.117 0.102 -0.810 1.00 99.99 H new ATOM 0 HA LEU D 36 10.826 0.694 -2.905 1.00 99.99 H new ATOM 0 HB2 LEU D 36 11.119 -1.304 -1.551 1.00 99.99 H new ATOM 0 HB3 LEU D 36 9.563 -1.936 -2.052 1.00 99.99 H new ATOM 0 HG LEU D 36 10.424 -2.123 -4.392 1.00 99.99 H new ATOM 0 HD11 LEU D 36 12.861 -1.991 -4.795 1.00 99.99 H new ATOM 0 HD12 LEU D 36 12.176 -0.419 -4.321 1.00 99.99 H new ATOM 0 HD13 LEU D 36 13.093 -1.382 -3.139 1.00 99.99 H new ATOM 0 HD21 LEU D 36 11.856 -4.101 -3.981 1.00 99.99 H new ATOM 0 HD22 LEU D 36 12.028 -3.612 -2.278 1.00 99.99 H new ATOM 0 HD23 LEU D 36 10.432 -4.076 -2.915 1.00 99.99 H new ATOM 1425 N HIS D 37 7.797 -0.522 -3.782 1.00 99.99 N ATOM 1426 CA HIS D 37 6.852 -0.744 -4.849 1.00 99.99 C ATOM 1427 C HIS D 37 6.526 0.557 -5.530 1.00 99.99 C ATOM 1428 O HIS D 37 6.189 0.580 -6.712 1.00 99.99 O ATOM 1429 CB HIS D 37 5.542 -1.379 -4.323 1.00 99.99 C ATOM 1430 CG HIS D 37 4.590 -1.818 -5.406 1.00 99.99 C ATOM 1431 ND1 HIS D 37 3.271 -2.090 -5.159 1.00 99.99 N ATOM 1432 CD2 HIS D 37 4.810 -2.074 -6.717 1.00 99.99 C ATOM 1433 CE1 HIS D 37 2.708 -2.489 -6.291 1.00 99.99 C ATOM 1434 NE2 HIS D 37 3.621 -2.488 -7.252 1.00 99.99 N ATOM 0 H HIS D 37 7.418 -0.750 -2.863 1.00 99.99 H new ATOM 0 HA HIS D 37 7.313 -1.432 -5.558 1.00 99.99 H new ATOM 0 HB2 HIS D 37 5.792 -2.240 -3.704 1.00 99.99 H new ATOM 0 HB3 HIS D 37 5.036 -0.660 -3.679 1.00 99.99 H new ATOM 0 HD2 HIS D 37 5.748 -1.971 -7.242 1.00 99.99 H new ATOM 0 HE1 HIS D 37 1.672 -2.770 -6.411 1.00 99.99 H new ATOM 0 HE2 HIS D 37 3.464 -2.751 -8.225 1.00 99.99 H new ATOM 1442 N LEU D 38 6.666 1.682 -4.787 1.00 99.99 N ATOM 1443 CA LEU D 38 6.412 3.018 -5.311 1.00 99.99 C ATOM 1444 C LEU D 38 7.528 3.404 -6.270 1.00 99.99 C ATOM 1445 O LEU D 38 7.247 3.932 -7.316 1.00 99.99 O ATOM 1446 CB LEU D 38 6.388 4.096 -4.219 1.00 99.99 C ATOM 1447 CG LEU D 38 6.143 5.524 -4.766 1.00 99.99 C ATOM 1448 CD1 LEU D 38 4.808 5.625 -5.516 1.00 99.99 C ATOM 1449 CD2 LEU D 38 6.218 6.583 -3.666 1.00 99.99 C ATOM 0 H LEU D 38 6.959 1.673 -3.810 1.00 99.99 H new ATOM 0 HA LEU D 38 5.435 2.975 -5.793 1.00 99.99 H new ATOM 0 HB2 LEU D 38 5.608 3.853 -3.497 1.00 99.99 H new ATOM 0 HB3 LEU D 38 7.336 4.079 -3.682 1.00 99.99 H new ATOM 0 HG LEU D 38 6.947 5.722 -5.475 1.00 99.99 H new ATOM 0 HD11 LEU D 38 4.673 6.642 -5.884 1.00 99.99 H new ATOM 0 HD12 LEU D 38 4.810 4.932 -6.357 1.00 99.99 H new ATOM 0 HD13 LEU D 38 3.991 5.373 -4.840 1.00 99.99 H new ATOM 0 HD21 LEU D 38 6.040 7.568 -4.097 1.00 99.99 H new ATOM 0 HD22 LEU D 38 5.461 6.376 -2.909 1.00 99.99 H new ATOM 0 HD23 LEU D 38 7.206 6.561 -3.207 1.00 99.99 H new ATOM 1461 N ILE D 39 8.704 3.145 -5.899 1.00 99.99 N ATOM 1462 CA ILE D 39 9.872 3.484 -6.705 1.00 99.99 C ATOM 1463 C ILE D 39 9.829 2.695 -8.005 1.00 99.99 C ATOM 1464 O ILE D 39 10.095 3.256 -9.040 1.00 99.99 O ATOM 1465 CB ILE D 39 11.197 3.121 -6.022 1.00 99.99 C ATOM 1466 CG1 ILE D 39 11.409 4.013 -4.779 1.00 99.99 C ATOM 1467 CG2 ILE D 39 12.371 3.282 -7.010 1.00 99.99 C ATOM 1468 CD1 ILE D 39 12.616 3.606 -3.923 1.00 99.99 C ATOM 0 H ILE D 39 8.928 2.684 -5.017 1.00 99.99 H new ATOM 0 HA ILE D 39 9.834 4.562 -6.861 1.00 99.99 H new ATOM 0 HB ILE D 39 11.158 2.079 -5.704 1.00 99.99 H new ATOM 0 HG12 ILE D 39 11.537 5.046 -5.102 1.00 99.99 H new ATOM 0 HG13 ILE D 39 10.511 3.980 -4.163 1.00 99.99 H new ATOM 0 HG21 ILE D 39 13.305 3.021 -6.511 1.00 99.99 H new ATOM 0 HG22 ILE D 39 12.220 2.623 -7.865 1.00 99.99 H new ATOM 0 HG23 ILE D 39 12.419 4.316 -7.352 1.00 99.99 H new ATOM 0 HD11 ILE D 39 12.700 4.278 -3.069 1.00 99.99 H new ATOM 0 HD12 ILE D 39 12.483 2.584 -3.568 1.00 99.99 H new ATOM 0 HD13 ILE D 39 13.524 3.666 -4.523 1.00 99.99 H new ATOM 1480 N LEU D 40 9.521 1.477 -7.917 1.00 99.99 N ATOM 1481 CA LEU D 40 9.467 0.597 -9.078 1.00 99.99 C ATOM 1482 C LEU D 40 8.413 1.108 -10.049 1.00 99.99 C ATOM 1483 O LEU D 40 8.665 1.130 -11.228 1.00 99.99 O ATOM 1484 CB LEU D 40 9.065 -0.840 -8.723 1.00 99.99 C ATOM 1485 CG LEU D 40 10.124 -1.655 -7.948 1.00 99.99 C ATOM 1486 CD1 LEU D 40 9.541 -3.029 -7.562 1.00 99.99 C ATOM 1487 CD2 LEU D 40 11.419 -1.843 -8.751 1.00 99.99 C ATOM 0 H LEU D 40 9.288 1.017 -7.037 1.00 99.99 H new ATOM 0 HA LEU D 40 10.470 0.594 -9.504 1.00 99.99 H new ATOM 0 HB2 LEU D 40 8.151 -0.807 -8.129 1.00 99.99 H new ATOM 0 HB3 LEU D 40 8.827 -1.370 -9.645 1.00 99.99 H new ATOM 0 HG LEU D 40 10.379 -1.092 -7.051 1.00 99.99 H new ATOM 0 HD11 LEU D 40 10.290 -3.602 -7.015 1.00 99.99 H new ATOM 0 HD12 LEU D 40 8.662 -2.888 -6.933 1.00 99.99 H new ATOM 0 HD13 LEU D 40 9.258 -3.571 -8.465 1.00 99.99 H new ATOM 0 HD21 LEU D 40 12.131 -2.422 -8.163 1.00 99.99 H new ATOM 0 HD22 LEU D 40 11.199 -2.372 -9.678 1.00 99.99 H new ATOM 0 HD23 LEU D 40 11.848 -0.868 -8.983 1.00 99.99 H new ATOM 1499 N TRP D 41 7.317 1.481 -9.548 1.00 99.99 N ATOM 1500 CA TRP D 41 6.210 1.967 -10.363 1.00 99.99 C ATOM 1501 C TRP D 41 6.605 3.287 -11.009 1.00 99.99 C ATOM 1502 O TRP D 41 6.324 3.482 -12.165 1.00 99.99 O ATOM 1503 CB TRP D 41 4.943 2.246 -9.544 1.00 99.99 C ATOM 1504 CG TRP D 41 3.743 2.652 -10.381 1.00 99.99 C ATOM 1505 CD1 TRP D 41 2.940 1.835 -11.116 1.00 99.99 C ATOM 1506 CD2 TRP D 41 3.305 3.998 -10.637 1.00 99.99 C ATOM 1507 NE1 TRP D 41 1.976 2.565 -11.750 1.00 99.99 N ATOM 1508 CE2 TRP D 41 2.203 3.898 -11.507 1.00 99.99 C ATOM 1509 CE3 TRP D 41 3.769 5.235 -10.180 1.00 99.99 C ATOM 1510 CZ2 TRP D 41 1.527 5.034 -11.927 1.00 99.99 C ATOM 1511 CZ3 TRP D 41 3.093 6.376 -10.618 1.00 99.99 C ATOM 1512 CH2 TRP D 41 1.985 6.284 -11.478 1.00 99.99 C ATOM 0 H TRP D 41 7.123 1.472 -8.547 1.00 99.99 H new ATOM 0 HA TRP D 41 5.999 1.185 -11.093 1.00 99.99 H new ATOM 0 HB2 TRP D 41 4.689 1.354 -8.972 1.00 99.99 H new ATOM 0 HB3 TRP D 41 5.155 3.036 -8.824 1.00 99.99 H new ATOM 0 HD1 TRP D 41 3.050 0.763 -11.187 1.00 99.99 H new ATOM 0 HE1 TRP D 41 1.214 2.184 -12.311 1.00 99.99 H new ATOM 0 HE3 TRP D 41 4.617 5.306 -9.515 1.00 99.99 H new ATOM 0 HZ2 TRP D 41 0.671 4.960 -12.582 1.00 99.99 H new ATOM 0 HZ3 TRP D 41 3.428 7.349 -10.289 1.00 99.99 H new ATOM 0 HH2 TRP D 41 1.480 7.184 -11.797 1.00 99.99 H new ATOM 1523 N ILE D 42 7.207 4.117 -10.272 1.00 99.99 N ATOM 1524 CA ILE D 42 7.620 5.432 -10.752 1.00 99.99 C ATOM 1525 C ILE D 42 8.705 5.263 -11.806 1.00 99.99 C ATOM 1526 O ILE D 42 8.660 5.936 -12.805 1.00 99.99 O ATOM 1527 CB ILE D 42 8.222 6.308 -9.649 1.00 99.99 C ATOM 1528 CG1 ILE D 42 7.116 6.763 -8.668 1.00 99.99 C ATOM 1529 CG2 ILE D 42 8.939 7.537 -10.251 1.00 99.99 C ATOM 1530 CD1 ILE D 42 7.646 7.569 -7.472 1.00 99.99 C ATOM 0 H ILE D 42 7.448 3.935 -9.298 1.00 99.99 H new ATOM 0 HA ILE D 42 6.722 5.912 -11.141 1.00 99.99 H new ATOM 0 HB ILE D 42 8.958 5.716 -9.105 1.00 99.99 H new ATOM 0 HG12 ILE D 42 6.389 7.368 -9.209 1.00 99.99 H new ATOM 0 HG13 ILE D 42 6.587 5.885 -8.298 1.00 99.99 H new ATOM 0 HG21 ILE D 42 9.358 8.143 -9.448 1.00 99.99 H new ATOM 0 HG22 ILE D 42 9.741 7.204 -10.910 1.00 99.99 H new ATOM 0 HG23 ILE D 42 8.225 8.132 -10.820 1.00 99.99 H new ATOM 0 HD11 ILE D 42 6.814 7.854 -6.828 1.00 99.99 H new ATOM 0 HD12 ILE D 42 8.351 6.960 -6.906 1.00 99.99 H new ATOM 0 HD13 ILE D 42 8.149 8.466 -7.832 1.00 99.99 H new ATOM 1542 N LEU D 43 9.607 4.417 -11.558 1.00 99.99 N ATOM 1543 CA LEU D 43 10.720 4.174 -12.467 1.00 99.99 C ATOM 1544 C LEU D 43 10.187 3.608 -13.776 1.00 99.99 C ATOM 1545 O LEU D 43 10.716 3.928 -14.810 1.00 99.99 O ATOM 1546 CB LEU D 43 11.719 3.144 -11.925 1.00 99.99 C ATOM 1547 CG LEU D 43 12.544 3.632 -10.712 1.00 99.99 C ATOM 1548 CD1 LEU D 43 13.310 2.455 -10.080 1.00 99.99 C ATOM 1549 CD2 LEU D 43 13.524 4.752 -11.094 1.00 99.99 C ATOM 0 H LEU D 43 9.627 3.845 -10.714 1.00 99.99 H new ATOM 0 HA LEU D 43 11.225 5.131 -12.595 1.00 99.99 H new ATOM 0 HB2 LEU D 43 11.175 2.243 -11.640 1.00 99.99 H new ATOM 0 HB3 LEU D 43 12.404 2.864 -12.726 1.00 99.99 H new ATOM 0 HG LEU D 43 11.842 4.041 -9.985 1.00 99.99 H new ATOM 0 HD11 LEU D 43 13.887 2.812 -9.227 1.00 99.99 H new ATOM 0 HD12 LEU D 43 12.601 1.697 -9.747 1.00 99.99 H new ATOM 0 HD13 LEU D 43 13.985 2.022 -10.818 1.00 99.99 H new ATOM 0 HD21 LEU D 43 14.082 5.064 -10.211 1.00 99.99 H new ATOM 0 HD22 LEU D 43 14.217 4.386 -11.851 1.00 99.99 H new ATOM 0 HD23 LEU D 43 12.969 5.602 -11.491 1.00 99.99 H new ATOM 1561 N ASP D 44 9.211 2.814 -13.691 1.00 99.99 N ATOM 1562 CA ASP D 44 8.618 2.179 -14.860 1.00 99.99 C ATOM 1563 C ASP D 44 7.947 3.238 -15.724 1.00 99.99 C ATOM 1564 O ASP D 44 8.046 3.165 -16.924 1.00 99.99 O ATOM 1565 CB ASP D 44 7.527 1.160 -14.500 1.00 99.99 C ATOM 1566 CG ASP D 44 6.971 0.430 -15.738 1.00 99.99 C ATOM 1567 OD1 ASP D 44 7.734 -0.342 -16.366 1.00 99.99 O ATOM 1568 OD2 ASP D 44 5.755 0.590 -16.056 1.00 99.99 O ATOM 0 H ASP D 44 8.767 2.558 -12.809 1.00 99.99 H new ATOM 0 HA ASP D 44 9.432 1.667 -15.374 1.00 99.99 H new ATOM 0 HB2 ASP D 44 7.934 0.428 -13.803 1.00 99.99 H new ATOM 0 HB3 ASP D 44 6.712 1.671 -13.987 1.00 99.99 H new ATOM 1573 N ARG D 45 7.310 4.141 -15.117 1.00 99.99 N ATOM 1574 CA ARG D 45 6.600 5.204 -15.819 1.00 99.99 C ATOM 1575 C ARG D 45 7.600 6.065 -16.576 1.00 99.99 C ATOM 1576 O ARG D 45 7.340 6.414 -17.700 1.00 99.99 O ATOM 1577 CB ARG D 45 5.849 6.148 -14.871 1.00 99.99 C ATOM 1578 CG ARG D 45 4.698 5.468 -14.101 1.00 99.99 C ATOM 1579 CD ARG D 45 3.457 5.219 -14.968 1.00 99.99 C ATOM 1580 NE ARG D 45 3.541 3.827 -15.539 1.00 99.99 N ATOM 1581 CZ ARG D 45 2.856 3.483 -16.646 1.00 99.99 C ATOM 1582 NH1 ARG D 45 2.050 4.357 -17.275 1.00 99.99 N ATOM 1583 NH2 ARG D 45 2.968 2.224 -17.099 1.00 99.99 N ATOM 0 H ARG D 45 7.243 4.197 -14.101 1.00 99.99 H new ATOM 0 HA ARG D 45 5.885 4.710 -16.476 1.00 99.99 H new ATOM 0 HB2 ARG D 45 6.556 6.567 -14.155 1.00 99.99 H new ATOM 0 HB3 ARG D 45 5.447 6.982 -15.446 1.00 99.99 H new ATOM 0 HG2 ARG D 45 5.050 4.518 -13.699 1.00 99.99 H new ATOM 0 HG3 ARG D 45 4.420 6.091 -13.250 1.00 99.99 H new ATOM 0 HD2 ARG D 45 2.551 5.329 -14.372 1.00 99.99 H new ATOM 0 HD3 ARG D 45 3.402 5.954 -15.771 1.00 99.99 H new ATOM 0 HE ARG D 45 4.128 3.132 -15.078 1.00 99.99 H new ATOM 0 HH11 ARG D 45 1.947 5.306 -16.915 1.00 99.99 H new ATOM 0 HH12 ARG D 45 1.542 4.071 -18.112 1.00 99.99 H new ATOM 0 HH21 ARG D 45 3.561 1.556 -16.607 1.00 99.99 H new ATOM 0 HH22 ARG D 45 2.460 1.936 -17.935 1.00 99.99 H new ATOM 1597 N LEU D 46 8.660 6.370 -15.963 1.00 99.99 N ATOM 1598 CA LEU D 46 9.693 7.209 -16.559 1.00 99.99 C ATOM 1599 C LEU D 46 10.339 6.466 -17.718 1.00 99.99 C ATOM 1600 O LEU D 46 11.017 5.458 -17.525 1.00 99.99 O ATOM 1601 CB LEU D 46 10.824 7.551 -15.580 1.00 99.99 C ATOM 1602 CG LEU D 46 10.440 8.311 -14.286 1.00 99.99 C ATOM 1603 CD1 LEU D 46 11.666 8.331 -13.353 1.00 99.99 C ATOM 1604 CD2 LEU D 46 9.947 9.739 -14.543 1.00 99.99 C ATOM 0 H LEU D 46 8.873 6.057 -15.016 1.00 99.99 H new ATOM 0 HA LEU D 46 9.197 8.129 -16.870 1.00 99.99 H new ATOM 0 HB2 LEU D 46 11.313 6.621 -15.292 1.00 99.99 H new ATOM 0 HB3 LEU D 46 11.563 8.148 -16.114 1.00 99.99 H new ATOM 0 HG LEU D 46 9.604 7.785 -13.826 1.00 99.99 H new ATOM 0 HD11 LEU D 46 11.416 8.862 -12.435 1.00 99.99 H new ATOM 0 HD12 LEU D 46 11.957 7.308 -13.113 1.00 99.99 H new ATOM 0 HD13 LEU D 46 12.494 8.836 -13.851 1.00 99.99 H new ATOM 0 HD21 LEU D 46 9.695 10.213 -13.594 1.00 99.99 H new ATOM 0 HD22 LEU D 46 10.732 10.311 -15.038 1.00 99.99 H new ATOM 0 HD23 LEU D 46 9.063 9.710 -15.180 1.00 99.99 H new