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= 0.317 USER MOD Single : A 37 HIS : no HD1:sc= -0.211 X(o=-0.21,f=-0.072) 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= 0.319 USER MOD Single : B 37 HIS : no HD1:sc= -0.192 X(o=-0.19,f=-0.072) 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 67:sc= 0.316 USER MOD Single : C 37 HIS : no HD1:sc= -0.183 X(o=-0.18,f=-0.074) 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= 0.312 USER MOD Single : D 37 HIS : no HD1:sc= -0.21 X(o=-0.21,f=-0.071) USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 22 0.518 10.395 18.943 1.00 99.99 N ATOM 2 CA SER A 22 1.252 10.116 17.676 1.00 99.99 C ATOM 3 C SER A 22 1.593 8.656 17.532 1.00 99.99 C ATOM 4 O SER A 22 1.421 7.863 18.459 1.00 99.99 O ATOM 5 CB SER A 22 2.530 11.005 17.552 1.00 99.99 C ATOM 6 OG SER A 22 3.491 10.754 18.575 1.00 99.99 O ATOM 0 HA SER A 22 0.581 10.375 16.856 1.00 99.99 H new ATOM 0 HB2 SER A 22 2.991 10.833 16.579 1.00 99.99 H new ATOM 0 HB3 SER A 22 2.239 12.055 17.586 1.00 99.99 H new ATOM 0 HG SER A 22 4.268 11.337 18.445 1.00 99.99 H new ATOM 11 N SER A 23 2.098 8.279 16.333 1.00 99.99 N ATOM 12 CA SER A 23 2.580 6.949 16.044 1.00 99.99 C ATOM 13 C SER A 23 4.007 7.123 15.589 1.00 99.99 C ATOM 14 O SER A 23 4.600 8.183 15.787 1.00 99.99 O ATOM 15 CB SER A 23 1.734 6.228 14.965 1.00 99.99 C ATOM 16 OG SER A 23 0.402 6.047 15.425 1.00 99.99 O ATOM 0 H SER A 23 2.174 8.917 15.541 1.00 99.99 H new ATOM 0 HA SER A 23 2.506 6.316 16.928 1.00 99.99 H new ATOM 0 HB2 SER A 23 1.732 6.811 14.044 1.00 99.99 H new ATOM 0 HB3 SER A 23 2.179 5.262 14.729 1.00 99.99 H new ATOM 0 HG SER A 23 -0.124 5.592 14.734 1.00 99.99 H new ATOM 22 N ASP A 24 4.608 6.062 14.990 1.00 99.99 N ATOM 23 CA ASP A 24 6.014 6.026 14.630 1.00 99.99 C ATOM 24 C ASP A 24 6.174 6.627 13.250 1.00 99.99 C ATOM 25 O ASP A 24 5.222 6.567 12.480 1.00 99.99 O ATOM 26 CB ASP A 24 6.572 4.576 14.600 1.00 99.99 C ATOM 27 CG ASP A 24 6.497 3.914 15.980 1.00 99.99 C ATOM 28 OD1 ASP A 24 6.411 4.642 17.006 1.00 99.99 O ATOM 29 OD2 ASP A 24 6.536 2.655 16.021 1.00 99.99 O ATOM 0 H ASP A 24 4.107 5.207 14.749 1.00 99.99 H new ATOM 0 HA ASP A 24 6.568 6.588 15.381 1.00 99.99 H new ATOM 0 HB2 ASP A 24 6.008 3.983 13.880 1.00 99.99 H new ATOM 0 HB3 ASP A 24 7.607 4.591 14.259 1.00 99.99 H new ATOM 34 N PRO A 25 7.303 7.231 12.871 1.00 99.99 N ATOM 35 CA PRO A 25 7.372 8.113 11.715 1.00 99.99 C ATOM 36 C PRO A 25 7.349 7.365 10.401 1.00 99.99 C ATOM 37 O PRO A 25 6.931 7.968 9.424 1.00 99.99 O ATOM 38 CB PRO A 25 8.695 8.877 11.887 1.00 99.99 C ATOM 39 CG PRO A 25 9.544 7.969 12.780 1.00 99.99 C ATOM 40 CD PRO A 25 8.501 7.341 13.701 1.00 99.99 C ATOM 0 HA PRO A 25 6.503 8.770 11.675 1.00 99.99 H new ATOM 0 HB2 PRO A 25 9.179 9.055 10.927 1.00 99.99 H new ATOM 0 HB3 PRO A 25 8.534 9.851 12.349 1.00 99.99 H new ATOM 0 HG2 PRO A 25 10.080 7.217 12.201 1.00 99.99 H new ATOM 0 HG3 PRO A 25 10.291 8.533 13.338 1.00 99.99 H new ATOM 0 HD2 PRO A 25 8.826 6.365 14.062 1.00 99.99 H new ATOM 0 HD3 PRO A 25 8.321 7.962 14.579 1.00 99.99 H new ATOM 48 N LEU A 26 7.796 6.089 10.358 1.00 99.99 N ATOM 49 CA LEU A 26 7.746 5.167 9.231 1.00 99.99 C ATOM 50 C LEU A 26 6.309 4.717 9.010 1.00 99.99 C ATOM 51 O LEU A 26 5.883 4.655 7.885 1.00 99.99 O ATOM 52 CB LEU A 26 8.567 3.891 9.466 1.00 99.99 C ATOM 53 CG LEU A 26 8.394 2.764 8.422 1.00 99.99 C ATOM 54 CD1 LEU A 26 8.880 3.170 7.028 1.00 99.99 C ATOM 55 CD2 LEU A 26 9.107 1.489 8.894 1.00 99.99 C ATOM 0 H LEU A 26 8.230 5.659 11.175 1.00 99.99 H new ATOM 0 HA LEU A 26 8.156 5.707 8.377 1.00 99.99 H new ATOM 0 HB2 LEU A 26 9.621 4.164 9.503 1.00 99.99 H new ATOM 0 HB3 LEU A 26 8.307 3.492 10.446 1.00 99.99 H new ATOM 0 HG LEU A 26 7.325 2.568 8.336 1.00 99.99 H new ATOM 0 HD11 LEU A 26 8.734 2.341 6.336 1.00 99.99 H new ATOM 0 HD12 LEU A 26 8.313 4.035 6.683 1.00 99.99 H new ATOM 0 HD13 LEU A 26 9.939 3.424 7.072 1.00 99.99 H new ATOM 0 HD21 LEU A 26 8.978 0.703 8.150 1.00 99.99 H new ATOM 0 HD22 LEU A 26 10.170 1.694 9.025 1.00 99.99 H new ATOM 0 HD23 LEU A 26 8.681 1.164 9.843 1.00 99.99 H new ATOM 67 N VAL A 27 5.645 4.427 10.044 1.00 99.99 N ATOM 68 CA VAL A 27 4.265 3.959 9.978 1.00 99.99 C ATOM 69 C VAL A 27 3.379 5.075 9.445 1.00 99.99 C ATOM 70 O VAL A 27 2.569 4.821 8.590 1.00 99.99 O ATOM 71 CB VAL A 27 3.699 3.575 11.352 1.00 99.99 C ATOM 72 CG1 VAL A 27 2.207 3.205 11.243 1.00 99.99 C ATOM 73 CG2 VAL A 27 4.486 2.371 11.916 1.00 99.99 C ATOM 0 H VAL A 27 6.016 4.496 10.991 1.00 99.99 H new ATOM 0 HA VAL A 27 4.271 3.080 9.333 1.00 99.99 H new ATOM 0 HB VAL A 27 3.799 4.430 12.020 1.00 99.99 H new ATOM 0 HG11 VAL A 27 1.826 2.936 12.228 1.00 99.99 H new ATOM 0 HG12 VAL A 27 1.648 4.058 10.858 1.00 99.99 H new ATOM 0 HG13 VAL A 27 2.090 2.359 10.566 1.00 99.99 H new ATOM 0 HG21 VAL A 27 4.084 2.098 12.892 1.00 99.99 H new ATOM 0 HG22 VAL A 27 4.393 1.524 11.236 1.00 99.99 H new ATOM 0 HG23 VAL A 27 5.537 2.640 12.019 1.00 99.99 H new ATOM 83 N VAL A 28 3.549 6.220 9.949 1.00 99.99 N ATOM 84 CA VAL A 28 2.752 7.374 9.552 1.00 99.99 C ATOM 85 C VAL A 28 3.122 7.776 8.133 1.00 99.99 C ATOM 86 O VAL A 28 2.244 8.049 7.353 1.00 99.99 O ATOM 87 CB VAL A 28 3.004 8.605 10.432 1.00 99.99 C ATOM 88 CG1 VAL A 28 2.281 9.849 9.876 1.00 99.99 C ATOM 89 CG2 VAL A 28 2.536 8.320 11.873 1.00 99.99 C ATOM 0 H VAL A 28 4.248 6.423 10.664 1.00 99.99 H new ATOM 0 HA VAL A 28 1.709 7.073 9.647 1.00 99.99 H new ATOM 0 HB VAL A 28 4.074 8.812 10.431 1.00 99.99 H new ATOM 0 HG11 VAL A 28 2.479 10.704 10.522 1.00 99.99 H new ATOM 0 HG12 VAL A 28 2.644 10.062 8.871 1.00 99.99 H new ATOM 0 HG13 VAL A 28 1.208 9.661 9.842 1.00 99.99 H new ATOM 0 HG21 VAL A 28 2.717 9.197 12.494 1.00 99.99 H new ATOM 0 HG22 VAL A 28 1.470 8.090 11.871 1.00 99.99 H new ATOM 0 HG23 VAL A 28 3.089 7.471 12.274 1.00 99.99 H new ATOM 99 N ALA A 29 4.352 7.807 7.858 1.00 99.99 N ATOM 100 CA ALA A 29 4.851 8.202 6.544 1.00 99.99 C ATOM 101 C ALA A 29 4.319 7.235 5.495 1.00 99.99 C ATOM 102 O ALA A 29 3.924 7.675 4.443 1.00 99.99 O ATOM 103 CB ALA A 29 6.380 8.148 6.444 1.00 99.99 C ATOM 0 H ALA A 29 5.085 7.562 8.524 1.00 99.99 H new ATOM 0 HA ALA A 29 4.517 9.227 6.385 1.00 99.99 H new ATOM 0 HB1 ALA A 29 6.690 8.452 5.444 1.00 99.99 H new ATOM 0 HB2 ALA A 29 6.817 8.822 7.181 1.00 99.99 H new ATOM 0 HB3 ALA A 29 6.721 7.131 6.636 1.00 99.99 H new ATOM 109 N ALA A 30 4.332 6.010 5.796 1.00 99.99 N ATOM 110 CA ALA A 30 3.876 4.976 4.876 1.00 99.99 C ATOM 111 C ALA A 30 2.397 5.176 4.583 1.00 99.99 C ATOM 112 O ALA A 30 1.980 4.923 3.480 1.00 99.99 O ATOM 113 CB ALA A 30 4.014 3.560 5.454 1.00 99.99 C ATOM 0 H ALA A 30 4.658 5.653 6.694 1.00 99.99 H new ATOM 0 HA ALA A 30 4.498 5.065 3.986 1.00 99.99 H new ATOM 0 HB1 ALA A 30 3.659 2.833 4.724 1.00 99.99 H new ATOM 0 HB2 ALA A 30 5.061 3.361 5.684 1.00 99.99 H new ATOM 0 HB3 ALA A 30 3.421 3.479 6.365 1.00 99.99 H new ATOM 119 N SER A 31 1.687 5.601 5.534 1.00 99.99 N ATOM 120 CA SER A 31 0.251 5.815 5.401 1.00 99.99 C ATOM 121 C SER A 31 -0.003 6.882 4.346 1.00 99.99 C ATOM 122 O SER A 31 -0.840 6.684 3.502 1.00 99.99 O ATOM 123 CB SER A 31 -0.401 6.320 6.694 1.00 99.99 C ATOM 124 OG SER A 31 -0.333 5.328 7.717 1.00 99.99 O ATOM 0 H SER A 31 2.057 5.825 6.458 1.00 99.99 H new ATOM 0 HA SER A 31 -0.179 4.849 5.137 1.00 99.99 H new ATOM 0 HB2 SER A 31 0.100 7.228 7.028 1.00 99.99 H new ATOM 0 HB3 SER A 31 -1.442 6.582 6.504 1.00 99.99 H new ATOM 0 HG SER A 31 0.601 5.198 7.985 1.00 99.99 H new ATOM 130 N ILE A 32 0.689 7.934 4.430 1.00 99.99 N ATOM 131 CA ILE A 32 0.532 9.047 3.502 1.00 99.99 C ATOM 132 C ILE A 32 0.941 8.604 2.105 1.00 99.99 C ATOM 133 O ILE A 32 0.323 9.011 1.157 1.00 99.99 O ATOM 134 CB ILE A 32 1.422 10.247 3.854 1.00 99.99 C ATOM 135 CG1 ILE A 32 0.983 10.859 5.202 1.00 99.99 C ATOM 136 CG2 ILE A 32 1.366 11.318 2.745 1.00 99.99 C ATOM 137 CD1 ILE A 32 2.023 11.820 5.793 1.00 99.99 C ATOM 0 H ILE A 32 1.402 8.085 5.144 1.00 99.99 H new ATOM 0 HA ILE A 32 -0.515 9.346 3.559 1.00 99.99 H new ATOM 0 HB ILE A 32 2.450 9.895 3.940 1.00 99.99 H new ATOM 0 HG12 ILE A 32 0.042 11.392 5.063 1.00 99.99 H new ATOM 0 HG13 ILE A 32 0.793 10.056 5.914 1.00 99.99 H new ATOM 0 HG21 ILE A 32 2.005 12.158 3.018 1.00 99.99 H new ATOM 0 HG22 ILE A 32 1.714 10.888 1.806 1.00 99.99 H new ATOM 0 HG23 ILE A 32 0.340 11.666 2.627 1.00 99.99 H new ATOM 0 HD11 ILE A 32 1.656 12.216 6.740 1.00 99.99 H new ATOM 0 HD12 ILE A 32 2.958 11.285 5.962 1.00 99.99 H new ATOM 0 HD13 ILE A 32 2.195 12.642 5.098 1.00 99.99 H new ATOM 149 N ILE A 33 1.929 7.824 2.031 1.00 99.99 N ATOM 150 CA ILE A 33 2.448 7.339 0.756 1.00 99.99 C ATOM 151 C ILE A 33 1.361 6.555 0.035 1.00 99.99 C ATOM 152 O ILE A 33 1.168 6.763 -1.135 1.00 99.99 O ATOM 153 CB ILE A 33 3.636 6.380 0.918 1.00 99.99 C ATOM 154 CG1 ILE A 33 4.924 7.219 1.106 1.00 99.99 C ATOM 155 CG2 ILE A 33 3.774 5.420 -0.277 1.00 99.99 C ATOM 156 CD1 ILE A 33 6.125 6.437 1.651 1.00 99.99 C ATOM 0 H ILE A 33 2.435 7.476 2.845 1.00 99.99 H new ATOM 0 HA ILE A 33 2.772 8.221 0.204 1.00 99.99 H new ATOM 0 HB ILE A 33 3.466 5.755 1.794 1.00 99.99 H new ATOM 0 HG12 ILE A 33 5.199 7.658 0.147 1.00 99.99 H new ATOM 0 HG13 ILE A 33 4.708 8.045 1.784 1.00 99.99 H new ATOM 0 HG21 ILE A 33 4.628 4.761 -0.118 1.00 99.99 H new ATOM 0 HG22 ILE A 33 2.867 4.823 -0.371 1.00 99.99 H new ATOM 0 HG23 ILE A 33 3.925 5.995 -1.190 1.00 99.99 H new ATOM 0 HD11 ILE A 33 6.980 7.106 1.749 1.00 99.99 H new ATOM 0 HD12 ILE A 33 5.876 6.021 2.627 1.00 99.99 H new ATOM 0 HD13 ILE A 33 6.374 5.628 0.964 1.00 99.99 H new ATOM 168 N GLY A 34 0.719 5.717 0.726 1.00 99.99 N ATOM 169 CA GLY A 34 -0.334 4.880 0.157 1.00 99.99 C ATOM 170 C GLY A 34 -1.498 5.758 -0.272 1.00 99.99 C ATOM 171 O GLY A 34 -2.112 5.468 -1.268 1.00 99.99 O ATOM 0 H GLY A 34 0.883 5.561 1.721 1.00 99.99 H new ATOM 0 HA2 GLY A 34 0.050 4.323 -0.698 1.00 99.99 H new ATOM 0 HA3 GLY A 34 -0.668 4.147 0.891 1.00 99.99 H new ATOM 175 N ILE A 35 -1.445 7.036 0.069 1.00 99.99 N ATOM 176 CA ILE A 35 -2.489 7.905 -0.466 1.00 99.99 C ATOM 177 C ILE A 35 -1.975 8.601 -1.716 1.00 99.99 C ATOM 178 O ILE A 35 -2.671 8.624 -2.699 1.00 99.99 O ATOM 179 CB ILE A 35 -2.898 9.016 0.510 1.00 99.99 C ATOM 180 CG1 ILE A 35 -3.428 8.405 1.832 1.00 99.99 C ATOM 181 CG2 ILE A 35 -3.974 9.913 -0.138 1.00 99.99 C ATOM 182 CD1 ILE A 35 -3.571 9.398 2.989 1.00 99.99 C ATOM 0 H ILE A 35 -0.746 7.474 0.669 1.00 99.99 H new ATOM 0 HA ILE A 35 -3.348 7.264 -0.663 1.00 99.99 H new ATOM 0 HB ILE A 35 -2.023 9.624 0.740 1.00 99.99 H new ATOM 0 HG12 ILE A 35 -4.400 7.950 1.641 1.00 99.99 H new ATOM 0 HG13 ILE A 35 -2.756 7.604 2.140 1.00 99.99 H new ATOM 0 HG21 ILE A 35 -4.260 10.700 0.560 1.00 99.99 H new ATOM 0 HG22 ILE A 35 -3.574 10.362 -1.047 1.00 99.99 H new ATOM 0 HG23 ILE A 35 -4.849 9.311 -0.385 1.00 99.99 H new ATOM 0 HD11 ILE A 35 -3.948 8.878 3.870 1.00 99.99 H new ATOM 0 HD12 ILE A 35 -2.599 9.836 3.214 1.00 99.99 H new ATOM 0 HD13 ILE A 35 -4.268 10.187 2.707 1.00 99.99 H new ATOM 194 N LEU A 36 -0.828 9.121 -1.642 1.00 99.99 N ATOM 195 CA LEU A 36 -0.225 9.843 -2.757 1.00 99.99 C ATOM 196 C LEU A 36 -0.119 8.914 -3.957 1.00 99.99 C ATOM 197 O LEU A 36 -0.394 9.338 -5.051 1.00 99.99 O ATOM 198 CB LEU A 36 1.201 10.323 -2.455 1.00 99.99 C ATOM 199 CG LEU A 36 1.945 10.978 -3.638 1.00 99.99 C ATOM 200 CD1 LEU A 36 1.238 12.261 -4.096 1.00 99.99 C ATOM 201 CD2 LEU A 36 3.409 11.260 -3.278 1.00 99.99 C ATOM 0 H LEU A 36 -0.242 9.078 -0.809 1.00 99.99 H new ATOM 0 HA LEU A 36 -0.863 10.707 -2.945 1.00 99.99 H new ATOM 0 HB2 LEU A 36 1.159 11.039 -1.634 1.00 99.99 H new ATOM 0 HB3 LEU A 36 1.786 9.472 -2.107 1.00 99.99 H new ATOM 0 HG LEU A 36 1.931 10.273 -4.470 1.00 99.99 H new ATOM 0 HD11 LEU A 36 1.785 12.700 -4.930 1.00 99.99 H new ATOM 0 HD12 LEU A 36 0.222 12.024 -4.413 1.00 99.99 H new ATOM 0 HD13 LEU A 36 1.204 12.972 -3.271 1.00 99.99 H new ATOM 0 HD21 LEU A 36 3.910 11.721 -4.129 1.00 99.99 H new ATOM 0 HD22 LEU A 36 3.450 11.935 -2.423 1.00 99.99 H new ATOM 0 HD23 LEU A 36 3.908 10.324 -3.026 1.00 99.99 H new ATOM 213 N HIS A 37 0.304 7.645 -3.753 1.00 99.99 N ATOM 214 CA HIS A 37 0.502 6.662 -4.791 1.00 99.99 C ATOM 215 C HIS A 37 -0.803 6.365 -5.480 1.00 99.99 C ATOM 216 O HIS A 37 -0.827 6.037 -6.665 1.00 99.99 O ATOM 217 CB HIS A 37 1.078 5.344 -4.218 1.00 99.99 C ATOM 218 CG HIS A 37 1.483 4.338 -5.264 1.00 99.99 C ATOM 219 ND1 HIS A 37 1.710 3.021 -4.968 1.00 99.99 N ATOM 220 CD2 HIS A 37 1.746 4.500 -6.583 1.00 99.99 C ATOM 221 CE1 HIS A 37 2.088 2.402 -6.078 1.00 99.99 C ATOM 222 NE2 HIS A 37 2.117 3.278 -7.073 1.00 99.99 N ATOM 0 H HIS A 37 0.518 7.286 -2.823 1.00 99.99 H new ATOM 0 HA HIS A 37 1.215 7.077 -5.504 1.00 99.99 H new ATOM 0 HB2 HIS A 37 1.945 5.578 -3.601 1.00 99.99 H new ATOM 0 HB3 HIS A 37 0.334 4.890 -3.563 1.00 99.99 H new ATOM 0 HD2 HIS A 37 1.676 5.421 -7.143 1.00 99.99 H new ATOM 0 HE1 HIS A 37 2.333 1.353 -6.159 1.00 99.99 H new ATOM 0 HE2 HIS A 37 2.373 3.075 -8.039 1.00 99.99 H new ATOM 230 N LEU A 38 -1.927 6.519 -4.740 1.00 99.99 N ATOM 231 CA LEU A 38 -3.268 6.284 -5.263 1.00 99.99 C ATOM 232 C LEU A 38 -3.641 7.410 -6.216 1.00 99.99 C ATOM 233 O LEU A 38 -4.169 7.140 -7.265 1.00 99.99 O ATOM 234 CB LEU A 38 -4.344 6.269 -4.169 1.00 99.99 C ATOM 235 CG LEU A 38 -5.775 6.046 -4.715 1.00 99.99 C ATOM 236 CD1 LEU A 38 -5.895 4.715 -5.470 1.00 99.99 C ATOM 237 CD2 LEU A 38 -6.832 6.129 -3.613 1.00 99.99 C ATOM 0 H LEU A 38 -1.915 6.811 -3.763 1.00 99.99 H new ATOM 0 HA LEU A 38 -3.239 5.309 -5.750 1.00 99.99 H new ATOM 0 HB2 LEU A 38 -4.111 5.482 -3.451 1.00 99.99 H new ATOM 0 HB3 LEU A 38 -4.313 7.214 -3.627 1.00 99.99 H new ATOM 0 HG LEU A 38 -5.963 6.856 -5.419 1.00 99.99 H new ATOM 0 HD11 LEU A 38 -6.914 4.596 -5.837 1.00 99.99 H new ATOM 0 HD12 LEU A 38 -5.203 4.711 -6.312 1.00 99.99 H new ATOM 0 HD13 LEU A 38 -5.653 3.892 -4.797 1.00 99.99 H new ATOM 0 HD21 LEU A 38 -7.820 5.966 -4.044 1.00 99.99 H new ATOM 0 HD22 LEU A 38 -6.634 5.366 -2.861 1.00 99.99 H new ATOM 0 HD23 LEU A 38 -6.797 7.114 -3.148 1.00 99.99 H new ATOM 249 N ILE A 39 -3.372 8.581 -5.837 1.00 99.99 N ATOM 250 CA ILE A 39 -3.698 9.757 -6.638 1.00 99.99 C ATOM 251 C ILE A 39 -2.858 9.748 -7.906 1.00 99.99 C ATOM 252 O ILE A 39 -3.381 10.025 -8.957 1.00 99.99 O ATOM 253 CB ILE A 39 -3.384 11.076 -5.920 1.00 99.99 C ATOM 254 CG1 ILE A 39 -4.328 11.253 -4.710 1.00 99.99 C ATOM 255 CG2 ILE A 39 -3.526 12.263 -6.895 1.00 99.99 C ATOM 256 CD1 ILE A 39 -3.975 12.452 -3.819 1.00 99.99 C ATOM 0 H ILE A 39 -2.911 8.795 -4.952 1.00 99.99 H new ATOM 0 HA ILE A 39 -4.768 9.704 -6.838 1.00 99.99 H new ATOM 0 HB ILE A 39 -2.355 11.048 -5.561 1.00 99.99 H new ATOM 0 HG12 ILE A 39 -5.350 11.370 -5.072 1.00 99.99 H new ATOM 0 HG13 ILE A 39 -4.305 10.345 -4.107 1.00 99.99 H new ATOM 0 HG21 ILE A 39 -3.300 13.192 -6.372 1.00 99.99 H new ATOM 0 HG22 ILE A 39 -2.832 12.136 -7.726 1.00 99.99 H new ATOM 0 HG23 ILE A 39 -4.546 12.300 -7.277 1.00 99.99 H new ATOM 0 HD11 ILE A 39 -4.682 12.511 -2.991 1.00 99.99 H new ATOM 0 HD12 ILE A 39 -2.966 12.329 -3.426 1.00 99.99 H new ATOM 0 HD13 ILE A 39 -4.026 13.369 -4.406 1.00 99.99 H new ATOM 268 N LEU A 40 -1.640 9.455 -7.776 1.00 99.99 N ATOM 269 CA LEU A 40 -0.715 9.433 -8.902 1.00 99.99 C ATOM 270 C LEU A 40 -1.195 8.421 -9.930 1.00 99.99 C ATOM 271 O LEU A 40 -1.180 8.720 -11.098 1.00 99.99 O ATOM 272 CB LEU A 40 0.703 9.004 -8.504 1.00 99.99 C ATOM 273 CG LEU A 40 1.496 10.025 -7.658 1.00 99.99 C ATOM 274 CD1 LEU A 40 2.847 9.414 -7.239 1.00 99.99 C ATOM 275 CD2 LEU A 40 1.728 11.346 -8.405 1.00 99.99 C ATOM 0 H LEU A 40 -1.212 9.213 -6.883 1.00 99.99 H new ATOM 0 HA LEU A 40 -0.687 10.451 -9.291 1.00 99.99 H new ATOM 0 HB2 LEU A 40 0.638 8.070 -7.946 1.00 99.99 H new ATOM 0 HB3 LEU A 40 1.268 8.794 -9.412 1.00 99.99 H new ATOM 0 HG LEU A 40 0.900 10.253 -6.775 1.00 99.99 H new ATOM 0 HD11 LEU A 40 3.404 10.137 -6.643 1.00 99.99 H new ATOM 0 HD12 LEU A 40 2.672 8.514 -6.649 1.00 99.99 H new ATOM 0 HD13 LEU A 40 3.422 9.158 -8.129 1.00 99.99 H new ATOM 0 HD21 LEU A 40 2.289 12.030 -7.769 1.00 99.99 H new ATOM 0 HD22 LEU A 40 2.292 11.154 -9.318 1.00 99.99 H new ATOM 0 HD23 LEU A 40 0.767 11.793 -8.660 1.00 99.99 H new ATOM 287 N TRP A 41 -1.586 7.306 -9.486 1.00 99.99 N ATOM 288 CA TRP A 41 -2.047 6.234 -10.360 1.00 99.99 C ATOM 289 C TRP A 41 -3.357 6.649 -11.014 1.00 99.99 C ATOM 290 O TRP A 41 -3.528 6.418 -12.184 1.00 99.99 O ATOM 291 CB TRP A 41 -2.332 4.929 -9.606 1.00 99.99 C ATOM 292 CG TRP A 41 -2.711 3.766 -10.505 1.00 99.99 C ATOM 293 CD1 TRP A 41 -1.873 3.003 -11.258 1.00 99.99 C ATOM 294 CD2 TRP A 41 -4.048 3.331 -10.807 1.00 99.99 C ATOM 295 NE1 TRP A 41 -2.583 2.063 -11.950 1.00 99.99 N ATOM 296 CE2 TRP A 41 -3.922 2.270 -11.724 1.00 99.99 C ATOM 297 CE3 TRP A 41 -5.298 3.764 -10.354 1.00 99.99 C ATOM 298 CZ2 TRP A 41 -5.044 1.606 -12.196 1.00 99.99 C ATOM 299 CZ3 TRP A 41 -6.424 3.100 -10.845 1.00 99.99 C ATOM 300 CH2 TRP A 41 -6.307 2.033 -11.753 1.00 99.99 C ATOM 0 H TRP A 41 -1.609 7.072 -8.494 1.00 99.99 H new ATOM 0 HA TRP A 41 -1.249 6.062 -11.082 1.00 99.99 H new ATOM 0 HB2 TRP A 41 -1.449 4.655 -9.028 1.00 99.99 H new ATOM 0 HB3 TRP A 41 -3.139 5.102 -8.894 1.00 99.99 H new ATOM 0 HD1 TRP A 41 -0.801 3.123 -11.302 1.00 99.99 H new ATOM 0 HE1 TRP A 41 -2.185 1.330 -12.537 1.00 99.99 H new ATOM 0 HE3 TRP A 41 -5.389 4.580 -9.652 1.00 99.99 H new ATOM 0 HZ2 TRP A 41 -4.949 0.781 -12.887 1.00 99.99 H new ATOM 0 HZ3 TRP A 41 -7.405 3.413 -10.520 1.00 99.99 H new ATOM 0 HH2 TRP A 41 -7.196 1.537 -12.113 1.00 99.99 H new ATOM 311 N ILE A 42 -4.205 7.213 -10.267 1.00 99.99 N ATOM 312 CA ILE A 42 -5.513 7.638 -10.754 1.00 99.99 C ATOM 313 C ILE A 42 -5.329 8.729 -11.799 1.00 99.99 C ATOM 314 O ILE A 42 -6.001 8.700 -12.800 1.00 99.99 O ATOM 315 CB ILE A 42 -6.394 8.238 -9.653 1.00 99.99 C ATOM 316 CG1 ILE A 42 -6.863 7.129 -8.683 1.00 99.99 C ATOM 317 CG2 ILE A 42 -7.613 8.968 -10.259 1.00 99.99 C ATOM 318 CD1 ILE A 42 -7.675 7.656 -7.490 1.00 99.99 C ATOM 0 H ILE A 42 -4.044 7.412 -9.280 1.00 99.99 H new ATOM 0 HA ILE A 42 -5.996 6.746 -11.153 1.00 99.99 H new ATOM 0 HB ILE A 42 -5.801 8.966 -9.099 1.00 99.99 H new ATOM 0 HG12 ILE A 42 -7.468 6.409 -9.234 1.00 99.99 H new ATOM 0 HG13 ILE A 42 -5.991 6.593 -8.309 1.00 99.99 H new ATOM 0 HG21 ILE A 42 -8.223 9.385 -9.458 1.00 99.99 H new ATOM 0 HG22 ILE A 42 -7.269 9.772 -10.909 1.00 99.99 H new ATOM 0 HG23 ILE A 42 -8.209 8.262 -10.838 1.00 99.99 H new ATOM 0 HD11 ILE A 42 -7.970 6.822 -6.853 1.00 99.99 H new ATOM 0 HD12 ILE A 42 -7.066 8.354 -6.915 1.00 99.99 H new ATOM 0 HD13 ILE A 42 -8.566 8.167 -7.854 1.00 99.99 H new ATOM 330 N LEU A 43 -4.473 9.620 -11.542 1.00 99.99 N ATOM 331 CA LEU A 43 -4.215 10.737 -12.442 1.00 99.99 C ATOM 332 C LEU A 43 -3.625 10.210 -13.742 1.00 99.99 C ATOM 333 O LEU A 43 -3.925 10.743 -14.780 1.00 99.99 O ATOM 334 CB LEU A 43 -3.196 11.735 -11.877 1.00 99.99 C ATOM 335 CG LEU A 43 -3.708 12.554 -10.669 1.00 99.99 C ATOM 336 CD1 LEU A 43 -2.544 13.319 -10.013 1.00 99.99 C ATOM 337 CD2 LEU A 43 -4.822 13.534 -11.068 1.00 99.99 C ATOM 0 H LEU A 43 -3.903 9.627 -10.696 1.00 99.99 H new ATOM 0 HA LEU A 43 -5.170 11.242 -12.586 1.00 99.99 H new ATOM 0 HB2 LEU A 43 -2.300 11.191 -11.578 1.00 99.99 H new ATOM 0 HB3 LEU A 43 -2.902 12.424 -12.669 1.00 99.99 H new ATOM 0 HG LEU A 43 -4.130 11.849 -9.953 1.00 99.99 H new ATOM 0 HD11 LEU A 43 -2.918 13.892 -9.164 1.00 99.99 H new ATOM 0 HD12 LEU A 43 -1.791 12.610 -9.669 1.00 99.99 H new ATOM 0 HD13 LEU A 43 -2.099 13.998 -10.741 1.00 99.99 H new ATOM 0 HD21 LEU A 43 -5.151 14.088 -10.189 1.00 99.99 H new ATOM 0 HD22 LEU A 43 -4.443 14.231 -11.815 1.00 99.99 H new ATOM 0 HD23 LEU A 43 -5.663 12.979 -11.483 1.00 99.99 H new ATOM 349 N ASP A 44 -2.831 9.234 -13.647 1.00 99.99 N ATOM 350 CA ASP A 44 -2.173 8.647 -14.806 1.00 99.99 C ATOM 351 C ASP A 44 -3.216 7.981 -15.694 1.00 99.99 C ATOM 352 O ASP A 44 -3.129 8.101 -16.891 1.00 99.99 O ATOM 353 CB ASP A 44 -1.162 7.554 -14.433 1.00 99.99 C ATOM 354 CG ASP A 44 -0.409 7.004 -15.659 1.00 99.99 C ATOM 355 OD1 ASP A 44 0.376 7.770 -16.268 1.00 99.99 O ATOM 356 OD2 ASP A 44 -0.563 5.790 -15.986 1.00 99.99 O ATOM 0 H ASP A 44 -2.592 8.786 -12.762 1.00 99.99 H new ATOM 0 HA ASP A 44 -1.650 9.463 -15.305 1.00 99.99 H new ATOM 0 HB2 ASP A 44 -0.443 7.957 -13.720 1.00 99.99 H new ATOM 0 HB3 ASP A 44 -1.683 6.737 -13.934 1.00 99.99 H new ATOM 361 N ARG A 45 -4.121 7.327 -15.109 1.00 99.99 N ATOM 362 CA ARG A 45 -5.169 6.620 -15.836 1.00 99.99 C ATOM 363 C ARG A 45 -6.024 7.624 -16.594 1.00 99.99 C ATOM 364 O ARG A 45 -6.329 7.388 -17.735 1.00 99.99 O ATOM 365 CB ARG A 45 -6.123 5.852 -14.911 1.00 99.99 C ATOM 366 CG ARG A 45 -5.448 4.696 -14.144 1.00 99.99 C ATOM 367 CD ARG A 45 -5.179 3.466 -15.022 1.00 99.99 C ATOM 368 NE ARG A 45 -3.779 3.565 -15.570 1.00 99.99 N ATOM 369 CZ ARG A 45 -3.414 2.895 -16.679 1.00 99.99 C ATOM 370 NH1 ARG A 45 -4.273 2.092 -17.331 1.00 99.99 N ATOM 371 NH2 ARG A 45 -2.149 3.019 -17.112 1.00 99.99 N ATOM 0 H ARG A 45 -4.190 7.243 -14.095 1.00 99.99 H new ATOM 0 HA ARG A 45 -4.661 5.916 -16.495 1.00 99.99 H new ATOM 0 HB2 ARG A 45 -6.557 6.548 -14.193 1.00 99.99 H new ATOM 0 HB3 ARG A 45 -6.945 5.451 -15.504 1.00 99.99 H new ATOM 0 HG2 ARG A 45 -4.506 5.048 -13.724 1.00 99.99 H new ATOM 0 HG3 ARG A 45 -6.082 4.405 -13.306 1.00 99.99 H new ATOM 0 HD2 ARG A 45 -5.293 2.552 -14.439 1.00 99.99 H new ATOM 0 HD3 ARG A 45 -5.902 3.417 -15.836 1.00 99.99 H new ATOM 0 HE ARG A 45 -3.095 4.151 -15.092 1.00 99.99 H new ATOM 0 HH11 ARG A 45 -5.227 1.979 -16.987 1.00 99.99 H new ATOM 0 HH12 ARG A 45 -3.971 1.596 -18.169 1.00 99.99 H new ATOM 0 HH21 ARG A 45 -1.491 3.610 -16.603 1.00 99.99 H new ATOM 0 HH22 ARG A 45 -1.846 2.522 -17.950 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 -6.445 10.375 -17.684 1.00 99.99 C ATOM 388 O LEU A 46 -5.453 11.063 -17.450 1.00 99.99 O ATOM 389 CB LEU A 46 -7.595 10.797 -15.566 1.00 99.99 C ATOM 390 CG LEU A 46 -8.382 10.373 -14.301 1.00 99.99 C ATOM 391 CD1 LEU A 46 -8.446 11.578 -13.343 1.00 99.99 C ATOM 392 CD2 LEU A 46 -9.795 9.865 -14.607 1.00 99.99 C ATOM 0 H LEU A 46 -6.094 8.853 -15.000 1.00 99.99 H new ATOM 0 HA LEU A 46 -8.112 9.191 -16.905 1.00 99.99 H new ATOM 0 HB2 LEU A 46 -6.681 11.295 -15.243 1.00 99.99 H new ATOM 0 HB3 LEU A 46 -8.190 11.538 -16.100 1.00 99.99 H new ATOM 0 HG LEU A 46 -7.855 9.535 -13.845 1.00 99.99 H new ATOM 0 HD11 LEU A 46 -8.997 11.300 -12.445 1.00 99.99 H new ATOM 0 HD12 LEU A 46 -7.435 11.880 -13.070 1.00 99.99 H new ATOM 0 HD13 LEU A 46 -8.952 12.408 -13.836 1.00 99.99 H new ATOM 0 HD21 LEU A 46 -10.290 9.585 -13.677 1.00 99.99 H new ATOM 0 HD22 LEU A 46 -10.366 10.652 -15.100 1.00 99.99 H new ATOM 0 HD23 LEU A 46 -9.735 8.996 -15.262 1.00 99.99 H new ATOM 405 N SER B 22 -10.395 0.518 18.943 1.00 99.99 N ATOM 406 CA SER B 22 -10.116 1.252 17.676 1.00 99.99 C ATOM 407 C SER B 22 -8.656 1.593 17.532 1.00 99.99 C ATOM 408 O SER B 22 -7.863 1.421 18.459 1.00 99.99 O ATOM 409 CB SER B 22 -11.005 2.530 17.552 1.00 99.99 C ATOM 410 OG SER B 22 -10.754 3.491 18.575 1.00 99.99 O ATOM 0 HA SER B 22 -10.375 0.581 16.856 1.00 99.99 H new ATOM 0 HB2 SER B 22 -10.833 2.991 16.579 1.00 99.99 H new ATOM 0 HB3 SER B 22 -12.055 2.239 17.586 1.00 99.99 H new ATOM 0 HG SER B 22 -11.337 4.268 18.445 1.00 99.99 H new ATOM 415 N SER B 23 -8.279 2.098 16.333 1.00 99.99 N ATOM 416 CA SER B 23 -6.949 2.580 16.044 1.00 99.99 C ATOM 417 C SER B 23 -7.123 4.007 15.589 1.00 99.99 C ATOM 418 O SER B 23 -8.183 4.600 15.787 1.00 99.99 O ATOM 419 CB SER B 23 -6.228 1.734 14.965 1.00 99.99 C ATOM 420 OG SER B 23 -6.047 0.402 15.425 1.00 99.99 O ATOM 0 H SER B 23 -8.917 2.174 15.541 1.00 99.99 H new ATOM 0 HA SER B 23 -6.316 2.506 16.928 1.00 99.99 H new ATOM 0 HB2 SER B 23 -6.811 1.732 14.044 1.00 99.99 H new ATOM 0 HB3 SER B 23 -5.262 2.179 14.729 1.00 99.99 H new ATOM 0 HG SER B 23 -5.592 -0.124 14.734 1.00 99.99 H new ATOM 426 N ASP B 24 -6.062 4.608 14.990 1.00 99.99 N ATOM 427 CA ASP B 24 -6.026 6.014 14.630 1.00 99.99 C ATOM 428 C ASP B 24 -6.627 6.174 13.250 1.00 99.99 C ATOM 429 O ASP B 24 -6.567 5.222 12.480 1.00 99.99 O ATOM 430 CB ASP B 24 -4.576 6.572 14.600 1.00 99.99 C ATOM 431 CG ASP B 24 -3.914 6.497 15.980 1.00 99.99 C ATOM 432 OD1 ASP B 24 -4.642 6.411 17.006 1.00 99.99 O ATOM 433 OD2 ASP B 24 -2.655 6.536 16.021 1.00 99.99 O ATOM 0 H ASP B 24 -5.207 4.107 14.749 1.00 99.99 H new ATOM 0 HA ASP B 24 -6.588 6.568 15.381 1.00 99.99 H new ATOM 0 HB2 ASP B 24 -3.983 6.008 13.880 1.00 99.99 H new ATOM 0 HB3 ASP B 24 -4.591 7.607 14.259 1.00 99.99 H new ATOM 438 N PRO B 25 -7.231 7.303 12.871 1.00 99.99 N ATOM 439 CA PRO B 25 -8.113 7.372 11.715 1.00 99.99 C ATOM 440 C PRO B 25 -7.365 7.349 10.401 1.00 99.99 C ATOM 441 O PRO B 25 -7.968 6.931 9.424 1.00 99.99 O ATOM 442 CB PRO B 25 -8.877 8.695 11.887 1.00 99.99 C ATOM 443 CG PRO B 25 -7.969 9.544 12.780 1.00 99.99 C ATOM 444 CD PRO B 25 -7.341 8.501 13.701 1.00 99.99 C ATOM 0 HA PRO B 25 -8.770 6.503 11.675 1.00 99.99 H new ATOM 0 HB2 PRO B 25 -9.055 9.179 10.927 1.00 99.99 H new ATOM 0 HB3 PRO B 25 -9.851 8.534 12.349 1.00 99.99 H new ATOM 0 HG2 PRO B 25 -7.217 10.080 12.201 1.00 99.99 H new ATOM 0 HG3 PRO B 25 -8.533 10.291 13.338 1.00 99.99 H new ATOM 0 HD2 PRO B 25 -6.365 8.826 14.062 1.00 99.99 H new ATOM 0 HD3 PRO B 25 -7.962 8.321 14.579 1.00 99.99 H new ATOM 452 N LEU B 26 -6.089 7.796 10.358 1.00 99.99 N ATOM 453 CA LEU B 26 -5.167 7.746 9.231 1.00 99.99 C ATOM 454 C LEU B 26 -4.717 6.309 9.010 1.00 99.99 C ATOM 455 O LEU B 26 -4.655 5.883 7.885 1.00 99.99 O ATOM 456 CB LEU B 26 -3.891 8.567 9.466 1.00 99.99 C ATOM 457 CG LEU B 26 -2.764 8.394 8.422 1.00 99.99 C ATOM 458 CD1 LEU B 26 -3.170 8.880 7.028 1.00 99.99 C ATOM 459 CD2 LEU B 26 -1.489 9.107 8.894 1.00 99.99 C ATOM 0 H LEU B 26 -5.659 8.230 11.175 1.00 99.99 H new ATOM 0 HA LEU B 26 -5.707 8.156 8.377 1.00 99.99 H new ATOM 0 HB2 LEU B 26 -4.164 9.621 9.503 1.00 99.99 H new ATOM 0 HB3 LEU B 26 -3.492 8.307 10.446 1.00 99.99 H new ATOM 0 HG LEU B 26 -2.568 7.325 8.336 1.00 99.99 H new ATOM 0 HD11 LEU B 26 -2.341 8.734 6.336 1.00 99.99 H new ATOM 0 HD12 LEU B 26 -4.035 8.313 6.683 1.00 99.99 H new ATOM 0 HD13 LEU B 26 -3.424 9.939 7.072 1.00 99.99 H new ATOM 0 HD21 LEU B 26 -0.703 8.978 8.150 1.00 99.99 H new ATOM 0 HD22 LEU B 26 -1.694 10.170 9.025 1.00 99.99 H new ATOM 0 HD23 LEU B 26 -1.164 8.681 9.843 1.00 99.99 H new ATOM 471 N VAL B 27 -4.427 5.645 10.044 1.00 99.99 N ATOM 472 CA VAL B 27 -3.959 4.265 9.978 1.00 99.99 C ATOM 473 C VAL B 27 -5.075 3.379 9.445 1.00 99.99 C ATOM 474 O VAL B 27 -4.821 2.569 8.590 1.00 99.99 O ATOM 475 CB VAL B 27 -3.575 3.699 11.352 1.00 99.99 C ATOM 476 CG1 VAL B 27 -3.205 2.207 11.243 1.00 99.99 C ATOM 477 CG2 VAL B 27 -2.371 4.486 11.916 1.00 99.99 C ATOM 0 H VAL B 27 -4.496 6.016 10.991 1.00 99.99 H new ATOM 0 HA VAL B 27 -3.080 4.271 9.333 1.00 99.99 H new ATOM 0 HB VAL B 27 -4.430 3.799 12.020 1.00 99.99 H new ATOM 0 HG11 VAL B 27 -2.936 1.826 12.228 1.00 99.99 H new ATOM 0 HG12 VAL B 27 -4.058 1.648 10.858 1.00 99.99 H new ATOM 0 HG13 VAL B 27 -2.359 2.090 10.566 1.00 99.99 H new ATOM 0 HG21 VAL B 27 -2.098 4.084 12.892 1.00 99.99 H new ATOM 0 HG22 VAL B 27 -1.524 4.393 11.236 1.00 99.99 H new ATOM 0 HG23 VAL B 27 -2.640 5.537 12.019 1.00 99.99 H new ATOM 487 N VAL B 28 -6.220 3.549 9.949 1.00 99.99 N ATOM 488 CA VAL B 28 -7.374 2.752 9.552 1.00 99.99 C ATOM 489 C VAL B 28 -7.776 3.122 8.133 1.00 99.99 C ATOM 490 O VAL B 28 -8.049 2.244 7.353 1.00 99.99 O ATOM 491 CB VAL B 28 -8.605 3.004 10.432 1.00 99.99 C ATOM 492 CG1 VAL B 28 -9.849 2.281 9.876 1.00 99.99 C ATOM 493 CG2 VAL B 28 -8.320 2.536 11.873 1.00 99.99 C ATOM 0 H VAL B 28 -6.423 4.248 10.664 1.00 99.99 H new ATOM 0 HA VAL B 28 -7.073 1.709 9.647 1.00 99.99 H new ATOM 0 HB VAL B 28 -8.812 4.074 10.431 1.00 99.99 H new ATOM 0 HG11 VAL B 28 -10.704 2.479 10.522 1.00 99.99 H new ATOM 0 HG12 VAL B 28 -10.062 2.644 8.871 1.00 99.99 H new ATOM 0 HG13 VAL B 28 -9.661 1.208 9.842 1.00 99.99 H new ATOM 0 HG21 VAL B 28 -9.197 2.717 12.494 1.00 99.99 H new ATOM 0 HG22 VAL B 28 -8.090 1.470 11.871 1.00 99.99 H new ATOM 0 HG23 VAL B 28 -7.471 3.089 12.274 1.00 99.99 H new ATOM 503 N ALA B 29 -7.807 4.352 7.858 1.00 99.99 N ATOM 504 CA ALA B 29 -8.202 4.851 6.544 1.00 99.99 C ATOM 505 C ALA B 29 -7.235 4.319 5.495 1.00 99.99 C ATOM 506 O ALA B 29 -7.675 3.924 4.443 1.00 99.99 O ATOM 507 CB ALA B 29 -8.148 6.380 6.444 1.00 99.99 C ATOM 0 H ALA B 29 -7.562 5.085 8.524 1.00 99.99 H new ATOM 0 HA ALA B 29 -9.227 4.517 6.385 1.00 99.99 H new ATOM 0 HB1 ALA B 29 -8.452 6.690 5.444 1.00 99.99 H new ATOM 0 HB2 ALA B 29 -8.822 6.817 7.181 1.00 99.99 H new ATOM 0 HB3 ALA B 29 -7.131 6.721 6.636 1.00 99.99 H new ATOM 513 N ALA B 30 -6.010 4.332 5.796 1.00 99.99 N ATOM 514 CA ALA B 30 -4.976 3.876 4.876 1.00 99.99 C ATOM 515 C ALA B 30 -5.176 2.397 4.583 1.00 99.99 C ATOM 516 O ALA B 30 -4.923 1.980 3.480 1.00 99.99 O ATOM 517 CB ALA B 30 -3.560 4.014 5.454 1.00 99.99 C ATOM 0 H ALA B 30 -5.653 4.658 6.694 1.00 99.99 H new ATOM 0 HA ALA B 30 -5.065 4.498 3.986 1.00 99.99 H new ATOM 0 HB1 ALA B 30 -2.833 3.659 4.724 1.00 99.99 H new ATOM 0 HB2 ALA B 30 -3.361 5.061 5.684 1.00 99.99 H new ATOM 0 HB3 ALA B 30 -3.479 3.421 6.365 1.00 99.99 H new ATOM 523 N SER B 31 -5.601 1.687 5.534 1.00 99.99 N ATOM 524 CA SER B 31 -5.815 0.251 5.401 1.00 99.99 C ATOM 525 C SER B 31 -6.882 -0.003 4.346 1.00 99.99 C ATOM 526 O SER B 31 -6.684 -0.840 3.502 1.00 99.99 O ATOM 527 CB SER B 31 -6.320 -0.401 6.694 1.00 99.99 C ATOM 528 OG SER B 31 -5.328 -0.333 7.717 1.00 99.99 O ATOM 0 H SER B 31 -5.825 2.057 6.458 1.00 99.99 H new ATOM 0 HA SER B 31 -4.849 -0.179 5.137 1.00 99.99 H new ATOM 0 HB2 SER B 31 -7.228 0.100 7.028 1.00 99.99 H new ATOM 0 HB3 SER B 31 -6.582 -1.442 6.504 1.00 99.99 H new ATOM 0 HG SER B 31 -5.198 0.601 7.985 1.00 99.99 H new ATOM 534 N ILE B 32 -7.934 0.689 4.430 1.00 99.99 N ATOM 535 CA ILE B 32 -9.047 0.532 3.502 1.00 99.99 C ATOM 536 C ILE B 32 -8.604 0.941 2.105 1.00 99.99 C ATOM 537 O ILE B 32 -9.011 0.323 1.157 1.00 99.99 O ATOM 538 CB ILE B 32 -10.247 1.422 3.854 1.00 99.99 C ATOM 539 CG1 ILE B 32 -10.859 0.983 5.202 1.00 99.99 C ATOM 540 CG2 ILE B 32 -11.318 1.366 2.745 1.00 99.99 C ATOM 541 CD1 ILE B 32 -11.820 2.023 5.793 1.00 99.99 C ATOM 0 H ILE B 32 -8.085 1.402 5.144 1.00 99.99 H new ATOM 0 HA ILE B 32 -9.346 -0.515 3.559 1.00 99.99 H new ATOM 0 HB ILE B 32 -9.895 2.450 3.940 1.00 99.99 H new ATOM 0 HG12 ILE B 32 -11.392 0.042 5.063 1.00 99.99 H new ATOM 0 HG13 ILE B 32 -10.056 0.793 5.914 1.00 99.99 H new ATOM 0 HG21 ILE B 32 -12.158 2.005 3.018 1.00 99.99 H new ATOM 0 HG22 ILE B 32 -10.888 1.714 1.806 1.00 99.99 H new ATOM 0 HG23 ILE B 32 -11.666 0.340 2.627 1.00 99.99 H new ATOM 0 HD11 ILE B 32 -12.216 1.656 6.740 1.00 99.99 H new ATOM 0 HD12 ILE B 32 -11.285 2.958 5.962 1.00 99.99 H new ATOM 0 HD13 ILE B 32 -12.642 2.195 5.098 1.00 99.99 H new ATOM 553 N ILE B 33 -7.824 1.929 2.031 1.00 99.99 N ATOM 554 CA ILE B 33 -7.339 2.448 0.756 1.00 99.99 C ATOM 555 C ILE B 33 -6.555 1.361 0.035 1.00 99.99 C ATOM 556 O ILE B 33 -6.763 1.168 -1.135 1.00 99.99 O ATOM 557 CB ILE B 33 -6.380 3.636 0.918 1.00 99.99 C ATOM 558 CG1 ILE B 33 -7.219 4.924 1.106 1.00 99.99 C ATOM 559 CG2 ILE B 33 -5.420 3.774 -0.277 1.00 99.99 C ATOM 560 CD1 ILE B 33 -6.437 6.125 1.651 1.00 99.99 C ATOM 0 H ILE B 33 -7.476 2.435 2.845 1.00 99.99 H new ATOM 0 HA ILE B 33 -8.221 2.772 0.204 1.00 99.99 H new ATOM 0 HB ILE B 33 -5.755 3.466 1.794 1.00 99.99 H new ATOM 0 HG12 ILE B 33 -7.658 5.199 0.147 1.00 99.99 H new ATOM 0 HG13 ILE B 33 -8.045 4.708 1.784 1.00 99.99 H new ATOM 0 HG21 ILE B 33 -4.761 4.628 -0.118 1.00 99.99 H new ATOM 0 HG22 ILE B 33 -4.823 2.867 -0.371 1.00 99.99 H new ATOM 0 HG23 ILE B 33 -5.995 3.925 -1.190 1.00 99.99 H new ATOM 0 HD11 ILE B 33 -7.106 6.980 1.749 1.00 99.99 H new ATOM 0 HD12 ILE B 33 -6.021 5.876 2.627 1.00 99.99 H new ATOM 0 HD13 ILE B 33 -5.628 6.374 0.964 1.00 99.99 H new ATOM 572 N GLY B 34 -5.717 0.719 0.726 1.00 99.99 N ATOM 573 CA GLY B 34 -4.880 -0.334 0.157 1.00 99.99 C ATOM 574 C GLY B 34 -5.758 -1.498 -0.272 1.00 99.99 C ATOM 575 O GLY B 34 -5.468 -2.112 -1.268 1.00 99.99 O ATOM 0 H GLY B 34 -5.561 0.883 1.721 1.00 99.99 H new ATOM 0 HA2 GLY B 34 -4.323 0.050 -0.698 1.00 99.99 H new ATOM 0 HA3 GLY B 34 -4.147 -0.668 0.891 1.00 99.99 H new ATOM 579 N ILE B 35 -7.036 -1.445 0.069 1.00 99.99 N ATOM 580 CA ILE B 35 -7.905 -2.489 -0.466 1.00 99.99 C ATOM 581 C ILE B 35 -8.601 -1.975 -1.716 1.00 99.99 C ATOM 582 O ILE B 35 -8.624 -2.671 -2.699 1.00 99.99 O ATOM 583 CB ILE B 35 -9.016 -2.898 0.510 1.00 99.99 C ATOM 584 CG1 ILE B 35 -8.405 -3.428 1.832 1.00 99.99 C ATOM 585 CG2 ILE B 35 -9.913 -3.974 -0.138 1.00 99.99 C ATOM 586 CD1 ILE B 35 -9.398 -3.571 2.989 1.00 99.99 C ATOM 0 H ILE B 35 -7.474 -0.746 0.669 1.00 99.99 H new ATOM 0 HA ILE B 35 -7.264 -3.348 -0.663 1.00 99.99 H new ATOM 0 HB ILE B 35 -9.624 -2.023 0.740 1.00 99.99 H new ATOM 0 HG12 ILE B 35 -7.950 -4.400 1.641 1.00 99.99 H new ATOM 0 HG13 ILE B 35 -7.604 -2.756 2.140 1.00 99.99 H new ATOM 0 HG21 ILE B 35 -10.700 -4.260 0.560 1.00 99.99 H new ATOM 0 HG22 ILE B 35 -10.362 -3.574 -1.047 1.00 99.99 H new ATOM 0 HG23 ILE B 35 -9.311 -4.849 -0.385 1.00 99.99 H new ATOM 0 HD11 ILE B 35 -8.878 -3.948 3.870 1.00 99.99 H new ATOM 0 HD12 ILE B 35 -9.836 -2.599 3.214 1.00 99.99 H new ATOM 0 HD13 ILE B 35 -10.187 -4.268 2.707 1.00 99.99 H new ATOM 598 N LEU B 36 -9.121 -0.828 -1.642 1.00 99.99 N ATOM 599 CA LEU B 36 -9.843 -0.225 -2.757 1.00 99.99 C ATOM 600 C LEU B 36 -8.914 -0.119 -3.957 1.00 99.99 C ATOM 601 O LEU B 36 -9.338 -0.394 -5.051 1.00 99.99 O ATOM 602 CB LEU B 36 -10.323 1.201 -2.455 1.00 99.99 C ATOM 603 CG LEU B 36 -10.978 1.945 -3.638 1.00 99.99 C ATOM 604 CD1 LEU B 36 -12.261 1.238 -4.096 1.00 99.99 C ATOM 605 CD2 LEU B 36 -11.260 3.409 -3.278 1.00 99.99 C ATOM 0 H LEU B 36 -9.078 -0.242 -0.809 1.00 99.99 H new ATOM 0 HA LEU B 36 -10.707 -0.863 -2.945 1.00 99.99 H new ATOM 0 HB2 LEU B 36 -11.039 1.159 -1.634 1.00 99.99 H new ATOM 0 HB3 LEU B 36 -9.472 1.786 -2.107 1.00 99.99 H new ATOM 0 HG LEU B 36 -10.273 1.931 -4.470 1.00 99.99 H new ATOM 0 HD11 LEU B 36 -12.700 1.785 -4.930 1.00 99.99 H new ATOM 0 HD12 LEU B 36 -12.024 0.222 -4.413 1.00 99.99 H new ATOM 0 HD13 LEU B 36 -12.972 1.204 -3.271 1.00 99.99 H new ATOM 0 HD21 LEU B 36 -11.721 3.910 -4.129 1.00 99.99 H new ATOM 0 HD22 LEU B 36 -11.935 3.450 -2.423 1.00 99.99 H new ATOM 0 HD23 LEU B 36 -10.324 3.908 -3.026 1.00 99.99 H new ATOM 617 N HIS B 37 -7.645 0.304 -3.753 1.00 99.99 N ATOM 618 CA HIS B 37 -6.662 0.502 -4.791 1.00 99.99 C ATOM 619 C HIS B 37 -6.365 -0.803 -5.480 1.00 99.99 C ATOM 620 O HIS B 37 -6.037 -0.827 -6.665 1.00 99.99 O ATOM 621 CB HIS B 37 -5.344 1.078 -4.218 1.00 99.99 C ATOM 622 CG HIS B 37 -4.338 1.483 -5.264 1.00 99.99 C ATOM 623 ND1 HIS B 37 -3.021 1.710 -4.968 1.00 99.99 N ATOM 624 CD2 HIS B 37 -4.500 1.746 -6.583 1.00 99.99 C ATOM 625 CE1 HIS B 37 -2.402 2.088 -6.078 1.00 99.99 C ATOM 626 NE2 HIS B 37 -3.278 2.117 -7.073 1.00 99.99 N ATOM 0 H HIS B 37 -7.286 0.518 -2.823 1.00 99.99 H new ATOM 0 HA HIS B 37 -7.077 1.215 -5.504 1.00 99.99 H new ATOM 0 HB2 HIS B 37 -5.578 1.945 -3.601 1.00 99.99 H new ATOM 0 HB3 HIS B 37 -4.890 0.334 -3.563 1.00 99.99 H new ATOM 0 HD2 HIS B 37 -5.421 1.676 -7.143 1.00 99.99 H new ATOM 0 HE1 HIS B 37 -1.353 2.333 -6.159 1.00 99.99 H new ATOM 0 HE2 HIS B 37 -3.075 2.373 -8.039 1.00 99.99 H new ATOM 634 N LEU B 38 -6.519 -1.927 -4.740 1.00 99.99 N ATOM 635 CA LEU B 38 -6.284 -3.268 -5.263 1.00 99.99 C ATOM 636 C LEU B 38 -7.410 -3.641 -6.216 1.00 99.99 C ATOM 637 O LEU B 38 -7.140 -4.169 -7.265 1.00 99.99 O ATOM 638 CB LEU B 38 -6.269 -4.344 -4.169 1.00 99.99 C ATOM 639 CG LEU B 38 -6.046 -5.775 -4.715 1.00 99.99 C ATOM 640 CD1 LEU B 38 -4.715 -5.895 -5.470 1.00 99.99 C ATOM 641 CD2 LEU B 38 -6.129 -6.832 -3.613 1.00 99.99 C ATOM 0 H LEU B 38 -6.811 -1.915 -3.763 1.00 99.99 H new ATOM 0 HA LEU B 38 -5.309 -3.239 -5.750 1.00 99.99 H new ATOM 0 HB2 LEU B 38 -5.482 -4.111 -3.451 1.00 99.99 H new ATOM 0 HB3 LEU B 38 -7.214 -4.313 -3.627 1.00 99.99 H new ATOM 0 HG LEU B 38 -6.856 -5.963 -5.419 1.00 99.99 H new ATOM 0 HD11 LEU B 38 -4.596 -6.914 -5.837 1.00 99.99 H new ATOM 0 HD12 LEU B 38 -4.711 -5.203 -6.312 1.00 99.99 H new ATOM 0 HD13 LEU B 38 -3.892 -5.653 -4.797 1.00 99.99 H new ATOM 0 HD21 LEU B 38 -5.966 -7.820 -4.044 1.00 99.99 H new ATOM 0 HD22 LEU B 38 -5.366 -6.634 -2.861 1.00 99.99 H new ATOM 0 HD23 LEU B 38 -7.114 -6.797 -3.148 1.00 99.99 H new ATOM 653 N ILE B 39 -8.581 -3.372 -5.837 1.00 99.99 N ATOM 654 CA ILE B 39 -9.757 -3.698 -6.638 1.00 99.99 C ATOM 655 C ILE B 39 -9.748 -2.858 -7.906 1.00 99.99 C ATOM 656 O ILE B 39 -10.025 -3.381 -8.957 1.00 99.99 O ATOM 657 CB ILE B 39 -11.076 -3.384 -5.920 1.00 99.99 C ATOM 658 CG1 ILE B 39 -11.253 -4.328 -4.710 1.00 99.99 C ATOM 659 CG2 ILE B 39 -12.263 -3.526 -6.895 1.00 99.99 C ATOM 660 CD1 ILE B 39 -12.452 -3.975 -3.819 1.00 99.99 C ATOM 0 H ILE B 39 -8.795 -2.911 -4.952 1.00 99.99 H new ATOM 0 HA ILE B 39 -9.704 -4.768 -6.838 1.00 99.99 H new ATOM 0 HB ILE B 39 -11.048 -2.355 -5.561 1.00 99.99 H new ATOM 0 HG12 ILE B 39 -11.370 -5.350 -5.072 1.00 99.99 H new ATOM 0 HG13 ILE B 39 -10.345 -4.305 -4.107 1.00 99.99 H new ATOM 0 HG21 ILE B 39 -13.192 -3.300 -6.372 1.00 99.99 H new ATOM 0 HG22 ILE B 39 -12.136 -2.832 -7.726 1.00 99.99 H new ATOM 0 HG23 ILE B 39 -12.300 -4.546 -7.277 1.00 99.99 H new ATOM 0 HD11 ILE B 39 -12.511 -4.682 -2.991 1.00 99.99 H new ATOM 0 HD12 ILE B 39 -12.329 -2.966 -3.426 1.00 99.99 H new ATOM 0 HD13 ILE B 39 -13.369 -4.026 -4.406 1.00 99.99 H new ATOM 672 N LEU B 40 -9.455 -1.640 -7.776 1.00 99.99 N ATOM 673 CA LEU B 40 -9.433 -0.715 -8.902 1.00 99.99 C ATOM 674 C LEU B 40 -8.421 -1.195 -9.930 1.00 99.99 C ATOM 675 O LEU B 40 -8.720 -1.180 -11.098 1.00 99.99 O ATOM 676 CB LEU B 40 -9.004 0.703 -8.504 1.00 99.99 C ATOM 677 CG LEU B 40 -10.025 1.496 -7.658 1.00 99.99 C ATOM 678 CD1 LEU B 40 -9.414 2.847 -7.239 1.00 99.99 C ATOM 679 CD2 LEU B 40 -11.346 1.728 -8.405 1.00 99.99 C ATOM 0 H LEU B 40 -9.213 -1.212 -6.883 1.00 99.99 H new ATOM 0 HA LEU B 40 -10.451 -0.687 -9.291 1.00 99.99 H new ATOM 0 HB2 LEU B 40 -8.070 0.638 -7.946 1.00 99.99 H new ATOM 0 HB3 LEU B 40 -8.794 1.268 -9.412 1.00 99.99 H new ATOM 0 HG LEU B 40 -10.253 0.900 -6.775 1.00 99.99 H new ATOM 0 HD11 LEU B 40 -10.137 3.404 -6.643 1.00 99.99 H new ATOM 0 HD12 LEU B 40 -8.514 2.672 -6.649 1.00 99.99 H new ATOM 0 HD13 LEU B 40 -9.158 3.422 -8.129 1.00 99.99 H new ATOM 0 HD21 LEU B 40 -12.030 2.289 -7.769 1.00 99.99 H new ATOM 0 HD22 LEU B 40 -11.154 2.292 -9.318 1.00 99.99 H new ATOM 0 HD23 LEU B 40 -11.793 0.767 -8.660 1.00 99.99 H new ATOM 691 N TRP B 41 -7.306 -1.586 -9.486 1.00 99.99 N ATOM 692 CA TRP B 41 -6.234 -2.047 -10.360 1.00 99.99 C ATOM 693 C TRP B 41 -6.649 -3.357 -11.014 1.00 99.99 C ATOM 694 O TRP B 41 -6.418 -3.528 -12.184 1.00 99.99 O ATOM 695 CB TRP B 41 -4.929 -2.332 -9.606 1.00 99.99 C ATOM 696 CG TRP B 41 -3.766 -2.711 -10.505 1.00 99.99 C ATOM 697 CD1 TRP B 41 -3.003 -1.873 -11.258 1.00 99.99 C ATOM 698 CD2 TRP B 41 -3.331 -4.048 -10.807 1.00 99.99 C ATOM 699 NE1 TRP B 41 -2.063 -2.583 -11.950 1.00 99.99 N ATOM 700 CE2 TRP B 41 -2.270 -3.922 -11.724 1.00 99.99 C ATOM 701 CE3 TRP B 41 -3.764 -5.298 -10.354 1.00 99.99 C ATOM 702 CZ2 TRP B 41 -1.606 -5.044 -12.196 1.00 99.99 C ATOM 703 CZ3 TRP B 41 -3.100 -6.424 -10.845 1.00 99.99 C ATOM 704 CH2 TRP B 41 -2.033 -6.307 -11.753 1.00 99.99 C ATOM 0 H TRP B 41 -7.072 -1.609 -8.494 1.00 99.99 H new ATOM 0 HA TRP B 41 -6.062 -1.249 -11.082 1.00 99.99 H new ATOM 0 HB2 TRP B 41 -4.655 -1.449 -9.028 1.00 99.99 H new ATOM 0 HB3 TRP B 41 -5.102 -3.139 -8.894 1.00 99.99 H new ATOM 0 HD1 TRP B 41 -3.123 -0.801 -11.302 1.00 99.99 H new ATOM 0 HE1 TRP B 41 -1.330 -2.185 -12.537 1.00 99.99 H new ATOM 0 HE3 TRP B 41 -4.580 -5.389 -9.652 1.00 99.99 H new ATOM 0 HZ2 TRP B 41 -0.781 -4.949 -12.887 1.00 99.99 H new ATOM 0 HZ3 TRP B 41 -3.413 -7.405 -10.520 1.00 99.99 H new ATOM 0 HH2 TRP B 41 -1.537 -7.196 -12.113 1.00 99.99 H new ATOM 715 N ILE B 42 -7.213 -4.205 -10.267 1.00 99.99 N ATOM 716 CA ILE B 42 -7.638 -5.513 -10.754 1.00 99.99 C ATOM 717 C ILE B 42 -8.729 -5.329 -11.799 1.00 99.99 C ATOM 718 O ILE B 42 -8.700 -6.001 -12.800 1.00 99.99 O ATOM 719 CB ILE B 42 -8.238 -6.394 -9.653 1.00 99.99 C ATOM 720 CG1 ILE B 42 -7.129 -6.863 -8.683 1.00 99.99 C ATOM 721 CG2 ILE B 42 -8.968 -7.613 -10.259 1.00 99.99 C ATOM 722 CD1 ILE B 42 -7.656 -7.675 -7.490 1.00 99.99 C ATOM 0 H ILE B 42 -7.412 -4.044 -9.280 1.00 99.99 H new ATOM 0 HA ILE B 42 -6.746 -5.996 -11.153 1.00 99.99 H new ATOM 0 HB ILE B 42 -8.966 -5.801 -9.099 1.00 99.99 H new ATOM 0 HG12 ILE B 42 -6.409 -7.468 -9.234 1.00 99.99 H new ATOM 0 HG13 ILE B 42 -6.593 -5.991 -8.309 1.00 99.99 H new ATOM 0 HG21 ILE B 42 -9.385 -8.223 -9.458 1.00 99.99 H new ATOM 0 HG22 ILE B 42 -9.772 -7.269 -10.909 1.00 99.99 H new ATOM 0 HG23 ILE B 42 -8.262 -8.209 -10.838 1.00 99.99 H new ATOM 0 HD11 ILE B 42 -6.822 -7.970 -6.853 1.00 99.99 H new ATOM 0 HD12 ILE B 42 -8.354 -7.066 -6.915 1.00 99.99 H new ATOM 0 HD13 ILE B 42 -8.167 -8.566 -7.854 1.00 99.99 H new ATOM 734 N LEU B 43 -9.620 -4.473 -11.542 1.00 99.99 N ATOM 735 CA LEU B 43 -10.737 -4.215 -12.442 1.00 99.99 C ATOM 736 C LEU B 43 -10.210 -3.625 -13.742 1.00 99.99 C ATOM 737 O LEU B 43 -10.743 -3.925 -14.780 1.00 99.99 O ATOM 738 CB LEU B 43 -11.735 -3.196 -11.877 1.00 99.99 C ATOM 739 CG LEU B 43 -12.554 -3.708 -10.669 1.00 99.99 C ATOM 740 CD1 LEU B 43 -13.319 -2.544 -10.013 1.00 99.99 C ATOM 741 CD2 LEU B 43 -13.534 -4.822 -11.068 1.00 99.99 C ATOM 0 H LEU B 43 -9.627 -3.903 -10.696 1.00 99.99 H new ATOM 0 HA LEU B 43 -11.242 -5.170 -12.586 1.00 99.99 H new ATOM 0 HB2 LEU B 43 -11.191 -2.300 -11.578 1.00 99.99 H new ATOM 0 HB3 LEU B 43 -12.424 -2.902 -12.669 1.00 99.99 H new ATOM 0 HG LEU B 43 -11.849 -4.130 -9.953 1.00 99.99 H new ATOM 0 HD11 LEU B 43 -13.892 -2.918 -9.164 1.00 99.99 H new ATOM 0 HD12 LEU B 43 -12.610 -1.791 -9.669 1.00 99.99 H new ATOM 0 HD13 LEU B 43 -13.998 -2.099 -10.741 1.00 99.99 H new ATOM 0 HD21 LEU B 43 -14.088 -5.151 -10.189 1.00 99.99 H new ATOM 0 HD22 LEU B 43 -14.231 -4.443 -11.815 1.00 99.99 H new ATOM 0 HD23 LEU B 43 -12.979 -5.663 -11.483 1.00 99.99 H new ATOM 753 N ASP B 44 -9.234 -2.831 -13.647 1.00 99.99 N ATOM 754 CA ASP B 44 -8.647 -2.173 -14.806 1.00 99.99 C ATOM 755 C ASP B 44 -7.981 -3.216 -15.694 1.00 99.99 C ATOM 756 O ASP B 44 -8.101 -3.129 -16.891 1.00 99.99 O ATOM 757 CB ASP B 44 -7.554 -1.162 -14.433 1.00 99.99 C ATOM 758 CG ASP B 44 -7.004 -0.409 -15.659 1.00 99.99 C ATOM 759 OD1 ASP B 44 -7.770 0.376 -16.268 1.00 99.99 O ATOM 760 OD2 ASP B 44 -5.790 -0.563 -15.986 1.00 99.99 O ATOM 0 H ASP B 44 -8.786 -2.592 -12.762 1.00 99.99 H new ATOM 0 HA ASP B 44 -9.463 -1.650 -15.305 1.00 99.99 H new ATOM 0 HB2 ASP B 44 -7.957 -0.443 -13.720 1.00 99.99 H new ATOM 0 HB3 ASP B 44 -6.737 -1.683 -13.934 1.00 99.99 H new ATOM 765 N ARG B 45 -7.327 -4.121 -15.109 1.00 99.99 N ATOM 766 CA ARG B 45 -6.620 -5.169 -15.836 1.00 99.99 C ATOM 767 C ARG B 45 -7.624 -6.024 -16.594 1.00 99.99 C ATOM 768 O ARG B 45 -7.388 -6.329 -17.735 1.00 99.99 O ATOM 769 CB ARG B 45 -5.852 -6.123 -14.911 1.00 99.99 C ATOM 770 CG ARG B 45 -4.696 -5.448 -14.144 1.00 99.99 C ATOM 771 CD ARG B 45 -3.466 -5.179 -15.022 1.00 99.99 C ATOM 772 NE ARG B 45 -3.565 -3.779 -15.570 1.00 99.99 N ATOM 773 CZ ARG B 45 -2.895 -3.414 -16.679 1.00 99.99 C ATOM 774 NH1 ARG B 45 -2.092 -4.273 -17.331 1.00 99.99 N ATOM 775 NH2 ARG B 45 -3.019 -2.149 -17.112 1.00 99.99 N ATOM 0 H ARG B 45 -7.243 -4.190 -14.095 1.00 99.99 H new ATOM 0 HA ARG B 45 -5.916 -4.661 -16.495 1.00 99.99 H new ATOM 0 HB2 ARG B 45 -6.548 -6.557 -14.193 1.00 99.99 H new ATOM 0 HB3 ARG B 45 -5.451 -6.945 -15.504 1.00 99.99 H new ATOM 0 HG2 ARG B 45 -5.048 -4.506 -13.724 1.00 99.99 H new ATOM 0 HG3 ARG B 45 -4.405 -6.082 -13.306 1.00 99.99 H new ATOM 0 HD2 ARG B 45 -2.552 -5.293 -14.439 1.00 99.99 H new ATOM 0 HD3 ARG B 45 -3.417 -5.902 -15.836 1.00 99.99 H new ATOM 0 HE ARG B 45 -4.151 -3.095 -15.092 1.00 99.99 H new ATOM 0 HH11 ARG B 45 -1.979 -5.227 -16.987 1.00 99.99 H new ATOM 0 HH12 ARG B 45 -1.596 -3.971 -18.169 1.00 99.99 H new ATOM 0 HH21 ARG B 45 -3.610 -1.491 -16.603 1.00 99.99 H new ATOM 0 HH22 ARG B 45 -2.522 -1.846 -17.950 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 -10.375 -6.445 -17.684 1.00 99.99 C ATOM 792 O LEU B 46 -11.063 -5.453 -17.450 1.00 99.99 O ATOM 793 CB LEU B 46 -10.797 -7.595 -15.566 1.00 99.99 C ATOM 794 CG LEU B 46 -10.373 -8.382 -14.301 1.00 99.99 C ATOM 795 CD1 LEU B 46 -11.578 -8.446 -13.343 1.00 99.99 C ATOM 796 CD2 LEU B 46 -9.865 -9.795 -14.607 1.00 99.99 C ATOM 0 H LEU B 46 -8.853 -6.094 -15.000 1.00 99.99 H new ATOM 0 HA LEU B 46 -9.191 -8.112 -16.905 1.00 99.99 H new ATOM 0 HB2 LEU B 46 -11.295 -6.681 -15.243 1.00 99.99 H new ATOM 0 HB3 LEU B 46 -11.538 -8.190 -16.100 1.00 99.99 H new ATOM 0 HG LEU B 46 -9.535 -7.855 -13.845 1.00 99.99 H new ATOM 0 HD11 LEU B 46 -11.300 -8.997 -12.445 1.00 99.99 H new ATOM 0 HD12 LEU B 46 -11.880 -7.435 -13.070 1.00 99.99 H new ATOM 0 HD13 LEU B 46 -12.408 -8.952 -13.836 1.00 99.99 H new ATOM 0 HD21 LEU B 46 -9.585 -10.290 -13.677 1.00 99.99 H new ATOM 0 HD22 LEU B 46 -10.652 -10.366 -15.100 1.00 99.99 H new ATOM 0 HD23 LEU B 46 -8.996 -9.735 -15.262 1.00 99.99 H new ATOM 809 N SER C 22 -0.518 -10.395 18.943 1.00 99.99 N ATOM 810 CA SER C 22 -1.252 -10.116 17.676 1.00 99.99 C ATOM 811 C SER C 22 -1.593 -8.656 17.532 1.00 99.99 C ATOM 812 O SER C 22 -1.421 -7.863 18.459 1.00 99.99 O ATOM 813 CB SER C 22 -2.530 -11.005 17.552 1.00 99.99 C ATOM 814 OG SER C 22 -3.491 -10.754 18.575 1.00 99.99 O ATOM 0 HA SER C 22 -0.581 -10.375 16.856 1.00 99.99 H new ATOM 0 HB2 SER C 22 -2.991 -10.833 16.579 1.00 99.99 H new ATOM 0 HB3 SER C 22 -2.239 -12.055 17.586 1.00 99.99 H new ATOM 0 HG SER C 22 -4.268 -11.337 18.445 1.00 99.99 H new ATOM 819 N SER C 23 -2.098 -8.279 16.333 1.00 99.99 N ATOM 820 CA SER C 23 -2.580 -6.949 16.044 1.00 99.99 C ATOM 821 C SER C 23 -4.007 -7.123 15.589 1.00 99.99 C ATOM 822 O SER C 23 -4.600 -8.183 15.787 1.00 99.99 O ATOM 823 CB SER C 23 -1.734 -6.228 14.965 1.00 99.99 C ATOM 824 OG SER C 23 -0.402 -6.047 15.425 1.00 99.99 O ATOM 0 H SER C 23 -2.174 -8.917 15.541 1.00 99.99 H new ATOM 0 HA SER C 23 -2.506 -6.316 16.928 1.00 99.99 H new ATOM 0 HB2 SER C 23 -1.732 -6.811 14.044 1.00 99.99 H new ATOM 0 HB3 SER C 23 -2.179 -5.262 14.729 1.00 99.99 H new ATOM 0 HG SER C 23 0.124 -5.592 14.734 1.00 99.99 H new ATOM 830 N ASP C 24 -4.608 -6.062 14.990 1.00 99.99 N ATOM 831 CA ASP C 24 -6.014 -6.026 14.630 1.00 99.99 C ATOM 832 C ASP C 24 -6.174 -6.627 13.250 1.00 99.99 C ATOM 833 O ASP C 24 -5.222 -6.567 12.480 1.00 99.99 O ATOM 834 CB ASP C 24 -6.572 -4.576 14.600 1.00 99.99 C ATOM 835 CG ASP C 24 -6.497 -3.914 15.980 1.00 99.99 C ATOM 836 OD1 ASP C 24 -6.411 -4.642 17.006 1.00 99.99 O ATOM 837 OD2 ASP C 24 -6.536 -2.655 16.021 1.00 99.99 O ATOM 0 H ASP C 24 -4.107 -5.207 14.749 1.00 99.99 H new ATOM 0 HA ASP C 24 -6.568 -6.588 15.381 1.00 99.99 H new ATOM 0 HB2 ASP C 24 -6.008 -3.983 13.880 1.00 99.99 H new ATOM 0 HB3 ASP C 24 -7.607 -4.591 14.259 1.00 99.99 H new ATOM 842 N PRO C 25 -7.303 -7.231 12.871 1.00 99.99 N ATOM 843 CA PRO C 25 -7.372 -8.113 11.715 1.00 99.99 C ATOM 844 C PRO C 25 -7.349 -7.365 10.401 1.00 99.99 C ATOM 845 O PRO C 25 -6.931 -7.968 9.424 1.00 99.99 O ATOM 846 CB PRO C 25 -8.695 -8.877 11.887 1.00 99.99 C ATOM 847 CG PRO C 25 -9.544 -7.969 12.780 1.00 99.99 C ATOM 848 CD PRO C 25 -8.501 -7.341 13.701 1.00 99.99 C ATOM 0 HA PRO C 25 -6.503 -8.770 11.675 1.00 99.99 H new ATOM 0 HB2 PRO C 25 -9.179 -9.055 10.927 1.00 99.99 H new ATOM 0 HB3 PRO C 25 -8.534 -9.851 12.349 1.00 99.99 H new ATOM 0 HG2 PRO C 25 -10.080 -7.217 12.201 1.00 99.99 H new ATOM 0 HG3 PRO C 25 -10.291 -8.533 13.338 1.00 99.99 H new ATOM 0 HD2 PRO C 25 -8.826 -6.365 14.062 1.00 99.99 H new ATOM 0 HD3 PRO C 25 -8.321 -7.962 14.579 1.00 99.99 H new ATOM 856 N LEU C 26 -7.796 -6.089 10.358 1.00 99.99 N ATOM 857 CA LEU C 26 -7.746 -5.167 9.231 1.00 99.99 C ATOM 858 C LEU C 26 -6.309 -4.717 9.010 1.00 99.99 C ATOM 859 O LEU C 26 -5.883 -4.655 7.885 1.00 99.99 O ATOM 860 CB LEU C 26 -8.567 -3.891 9.466 1.00 99.99 C ATOM 861 CG LEU C 26 -8.394 -2.764 8.422 1.00 99.99 C ATOM 862 CD1 LEU C 26 -8.880 -3.170 7.028 1.00 99.99 C ATOM 863 CD2 LEU C 26 -9.107 -1.489 8.894 1.00 99.99 C ATOM 0 H LEU C 26 -8.230 -5.659 11.175 1.00 99.99 H new ATOM 0 HA LEU C 26 -8.156 -5.707 8.377 1.00 99.99 H new ATOM 0 HB2 LEU C 26 -9.621 -4.164 9.503 1.00 99.99 H new ATOM 0 HB3 LEU C 26 -8.307 -3.492 10.446 1.00 99.99 H new ATOM 0 HG LEU C 26 -7.325 -2.568 8.336 1.00 99.99 H new ATOM 0 HD11 LEU C 26 -8.734 -2.341 6.336 1.00 99.99 H new ATOM 0 HD12 LEU C 26 -8.313 -4.035 6.683 1.00 99.99 H new ATOM 0 HD13 LEU C 26 -9.939 -3.424 7.072 1.00 99.99 H new ATOM 0 HD21 LEU C 26 -8.978 -0.703 8.150 1.00 99.99 H new ATOM 0 HD22 LEU C 26 -10.170 -1.694 9.025 1.00 99.99 H new ATOM 0 HD23 LEU C 26 -8.681 -1.164 9.843 1.00 99.99 H new ATOM 875 N VAL C 27 -5.645 -4.427 10.044 1.00 99.99 N ATOM 876 CA VAL C 27 -4.265 -3.959 9.978 1.00 99.99 C ATOM 877 C VAL C 27 -3.379 -5.075 9.445 1.00 99.99 C ATOM 878 O VAL C 27 -2.569 -4.821 8.590 1.00 99.99 O ATOM 879 CB VAL C 27 -3.699 -3.575 11.352 1.00 99.99 C ATOM 880 CG1 VAL C 27 -2.207 -3.205 11.243 1.00 99.99 C ATOM 881 CG2 VAL C 27 -4.486 -2.371 11.916 1.00 99.99 C ATOM 0 H VAL C 27 -6.016 -4.496 10.991 1.00 99.99 H new ATOM 0 HA VAL C 27 -4.271 -3.080 9.333 1.00 99.99 H new ATOM 0 HB VAL C 27 -3.799 -4.430 12.020 1.00 99.99 H new ATOM 0 HG11 VAL C 27 -1.826 -2.936 12.228 1.00 99.99 H new ATOM 0 HG12 VAL C 27 -1.648 -4.058 10.858 1.00 99.99 H new ATOM 0 HG13 VAL C 27 -2.090 -2.359 10.566 1.00 99.99 H new ATOM 0 HG21 VAL C 27 -4.084 -2.098 12.892 1.00 99.99 H new ATOM 0 HG22 VAL C 27 -4.393 -1.524 11.236 1.00 99.99 H new ATOM 0 HG23 VAL C 27 -5.537 -2.640 12.019 1.00 99.99 H new ATOM 891 N VAL C 28 -3.549 -6.220 9.949 1.00 99.99 N ATOM 892 CA VAL C 28 -2.752 -7.374 9.552 1.00 99.99 C ATOM 893 C VAL C 28 -3.122 -7.776 8.133 1.00 99.99 C ATOM 894 O VAL C 28 -2.244 -8.049 7.353 1.00 99.99 O ATOM 895 CB VAL C 28 -3.004 -8.605 10.432 1.00 99.99 C ATOM 896 CG1 VAL C 28 -2.281 -9.849 9.876 1.00 99.99 C ATOM 897 CG2 VAL C 28 -2.536 -8.320 11.873 1.00 99.99 C ATOM 0 H VAL C 28 -4.248 -6.423 10.664 1.00 99.99 H new ATOM 0 HA VAL C 28 -1.709 -7.073 9.647 1.00 99.99 H new ATOM 0 HB VAL C 28 -4.074 -8.812 10.431 1.00 99.99 H new ATOM 0 HG11 VAL C 28 -2.479 -10.704 10.522 1.00 99.99 H new ATOM 0 HG12 VAL C 28 -2.644 -10.062 8.871 1.00 99.99 H new ATOM 0 HG13 VAL C 28 -1.208 -9.661 9.842 1.00 99.99 H new ATOM 0 HG21 VAL C 28 -2.717 -9.197 12.494 1.00 99.99 H new ATOM 0 HG22 VAL C 28 -1.470 -8.090 11.871 1.00 99.99 H new ATOM 0 HG23 VAL C 28 -3.089 -7.471 12.274 1.00 99.99 H new ATOM 907 N ALA C 29 -4.352 -7.807 7.858 1.00 99.99 N ATOM 908 CA ALA C 29 -4.851 -8.202 6.544 1.00 99.99 C ATOM 909 C ALA C 29 -4.319 -7.235 5.495 1.00 99.99 C ATOM 910 O ALA C 29 -3.924 -7.675 4.443 1.00 99.99 O ATOM 911 CB ALA C 29 -6.380 -8.148 6.444 1.00 99.99 C ATOM 0 H ALA C 29 -5.085 -7.562 8.524 1.00 99.99 H new ATOM 0 HA ALA C 29 -4.517 -9.227 6.385 1.00 99.99 H new ATOM 0 HB1 ALA C 29 -6.690 -8.452 5.444 1.00 99.99 H new ATOM 0 HB2 ALA C 29 -6.817 -8.822 7.181 1.00 99.99 H new ATOM 0 HB3 ALA C 29 -6.721 -7.131 6.636 1.00 99.99 H new ATOM 917 N ALA C 30 -4.332 -6.010 5.796 1.00 99.99 N ATOM 918 CA ALA C 30 -3.876 -4.976 4.876 1.00 99.99 C ATOM 919 C ALA C 30 -2.397 -5.176 4.583 1.00 99.99 C ATOM 920 O ALA C 30 -1.980 -4.923 3.480 1.00 99.99 O ATOM 921 CB ALA C 30 -4.014 -3.560 5.454 1.00 99.99 C ATOM 0 H ALA C 30 -4.658 -5.653 6.694 1.00 99.99 H new ATOM 0 HA ALA C 30 -4.498 -5.065 3.986 1.00 99.99 H new ATOM 0 HB1 ALA C 30 -3.659 -2.833 4.724 1.00 99.99 H new ATOM 0 HB2 ALA C 30 -5.061 -3.361 5.684 1.00 99.99 H new ATOM 0 HB3 ALA C 30 -3.421 -3.479 6.365 1.00 99.99 H new ATOM 927 N SER C 31 -1.687 -5.601 5.534 1.00 99.99 N ATOM 928 CA SER C 31 -0.251 -5.815 5.401 1.00 99.99 C ATOM 929 C SER C 31 0.003 -6.882 4.346 1.00 99.99 C ATOM 930 O SER C 31 0.840 -6.684 3.502 1.00 99.99 O ATOM 931 CB SER C 31 0.401 -6.320 6.694 1.00 99.99 C ATOM 932 OG SER C 31 0.333 -5.328 7.717 1.00 99.99 O ATOM 0 H SER C 31 -2.057 -5.825 6.458 1.00 99.99 H new ATOM 0 HA SER C 31 0.179 -4.849 5.137 1.00 99.99 H new ATOM 0 HB2 SER C 31 -0.100 -7.228 7.028 1.00 99.99 H new ATOM 0 HB3 SER C 31 1.442 -6.582 6.504 1.00 99.99 H new ATOM 0 HG SER C 31 -0.602 -5.186 7.974 1.00 99.99 H new ATOM 938 N ILE C 32 -0.689 -7.934 4.430 1.00 99.99 N ATOM 939 CA ILE C 32 -0.532 -9.047 3.502 1.00 99.99 C ATOM 940 C ILE C 32 -0.941 -8.604 2.105 1.00 99.99 C ATOM 941 O ILE C 32 -0.323 -9.011 1.157 1.00 99.99 O ATOM 942 CB ILE C 32 -1.422 -10.247 3.854 1.00 99.99 C ATOM 943 CG1 ILE C 32 -0.983 -10.859 5.202 1.00 99.99 C ATOM 944 CG2 ILE C 32 -1.366 -11.318 2.745 1.00 99.99 C ATOM 945 CD1 ILE C 32 -2.023 -11.820 5.793 1.00 99.99 C ATOM 0 H ILE C 32 -1.402 -8.085 5.144 1.00 99.99 H new ATOM 0 HA ILE C 32 0.515 -9.346 3.559 1.00 99.99 H new ATOM 0 HB ILE C 32 -2.450 -9.895 3.940 1.00 99.99 H new ATOM 0 HG12 ILE C 32 -0.042 -11.392 5.063 1.00 99.99 H new ATOM 0 HG13 ILE C 32 -0.793 -10.056 5.914 1.00 99.99 H new ATOM 0 HG21 ILE C 32 -2.005 -12.158 3.018 1.00 99.99 H new ATOM 0 HG22 ILE C 32 -1.714 -10.888 1.806 1.00 99.99 H new ATOM 0 HG23 ILE C 32 -0.340 -11.666 2.627 1.00 99.99 H new ATOM 0 HD11 ILE C 32 -1.656 -12.216 6.740 1.00 99.99 H new ATOM 0 HD12 ILE C 32 -2.958 -11.285 5.962 1.00 99.99 H new ATOM 0 HD13 ILE C 32 -2.195 -12.642 5.098 1.00 99.99 H new ATOM 957 N ILE C 33 -1.929 -7.824 2.031 1.00 99.99 N ATOM 958 CA ILE C 33 -2.448 -7.339 0.756 1.00 99.99 C ATOM 959 C ILE C 33 -1.361 -6.555 0.035 1.00 99.99 C ATOM 960 O ILE C 33 -1.168 -6.763 -1.135 1.00 99.99 O ATOM 961 CB ILE C 33 -3.636 -6.380 0.918 1.00 99.99 C ATOM 962 CG1 ILE C 33 -4.924 -7.219 1.106 1.00 99.99 C ATOM 963 CG2 ILE C 33 -3.774 -5.420 -0.277 1.00 99.99 C ATOM 964 CD1 ILE C 33 -6.125 -6.437 1.651 1.00 99.99 C ATOM 0 H ILE C 33 -2.435 -7.476 2.845 1.00 99.99 H new ATOM 0 HA ILE C 33 -2.772 -8.221 0.204 1.00 99.99 H new ATOM 0 HB ILE C 33 -3.466 -5.755 1.794 1.00 99.99 H new ATOM 0 HG12 ILE C 33 -5.199 -7.658 0.147 1.00 99.99 H new ATOM 0 HG13 ILE C 33 -4.708 -8.045 1.784 1.00 99.99 H new ATOM 0 HG21 ILE C 33 -4.628 -4.761 -0.118 1.00 99.99 H new ATOM 0 HG22 ILE C 33 -2.867 -4.823 -0.371 1.00 99.99 H new ATOM 0 HG23 ILE C 33 -3.925 -5.995 -1.190 1.00 99.99 H new ATOM 0 HD11 ILE C 33 -6.980 -7.106 1.749 1.00 99.99 H new ATOM 0 HD12 ILE C 33 -5.876 -6.021 2.627 1.00 99.99 H new ATOM 0 HD13 ILE C 33 -6.374 -5.628 0.964 1.00 99.99 H new ATOM 976 N GLY C 34 -0.719 -5.717 0.726 1.00 99.99 N ATOM 977 CA GLY C 34 0.334 -4.880 0.157 1.00 99.99 C ATOM 978 C GLY C 34 1.498 -5.758 -0.272 1.00 99.99 C ATOM 979 O GLY C 34 2.112 -5.468 -1.268 1.00 99.99 O ATOM 0 H GLY C 34 -0.883 -5.561 1.721 1.00 99.99 H new ATOM 0 HA2 GLY C 34 -0.050 -4.323 -0.698 1.00 99.99 H new ATOM 0 HA3 GLY C 34 0.668 -4.147 0.891 1.00 99.99 H new ATOM 983 N ILE C 35 1.445 -7.036 0.069 1.00 99.99 N ATOM 984 CA ILE C 35 2.489 -7.905 -0.466 1.00 99.99 C ATOM 985 C ILE C 35 1.975 -8.601 -1.716 1.00 99.99 C ATOM 986 O ILE C 35 2.671 -8.624 -2.699 1.00 99.99 O ATOM 987 CB ILE C 35 2.898 -9.016 0.510 1.00 99.99 C ATOM 988 CG1 ILE C 35 3.428 -8.405 1.832 1.00 99.99 C ATOM 989 CG2 ILE C 35 3.974 -9.913 -0.138 1.00 99.99 C ATOM 990 CD1 ILE C 35 3.571 -9.398 2.989 1.00 99.99 C ATOM 0 H ILE C 35 0.746 -7.474 0.669 1.00 99.99 H new ATOM 0 HA ILE C 35 3.348 -7.264 -0.663 1.00 99.99 H new ATOM 0 HB ILE C 35 2.023 -9.624 0.740 1.00 99.99 H new ATOM 0 HG12 ILE C 35 4.400 -7.950 1.641 1.00 99.99 H new ATOM 0 HG13 ILE C 35 2.756 -7.604 2.140 1.00 99.99 H new ATOM 0 HG21 ILE C 35 4.260 -10.700 0.560 1.00 99.99 H new ATOM 0 HG22 ILE C 35 3.574 -10.362 -1.047 1.00 99.99 H new ATOM 0 HG23 ILE C 35 4.849 -9.311 -0.385 1.00 99.99 H new ATOM 0 HD11 ILE C 35 3.948 -8.878 3.870 1.00 99.99 H new ATOM 0 HD12 ILE C 35 2.599 -9.836 3.214 1.00 99.99 H new ATOM 0 HD13 ILE C 35 4.268 -10.187 2.707 1.00 99.99 H new ATOM 1002 N LEU C 36 0.828 -9.121 -1.642 1.00 99.99 N ATOM 1003 CA LEU C 36 0.225 -9.843 -2.757 1.00 99.99 C ATOM 1004 C LEU C 36 0.119 -8.914 -3.957 1.00 99.99 C ATOM 1005 O LEU C 36 0.394 -9.338 -5.051 1.00 99.99 O ATOM 1006 CB LEU C 36 -1.201 -10.323 -2.455 1.00 99.99 C ATOM 1007 CG LEU C 36 -1.945 -10.978 -3.638 1.00 99.99 C ATOM 1008 CD1 LEU C 36 -1.238 -12.261 -4.096 1.00 99.99 C ATOM 1009 CD2 LEU C 36 -3.409 -11.260 -3.278 1.00 99.99 C ATOM 0 H LEU C 36 0.242 -9.078 -0.809 1.00 99.99 H new ATOM 0 HA LEU C 36 0.863 -10.707 -2.945 1.00 99.99 H new ATOM 0 HB2 LEU C 36 -1.159 -11.039 -1.634 1.00 99.99 H new ATOM 0 HB3 LEU C 36 -1.786 -9.472 -2.107 1.00 99.99 H new ATOM 0 HG LEU C 36 -1.931 -10.273 -4.470 1.00 99.99 H new ATOM 0 HD11 LEU C 36 -1.785 -12.700 -4.930 1.00 99.99 H new ATOM 0 HD12 LEU C 36 -0.222 -12.024 -4.413 1.00 99.99 H new ATOM 0 HD13 LEU C 36 -1.204 -12.972 -3.271 1.00 99.99 H new ATOM 0 HD21 LEU C 36 -3.910 -11.721 -4.129 1.00 99.99 H new ATOM 0 HD22 LEU C 36 -3.450 -11.935 -2.423 1.00 99.99 H new ATOM 0 HD23 LEU C 36 -3.908 -10.324 -3.026 1.00 99.99 H new ATOM 1021 N HIS C 37 -0.304 -7.645 -3.753 1.00 99.99 N ATOM 1022 CA HIS C 37 -0.502 -6.662 -4.791 1.00 99.99 C ATOM 1023 C HIS C 37 0.803 -6.365 -5.480 1.00 99.99 C ATOM 1024 O HIS C 37 0.827 -6.037 -6.665 1.00 99.99 O ATOM 1025 CB HIS C 37 -1.078 -5.344 -4.218 1.00 99.99 C ATOM 1026 CG HIS C 37 -1.483 -4.338 -5.264 1.00 99.99 C ATOM 1027 ND1 HIS C 37 -1.710 -3.021 -4.968 1.00 99.99 N ATOM 1028 CD2 HIS C 37 -1.746 -4.500 -6.583 1.00 99.99 C ATOM 1029 CE1 HIS C 37 -2.088 -2.402 -6.078 1.00 99.99 C ATOM 1030 NE2 HIS C 37 -2.117 -3.278 -7.073 1.00 99.99 N ATOM 0 H HIS C 37 -0.518 -7.286 -2.823 1.00 99.99 H new ATOM 0 HA HIS C 37 -1.215 -7.077 -5.504 1.00 99.99 H new ATOM 0 HB2 HIS C 37 -1.945 -5.578 -3.601 1.00 99.99 H new ATOM 0 HB3 HIS C 37 -0.334 -4.890 -3.563 1.00 99.99 H new ATOM 0 HD2 HIS C 37 -1.676 -5.421 -7.143 1.00 99.99 H new ATOM 0 HE1 HIS C 37 -2.333 -1.353 -6.159 1.00 99.99 H new ATOM 0 HE2 HIS C 37 -2.373 -3.075 -8.039 1.00 99.99 H new ATOM 1038 N LEU C 38 1.927 -6.519 -4.740 1.00 99.99 N ATOM 1039 CA LEU C 38 3.268 -6.284 -5.263 1.00 99.99 C ATOM 1040 C LEU C 38 3.641 -7.410 -6.216 1.00 99.99 C ATOM 1041 O LEU C 38 4.169 -7.140 -7.265 1.00 99.99 O ATOM 1042 CB LEU C 38 4.344 -6.269 -4.169 1.00 99.99 C ATOM 1043 CG LEU C 38 5.775 -6.046 -4.715 1.00 99.99 C ATOM 1044 CD1 LEU C 38 5.895 -4.715 -5.470 1.00 99.99 C ATOM 1045 CD2 LEU C 38 6.832 -6.129 -3.613 1.00 99.99 C ATOM 0 H LEU C 38 1.915 -6.811 -3.763 1.00 99.99 H new ATOM 0 HA LEU C 38 3.239 -5.309 -5.750 1.00 99.99 H new ATOM 0 HB2 LEU C 38 4.111 -5.482 -3.451 1.00 99.99 H new ATOM 0 HB3 LEU C 38 4.313 -7.214 -3.627 1.00 99.99 H new ATOM 0 HG LEU C 38 5.963 -6.856 -5.419 1.00 99.99 H new ATOM 0 HD11 LEU C 38 6.914 -4.596 -5.837 1.00 99.99 H new ATOM 0 HD12 LEU C 38 5.203 -4.711 -6.312 1.00 99.99 H new ATOM 0 HD13 LEU C 38 5.653 -3.892 -4.797 1.00 99.99 H new ATOM 0 HD21 LEU C 38 7.820 -5.966 -4.044 1.00 99.99 H new ATOM 0 HD22 LEU C 38 6.634 -5.366 -2.861 1.00 99.99 H new ATOM 0 HD23 LEU C 38 6.797 -7.114 -3.148 1.00 99.99 H new ATOM 1057 N ILE C 39 3.372 -8.581 -5.837 1.00 99.99 N ATOM 1058 CA ILE C 39 3.698 -9.757 -6.638 1.00 99.99 C ATOM 1059 C ILE C 39 2.858 -9.748 -7.906 1.00 99.99 C ATOM 1060 O ILE C 39 3.381 -10.025 -8.957 1.00 99.99 O ATOM 1061 CB ILE C 39 3.384 -11.076 -5.920 1.00 99.99 C ATOM 1062 CG1 ILE C 39 4.328 -11.253 -4.710 1.00 99.99 C ATOM 1063 CG2 ILE C 39 3.526 -12.263 -6.895 1.00 99.99 C ATOM 1064 CD1 ILE C 39 3.975 -12.452 -3.819 1.00 99.99 C ATOM 0 H ILE C 39 2.911 -8.795 -4.952 1.00 99.99 H new ATOM 0 HA ILE C 39 4.768 -9.704 -6.838 1.00 99.99 H new ATOM 0 HB ILE C 39 2.355 -11.048 -5.561 1.00 99.99 H new ATOM 0 HG12 ILE C 39 5.350 -11.370 -5.072 1.00 99.99 H new ATOM 0 HG13 ILE C 39 4.305 -10.345 -4.107 1.00 99.99 H new ATOM 0 HG21 ILE C 39 3.300 -13.192 -6.372 1.00 99.99 H new ATOM 0 HG22 ILE C 39 2.832 -12.136 -7.726 1.00 99.99 H new ATOM 0 HG23 ILE C 39 4.546 -12.300 -7.277 1.00 99.99 H new ATOM 0 HD11 ILE C 39 4.682 -12.511 -2.991 1.00 99.99 H new ATOM 0 HD12 ILE C 39 2.966 -12.329 -3.426 1.00 99.99 H new ATOM 0 HD13 ILE C 39 4.026 -13.369 -4.406 1.00 99.99 H new ATOM 1076 N LEU C 40 1.640 -9.455 -7.776 1.00 99.99 N ATOM 1077 CA LEU C 40 0.715 -9.433 -8.902 1.00 99.99 C ATOM 1078 C LEU C 40 1.195 -8.421 -9.930 1.00 99.99 C ATOM 1079 O LEU C 40 1.180 -8.720 -11.098 1.00 99.99 O ATOM 1080 CB LEU C 40 -0.703 -9.004 -8.504 1.00 99.99 C ATOM 1081 CG LEU C 40 -1.496 -10.025 -7.658 1.00 99.99 C ATOM 1082 CD1 LEU C 40 -2.847 -9.414 -7.239 1.00 99.99 C ATOM 1083 CD2 LEU C 40 -1.728 -11.346 -8.405 1.00 99.99 C ATOM 0 H LEU C 40 1.212 -9.213 -6.883 1.00 99.99 H new ATOM 0 HA LEU C 40 0.687 -10.451 -9.291 1.00 99.99 H new ATOM 0 HB2 LEU C 40 -0.638 -8.070 -7.946 1.00 99.99 H new ATOM 0 HB3 LEU C 40 -1.268 -8.794 -9.412 1.00 99.99 H new ATOM 0 HG LEU C 40 -0.900 -10.253 -6.775 1.00 99.99 H new ATOM 0 HD11 LEU C 40 -3.404 -10.137 -6.643 1.00 99.99 H new ATOM 0 HD12 LEU C 40 -2.672 -8.514 -6.649 1.00 99.99 H new ATOM 0 HD13 LEU C 40 -3.422 -9.158 -8.129 1.00 99.99 H new ATOM 0 HD21 LEU C 40 -2.289 -12.030 -7.769 1.00 99.99 H new ATOM 0 HD22 LEU C 40 -2.292 -11.154 -9.318 1.00 99.99 H new ATOM 0 HD23 LEU C 40 -0.767 -11.793 -8.660 1.00 99.99 H new ATOM 1095 N TRP C 41 1.586 -7.306 -9.486 1.00 99.99 N ATOM 1096 CA TRP C 41 2.047 -6.234 -10.360 1.00 99.99 C ATOM 1097 C TRP C 41 3.357 -6.649 -11.014 1.00 99.99 C ATOM 1098 O TRP C 41 3.528 -6.418 -12.184 1.00 99.99 O ATOM 1099 CB TRP C 41 2.332 -4.929 -9.606 1.00 99.99 C ATOM 1100 CG TRP C 41 2.711 -3.766 -10.505 1.00 99.99 C ATOM 1101 CD1 TRP C 41 1.873 -3.003 -11.258 1.00 99.99 C ATOM 1102 CD2 TRP C 41 4.048 -3.331 -10.807 1.00 99.99 C ATOM 1103 NE1 TRP C 41 2.583 -2.063 -11.950 1.00 99.99 N ATOM 1104 CE2 TRP C 41 3.922 -2.270 -11.724 1.00 99.99 C ATOM 1105 CE3 TRP C 41 5.298 -3.764 -10.354 1.00 99.99 C ATOM 1106 CZ2 TRP C 41 5.044 -1.606 -12.196 1.00 99.99 C ATOM 1107 CZ3 TRP C 41 6.424 -3.100 -10.845 1.00 99.99 C ATOM 1108 CH2 TRP C 41 6.307 -2.033 -11.753 1.00 99.99 C ATOM 0 H TRP C 41 1.609 -7.072 -8.494 1.00 99.99 H new ATOM 0 HA TRP C 41 1.249 -6.062 -11.082 1.00 99.99 H new ATOM 0 HB2 TRP C 41 1.449 -4.655 -9.028 1.00 99.99 H new ATOM 0 HB3 TRP C 41 3.139 -5.102 -8.894 1.00 99.99 H new ATOM 0 HD1 TRP C 41 0.801 -3.123 -11.302 1.00 99.99 H new ATOM 0 HE1 TRP C 41 2.185 -1.330 -12.537 1.00 99.99 H new ATOM 0 HE3 TRP C 41 5.389 -4.580 -9.652 1.00 99.99 H new ATOM 0 HZ2 TRP C 41 4.949 -0.781 -12.887 1.00 99.99 H new ATOM 0 HZ3 TRP C 41 7.405 -3.413 -10.520 1.00 99.99 H new ATOM 0 HH2 TRP C 41 7.196 -1.537 -12.113 1.00 99.99 H new ATOM 1119 N ILE C 42 4.205 -7.213 -10.267 1.00 99.99 N ATOM 1120 CA ILE C 42 5.513 -7.638 -10.754 1.00 99.99 C ATOM 1121 C ILE C 42 5.329 -8.729 -11.799 1.00 99.99 C ATOM 1122 O ILE C 42 6.001 -8.700 -12.800 1.00 99.99 O ATOM 1123 CB ILE C 42 6.394 -8.238 -9.653 1.00 99.99 C ATOM 1124 CG1 ILE C 42 6.863 -7.129 -8.683 1.00 99.99 C ATOM 1125 CG2 ILE C 42 7.613 -8.968 -10.259 1.00 99.99 C ATOM 1126 CD1 ILE C 42 7.675 -7.656 -7.490 1.00 99.99 C ATOM 0 H ILE C 42 4.044 -7.412 -9.280 1.00 99.99 H new ATOM 0 HA ILE C 42 5.996 -6.746 -11.153 1.00 99.99 H new ATOM 0 HB ILE C 42 5.801 -8.966 -9.099 1.00 99.99 H new ATOM 0 HG12 ILE C 42 7.468 -6.409 -9.234 1.00 99.99 H new ATOM 0 HG13 ILE C 42 5.991 -6.593 -8.309 1.00 99.99 H new ATOM 0 HG21 ILE C 42 8.223 -9.385 -9.458 1.00 99.99 H new ATOM 0 HG22 ILE C 42 7.269 -9.772 -10.909 1.00 99.99 H new ATOM 0 HG23 ILE C 42 8.209 -8.262 -10.838 1.00 99.99 H new ATOM 0 HD11 ILE C 42 7.970 -6.822 -6.853 1.00 99.99 H new ATOM 0 HD12 ILE C 42 7.066 -8.354 -6.915 1.00 99.99 H new ATOM 0 HD13 ILE C 42 8.566 -8.167 -7.854 1.00 99.99 H new ATOM 1138 N LEU C 43 4.473 -9.620 -11.542 1.00 99.99 N ATOM 1139 CA LEU C 43 4.215 -10.737 -12.442 1.00 99.99 C ATOM 1140 C LEU C 43 3.625 -10.210 -13.742 1.00 99.99 C ATOM 1141 O LEU C 43 3.925 -10.743 -14.780 1.00 99.99 O ATOM 1142 CB LEU C 43 3.196 -11.735 -11.877 1.00 99.99 C ATOM 1143 CG LEU C 43 3.708 -12.554 -10.669 1.00 99.99 C ATOM 1144 CD1 LEU C 43 2.544 -13.319 -10.013 1.00 99.99 C ATOM 1145 CD2 LEU C 43 4.822 -13.534 -11.068 1.00 99.99 C ATOM 0 H LEU C 43 3.903 -9.627 -10.696 1.00 99.99 H new ATOM 0 HA LEU C 43 5.170 -11.242 -12.586 1.00 99.99 H new ATOM 0 HB2 LEU C 43 2.300 -11.191 -11.578 1.00 99.99 H new ATOM 0 HB3 LEU C 43 2.902 -12.424 -12.669 1.00 99.99 H new ATOM 0 HG LEU C 43 4.130 -11.849 -9.953 1.00 99.99 H new ATOM 0 HD11 LEU C 43 2.918 -13.892 -9.164 1.00 99.99 H new ATOM 0 HD12 LEU C 43 1.791 -12.610 -9.669 1.00 99.99 H new ATOM 0 HD13 LEU C 43 2.099 -13.998 -10.741 1.00 99.99 H new ATOM 0 HD21 LEU C 43 5.151 -14.088 -10.189 1.00 99.99 H new ATOM 0 HD22 LEU C 43 4.443 -14.231 -11.815 1.00 99.99 H new ATOM 0 HD23 LEU C 43 5.663 -12.979 -11.483 1.00 99.99 H new ATOM 1157 N ASP C 44 2.831 -9.234 -13.647 1.00 99.99 N ATOM 1158 CA ASP C 44 2.173 -8.647 -14.806 1.00 99.99 C ATOM 1159 C ASP C 44 3.216 -7.981 -15.694 1.00 99.99 C ATOM 1160 O ASP C 44 3.129 -8.101 -16.891 1.00 99.99 O ATOM 1161 CB ASP C 44 1.162 -7.554 -14.433 1.00 99.99 C ATOM 1162 CG ASP C 44 0.409 -7.004 -15.659 1.00 99.99 C ATOM 1163 OD1 ASP C 44 -0.376 -7.770 -16.268 1.00 99.99 O ATOM 1164 OD2 ASP C 44 0.563 -5.790 -15.986 1.00 99.99 O ATOM 0 H ASP C 44 2.592 -8.786 -12.762 1.00 99.99 H new ATOM 0 HA ASP C 44 1.650 -9.463 -15.305 1.00 99.99 H new ATOM 0 HB2 ASP C 44 0.443 -7.957 -13.720 1.00 99.99 H new ATOM 0 HB3 ASP C 44 1.683 -6.737 -13.934 1.00 99.99 H new ATOM 1169 N ARG C 45 4.121 -7.327 -15.109 1.00 99.99 N ATOM 1170 CA ARG C 45 5.169 -6.620 -15.836 1.00 99.99 C ATOM 1171 C ARG C 45 6.024 -7.624 -16.594 1.00 99.99 C ATOM 1172 O ARG C 45 6.329 -7.388 -17.735 1.00 99.99 O ATOM 1173 CB ARG C 45 6.123 -5.852 -14.911 1.00 99.99 C ATOM 1174 CG ARG C 45 5.448 -4.696 -14.144 1.00 99.99 C ATOM 1175 CD ARG C 45 5.179 -3.466 -15.022 1.00 99.99 C ATOM 1176 NE ARG C 45 3.779 -3.565 -15.570 1.00 99.99 N ATOM 1177 CZ ARG C 45 3.414 -2.895 -16.679 1.00 99.99 C ATOM 1178 NH1 ARG C 45 4.273 -2.092 -17.331 1.00 99.99 N ATOM 1179 NH2 ARG C 45 2.149 -3.019 -17.112 1.00 99.99 N ATOM 0 H ARG C 45 4.190 -7.243 -14.095 1.00 99.99 H new ATOM 0 HA ARG C 45 4.661 -5.916 -16.495 1.00 99.99 H new ATOM 0 HB2 ARG C 45 6.557 -6.548 -14.193 1.00 99.99 H new ATOM 0 HB3 ARG C 45 6.945 -5.451 -15.504 1.00 99.99 H new ATOM 0 HG2 ARG C 45 4.506 -5.048 -13.724 1.00 99.99 H new ATOM 0 HG3 ARG C 45 6.082 -4.405 -13.306 1.00 99.99 H new ATOM 0 HD2 ARG C 45 5.293 -2.552 -14.439 1.00 99.99 H new ATOM 0 HD3 ARG C 45 5.902 -3.417 -15.836 1.00 99.99 H new ATOM 0 HE ARG C 45 3.095 -4.151 -15.092 1.00 99.99 H new ATOM 0 HH11 ARG C 45 5.227 -1.979 -16.987 1.00 99.99 H new ATOM 0 HH12 ARG C 45 3.971 -1.596 -18.169 1.00 99.99 H new ATOM 0 HH21 ARG C 45 1.491 -3.610 -16.603 1.00 99.99 H new ATOM 0 HH22 ARG C 45 1.846 -2.522 -17.950 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 6.445 -10.375 -17.684 1.00 99.99 C ATOM 1196 O LEU C 46 5.453 -11.063 -17.450 1.00 99.99 O ATOM 1197 CB LEU C 46 7.595 -10.797 -15.566 1.00 99.99 C ATOM 1198 CG LEU C 46 8.382 -10.373 -14.301 1.00 99.99 C ATOM 1199 CD1 LEU C 46 8.446 -11.578 -13.343 1.00 99.99 C ATOM 1200 CD2 LEU C 46 9.795 -9.865 -14.607 1.00 99.99 C ATOM 0 H LEU C 46 6.094 -8.853 -15.000 1.00 99.99 H new ATOM 0 HA LEU C 46 8.112 -9.191 -16.905 1.00 99.99 H new ATOM 0 HB2 LEU C 46 6.681 -11.295 -15.243 1.00 99.99 H new ATOM 0 HB3 LEU C 46 8.190 -11.538 -16.100 1.00 99.99 H new ATOM 0 HG LEU C 46 7.855 -9.535 -13.845 1.00 99.99 H new ATOM 0 HD11 LEU C 46 8.997 -11.300 -12.445 1.00 99.99 H new ATOM 0 HD12 LEU C 46 7.435 -11.880 -13.070 1.00 99.99 H new ATOM 0 HD13 LEU C 46 8.952 -12.408 -13.836 1.00 99.99 H new ATOM 0 HD21 LEU C 46 10.290 -9.585 -13.677 1.00 99.99 H new ATOM 0 HD22 LEU C 46 10.366 -10.652 -15.100 1.00 99.99 H new ATOM 0 HD23 LEU C 46 9.735 -8.996 -15.262 1.00 99.99 H new ATOM 1213 N SER D 22 10.395 -0.518 18.943 1.00 99.99 N ATOM 1214 CA SER D 22 10.116 -1.252 17.676 1.00 99.99 C ATOM 1215 C SER D 22 8.656 -1.593 17.532 1.00 99.99 C ATOM 1216 O SER D 22 7.863 -1.421 18.459 1.00 99.99 O ATOM 1217 CB SER D 22 11.005 -2.530 17.552 1.00 99.99 C ATOM 1218 OG SER D 22 10.754 -3.491 18.575 1.00 99.99 O ATOM 0 HA SER D 22 10.375 -0.581 16.856 1.00 99.99 H new ATOM 0 HB2 SER D 22 10.833 -2.991 16.579 1.00 99.99 H new ATOM 0 HB3 SER D 22 12.055 -2.239 17.586 1.00 99.99 H new ATOM 0 HG SER D 22 11.337 -4.268 18.445 1.00 99.99 H new ATOM 1223 N SER D 23 8.279 -2.098 16.333 1.00 99.99 N ATOM 1224 CA SER D 23 6.949 -2.580 16.044 1.00 99.99 C ATOM 1225 C SER D 23 7.123 -4.007 15.589 1.00 99.99 C ATOM 1226 O SER D 23 8.183 -4.600 15.787 1.00 99.99 O ATOM 1227 CB SER D 23 6.228 -1.734 14.965 1.00 99.99 C ATOM 1228 OG SER D 23 6.047 -0.402 15.425 1.00 99.99 O ATOM 0 H SER D 23 8.917 -2.174 15.541 1.00 99.99 H new ATOM 0 HA SER D 23 6.316 -2.506 16.928 1.00 99.99 H new ATOM 0 HB2 SER D 23 6.811 -1.732 14.044 1.00 99.99 H new ATOM 0 HB3 SER D 23 5.262 -2.179 14.729 1.00 99.99 H new ATOM 0 HG SER D 23 5.592 0.124 14.734 1.00 99.99 H new ATOM 1234 N ASP D 24 6.062 -4.608 14.990 1.00 99.99 N ATOM 1235 CA ASP D 24 6.026 -6.014 14.630 1.00 99.99 C ATOM 1236 C ASP D 24 6.627 -6.174 13.250 1.00 99.99 C ATOM 1237 O ASP D 24 6.567 -5.222 12.480 1.00 99.99 O ATOM 1238 CB ASP D 24 4.576 -6.572 14.600 1.00 99.99 C ATOM 1239 CG ASP D 24 3.914 -6.497 15.980 1.00 99.99 C ATOM 1240 OD1 ASP D 24 4.642 -6.411 17.006 1.00 99.99 O ATOM 1241 OD2 ASP D 24 2.655 -6.536 16.021 1.00 99.99 O ATOM 0 H ASP D 24 5.207 -4.107 14.749 1.00 99.99 H new ATOM 0 HA ASP D 24 6.588 -6.568 15.381 1.00 99.99 H new ATOM 0 HB2 ASP D 24 3.983 -6.008 13.880 1.00 99.99 H new ATOM 0 HB3 ASP D 24 4.591 -7.607 14.259 1.00 99.99 H new ATOM 1246 N PRO D 25 7.231 -7.303 12.871 1.00 99.99 N ATOM 1247 CA PRO D 25 8.113 -7.372 11.715 1.00 99.99 C ATOM 1248 C PRO D 25 7.365 -7.349 10.401 1.00 99.99 C ATOM 1249 O PRO D 25 7.968 -6.931 9.424 1.00 99.99 O ATOM 1250 CB PRO D 25 8.877 -8.695 11.887 1.00 99.99 C ATOM 1251 CG PRO D 25 7.969 -9.544 12.780 1.00 99.99 C ATOM 1252 CD PRO D 25 7.341 -8.501 13.701 1.00 99.99 C ATOM 0 HA PRO D 25 8.770 -6.503 11.675 1.00 99.99 H new ATOM 0 HB2 PRO D 25 9.055 -9.179 10.927 1.00 99.99 H new ATOM 0 HB3 PRO D 25 9.851 -8.534 12.349 1.00 99.99 H new ATOM 0 HG2 PRO D 25 7.217 -10.080 12.201 1.00 99.99 H new ATOM 0 HG3 PRO D 25 8.533 -10.291 13.338 1.00 99.99 H new ATOM 0 HD2 PRO D 25 6.365 -8.826 14.062 1.00 99.99 H new ATOM 0 HD3 PRO D 25 7.962 -8.321 14.579 1.00 99.99 H new ATOM 1260 N LEU D 26 6.089 -7.796 10.358 1.00 99.99 N ATOM 1261 CA LEU D 26 5.167 -7.746 9.231 1.00 99.99 C ATOM 1262 C LEU D 26 4.717 -6.309 9.010 1.00 99.99 C ATOM 1263 O LEU D 26 4.655 -5.883 7.885 1.00 99.99 O ATOM 1264 CB LEU D 26 3.891 -8.567 9.466 1.00 99.99 C ATOM 1265 CG LEU D 26 2.764 -8.394 8.422 1.00 99.99 C ATOM 1266 CD1 LEU D 26 3.170 -8.880 7.028 1.00 99.99 C ATOM 1267 CD2 LEU D 26 1.489 -9.107 8.894 1.00 99.99 C ATOM 0 H LEU D 26 5.659 -8.230 11.175 1.00 99.99 H new ATOM 0 HA LEU D 26 5.707 -8.156 8.377 1.00 99.99 H new ATOM 0 HB2 LEU D 26 4.164 -9.621 9.503 1.00 99.99 H new ATOM 0 HB3 LEU D 26 3.492 -8.307 10.446 1.00 99.99 H new ATOM 0 HG LEU D 26 2.568 -7.325 8.336 1.00 99.99 H new ATOM 0 HD11 LEU D 26 2.341 -8.734 6.336 1.00 99.99 H new ATOM 0 HD12 LEU D 26 4.035 -8.313 6.683 1.00 99.99 H new ATOM 0 HD13 LEU D 26 3.424 -9.939 7.072 1.00 99.99 H new ATOM 0 HD21 LEU D 26 0.703 -8.978 8.150 1.00 99.99 H new ATOM 0 HD22 LEU D 26 1.694 -10.170 9.025 1.00 99.99 H new ATOM 0 HD23 LEU D 26 1.164 -8.681 9.843 1.00 99.99 H new ATOM 1279 N VAL D 27 4.427 -5.645 10.044 1.00 99.99 N ATOM 1280 CA VAL D 27 3.959 -4.265 9.978 1.00 99.99 C ATOM 1281 C VAL D 27 5.075 -3.379 9.445 1.00 99.99 C ATOM 1282 O VAL D 27 4.821 -2.569 8.590 1.00 99.99 O ATOM 1283 CB VAL D 27 3.575 -3.699 11.352 1.00 99.99 C ATOM 1284 CG1 VAL D 27 3.205 -2.207 11.243 1.00 99.99 C ATOM 1285 CG2 VAL D 27 2.371 -4.486 11.916 1.00 99.99 C ATOM 0 H VAL D 27 4.496 -6.016 10.991 1.00 99.99 H new ATOM 0 HA VAL D 27 3.080 -4.271 9.333 1.00 99.99 H new ATOM 0 HB VAL D 27 4.430 -3.799 12.020 1.00 99.99 H new ATOM 0 HG11 VAL D 27 2.936 -1.826 12.228 1.00 99.99 H new ATOM 0 HG12 VAL D 27 4.058 -1.648 10.858 1.00 99.99 H new ATOM 0 HG13 VAL D 27 2.359 -2.090 10.566 1.00 99.99 H new ATOM 0 HG21 VAL D 27 2.098 -4.084 12.892 1.00 99.99 H new ATOM 0 HG22 VAL D 27 1.524 -4.393 11.236 1.00 99.99 H new ATOM 0 HG23 VAL D 27 2.640 -5.537 12.019 1.00 99.99 H new ATOM 1295 N VAL D 28 6.220 -3.549 9.949 1.00 99.99 N ATOM 1296 CA VAL D 28 7.374 -2.752 9.552 1.00 99.99 C ATOM 1297 C VAL D 28 7.776 -3.122 8.133 1.00 99.99 C ATOM 1298 O VAL D 28 8.049 -2.244 7.353 1.00 99.99 O ATOM 1299 CB VAL D 28 8.605 -3.004 10.432 1.00 99.99 C ATOM 1300 CG1 VAL D 28 9.849 -2.281 9.876 1.00 99.99 C ATOM 1301 CG2 VAL D 28 8.320 -2.536 11.873 1.00 99.99 C ATOM 0 H VAL D 28 6.423 -4.248 10.664 1.00 99.99 H new ATOM 0 HA VAL D 28 7.073 -1.709 9.647 1.00 99.99 H new ATOM 0 HB VAL D 28 8.812 -4.074 10.431 1.00 99.99 H new ATOM 0 HG11 VAL D 28 10.704 -2.479 10.522 1.00 99.99 H new ATOM 0 HG12 VAL D 28 10.062 -2.644 8.871 1.00 99.99 H new ATOM 0 HG13 VAL D 28 9.661 -1.208 9.842 1.00 99.99 H new ATOM 0 HG21 VAL D 28 9.197 -2.717 12.494 1.00 99.99 H new ATOM 0 HG22 VAL D 28 8.090 -1.470 11.871 1.00 99.99 H new ATOM 0 HG23 VAL D 28 7.471 -3.089 12.274 1.00 99.99 H new ATOM 1311 N ALA D 29 7.807 -4.352 7.858 1.00 99.99 N ATOM 1312 CA ALA D 29 8.202 -4.851 6.544 1.00 99.99 C ATOM 1313 C ALA D 29 7.235 -4.319 5.495 1.00 99.99 C ATOM 1314 O ALA D 29 7.675 -3.924 4.443 1.00 99.99 O ATOM 1315 CB ALA D 29 8.148 -6.380 6.444 1.00 99.99 C ATOM 0 H ALA D 29 7.562 -5.085 8.524 1.00 99.99 H new ATOM 0 HA ALA D 29 9.227 -4.517 6.385 1.00 99.99 H new ATOM 0 HB1 ALA D 29 8.452 -6.690 5.444 1.00 99.99 H new ATOM 0 HB2 ALA D 29 8.822 -6.817 7.181 1.00 99.99 H new ATOM 0 HB3 ALA D 29 7.131 -6.721 6.636 1.00 99.99 H new ATOM 1321 N ALA D 30 6.010 -4.332 5.796 1.00 99.99 N ATOM 1322 CA ALA D 30 4.976 -3.876 4.876 1.00 99.99 C ATOM 1323 C ALA D 30 5.176 -2.397 4.583 1.00 99.99 C ATOM 1324 O ALA D 30 4.923 -1.980 3.480 1.00 99.99 O ATOM 1325 CB ALA D 30 3.560 -4.014 5.454 1.00 99.99 C ATOM 0 H ALA D 30 5.653 -4.658 6.694 1.00 99.99 H new ATOM 0 HA ALA D 30 5.065 -4.498 3.986 1.00 99.99 H new ATOM 0 HB1 ALA D 30 2.833 -3.659 4.724 1.00 99.99 H new ATOM 0 HB2 ALA D 30 3.361 -5.061 5.684 1.00 99.99 H new ATOM 0 HB3 ALA D 30 3.479 -3.421 6.365 1.00 99.99 H new ATOM 1331 N SER D 31 5.601 -1.687 5.534 1.00 99.99 N ATOM 1332 CA SER D 31 5.815 -0.251 5.401 1.00 99.99 C ATOM 1333 C SER D 31 6.882 0.003 4.346 1.00 99.99 C ATOM 1334 O SER D 31 6.684 0.840 3.502 1.00 99.99 O ATOM 1335 CB SER D 31 6.320 0.401 6.694 1.00 99.99 C ATOM 1336 OG SER D 31 5.328 0.333 7.717 1.00 99.99 O ATOM 0 H SER D 31 5.825 -2.057 6.458 1.00 99.99 H new ATOM 0 HA SER D 31 4.849 0.179 5.137 1.00 99.99 H new ATOM 0 HB2 SER D 31 7.228 -0.100 7.028 1.00 99.99 H new ATOM 0 HB3 SER D 31 6.582 1.442 6.504 1.00 99.99 H new ATOM 0 HG SER D 31 5.198 -0.601 7.985 1.00 99.99 H new ATOM 1342 N ILE D 32 7.934 -0.689 4.430 1.00 99.99 N ATOM 1343 CA ILE D 32 9.047 -0.532 3.502 1.00 99.99 C ATOM 1344 C ILE D 32 8.604 -0.941 2.105 1.00 99.99 C ATOM 1345 O ILE D 32 9.011 -0.323 1.157 1.00 99.99 O ATOM 1346 CB ILE D 32 10.247 -1.422 3.854 1.00 99.99 C ATOM 1347 CG1 ILE D 32 10.859 -0.983 5.202 1.00 99.99 C ATOM 1348 CG2 ILE D 32 11.318 -1.366 2.745 1.00 99.99 C ATOM 1349 CD1 ILE D 32 11.820 -2.023 5.793 1.00 99.99 C ATOM 0 H ILE D 32 8.085 -1.402 5.144 1.00 99.99 H new ATOM 0 HA ILE D 32 9.346 0.515 3.559 1.00 99.99 H new ATOM 0 HB ILE D 32 9.895 -2.450 3.940 1.00 99.99 H new ATOM 0 HG12 ILE D 32 11.392 -0.042 5.063 1.00 99.99 H new ATOM 0 HG13 ILE D 32 10.056 -0.793 5.914 1.00 99.99 H new ATOM 0 HG21 ILE D 32 12.158 -2.005 3.018 1.00 99.99 H new ATOM 0 HG22 ILE D 32 10.888 -1.714 1.806 1.00 99.99 H new ATOM 0 HG23 ILE D 32 11.666 -0.340 2.627 1.00 99.99 H new ATOM 0 HD11 ILE D 32 12.216 -1.656 6.740 1.00 99.99 H new ATOM 0 HD12 ILE D 32 11.285 -2.958 5.962 1.00 99.99 H new ATOM 0 HD13 ILE D 32 12.642 -2.195 5.098 1.00 99.99 H new ATOM 1361 N ILE D 33 7.824 -1.929 2.031 1.00 99.99 N ATOM 1362 CA ILE D 33 7.339 -2.448 0.756 1.00 99.99 C ATOM 1363 C ILE D 33 6.555 -1.361 0.035 1.00 99.99 C ATOM 1364 O ILE D 33 6.763 -1.168 -1.135 1.00 99.99 O ATOM 1365 CB ILE D 33 6.380 -3.636 0.918 1.00 99.99 C ATOM 1366 CG1 ILE D 33 7.219 -4.924 1.106 1.00 99.99 C ATOM 1367 CG2 ILE D 33 5.420 -3.774 -0.277 1.00 99.99 C ATOM 1368 CD1 ILE D 33 6.437 -6.125 1.651 1.00 99.99 C ATOM 0 H ILE D 33 7.476 -2.435 2.845 1.00 99.99 H new ATOM 0 HA ILE D 33 8.221 -2.772 0.204 1.00 99.99 H new ATOM 0 HB ILE D 33 5.755 -3.466 1.794 1.00 99.99 H new ATOM 0 HG12 ILE D 33 7.658 -5.199 0.147 1.00 99.99 H new ATOM 0 HG13 ILE D 33 8.045 -4.708 1.784 1.00 99.99 H new ATOM 0 HG21 ILE D 33 4.761 -4.628 -0.118 1.00 99.99 H new ATOM 0 HG22 ILE D 33 4.823 -2.867 -0.371 1.00 99.99 H new ATOM 0 HG23 ILE D 33 5.995 -3.925 -1.190 1.00 99.99 H new ATOM 0 HD11 ILE D 33 7.106 -6.980 1.749 1.00 99.99 H new ATOM 0 HD12 ILE D 33 6.021 -5.876 2.627 1.00 99.99 H new ATOM 0 HD13 ILE D 33 5.628 -6.374 0.964 1.00 99.99 H new ATOM 1380 N GLY D 34 5.717 -0.719 0.726 1.00 99.99 N ATOM 1381 CA GLY D 34 4.880 0.334 0.157 1.00 99.99 C ATOM 1382 C GLY D 34 5.758 1.498 -0.272 1.00 99.99 C ATOM 1383 O GLY D 34 5.468 2.112 -1.268 1.00 99.99 O ATOM 0 H GLY D 34 5.561 -0.883 1.721 1.00 99.99 H new ATOM 0 HA2 GLY D 34 4.323 -0.050 -0.698 1.00 99.99 H new ATOM 0 HA3 GLY D 34 4.147 0.668 0.891 1.00 99.99 H new ATOM 1387 N ILE D 35 7.036 1.445 0.069 1.00 99.99 N ATOM 1388 CA ILE D 35 7.905 2.489 -0.466 1.00 99.99 C ATOM 1389 C ILE D 35 8.601 1.975 -1.716 1.00 99.99 C ATOM 1390 O ILE D 35 8.624 2.671 -2.699 1.00 99.99 O ATOM 1391 CB ILE D 35 9.016 2.898 0.510 1.00 99.99 C ATOM 1392 CG1 ILE D 35 8.405 3.428 1.832 1.00 99.99 C ATOM 1393 CG2 ILE D 35 9.913 3.974 -0.138 1.00 99.99 C ATOM 1394 CD1 ILE D 35 9.398 3.571 2.989 1.00 99.99 C ATOM 0 H ILE D 35 7.474 0.746 0.669 1.00 99.99 H new ATOM 0 HA ILE D 35 7.264 3.348 -0.663 1.00 99.99 H new ATOM 0 HB ILE D 35 9.624 2.023 0.740 1.00 99.99 H new ATOM 0 HG12 ILE D 35 7.950 4.400 1.641 1.00 99.99 H new ATOM 0 HG13 ILE D 35 7.604 2.756 2.140 1.00 99.99 H new ATOM 0 HG21 ILE D 35 10.700 4.260 0.560 1.00 99.99 H new ATOM 0 HG22 ILE D 35 10.362 3.574 -1.047 1.00 99.99 H new ATOM 0 HG23 ILE D 35 9.311 4.849 -0.385 1.00 99.99 H new ATOM 0 HD11 ILE D 35 8.878 3.948 3.870 1.00 99.99 H new ATOM 0 HD12 ILE D 35 9.836 2.599 3.214 1.00 99.99 H new ATOM 0 HD13 ILE D 35 10.187 4.268 2.707 1.00 99.99 H new ATOM 1406 N LEU D 36 9.121 0.828 -1.642 1.00 99.99 N ATOM 1407 CA LEU D 36 9.843 0.225 -2.757 1.00 99.99 C ATOM 1408 C LEU D 36 8.914 0.119 -3.957 1.00 99.99 C ATOM 1409 O LEU D 36 9.338 0.394 -5.051 1.00 99.99 O ATOM 1410 CB LEU D 36 10.323 -1.201 -2.455 1.00 99.99 C ATOM 1411 CG LEU D 36 10.978 -1.945 -3.638 1.00 99.99 C ATOM 1412 CD1 LEU D 36 12.261 -1.238 -4.096 1.00 99.99 C ATOM 1413 CD2 LEU D 36 11.260 -3.409 -3.278 1.00 99.99 C ATOM 0 H LEU D 36 9.078 0.242 -0.809 1.00 99.99 H new ATOM 0 HA LEU D 36 10.707 0.863 -2.945 1.00 99.99 H new ATOM 0 HB2 LEU D 36 11.039 -1.159 -1.634 1.00 99.99 H new ATOM 0 HB3 LEU D 36 9.472 -1.786 -2.107 1.00 99.99 H new ATOM 0 HG LEU D 36 10.273 -1.931 -4.470 1.00 99.99 H new ATOM 0 HD11 LEU D 36 12.700 -1.785 -4.930 1.00 99.99 H new ATOM 0 HD12 LEU D 36 12.024 -0.222 -4.413 1.00 99.99 H new ATOM 0 HD13 LEU D 36 12.972 -1.204 -3.271 1.00 99.99 H new ATOM 0 HD21 LEU D 36 11.721 -3.910 -4.129 1.00 99.99 H new ATOM 0 HD22 LEU D 36 11.935 -3.450 -2.423 1.00 99.99 H new ATOM 0 HD23 LEU D 36 10.324 -3.908 -3.026 1.00 99.99 H new ATOM 1425 N HIS D 37 7.645 -0.304 -3.753 1.00 99.99 N ATOM 1426 CA HIS D 37 6.662 -0.502 -4.791 1.00 99.99 C ATOM 1427 C HIS D 37 6.365 0.803 -5.480 1.00 99.99 C ATOM 1428 O HIS D 37 6.037 0.827 -6.665 1.00 99.99 O ATOM 1429 CB HIS D 37 5.344 -1.078 -4.218 1.00 99.99 C ATOM 1430 CG HIS D 37 4.338 -1.483 -5.264 1.00 99.99 C ATOM 1431 ND1 HIS D 37 3.021 -1.710 -4.968 1.00 99.99 N ATOM 1432 CD2 HIS D 37 4.500 -1.746 -6.583 1.00 99.99 C ATOM 1433 CE1 HIS D 37 2.402 -2.088 -6.078 1.00 99.99 C ATOM 1434 NE2 HIS D 37 3.278 -2.117 -7.073 1.00 99.99 N ATOM 0 H HIS D 37 7.286 -0.518 -2.823 1.00 99.99 H new ATOM 0 HA HIS D 37 7.077 -1.215 -5.504 1.00 99.99 H new ATOM 0 HB2 HIS D 37 5.578 -1.945 -3.601 1.00 99.99 H new ATOM 0 HB3 HIS D 37 4.890 -0.334 -3.563 1.00 99.99 H new ATOM 0 HD2 HIS D 37 5.421 -1.676 -7.143 1.00 99.99 H new ATOM 0 HE1 HIS D 37 1.353 -2.333 -6.159 1.00 99.99 H new ATOM 0 HE2 HIS D 37 3.075 -2.373 -8.039 1.00 99.99 H new ATOM 1442 N LEU D 38 6.519 1.927 -4.740 1.00 99.99 N ATOM 1443 CA LEU D 38 6.284 3.268 -5.263 1.00 99.99 C ATOM 1444 C LEU D 38 7.410 3.641 -6.216 1.00 99.99 C ATOM 1445 O LEU D 38 7.140 4.169 -7.265 1.00 99.99 O ATOM 1446 CB LEU D 38 6.269 4.344 -4.169 1.00 99.99 C ATOM 1447 CG LEU D 38 6.046 5.775 -4.715 1.00 99.99 C ATOM 1448 CD1 LEU D 38 4.715 5.895 -5.470 1.00 99.99 C ATOM 1449 CD2 LEU D 38 6.129 6.832 -3.613 1.00 99.99 C ATOM 0 H LEU D 38 6.811 1.915 -3.763 1.00 99.99 H new ATOM 0 HA LEU D 38 5.309 3.239 -5.750 1.00 99.99 H new ATOM 0 HB2 LEU D 38 5.482 4.111 -3.451 1.00 99.99 H new ATOM 0 HB3 LEU D 38 7.214 4.313 -3.627 1.00 99.99 H new ATOM 0 HG LEU D 38 6.856 5.963 -5.419 1.00 99.99 H new ATOM 0 HD11 LEU D 38 4.596 6.914 -5.837 1.00 99.99 H new ATOM 0 HD12 LEU D 38 4.711 5.203 -6.312 1.00 99.99 H new ATOM 0 HD13 LEU D 38 3.892 5.653 -4.797 1.00 99.99 H new ATOM 0 HD21 LEU D 38 5.966 7.820 -4.044 1.00 99.99 H new ATOM 0 HD22 LEU D 38 5.366 6.634 -2.861 1.00 99.99 H new ATOM 0 HD23 LEU D 38 7.114 6.797 -3.148 1.00 99.99 H new ATOM 1461 N ILE D 39 8.581 3.372 -5.837 1.00 99.99 N ATOM 1462 CA ILE D 39 9.757 3.698 -6.638 1.00 99.99 C ATOM 1463 C ILE D 39 9.748 2.858 -7.906 1.00 99.99 C ATOM 1464 O ILE D 39 10.025 3.381 -8.957 1.00 99.99 O ATOM 1465 CB ILE D 39 11.076 3.384 -5.920 1.00 99.99 C ATOM 1466 CG1 ILE D 39 11.253 4.328 -4.710 1.00 99.99 C ATOM 1467 CG2 ILE D 39 12.263 3.526 -6.895 1.00 99.99 C ATOM 1468 CD1 ILE D 39 12.452 3.975 -3.819 1.00 99.99 C ATOM 0 H ILE D 39 8.795 2.911 -4.952 1.00 99.99 H new ATOM 0 HA ILE D 39 9.704 4.768 -6.838 1.00 99.99 H new ATOM 0 HB ILE D 39 11.048 2.355 -5.561 1.00 99.99 H new ATOM 0 HG12 ILE D 39 11.370 5.350 -5.072 1.00 99.99 H new ATOM 0 HG13 ILE D 39 10.345 4.305 -4.107 1.00 99.99 H new ATOM 0 HG21 ILE D 39 13.192 3.300 -6.372 1.00 99.99 H new ATOM 0 HG22 ILE D 39 12.136 2.832 -7.726 1.00 99.99 H new ATOM 0 HG23 ILE D 39 12.300 4.546 -7.277 1.00 99.99 H new ATOM 0 HD11 ILE D 39 12.511 4.682 -2.991 1.00 99.99 H new ATOM 0 HD12 ILE D 39 12.329 2.966 -3.426 1.00 99.99 H new ATOM 0 HD13 ILE D 39 13.369 4.026 -4.406 1.00 99.99 H new ATOM 1480 N LEU D 40 9.455 1.640 -7.776 1.00 99.99 N ATOM 1481 CA LEU D 40 9.433 0.715 -8.902 1.00 99.99 C ATOM 1482 C LEU D 40 8.421 1.195 -9.930 1.00 99.99 C ATOM 1483 O LEU D 40 8.720 1.180 -11.098 1.00 99.99 O ATOM 1484 CB LEU D 40 9.004 -0.703 -8.504 1.00 99.99 C ATOM 1485 CG LEU D 40 10.025 -1.496 -7.658 1.00 99.99 C ATOM 1486 CD1 LEU D 40 9.414 -2.847 -7.239 1.00 99.99 C ATOM 1487 CD2 LEU D 40 11.346 -1.728 -8.405 1.00 99.99 C ATOM 0 H LEU D 40 9.213 1.212 -6.883 1.00 99.99 H new ATOM 0 HA LEU D 40 10.451 0.687 -9.291 1.00 99.99 H new ATOM 0 HB2 LEU D 40 8.070 -0.638 -7.946 1.00 99.99 H new ATOM 0 HB3 LEU D 40 8.794 -1.268 -9.412 1.00 99.99 H new ATOM 0 HG LEU D 40 10.253 -0.900 -6.775 1.00 99.99 H new ATOM 0 HD11 LEU D 40 10.137 -3.404 -6.643 1.00 99.99 H new ATOM 0 HD12 LEU D 40 8.514 -2.672 -6.649 1.00 99.99 H new ATOM 0 HD13 LEU D 40 9.158 -3.422 -8.129 1.00 99.99 H new ATOM 0 HD21 LEU D 40 12.030 -2.289 -7.769 1.00 99.99 H new ATOM 0 HD22 LEU D 40 11.154 -2.292 -9.318 1.00 99.99 H new ATOM 0 HD23 LEU D 40 11.793 -0.767 -8.660 1.00 99.99 H new ATOM 1499 N TRP D 41 7.306 1.586 -9.486 1.00 99.99 N ATOM 1500 CA TRP D 41 6.234 2.047 -10.360 1.00 99.99 C ATOM 1501 C TRP D 41 6.649 3.357 -11.014 1.00 99.99 C ATOM 1502 O TRP D 41 6.418 3.528 -12.184 1.00 99.99 O ATOM 1503 CB TRP D 41 4.929 2.332 -9.606 1.00 99.99 C ATOM 1504 CG TRP D 41 3.766 2.711 -10.505 1.00 99.99 C ATOM 1505 CD1 TRP D 41 3.003 1.873 -11.258 1.00 99.99 C ATOM 1506 CD2 TRP D 41 3.331 4.048 -10.807 1.00 99.99 C ATOM 1507 NE1 TRP D 41 2.063 2.583 -11.950 1.00 99.99 N ATOM 1508 CE2 TRP D 41 2.270 3.922 -11.724 1.00 99.99 C ATOM 1509 CE3 TRP D 41 3.764 5.298 -10.354 1.00 99.99 C ATOM 1510 CZ2 TRP D 41 1.606 5.044 -12.196 1.00 99.99 C ATOM 1511 CZ3 TRP D 41 3.100 6.424 -10.845 1.00 99.99 C ATOM 1512 CH2 TRP D 41 2.033 6.307 -11.753 1.00 99.99 C ATOM 0 H TRP D 41 7.072 1.609 -8.494 1.00 99.99 H new ATOM 0 HA TRP D 41 6.062 1.249 -11.082 1.00 99.99 H new ATOM 0 HB2 TRP D 41 4.655 1.449 -9.028 1.00 99.99 H new ATOM 0 HB3 TRP D 41 5.102 3.139 -8.894 1.00 99.99 H new ATOM 0 HD1 TRP D 41 3.123 0.801 -11.302 1.00 99.99 H new ATOM 0 HE1 TRP D 41 1.330 2.185 -12.537 1.00 99.99 H new ATOM 0 HE3 TRP D 41 4.580 5.389 -9.652 1.00 99.99 H new ATOM 0 HZ2 TRP D 41 0.781 4.949 -12.887 1.00 99.99 H new ATOM 0 HZ3 TRP D 41 3.413 7.405 -10.520 1.00 99.99 H new ATOM 0 HH2 TRP D 41 1.537 7.196 -12.113 1.00 99.99 H new ATOM 1523 N ILE D 42 7.213 4.205 -10.267 1.00 99.99 N ATOM 1524 CA ILE D 42 7.638 5.513 -10.754 1.00 99.99 C ATOM 1525 C ILE D 42 8.729 5.329 -11.799 1.00 99.99 C ATOM 1526 O ILE D 42 8.700 6.001 -12.800 1.00 99.99 O ATOM 1527 CB ILE D 42 8.238 6.394 -9.653 1.00 99.99 C ATOM 1528 CG1 ILE D 42 7.129 6.863 -8.683 1.00 99.99 C ATOM 1529 CG2 ILE D 42 8.968 7.613 -10.259 1.00 99.99 C ATOM 1530 CD1 ILE D 42 7.656 7.675 -7.490 1.00 99.99 C ATOM 0 H ILE D 42 7.412 4.044 -9.280 1.00 99.99 H new ATOM 0 HA ILE D 42 6.746 5.996 -11.153 1.00 99.99 H new ATOM 0 HB ILE D 42 8.966 5.801 -9.099 1.00 99.99 H new ATOM 0 HG12 ILE D 42 6.409 7.468 -9.234 1.00 99.99 H new ATOM 0 HG13 ILE D 42 6.593 5.991 -8.309 1.00 99.99 H new ATOM 0 HG21 ILE D 42 9.385 8.223 -9.458 1.00 99.99 H new ATOM 0 HG22 ILE D 42 9.772 7.269 -10.909 1.00 99.99 H new ATOM 0 HG23 ILE D 42 8.262 8.209 -10.838 1.00 99.99 H new ATOM 0 HD11 ILE D 42 6.822 7.970 -6.853 1.00 99.99 H new ATOM 0 HD12 ILE D 42 8.354 7.066 -6.915 1.00 99.99 H new ATOM 0 HD13 ILE D 42 8.167 8.566 -7.854 1.00 99.99 H new ATOM 1542 N LEU D 43 9.620 4.473 -11.542 1.00 99.99 N ATOM 1543 CA LEU D 43 10.737 4.215 -12.442 1.00 99.99 C ATOM 1544 C LEU D 43 10.210 3.625 -13.742 1.00 99.99 C ATOM 1545 O LEU D 43 10.743 3.925 -14.780 1.00 99.99 O ATOM 1546 CB LEU D 43 11.735 3.196 -11.877 1.00 99.99 C ATOM 1547 CG LEU D 43 12.554 3.708 -10.669 1.00 99.99 C ATOM 1548 CD1 LEU D 43 13.319 2.544 -10.013 1.00 99.99 C ATOM 1549 CD2 LEU D 43 13.534 4.822 -11.068 1.00 99.99 C ATOM 0 H LEU D 43 9.627 3.903 -10.696 1.00 99.99 H new ATOM 0 HA LEU D 43 11.242 5.170 -12.586 1.00 99.99 H new ATOM 0 HB2 LEU D 43 11.191 2.300 -11.578 1.00 99.99 H new ATOM 0 HB3 LEU D 43 12.424 2.902 -12.669 1.00 99.99 H new ATOM 0 HG LEU D 43 11.849 4.130 -9.953 1.00 99.99 H new ATOM 0 HD11 LEU D 43 13.892 2.918 -9.164 1.00 99.99 H new ATOM 0 HD12 LEU D 43 12.610 1.791 -9.669 1.00 99.99 H new ATOM 0 HD13 LEU D 43 13.998 2.099 -10.741 1.00 99.99 H new ATOM 0 HD21 LEU D 43 14.088 5.151 -10.189 1.00 99.99 H new ATOM 0 HD22 LEU D 43 14.231 4.443 -11.815 1.00 99.99 H new ATOM 0 HD23 LEU D 43 12.979 5.663 -11.483 1.00 99.99 H new ATOM 1561 N ASP D 44 9.234 2.831 -13.647 1.00 99.99 N ATOM 1562 CA ASP D 44 8.647 2.173 -14.806 1.00 99.99 C ATOM 1563 C ASP D 44 7.981 3.216 -15.694 1.00 99.99 C ATOM 1564 O ASP D 44 8.101 3.129 -16.891 1.00 99.99 O ATOM 1565 CB ASP D 44 7.554 1.162 -14.433 1.00 99.99 C ATOM 1566 CG ASP D 44 7.004 0.409 -15.659 1.00 99.99 C ATOM 1567 OD1 ASP D 44 7.770 -0.376 -16.268 1.00 99.99 O ATOM 1568 OD2 ASP D 44 5.790 0.563 -15.986 1.00 99.99 O ATOM 0 H ASP D 44 8.786 2.592 -12.762 1.00 99.99 H new ATOM 0 HA ASP D 44 9.463 1.650 -15.305 1.00 99.99 H new ATOM 0 HB2 ASP D 44 7.957 0.443 -13.720 1.00 99.99 H new ATOM 0 HB3 ASP D 44 6.737 1.683 -13.934 1.00 99.99 H new ATOM 1573 N ARG D 45 7.327 4.121 -15.109 1.00 99.99 N ATOM 1574 CA ARG D 45 6.620 5.169 -15.836 1.00 99.99 C ATOM 1575 C ARG D 45 7.624 6.024 -16.594 1.00 99.99 C ATOM 1576 O ARG D 45 7.388 6.329 -17.735 1.00 99.99 O ATOM 1577 CB ARG D 45 5.852 6.123 -14.911 1.00 99.99 C ATOM 1578 CG ARG D 45 4.696 5.448 -14.144 1.00 99.99 C ATOM 1579 CD ARG D 45 3.466 5.179 -15.022 1.00 99.99 C ATOM 1580 NE ARG D 45 3.565 3.779 -15.570 1.00 99.99 N ATOM 1581 CZ ARG D 45 2.895 3.414 -16.679 1.00 99.99 C ATOM 1582 NH1 ARG D 45 2.092 4.273 -17.331 1.00 99.99 N ATOM 1583 NH2 ARG D 45 3.019 2.149 -17.112 1.00 99.99 N ATOM 0 H ARG D 45 7.243 4.190 -14.095 1.00 99.99 H new ATOM 0 HA ARG D 45 5.916 4.661 -16.495 1.00 99.99 H new ATOM 0 HB2 ARG D 45 6.548 6.557 -14.193 1.00 99.99 H new ATOM 0 HB3 ARG D 45 5.451 6.945 -15.504 1.00 99.99 H new ATOM 0 HG2 ARG D 45 5.048 4.506 -13.724 1.00 99.99 H new ATOM 0 HG3 ARG D 45 4.405 6.082 -13.306 1.00 99.99 H new ATOM 0 HD2 ARG D 45 2.552 5.293 -14.439 1.00 99.99 H new ATOM 0 HD3 ARG D 45 3.417 5.902 -15.836 1.00 99.99 H new ATOM 0 HE ARG D 45 4.151 3.095 -15.092 1.00 99.99 H new ATOM 0 HH11 ARG D 45 1.979 5.227 -16.987 1.00 99.99 H new ATOM 0 HH12 ARG D 45 1.596 3.971 -18.169 1.00 99.99 H new ATOM 0 HH21 ARG D 45 3.610 1.491 -16.603 1.00 99.99 H new ATOM 0 HH22 ARG D 45 2.522 1.846 -17.950 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 10.375 6.445 -17.684 1.00 99.99 C ATOM 1600 O LEU D 46 11.063 5.453 -17.450 1.00 99.99 O ATOM 1601 CB LEU D 46 10.797 7.595 -15.566 1.00 99.99 C ATOM 1602 CG LEU D 46 10.373 8.382 -14.301 1.00 99.99 C ATOM 1603 CD1 LEU D 46 11.578 8.446 -13.343 1.00 99.99 C ATOM 1604 CD2 LEU D 46 9.865 9.795 -14.607 1.00 99.99 C ATOM 0 H LEU D 46 8.853 6.094 -15.000 1.00 99.99 H new ATOM 0 HA LEU D 46 9.191 8.112 -16.905 1.00 99.99 H new ATOM 0 HB2 LEU D 46 11.295 6.681 -15.243 1.00 99.99 H new ATOM 0 HB3 LEU D 46 11.538 8.190 -16.100 1.00 99.99 H new ATOM 0 HG LEU D 46 9.535 7.855 -13.845 1.00 99.99 H new ATOM 0 HD11 LEU D 46 11.300 8.997 -12.445 1.00 99.99 H new ATOM 0 HD12 LEU D 46 11.880 7.435 -13.070 1.00 99.99 H new ATOM 0 HD13 LEU D 46 12.408 8.952 -13.836 1.00 99.99 H new ATOM 0 HD21 LEU D 46 9.585 10.290 -13.677 1.00 99.99 H new ATOM 0 HD22 LEU D 46 10.652 10.366 -15.100 1.00 99.99 H new ATOM 0 HD23 LEU D 46 8.996 9.735 -15.262 1.00 99.99 H new