USER MOD reduce.3.24.130724 H: found=0, std=0, add=840, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 836 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 6 GLN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 9 SER OG : rot 170:sc= 0 USER MOD Single : A 11 CYS SG : rot 180:sc= -0.149 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 83:sc= 0.0123 USER MOD Single : A 19 HIS : no HD1:sc= -0.768 K(o=-0.77,f=-0.032) USER MOD Single : A 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 93:sc= 1.1 USER MOD Single : A 27 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 6 GLN : amide:sc= 0 K(o=0,f=-0.6) USER MOD Single : B 9 SER OG : rot 160:sc= 0 USER MOD Single : B 11 CYS SG : rot 180:sc= -0.149 USER MOD Single : B 12 SER OG : rot 180:sc= 0 USER MOD Single : B 16 SER OG : rot 81:sc= 0.0139 USER MOD Single : B 19 HIS : no HD1:sc= -0.715 K(o=-0.72,f=-0.027) USER MOD Single : B 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 24 THR OG1 : rot 107:sc= 1.17 USER MOD Single : B 27 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : C 6 GLN : amide:sc= 0 K(o=0,f=-0.66) USER MOD Single : C 9 SER OG : rot 170:sc= 0 USER MOD Single : C 11 CYS SG : rot 180:sc= -0.145 USER MOD Single : C 12 SER OG : rot 180:sc= 0 USER MOD Single : C 16 SER OG : rot 79:sc= 0.0144 USER MOD Single : C 19 HIS : no HD1:sc= -0.67 K(o=-0.67,f=-0.043) USER MOD Single : C 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 24 THR OG1 : rot 73:sc= 1.14 USER MOD Single : C 27 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : D 6 GLN : amide:sc= 0 K(o=0,f=-0.55) USER MOD Single : D 9 SER OG : rot 160:sc= 0 USER MOD Single : D 11 CYS SG : rot 180:sc= -0.15 USER MOD Single : D 12 SER OG : rot 180:sc= 0 USER MOD Single : D 16 SER OG : rot 81:sc= 0.014 USER MOD Single : D 19 HIS : no HD1:sc= -0.734 K(o=-0.73,f=-0.052) USER MOD Single : D 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : D 24 THR OG1 : rot 85:sc= 1.18 USER MOD Single : D 27 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 40 N GLU A 3 47.190 26.448 9.969 1.00 0.00 N0 ATOM 41 CA GLU A 3 46.644 25.104 9.979 1.00 0.00 C0 ATOM 42 C GLU A 3 46.232 24.706 11.405 1.00 0.00 C0 ATOM 43 O GLU A 3 47.067 24.725 12.315 1.00 0.00 O0 ATOM 44 CB GLU A 3 47.688 24.123 9.448 1.00 0.00 C0 ATOM 45 CG GLU A 3 47.901 24.377 7.956 1.00 0.00 C0 ATOM 46 CD GLU A 3 46.918 23.543 7.144 1.00 0.00 C0 ATOM 47 OE1 GLU A 3 47.047 22.329 7.163 1.00 0.00 O0 ATOM 48 OE2 GLU A 3 46.048 24.126 6.518 1.00 0.00 O1- ATOM 0 HA GLU A 3 45.762 25.076 9.340 1.00 0.00 H new ATOM 0 HB2 GLU A 3 48.627 24.245 9.988 1.00 0.00 H new ATOM 0 HB3 GLU A 3 47.357 23.097 9.611 1.00 0.00 H new ATOM 0 HG2 GLU A 3 47.763 25.435 7.735 1.00 0.00 H new ATOM 0 HG3 GLU A 3 48.924 24.124 7.677 1.00 0.00 H new ATOM 55 N PRO A 4 44.980 24.352 11.629 1.00 0.00 N0 ATOM 56 CA PRO A 4 44.499 23.955 12.983 1.00 0.00 C0 ATOM 57 C PRO A 4 45.036 22.593 13.415 1.00 0.00 C0 ATOM 58 O PRO A 4 45.290 22.365 14.596 1.00 0.00 O0 ATOM 59 CB PRO A 4 42.975 23.915 12.833 1.00 0.00 C0 ATOM 60 CG PRO A 4 42.725 23.664 11.385 1.00 0.00 C0 ATOM 61 CD PRO A 4 43.893 24.288 10.630 1.00 0.00 C0 ATOM 0 HA PRO A 4 44.840 24.648 13.752 1.00 0.00 H new ATOM 0 HB2 PRO A 4 42.540 23.128 13.449 1.00 0.00 H new ATOM 0 HB3 PRO A 4 42.524 24.855 13.152 1.00 0.00 H new ATOM 0 HG2 PRO A 4 42.659 22.595 11.182 1.00 0.00 H new ATOM 0 HG3 PRO A 4 41.780 24.107 11.072 1.00 0.00 H new ATOM 0 HD2 PRO A 4 44.179 23.684 9.769 1.00 0.00 H new ATOM 0 HD3 PRO A 4 43.640 25.279 10.254 1.00 0.00 H new ATOM 69 N PHE A 5 45.205 21.696 12.448 1.00 0.00 N0 ATOM 70 CA PHE A 5 45.710 20.360 12.738 1.00 0.00 C0 ATOM 71 C PHE A 5 46.378 19.759 11.506 1.00 0.00 C0 ATOM 72 O PHE A 5 47.603 19.755 11.389 1.00 0.00 O0 ATOM 73 CB PHE A 5 44.563 19.452 13.189 1.00 0.00 C0 ATOM 74 CG PHE A 5 44.220 19.749 14.630 1.00 0.00 C0 ATOM 75 CD1 PHE A 5 43.057 20.465 14.939 1.00 0.00 C0 ATOM 76 CD2 PHE A 5 45.066 19.310 15.654 1.00 0.00 C0 ATOM 77 CE1 PHE A 5 42.741 20.742 16.275 1.00 0.00 C0 ATOM 78 CE2 PHE A 5 44.750 19.587 16.989 1.00 0.00 C0 ATOM 79 CZ PHE A 5 43.588 20.302 17.300 1.00 0.00 C0 ATOM 0 H PHE A 5 45.001 21.869 11.464 1.00 0.00 H new ATOM 0 HA PHE A 5 46.447 20.439 13.537 1.00 0.00 H new ATOM 0 HB2 PHE A 5 43.690 19.611 12.556 1.00 0.00 H new ATOM 0 HB3 PHE A 5 44.849 18.406 13.081 1.00 0.00 H new ATOM 0 HD1 PHE A 5 42.404 20.803 14.148 1.00 0.00 H new ATOM 0 HD2 PHE A 5 45.963 18.758 15.414 1.00 0.00 H new ATOM 0 HE1 PHE A 5 41.845 21.295 16.515 1.00 0.00 H new ATOM 0 HE2 PHE A 5 45.403 19.249 17.780 1.00 0.00 H new ATOM 0 HZ PHE A 5 43.344 20.515 18.330 1.00 0.00 H new ATOM 89 N GLN A 6 45.561 19.247 10.593 1.00 0.00 N0 ATOM 90 CA GLN A 6 46.073 18.638 9.371 1.00 0.00 C0 ATOM 91 C GLN A 6 45.084 18.829 8.224 1.00 0.00 C0 ATOM 92 O GLN A 6 43.931 19.198 8.440 1.00 0.00 O0 ATOM 93 CB GLN A 6 46.318 17.144 9.594 1.00 0.00 C0 ATOM 94 CG GLN A 6 47.328 16.953 10.729 1.00 0.00 C0 ATOM 95 CD GLN A 6 47.700 15.481 10.858 1.00 0.00 C0 ATOM 96 OE1 GLN A 6 46.872 14.605 10.609 1.00 0.00 O0 ATOM 97 NE2 GLN A 6 48.904 15.154 11.241 1.00 0.00 N0 ATOM 0 H GLN A 6 44.544 19.241 10.675 1.00 0.00 H new ATOM 0 HA GLN A 6 47.013 19.124 9.111 1.00 0.00 H new ATOM 0 HB2 GLN A 6 45.381 16.644 9.840 1.00 0.00 H new ATOM 0 HB3 GLN A 6 46.693 16.686 8.679 1.00 0.00 H new ATOM 0 HG2 GLN A 6 48.222 17.546 10.534 1.00 0.00 H new ATOM 0 HG3 GLN A 6 46.905 17.313 11.667 1.00 0.00 H new ATOM 0 HE21 GLN A 6 49.589 15.881 11.447 1.00 0.00 H new ATOM 0 HE22 GLN A 6 49.160 14.171 11.334 1.00 0.00 H new ATOM 106 N ILE A 7 45.547 18.567 7.007 1.00 0.00 N0 ATOM 107 CA ILE A 7 44.700 18.706 5.824 1.00 0.00 C0 ATOM 108 C ILE A 7 43.469 17.801 5.937 1.00 0.00 C0 ATOM 109 O ILE A 7 42.363 18.171 5.541 1.00 0.00 O0 ATOM 110 CB ILE A 7 45.495 18.340 4.569 1.00 0.00 C0 ATOM 111 CG1 ILE A 7 46.554 19.415 4.302 1.00 0.00 C0 ATOM 112 CG2 ILE A 7 44.545 18.252 3.372 1.00 0.00 C0 ATOM 113 CD1 ILE A 7 47.547 18.912 3.249 1.00 0.00 C0 ATOM 0 H ILE A 7 46.499 18.258 6.812 1.00 0.00 H new ATOM 0 HA ILE A 7 44.369 19.742 5.754 1.00 0.00 H new ATOM 0 HB ILE A 7 45.985 17.377 4.717 1.00 0.00 H new ATOM 0 HG12 ILE A 7 46.076 20.332 3.957 1.00 0.00 H new ATOM 0 HG13 ILE A 7 47.080 19.658 5.225 1.00 0.00 H new ATOM 0 HG21 ILE A 7 45.110 17.991 2.477 1.00 0.00 H new ATOM 0 HG22 ILE A 7 43.792 17.487 3.561 1.00 0.00 H new ATOM 0 HG23 ILE A 7 44.056 19.215 3.224 1.00 0.00 H new ATOM 0 HD11 ILE A 7 48.298 19.679 3.062 1.00 0.00 H new ATOM 0 HD12 ILE A 7 48.035 18.007 3.612 1.00 0.00 H new ATOM 0 HD13 ILE A 7 47.015 18.691 2.323 1.00 0.00 H new ATOM 125 N LEU A 8 43.673 16.608 6.474 1.00 0.00 N0 ATOM 126 CA LEU A 8 42.578 15.654 6.636 1.00 0.00 C0 ATOM 127 C LEU A 8 41.597 16.125 7.715 1.00 0.00 C0 ATOM 128 O LEU A 8 40.380 15.930 7.602 1.00 0.00 O0 ATOM 129 CB LEU A 8 43.140 14.281 7.016 1.00 0.00 C0 ATOM 130 CG LEU A 8 42.155 13.187 6.595 1.00 0.00 C0 ATOM 131 CD1 LEU A 8 42.932 11.959 6.119 1.00 0.00 C0 ATOM 132 CD2 LEU A 8 41.277 12.804 7.787 1.00 0.00 C0 ATOM 0 H LEU A 8 44.579 16.275 6.804 1.00 0.00 H new ATOM 0 HA LEU A 8 42.042 15.582 5.689 1.00 0.00 H new ATOM 0 HB2 LEU A 8 44.103 14.124 6.530 1.00 0.00 H new ATOM 0 HB3 LEU A 8 43.314 14.233 8.091 1.00 0.00 H new ATOM 0 HG LEU A 8 41.526 13.556 5.785 1.00 0.00 H new ATOM 0 HD11 LEU A 8 42.232 11.179 5.819 1.00 0.00 H new ATOM 0 HD12 LEU A 8 43.558 12.231 5.269 1.00 0.00 H new ATOM 0 HD13 LEU A 8 43.561 11.590 6.929 1.00 0.00 H new ATOM 0 HD21 LEU A 8 40.576 12.025 7.487 1.00 0.00 H new ATOM 0 HD22 LEU A 8 41.905 12.434 8.598 1.00 0.00 H new ATOM 0 HD23 LEU A 8 40.723 13.679 8.127 1.00 0.00 H new ATOM 144 N SER A 9 42.139 16.769 8.746 1.00 0.00 N0 ATOM 145 CA SER A 9 41.317 17.284 9.841 1.00 0.00 C0 ATOM 146 C SER A 9 40.437 18.440 9.364 1.00 0.00 C0 ATOM 147 O SER A 9 39.244 18.499 9.675 1.00 0.00 O0 ATOM 148 CB SER A 9 42.204 17.766 10.986 1.00 0.00 C0 ATOM 149 OG SER A 9 41.388 18.215 12.059 1.00 0.00 O0 ATOM 0 H SER A 9 43.138 16.947 8.847 1.00 0.00 H new ATOM 0 HA SER A 9 40.678 16.473 10.191 1.00 0.00 H new ATOM 0 HB2 SER A 9 42.854 16.958 11.322 1.00 0.00 H new ATOM 0 HB3 SER A 9 42.851 18.574 10.644 1.00 0.00 H new ATOM 0 HG SER A 9 41.945 18.372 12.850 1.00 0.00 H new ATOM 155 N ILE A 10 41.026 19.350 8.593 1.00 0.00 N0 ATOM 156 CA ILE A 10 40.278 20.488 8.080 1.00 0.00 C0 ATOM 157 C ILE A 10 39.256 20.025 7.050 1.00 0.00 C0 ATOM 158 O ILE A 10 38.189 20.623 6.916 1.00 0.00 O0 ATOM 159 CB ILE A 10 41.233 21.513 7.452 1.00 0.00 C0 ATOM 160 CG1 ILE A 10 42.016 20.855 6.320 1.00 0.00 C0 ATOM 161 CG2 ILE A 10 42.208 22.010 8.521 1.00 0.00 C0 ATOM 162 CD1 ILE A 10 42.867 21.897 5.591 1.00 0.00 C0 ATOM 0 H ILE A 10 42.007 19.321 8.314 1.00 0.00 H new ATOM 0 HA ILE A 10 39.752 20.961 8.909 1.00 0.00 H new ATOM 0 HB ILE A 10 40.660 22.352 7.056 1.00 0.00 H new ATOM 0 HG12 ILE A 10 42.655 20.068 6.720 1.00 0.00 H new ATOM 0 HG13 ILE A 10 41.328 20.382 5.619 1.00 0.00 H new ATOM 0 HG21 ILE A 10 42.889 22.739 8.082 1.00 0.00 H new ATOM 0 HG22 ILE A 10 41.651 22.478 9.333 1.00 0.00 H new ATOM 0 HG23 ILE A 10 42.780 21.168 8.912 1.00 0.00 H new ATOM 0 HD11 ILE A 10 43.421 21.415 4.785 1.00 0.00 H new ATOM 0 HD12 ILE A 10 42.220 22.669 5.175 1.00 0.00 H new ATOM 0 HD13 ILE A 10 43.567 22.350 6.293 1.00 0.00 H new ATOM 174 N CYS A 11 39.580 18.949 6.331 1.00 0.00 N0 ATOM 175 CA CYS A 11 38.665 18.421 5.329 1.00 0.00 C0 ATOM 176 C CYS A 11 37.382 17.950 5.998 1.00 0.00 C0 ATOM 177 O CYS A 11 36.283 18.345 5.607 1.00 0.00 O0 ATOM 178 CB CYS A 11 39.322 17.256 4.590 1.00 0.00 C0 ATOM 179 SG CYS A 11 38.185 16.631 3.329 1.00 0.00 S0 ATOM 0 H CYS A 11 40.456 18.436 6.424 1.00 0.00 H new ATOM 0 HA CYS A 11 38.426 19.208 4.614 1.00 0.00 H new ATOM 0 HB2 CYS A 11 40.253 17.583 4.127 1.00 0.00 H new ATOM 0 HB3 CYS A 11 39.577 16.462 5.292 1.00 0.00 H new ATOM 0 HG CYS A 11 38.741 15.641 2.696 1.00 0.00 H new ATOM 185 N SER A 12 37.525 17.106 7.018 1.00 0.00 N0 ATOM 186 CA SER A 12 36.363 16.592 7.734 1.00 0.00 C0 ATOM 187 C SER A 12 35.570 17.737 8.357 1.00 0.00 C0 ATOM 188 O SER A 12 34.341 17.701 8.404 1.00 0.00 O0 ATOM 189 CB SER A 12 36.795 15.618 8.825 1.00 0.00 C0 ATOM 190 OG SER A 12 35.642 15.128 9.498 1.00 0.00 O0 ATOM 0 H SER A 12 38.423 16.768 7.363 1.00 0.00 H new ATOM 0 HA SER A 12 35.730 16.067 7.019 1.00 0.00 H new ATOM 0 HB2 SER A 12 37.356 14.791 8.389 1.00 0.00 H new ATOM 0 HB3 SER A 12 37.459 16.116 9.532 1.00 0.00 H new ATOM 0 HG SER A 12 35.915 14.500 10.199 1.00 0.00 H new ATOM 196 N PHE A 13 36.286 18.754 8.833 1.00 0.00 N0 ATOM 197 CA PHE A 13 35.636 19.910 9.444 1.00 0.00 C0 ATOM 198 C PHE A 13 34.685 20.593 8.458 1.00 0.00 C0 ATOM 199 O PHE A 13 33.510 20.826 8.767 1.00 0.00 O0 ATOM 200 CB PHE A 13 36.698 20.911 9.897 1.00 0.00 C0 ATOM 201 CG PHE A 13 36.040 22.228 10.236 1.00 0.00 C0 ATOM 202 CD1 PHE A 13 35.264 22.351 11.394 1.00 0.00 C0 ATOM 203 CD2 PHE A 13 36.212 23.330 9.389 1.00 0.00 C0 ATOM 204 CE1 PHE A 13 34.659 23.575 11.705 1.00 0.00 C0 ATOM 205 CE2 PHE A 13 35.607 24.555 9.701 1.00 0.00 C0 ATOM 206 CZ PHE A 13 34.830 24.677 10.859 1.00 0.00 C0 ATOM 0 H PHE A 13 37.305 18.801 8.808 1.00 0.00 H new ATOM 0 HA PHE A 13 35.056 19.564 10.300 1.00 0.00 H new ATOM 0 HB2 PHE A 13 37.230 20.524 10.766 1.00 0.00 H new ATOM 0 HB3 PHE A 13 37.437 21.054 9.109 1.00 0.00 H new ATOM 0 HD1 PHE A 13 35.132 21.502 12.048 1.00 0.00 H new ATOM 0 HD2 PHE A 13 36.811 23.236 8.495 1.00 0.00 H new ATOM 0 HE1 PHE A 13 34.060 23.669 12.599 1.00 0.00 H new ATOM 0 HE2 PHE A 13 35.740 25.405 9.048 1.00 0.00 H new ATOM 0 HZ PHE A 13 34.363 25.621 11.099 1.00 0.00 H new ATOM 216 N ILE A 14 35.186 20.887 7.261 1.00 0.00 N0 ATOM 217 CA ILE A 14 34.370 21.527 6.239 1.00 0.00 C0 ATOM 218 C ILE A 14 33.255 20.591 5.788 1.00 0.00 C0 ATOM 219 O ILE A 14 32.124 21.021 5.567 1.00 0.00 O0 ATOM 220 CB ILE A 14 35.240 21.915 5.038 1.00 0.00 C0 ATOM 221 CG1 ILE A 14 36.266 22.972 5.470 1.00 0.00 C0 ATOM 222 CG2 ILE A 14 34.354 22.485 3.923 1.00 0.00 C0 ATOM 223 CD1 ILE A 14 35.599 24.349 5.571 1.00 0.00 C0 ATOM 0 H ILE A 14 36.147 20.693 6.978 1.00 0.00 H new ATOM 0 HA ILE A 14 33.925 22.427 6.663 1.00 0.00 H new ATOM 0 HB ILE A 14 35.762 21.032 4.668 1.00 0.00 H new ATOM 0 HG12 ILE A 14 36.698 22.698 6.433 1.00 0.00 H new ATOM 0 HG13 ILE A 14 37.085 23.009 4.752 1.00 0.00 H new ATOM 0 HG21 ILE A 14 34.974 22.760 3.070 1.00 0.00 H new ATOM 0 HG22 ILE A 14 33.627 21.733 3.615 1.00 0.00 H new ATOM 0 HG23 ILE A 14 33.830 23.367 4.290 1.00 0.00 H new ATOM 0 HD11 ILE A 14 36.338 25.089 5.878 1.00 0.00 H new ATOM 0 HD12 ILE A 14 35.189 24.627 4.600 1.00 0.00 H new ATOM 0 HD13 ILE A 14 34.796 24.311 6.307 1.00 0.00 H new ATOM 235 N LEU A 15 33.580 19.309 5.661 1.00 0.00 N0 ATOM 236 CA LEU A 15 32.585 18.330 5.246 1.00 0.00 C0 ATOM 237 C LEU A 15 31.419 18.343 6.218 1.00 0.00 C0 ATOM 238 O LEU A 15 30.296 18.648 5.833 1.00 0.00 O0 ATOM 239 CB LEU A 15 33.204 16.935 5.193 1.00 0.00 C0 ATOM 240 CG LEU A 15 34.081 16.820 3.947 1.00 0.00 C0 ATOM 241 CD1 LEU A 15 34.953 15.569 4.054 1.00 0.00 C0 ATOM 242 CD2 LEU A 15 33.192 16.715 2.701 1.00 0.00 C0 ATOM 0 H LEU A 15 34.510 18.929 5.837 1.00 0.00 H new ATOM 0 HA LEU A 15 32.227 18.590 4.250 1.00 0.00 H new ATOM 0 HB2 LEU A 15 33.799 16.754 6.088 1.00 0.00 H new ATOM 0 HB3 LEU A 15 32.421 16.177 5.172 1.00 0.00 H new ATOM 0 HG LEU A 15 34.715 17.703 3.867 1.00 0.00 H new ATOM 0 HD11 LEU A 15 35.579 15.485 3.166 1.00 0.00 H new ATOM 0 HD12 LEU A 15 35.585 15.641 4.939 1.00 0.00 H new ATOM 0 HD13 LEU A 15 34.317 14.688 4.134 1.00 0.00 H new ATOM 0 HD21 LEU A 15 33.819 16.633 1.813 1.00 0.00 H new ATOM 0 HD22 LEU A 15 32.557 15.832 2.780 1.00 0.00 H new ATOM 0 HD23 LEU A 15 32.568 17.605 2.624 1.00 0.00 H new ATOM 254 N SER A 16 31.686 17.988 7.471 1.00 0.00 N0 ATOM 255 CA SER A 16 30.638 17.948 8.485 1.00 0.00 C0 ATOM 256 C SER A 16 29.815 19.227 8.442 1.00 0.00 C0 ATOM 257 O SER A 16 28.601 19.203 8.647 1.00 0.00 O0 ATOM 258 CB SER A 16 31.256 17.788 9.872 1.00 0.00 C0 ATOM 259 OG SER A 16 31.830 16.490 9.977 1.00 0.00 O0 ATOM 0 H SER A 16 32.613 17.726 7.807 1.00 0.00 H new ATOM 0 HA SER A 16 29.989 17.097 8.279 1.00 0.00 H new ATOM 0 HB2 SER A 16 32.018 18.551 10.035 1.00 0.00 H new ATOM 0 HB3 SER A 16 30.496 17.927 10.641 1.00 0.00 H new ATOM 0 HG SER A 16 32.725 16.495 9.577 1.00 0.00 H new ATOM 265 N ALA A 17 30.475 20.347 8.174 1.00 0.00 N0 ATOM 266 CA ALA A 17 29.772 21.621 8.108 1.00 0.00 C0 ATOM 267 C ALA A 17 28.692 21.590 7.024 1.00 0.00 C0 ATOM 268 O ALA A 17 27.522 21.878 7.279 1.00 0.00 O0 ATOM 269 CB ALA A 17 30.776 22.732 7.794 1.00 0.00 C0 ATOM 0 H ALA A 17 31.479 20.400 8.002 1.00 0.00 H new ATOM 0 HA ALA A 17 29.293 21.808 9.069 1.00 0.00 H new ATOM 0 HB1 ALA A 17 30.256 23.689 7.743 1.00 0.00 H new ATOM 0 HB2 ALA A 17 31.532 22.771 8.578 1.00 0.00 H new ATOM 0 HB3 ALA A 17 31.256 22.529 6.837 1.00 0.00 H new ATOM 275 N LEU A 18 29.088 21.225 5.811 1.00 0.00 N0 ATOM 276 CA LEU A 18 28.145 21.160 4.699 1.00 0.00 C0 ATOM 277 C LEU A 18 27.182 19.997 4.878 1.00 0.00 C0 ATOM 278 O LEU A 18 26.099 19.978 4.291 1.00 0.00 O0 ATOM 279 CB LEU A 18 28.900 20.990 3.380 1.00 0.00 C0 ATOM 280 CG LEU A 18 29.952 22.091 3.246 1.00 0.00 C0 ATOM 281 CD1 LEU A 18 30.691 21.935 1.917 1.00 0.00 C0 ATOM 282 CD2 LEU A 18 29.272 23.463 3.292 1.00 0.00 C0 ATOM 0 H LEU A 18 30.047 20.971 5.572 1.00 0.00 H new ATOM 0 HA LEU A 18 27.578 22.091 4.680 1.00 0.00 H new ATOM 0 HB2 LEU A 18 29.377 20.011 3.346 1.00 0.00 H new ATOM 0 HB3 LEU A 18 28.204 21.034 2.542 1.00 0.00 H new ATOM 0 HG LEU A 18 30.662 22.011 4.069 1.00 0.00 H new ATOM 0 HD11 LEU A 18 31.441 22.721 1.823 1.00 0.00 H new ATOM 0 HD12 LEU A 18 31.180 20.961 1.885 1.00 0.00 H new ATOM 0 HD13 LEU A 18 29.980 22.012 1.094 1.00 0.00 H new ATOM 0 HD21 LEU A 18 30.025 24.246 3.196 1.00 0.00 H new ATOM 0 HD22 LEU A 18 28.559 23.543 2.472 1.00 0.00 H new ATOM 0 HD23 LEU A 18 28.748 23.578 4.241 1.00 0.00 H new ATOM 294 N HIS A 19 27.579 19.038 5.697 1.00 0.00 N0 ATOM 295 CA HIS A 19 26.751 17.880 5.959 1.00 0.00 C0 ATOM 296 C HIS A 19 25.518 18.259 6.760 1.00 0.00 C0 ATOM 297 O HIS A 19 24.410 17.850 6.430 1.00 0.00 O0 ATOM 298 CB HIS A 19 27.556 16.830 6.721 1.00 0.00 C0 ATOM 299 CG HIS A 19 26.634 15.750 7.209 1.00 0.00 C0 ATOM 300 ND1 HIS A 19 26.347 14.622 6.457 1.00 0.00 N0 ATOM 301 CD2 HIS A 19 25.924 15.619 8.373 1.00 0.00 C0 ATOM 302 CE1 HIS A 19 25.497 13.865 7.173 1.00 0.00 C0 ATOM 303 NE2 HIS A 19 25.206 14.427 8.351 1.00 0.00 N0 ATOM 0 H HIS A 19 28.471 19.041 6.191 1.00 0.00 H new ATOM 0 HA HIS A 19 26.426 17.471 5.002 1.00 0.00 H new ATOM 0 HB2 HIS A 19 28.323 16.404 6.074 1.00 0.00 H new ATOM 0 HB3 HIS A 19 28.071 17.292 7.564 1.00 0.00 H new ATOM 0 HD2 HIS A 19 25.922 16.332 9.184 1.00 0.00 H new ATOM 0 HE1 HIS A 19 25.098 12.919 6.838 1.00 0.00 H new ATOM 0 HE2 HIS A 19 24.590 14.061 9.077 1.00 0.00 H new ATOM 311 N PHE A 20 25.714 19.063 7.796 1.00 0.00 N0 ATOM 312 CA PHE A 20 24.603 19.496 8.625 1.00 0.00 C0 ATOM 313 C PHE A 20 23.827 20.612 7.945 1.00 0.00 C0 ATOM 314 O PHE A 20 22.652 20.817 8.229 1.00 0.00 O0 ATOM 315 CB PHE A 20 25.117 19.979 9.979 1.00 0.00 C0 ATOM 316 CG PHE A 20 24.611 19.059 11.063 1.00 0.00 C0 ATOM 317 CD1 PHE A 20 25.174 17.787 11.227 1.00 0.00 C0 ATOM 318 CD2 PHE A 20 23.573 19.479 11.901 1.00 0.00 C0 ATOM 319 CE1 PHE A 20 24.695 16.936 12.228 1.00 0.00 C0 ATOM 320 CE2 PHE A 20 23.096 18.629 12.904 1.00 0.00 C0 ATOM 321 CZ PHE A 20 23.657 17.357 13.066 1.00 0.00 C0 ATOM 0 H PHE A 20 26.625 19.425 8.079 1.00 0.00 H new ATOM 0 HA PHE A 20 23.936 18.647 8.773 1.00 0.00 H new ATOM 0 HB2 PHE A 20 26.207 19.997 9.981 1.00 0.00 H new ATOM 0 HB3 PHE A 20 24.781 20.999 10.166 1.00 0.00 H new ATOM 0 HD1 PHE A 20 25.977 17.464 10.581 1.00 0.00 H new ATOM 0 HD2 PHE A 20 23.140 20.460 11.774 1.00 0.00 H new ATOM 0 HE1 PHE A 20 25.126 15.954 12.354 1.00 0.00 H new ATOM 0 HE2 PHE A 20 22.296 18.954 13.553 1.00 0.00 H new ATOM 0 HZ PHE A 20 23.288 16.699 13.839 1.00 0.00 H new ATOM 331 N MET A 21 24.479 21.320 7.032 1.00 0.00 N0 ATOM 332 CA MET A 21 23.819 22.404 6.320 1.00 0.00 C0 ATOM 333 C MET A 21 22.780 21.863 5.339 1.00 0.00 C0 ATOM 334 O MET A 21 21.590 22.168 5.437 1.00 0.00 O0 ATOM 335 CB MET A 21 24.864 23.220 5.562 1.00 0.00 C0 ATOM 336 CG MET A 21 25.631 24.099 6.554 1.00 0.00 C0 ATOM 337 SD MET A 21 24.555 25.426 7.153 1.00 0.00 S0 ATOM 338 CE MET A 21 25.779 26.254 8.200 1.00 0.00 C0 ATOM 0 H MET A 21 25.453 21.165 6.770 1.00 0.00 H new ATOM 0 HA MET A 21 23.307 23.036 7.046 1.00 0.00 H new ATOM 0 HB2 MET A 21 25.552 22.556 5.038 1.00 0.00 H new ATOM 0 HB3 MET A 21 24.381 23.839 4.806 1.00 0.00 H new ATOM 0 HG2 MET A 21 25.983 23.497 7.392 1.00 0.00 H new ATOM 0 HG3 MET A 21 26.513 24.522 6.073 1.00 0.00 H new ATOM 0 HE1 MET A 21 25.322 27.120 8.678 1.00 0.00 H new ATOM 0 HE2 MET A 21 26.132 25.562 8.964 1.00 0.00 H new ATOM 0 HE3 MET A 21 26.621 26.579 7.588 1.00 0.00 H new ATOM 348 N ALA A 22 23.242 21.062 4.389 1.00 0.00 N0 ATOM 349 CA ALA A 22 22.347 20.490 3.389 1.00 0.00 C0 ATOM 350 C ALA A 22 21.342 19.542 4.034 1.00 0.00 C0 ATOM 351 O ALA A 22 20.160 19.543 3.683 1.00 0.00 O0 ATOM 352 CB ALA A 22 23.153 19.745 2.326 1.00 0.00 C0 ATOM 0 H ALA A 22 24.221 20.795 4.288 1.00 0.00 H new ATOM 0 HA ALA A 22 21.799 21.306 2.919 1.00 0.00 H new ATOM 0 HB1 ALA A 22 22.475 19.322 1.585 1.00 0.00 H new ATOM 0 HB2 ALA A 22 23.838 20.438 1.837 1.00 0.00 H new ATOM 0 HB3 ALA A 22 23.722 18.943 2.796 1.00 0.00 H new ATOM 358 N TRP A 23 21.820 18.724 4.967 1.00 0.00 N0 ATOM 359 CA TRP A 23 20.948 17.769 5.639 1.00 0.00 C0 ATOM 360 C TRP A 23 19.850 18.498 6.416 1.00 0.00 C0 ATOM 361 O TRP A 23 18.704 18.049 6.453 1.00 0.00 O0 ATOM 362 CB TRP A 23 21.765 16.886 6.581 1.00 0.00 C0 ATOM 363 CG TRP A 23 20.950 15.711 7.004 1.00 0.00 C0 ATOM 364 CD1 TRP A 23 20.988 14.492 6.417 1.00 0.00 C0 ATOM 365 CD2 TRP A 23 19.970 15.617 8.080 1.00 0.00 C0 ATOM 366 NE1 TRP A 23 20.103 13.653 7.071 1.00 0.00 N0 ATOM 367 CE2 TRP A 23 19.450 14.301 8.101 1.00 0.00 C0 ATOM 368 CE3 TRP A 23 19.488 16.533 9.034 1.00 0.00 C0 ATOM 369 CZ2 TRP A 23 18.487 13.906 9.032 1.00 0.00 C0 ATOM 370 CZ3 TRP A 23 18.517 16.138 9.972 1.00 0.00 C0 ATOM 371 CH2 TRP A 23 18.019 14.828 9.970 1.00 0.00 C0 ATOM 0 H TRP A 23 22.793 18.703 5.271 1.00 0.00 H new ATOM 0 HA TRP A 23 20.476 17.139 4.885 1.00 0.00 H new ATOM 0 HB2 TRP A 23 22.674 16.549 6.082 1.00 0.00 H new ATOM 0 HB3 TRP A 23 22.075 17.459 7.455 1.00 0.00 H new ATOM 0 HD1 TRP A 23 21.608 14.219 5.576 1.00 0.00 H new ATOM 0 HE1 TRP A 23 19.951 12.675 6.823 1.00 0.00 H new ATOM 0 HE3 TRP A 23 19.866 17.545 9.046 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 18.107 12.895 9.026 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 18.153 16.849 10.699 1.00 0.00 H new ATOM 0 HH2 TRP A 23 17.274 14.532 10.694 1.00 0.00 H new ATOM 382 N THR A 24 20.203 19.638 7.010 1.00 0.00 N0 ATOM 383 CA THR A 24 19.231 20.436 7.755 1.00 0.00 C0 ATOM 384 C THR A 24 18.161 21.000 6.827 1.00 0.00 C0 ATOM 385 O THR A 24 16.972 20.972 7.148 1.00 0.00 O0 ATOM 386 CB THR A 24 19.936 21.585 8.481 1.00 0.00 C0 ATOM 387 OG1 THR A 24 20.607 21.080 9.625 1.00 0.00 O0 ATOM 388 CG2 THR A 24 18.913 22.643 8.899 1.00 0.00 C0 ATOM 0 H THR A 24 21.146 20.026 6.990 1.00 0.00 H new ATOM 0 HA THR A 24 18.751 19.785 8.485 1.00 0.00 H new ATOM 0 HB THR A 24 20.663 22.044 7.811 1.00 0.00 H new ATOM 0 HG1 THR A 24 21.532 20.856 9.390 1.00 0.00 H new ATOM 0 HG21 THR A 24 19.422 23.457 9.415 1.00 0.00 H new ATOM 0 HG22 THR A 24 18.410 23.032 8.014 1.00 0.00 H new ATOM 0 HG23 THR A 24 18.177 22.194 9.566 1.00 0.00 H new ATOM 396 N ILE A 25 18.585 21.508 5.675 1.00 0.00 N0 ATOM 397 CA ILE A 25 17.643 22.072 4.714 1.00 0.00 C0 ATOM 398 C ILE A 25 16.653 21.007 4.251 1.00 0.00 C0 ATOM 399 O ILE A 25 15.451 21.259 4.163 1.00 0.00 O0 ATOM 400 CB ILE A 25 18.402 22.632 3.512 1.00 0.00 C0 ATOM 401 CG1 ILE A 25 19.199 23.865 3.945 1.00 0.00 C0 ATOM 402 CG2 ILE A 25 17.409 23.026 2.415 1.00 0.00 C0 ATOM 403 CD1 ILE A 25 20.197 24.242 2.846 1.00 0.00 C0 ATOM 0 H ILE A 25 19.563 21.541 5.386 1.00 0.00 H new ATOM 0 HA ILE A 25 17.090 22.877 5.198 1.00 0.00 H new ATOM 0 HB ILE A 25 19.083 21.873 3.127 1.00 0.00 H new ATOM 0 HG12 ILE A 25 18.523 24.698 4.138 1.00 0.00 H new ATOM 0 HG13 ILE A 25 19.728 23.661 4.876 1.00 0.00 H new ATOM 0 HG21 ILE A 25 17.952 23.425 1.559 1.00 0.00 H new ATOM 0 HG22 ILE A 25 16.840 22.149 2.107 1.00 0.00 H new ATOM 0 HG23 ILE A 25 16.727 23.785 2.797 1.00 0.00 H new ATOM 0 HD11 ILE A 25 20.764 25.120 3.155 1.00 0.00 H new ATOM 0 HD12 ILE A 25 20.881 23.410 2.674 1.00 0.00 H new ATOM 0 HD13 ILE A 25 19.658 24.464 1.925 1.00 0.00 H new ATOM 415 N GLY A 26 17.165 19.815 3.962 1.00 0.00 N0 ATOM 416 CA GLY A 26 16.315 18.715 3.517 1.00 0.00 C0 ATOM 417 C GLY A 26 15.307 18.332 4.596 1.00 0.00 C0 ATOM 418 O GLY A 26 14.139 18.071 4.308 1.00 0.00 O0 ATOM 0 H GLY A 26 18.157 19.586 4.027 1.00 0.00 H new ATOM 0 HA2 GLY A 26 15.788 19.003 2.608 1.00 0.00 H new ATOM 0 HA3 GLY A 26 16.932 17.852 3.268 1.00 0.00 H new ATOM 422 N HIS A 27 15.768 18.310 5.842 1.00 0.00 N0 ATOM 423 CA HIS A 27 14.905 17.966 6.966 1.00 0.00 C0 ATOM 424 C HIS A 27 13.737 18.939 7.072 1.00 0.00 C0 ATOM 425 O HIS A 27 12.598 18.534 7.310 1.00 0.00 O0 ATOM 426 CB HIS A 27 15.708 17.988 8.267 1.00 0.00 C0 ATOM 427 CG HIS A 27 14.767 17.909 9.436 1.00 0.00 C0 ATOM 428 ND1 HIS A 27 14.087 16.747 9.765 1.00 0.00 N0 ATOM 429 CD2 HIS A 27 14.378 18.847 10.358 1.00 0.00 C0 ATOM 430 CE1 HIS A 27 13.330 17.013 10.846 1.00 0.00 C0 ATOM 431 NE2 HIS A 27 13.470 18.279 11.249 1.00 0.00 N0 ATOM 0 H HIS A 27 16.731 18.526 6.099 1.00 0.00 H new ATOM 0 HA HIS A 27 14.510 16.964 6.797 1.00 0.00 H new ATOM 0 HB2 HIS A 27 16.406 17.151 8.291 1.00 0.00 H new ATOM 0 HB3 HIS A 27 16.302 18.900 8.325 1.00 0.00 H new ATOM 0 HD2 HIS A 27 14.723 19.870 10.389 1.00 0.00 H new ATOM 0 HE1 HIS A 27 12.688 16.291 11.329 1.00 0.00 H new ATOM 0 HE2 HIS A 27 13.011 18.732 12.039 1.00 0.00 H new ATOM 439 N LEU A 28 14.024 20.222 6.894 1.00 0.00 N0 ATOM 440 CA LEU A 28 12.989 21.246 6.973 1.00 0.00 C0 ATOM 441 C LEU A 28 12.089 21.195 5.742 1.00 0.00 C0 ATOM 442 O LEU A 28 12.559 20.973 4.626 1.00 0.00 O0 ATOM 443 CB LEU A 28 13.639 22.625 7.078 1.00 0.00 C0 ATOM 444 CG LEU A 28 14.402 22.732 8.398 1.00 0.00 C0 ATOM 445 CD1 LEU A 28 15.279 23.984 8.381 1.00 0.00 C0 ATOM 446 CD2 LEU A 28 13.405 22.829 9.557 1.00 0.00 C0 ATOM 0 H LEU A 28 14.959 20.578 6.695 1.00 0.00 H new ATOM 0 HA LEU A 28 12.380 21.060 7.858 1.00 0.00 H new ATOM 0 HB2 LEU A 28 14.318 22.783 6.240 1.00 0.00 H new ATOM 0 HB3 LEU A 28 12.877 23.403 7.022 1.00 0.00 H new ATOM 0 HG LEU A 28 15.028 21.849 8.526 1.00 0.00 H new ATOM 0 HD11 LEU A 28 15.823 24.060 9.323 1.00 0.00 H new ATOM 0 HD12 LEU A 28 15.989 23.920 7.556 1.00 0.00 H new ATOM 0 HD13 LEU A 28 14.652 24.866 8.252 1.00 0.00 H new ATOM 0 HD21 LEU A 28 13.948 22.905 10.499 1.00 0.00 H new ATOM 0 HD22 LEU A 28 12.780 23.712 9.426 1.00 0.00 H new ATOM 0 HD23 LEU A 28 12.777 21.939 9.572 1.00 0.00 H new ATOM 594 N GLU B 3 40.644 17.001 30.748 1.00 0.00 N0 ATOM 595 CA GLU B 3 40.532 16.827 29.313 1.00 0.00 C0 ATOM 596 C GLU B 3 40.767 15.355 28.933 1.00 0.00 C0 ATOM 597 O GLU B 3 41.825 14.801 29.248 1.00 0.00 O0 ATOM 598 CB GLU B 3 41.557 17.714 28.608 1.00 0.00 C0 ATOM 599 CG GLU B 3 41.160 19.178 28.790 1.00 0.00 C0 ATOM 600 CD GLU B 3 40.230 19.607 27.661 1.00 0.00 C0 ATOM 601 OE1 GLU B 3 40.690 19.661 26.532 1.00 0.00 O0 ATOM 602 OE2 GLU B 3 39.073 19.872 27.941 1.00 0.00 O1- ATOM 0 HA GLU B 3 39.528 17.113 28.999 1.00 0.00 H new ATOM 0 HB2 GLU B 3 42.551 17.540 29.020 1.00 0.00 H new ATOM 0 HB3 GLU B 3 41.603 17.466 27.548 1.00 0.00 H new ATOM 0 HG2 GLU B 3 40.665 19.313 29.752 1.00 0.00 H new ATOM 0 HG3 GLU B 3 42.050 19.807 28.799 1.00 0.00 H new ATOM 609 N PRO B 4 39.822 14.710 28.277 1.00 0.00 N0 ATOM 610 CA PRO B 4 39.970 13.282 27.876 1.00 0.00 C0 ATOM 611 C PRO B 4 40.978 13.098 26.746 1.00 0.00 C0 ATOM 612 O PRO B 4 41.679 12.089 26.688 1.00 0.00 O0 ATOM 613 CB PRO B 4 38.564 12.883 27.418 1.00 0.00 C0 ATOM 614 CG PRO B 4 37.908 14.152 26.995 1.00 0.00 C0 ATOM 615 CD PRO B 4 38.520 15.261 27.845 1.00 0.00 C0 ATOM 0 HA PRO B 4 40.348 12.670 28.694 1.00 0.00 H new ATOM 0 HB2 PRO B 4 38.607 12.170 26.595 1.00 0.00 H new ATOM 0 HB3 PRO B 4 38.009 12.405 28.225 1.00 0.00 H new ATOM 0 HG2 PRO B 4 38.074 14.340 25.934 1.00 0.00 H new ATOM 0 HG3 PRO B 4 36.830 14.099 27.144 1.00 0.00 H new ATOM 0 HD2 PRO B 4 38.647 16.179 27.271 1.00 0.00 H new ATOM 0 HD3 PRO B 4 37.887 15.504 28.699 1.00 0.00 H new ATOM 623 N PHE B 5 41.044 14.080 25.852 1.00 0.00 N0 ATOM 624 CA PHE B 5 41.969 14.016 24.727 1.00 0.00 C0 ATOM 625 C PHE B 5 42.308 15.417 24.230 1.00 0.00 C0 ATOM 626 O PHE B 5 43.367 15.959 24.544 1.00 0.00 O0 ATOM 627 CB PHE B 5 41.350 13.207 23.584 1.00 0.00 C0 ATOM 628 CG PHE B 5 41.458 11.733 23.892 1.00 0.00 C0 ATOM 629 CD1 PHE B 5 40.325 11.015 24.293 1.00 0.00 C0 ATOM 630 CD2 PHE B 5 42.693 11.085 23.778 1.00 0.00 C0 ATOM 631 CE1 PHE B 5 40.428 9.648 24.579 1.00 0.00 C0 ATOM 632 CE2 PHE B 5 42.796 9.720 24.064 1.00 0.00 C0 ATOM 633 CZ PHE B 5 41.665 9.001 24.465 1.00 0.00 C0 ATOM 0 H PHE B 5 40.472 14.924 25.884 1.00 0.00 H new ATOM 0 HA PHE B 5 42.884 13.529 25.064 1.00 0.00 H new ATOM 0 HB2 PHE B 5 40.305 13.486 23.452 1.00 0.00 H new ATOM 0 HB3 PHE B 5 41.861 13.432 22.648 1.00 0.00 H new ATOM 0 HD1 PHE B 5 39.372 11.515 24.382 1.00 0.00 H new ATOM 0 HD2 PHE B 5 43.567 11.639 23.469 1.00 0.00 H new ATOM 0 HE1 PHE B 5 39.554 9.093 24.887 1.00 0.00 H new ATOM 0 HE2 PHE B 5 43.749 9.221 23.975 1.00 0.00 H new ATOM 0 HZ PHE B 5 41.746 7.947 24.687 1.00 0.00 H new ATOM 643 N GLN B 6 41.402 15.996 23.447 1.00 0.00 N0 ATOM 644 CA GLN B 6 41.609 17.330 22.904 1.00 0.00 C0 ATOM 645 C GLN B 6 40.272 18.047 22.728 1.00 0.00 C0 ATOM 646 O GLN B 6 39.210 17.428 22.792 1.00 0.00 O0 ATOM 647 CB GLN B 6 42.321 17.241 21.551 1.00 0.00 C0 ATOM 648 CG GLN B 6 43.670 16.541 21.728 1.00 0.00 C0 ATOM 649 CD GLN B 6 44.458 16.583 20.422 1.00 0.00 C0 ATOM 650 OE1 GLN B 6 43.873 16.542 19.341 1.00 0.00 O0 ATOM 651 NE2 GLN B 6 45.761 16.661 20.460 1.00 0.00 N0 ATOM 0 H GLN B 6 40.520 15.561 23.176 1.00 0.00 H new ATOM 0 HA GLN B 6 42.226 17.895 23.603 1.00 0.00 H new ATOM 0 HB2 GLN B 6 41.705 16.691 20.840 1.00 0.00 H new ATOM 0 HB3 GLN B 6 42.469 18.240 21.140 1.00 0.00 H new ATOM 0 HG2 GLN B 6 44.239 17.026 22.521 1.00 0.00 H new ATOM 0 HG3 GLN B 6 43.514 15.507 22.035 1.00 0.00 H new ATOM 0 HE21 GLN B 6 46.244 16.695 21.358 1.00 0.00 H new ATOM 0 HE22 GLN B 6 46.296 16.688 19.592 1.00 0.00 H new ATOM 660 N ILE B 7 40.338 19.354 22.506 1.00 0.00 N0 ATOM 661 CA ILE B 7 39.131 20.157 22.319 1.00 0.00 C0 ATOM 662 C ILE B 7 38.318 19.635 21.129 1.00 0.00 C0 ATOM 663 O ILE B 7 37.088 19.606 21.159 1.00 0.00 O0 ATOM 664 CB ILE B 7 39.510 21.619 22.080 1.00 0.00 C0 ATOM 665 CG1 ILE B 7 40.067 22.222 23.374 1.00 0.00 C0 ATOM 666 CG2 ILE B 7 38.270 22.404 21.646 1.00 0.00 C0 ATOM 667 CD1 ILE B 7 40.734 23.568 23.073 1.00 0.00 C0 ATOM 0 H ILE B 7 41.210 19.881 22.451 1.00 0.00 H new ATOM 0 HA ILE B 7 38.523 20.083 23.220 1.00 0.00 H new ATOM 0 HB ILE B 7 40.267 21.673 21.298 1.00 0.00 H new ATOM 0 HG12 ILE B 7 39.264 22.357 24.098 1.00 0.00 H new ATOM 0 HG13 ILE B 7 40.789 21.540 23.823 1.00 0.00 H new ATOM 0 HG21 ILE B 7 38.540 23.446 21.476 1.00 0.00 H new ATOM 0 HG22 ILE B 7 37.873 21.977 20.725 1.00 0.00 H new ATOM 0 HG23 ILE B 7 37.512 22.349 22.428 1.00 0.00 H new ATOM 0 HD11 ILE B 7 41.129 23.993 23.996 1.00 0.00 H new ATOM 0 HD12 ILE B 7 41.549 23.420 22.364 1.00 0.00 H new ATOM 0 HD13 ILE B 7 40.000 24.250 22.644 1.00 0.00 H new ATOM 679 N LEU B 8 39.019 19.230 20.080 1.00 0.00 N0 ATOM 680 CA LEU B 8 38.359 18.711 18.886 1.00 0.00 C0 ATOM 681 C LEU B 8 37.720 17.345 19.164 1.00 0.00 C0 ATOM 682 O LEU B 8 36.645 17.026 18.643 1.00 0.00 O0 ATOM 683 CB LEU B 8 39.373 18.583 17.747 1.00 0.00 C0 ATOM 684 CG LEU B 8 38.650 18.651 16.401 1.00 0.00 C0 ATOM 685 CD1 LEU B 8 39.524 19.397 15.390 1.00 0.00 C0 ATOM 686 CD2 LEU B 8 38.381 17.233 15.893 1.00 0.00 C0 ATOM 0 H LEU B 8 40.038 19.249 20.029 1.00 0.00 H new ATOM 0 HA LEU B 8 37.572 19.408 18.599 1.00 0.00 H new ATOM 0 HB2 LEU B 8 40.112 19.381 17.814 1.00 0.00 H new ATOM 0 HB3 LEU B 8 39.913 17.640 17.833 1.00 0.00 H new ATOM 0 HG LEU B 8 37.704 19.178 16.524 1.00 0.00 H new ATOM 0 HD11 LEU B 8 39.009 19.446 14.430 1.00 0.00 H new ATOM 0 HD12 LEU B 8 39.716 20.408 15.751 1.00 0.00 H new ATOM 0 HD13 LEU B 8 40.470 18.870 15.268 1.00 0.00 H new ATOM 0 HD21 LEU B 8 37.866 17.282 14.934 1.00 0.00 H new ATOM 0 HD22 LEU B 8 39.327 16.705 15.770 1.00 0.00 H new ATOM 0 HD23 LEU B 8 37.759 16.701 16.612 1.00 0.00 H new ATOM 698 N SER B 9 38.386 16.558 20.007 1.00 0.00 N0 ATOM 699 CA SER B 9 37.884 15.232 20.370 1.00 0.00 C0 ATOM 700 C SER B 9 36.609 15.344 21.204 1.00 0.00 C0 ATOM 701 O SER B 9 35.631 14.630 20.965 1.00 0.00 O0 ATOM 702 CB SER B 9 38.942 14.466 21.160 1.00 0.00 C0 ATOM 703 OG SER B 9 38.458 13.164 21.459 1.00 0.00 O0 ATOM 0 H SER B 9 39.269 16.812 20.450 1.00 0.00 H new ATOM 0 HA SER B 9 37.657 14.693 19.450 1.00 0.00 H new ATOM 0 HB2 SER B 9 39.865 14.399 20.583 1.00 0.00 H new ATOM 0 HB3 SER B 9 39.180 14.998 22.081 1.00 0.00 H new ATOM 0 HG SER B 9 39.212 12.575 21.668 1.00 0.00 H new ATOM 709 N ILE B 10 36.619 16.251 22.178 1.00 0.00 N0 ATOM 710 CA ILE B 10 35.453 16.443 23.029 1.00 0.00 C0 ATOM 711 C ILE B 10 34.310 17.051 22.228 1.00 0.00 C0 ATOM 712 O ILE B 10 33.142 16.786 22.508 1.00 0.00 O0 ATOM 713 CB ILE B 10 35.807 17.346 24.218 1.00 0.00 C0 ATOM 714 CG1 ILE B 10 36.300 18.696 23.705 1.00 0.00 C0 ATOM 715 CG2 ILE B 10 36.913 16.683 25.039 1.00 0.00 C0 ATOM 716 CD1 ILE B 10 36.521 19.657 24.876 1.00 0.00 C0 ATOM 0 H ILE B 10 37.411 16.856 22.394 1.00 0.00 H new ATOM 0 HA ILE B 10 35.135 15.472 23.410 1.00 0.00 H new ATOM 0 HB ILE B 10 34.924 17.495 24.839 1.00 0.00 H new ATOM 0 HG12 ILE B 10 37.230 18.566 23.151 1.00 0.00 H new ATOM 0 HG13 ILE B 10 35.573 19.117 23.011 1.00 0.00 H new ATOM 0 HG21 ILE B 10 37.169 17.320 25.886 1.00 0.00 H new ATOM 0 HG22 ILE B 10 36.566 15.716 25.404 1.00 0.00 H new ATOM 0 HG23 ILE B 10 37.794 16.539 24.414 1.00 0.00 H new ATOM 0 HD11 ILE B 10 36.873 20.617 24.498 1.00 0.00 H new ATOM 0 HD12 ILE B 10 35.582 19.800 25.412 1.00 0.00 H new ATOM 0 HD13 ILE B 10 37.265 19.239 25.554 1.00 0.00 H new ATOM 728 N CYS B 11 34.650 17.862 21.225 1.00 0.00 N0 ATOM 729 CA CYS B 11 33.631 18.485 20.394 1.00 0.00 C0 ATOM 730 C CYS B 11 32.842 17.415 19.651 1.00 0.00 C0 ATOM 731 O CYS B 11 31.612 17.386 19.705 1.00 0.00 O0 ATOM 732 CB CYS B 11 34.286 19.434 19.391 1.00 0.00 C0 ATOM 733 SG CYS B 11 33.004 20.225 18.390 1.00 0.00 S0 ATOM 0 H CYS B 11 35.610 18.098 20.974 1.00 0.00 H new ATOM 0 HA CYS B 11 32.952 19.052 21.031 1.00 0.00 H new ATOM 0 HB2 CYS B 11 34.871 20.189 19.916 1.00 0.00 H new ATOM 0 HB3 CYS B 11 34.976 18.885 18.751 1.00 0.00 H new ATOM 0 HG CYS B 11 33.558 21.035 17.537 1.00 0.00 H new ATOM 739 N SER B 12 33.559 16.530 18.962 1.00 0.00 N0 ATOM 740 CA SER B 12 32.909 15.460 18.215 1.00 0.00 C0 ATOM 741 C SER B 12 32.095 14.574 19.152 1.00 0.00 C0 ATOM 742 O SER B 12 31.019 14.098 18.792 1.00 0.00 O0 ATOM 743 CB SER B 12 33.946 14.614 17.481 1.00 0.00 C0 ATOM 744 OG SER B 12 33.281 13.585 16.758 1.00 0.00 O0 ATOM 0 H SER B 12 34.577 16.533 18.906 1.00 0.00 H new ATOM 0 HA SER B 12 32.240 15.914 17.484 1.00 0.00 H new ATOM 0 HB2 SER B 12 34.526 15.237 16.800 1.00 0.00 H new ATOM 0 HB3 SER B 12 34.649 14.180 18.192 1.00 0.00 H new ATOM 0 HG SER B 12 33.942 13.039 16.283 1.00 0.00 H new ATOM 750 N PHE B 13 32.619 14.359 20.355 1.00 0.00 N0 ATOM 751 CA PHE B 13 31.926 13.533 21.341 1.00 0.00 C0 ATOM 752 C PHE B 13 30.543 14.105 21.663 1.00 0.00 C0 ATOM 753 O PHE B 13 29.532 13.395 21.595 1.00 0.00 O0 ATOM 754 CB PHE B 13 32.756 13.465 22.622 1.00 0.00 C0 ATOM 755 CG PHE B 13 31.919 12.887 23.739 1.00 0.00 C0 ATOM 756 CD1 PHE B 13 31.591 11.526 23.741 1.00 0.00 C0 ATOM 757 CD2 PHE B 13 31.475 13.716 24.777 1.00 0.00 C0 ATOM 758 CE1 PHE B 13 30.816 10.996 24.781 1.00 0.00 C0 ATOM 759 CE2 PHE B 13 30.700 13.185 25.815 1.00 0.00 C0 ATOM 760 CZ PHE B 13 30.371 11.825 25.818 1.00 0.00 C0 ATOM 0 H PHE B 13 33.511 14.740 20.669 1.00 0.00 H new ATOM 0 HA PHE B 13 31.799 12.534 20.924 1.00 0.00 H new ATOM 0 HB2 PHE B 13 33.641 12.849 22.461 1.00 0.00 H new ATOM 0 HB3 PHE B 13 33.106 14.461 22.894 1.00 0.00 H new ATOM 0 HD1 PHE B 13 31.935 10.886 22.942 1.00 0.00 H new ATOM 0 HD2 PHE B 13 31.731 14.765 24.777 1.00 0.00 H new ATOM 0 HE1 PHE B 13 30.561 9.946 24.783 1.00 0.00 H new ATOM 0 HE2 PHE B 13 30.356 13.825 26.614 1.00 0.00 H new ATOM 0 HZ PHE B 13 29.774 11.415 26.619 1.00 0.00 H new ATOM 770 N ILE B 14 30.498 15.395 21.987 1.00 0.00 N0 ATOM 771 CA ILE B 14 29.233 16.046 22.303 1.00 0.00 C0 ATOM 772 C ILE B 14 28.338 16.093 21.070 1.00 0.00 C0 ATOM 773 O ILE B 14 27.128 15.886 21.162 1.00 0.00 O0 ATOM 774 CB ILE B 14 29.490 17.469 22.812 1.00 0.00 C0 ATOM 775 CG1 ILE B 14 30.265 17.406 24.135 1.00 0.00 C0 ATOM 776 CG2 ILE B 14 28.151 18.187 23.034 1.00 0.00 C0 ATOM 777 CD1 ILE B 14 29.320 17.046 25.288 1.00 0.00 C0 ATOM 0 H ILE B 14 31.315 16.004 22.037 1.00 0.00 H new ATOM 0 HA ILE B 14 28.730 15.471 23.081 1.00 0.00 H new ATOM 0 HB ILE B 14 30.075 18.018 22.074 1.00 0.00 H new ATOM 0 HG12 ILE B 14 31.061 16.665 24.063 1.00 0.00 H new ATOM 0 HG13 ILE B 14 30.741 18.367 24.332 1.00 0.00 H new ATOM 0 HG21 ILE B 14 28.336 19.198 23.396 1.00 0.00 H new ATOM 0 HG22 ILE B 14 27.602 18.233 22.093 1.00 0.00 H new ATOM 0 HG23 ILE B 14 27.563 17.640 23.771 1.00 0.00 H new ATOM 0 HD11 ILE B 14 29.883 17.005 26.220 1.00 0.00 H new ATOM 0 HD12 ILE B 14 28.540 17.803 25.369 1.00 0.00 H new ATOM 0 HD13 ILE B 14 28.865 16.074 25.096 1.00 0.00 H new ATOM 789 N LEU B 15 28.942 16.354 19.916 1.00 0.00 N0 ATOM 790 CA LEU B 15 28.179 16.410 18.677 1.00 0.00 C0 ATOM 791 C LEU B 15 27.467 15.088 18.455 1.00 0.00 C0 ATOM 792 O LEU B 15 26.242 15.043 18.423 1.00 0.00 O0 ATOM 793 CB LEU B 15 29.105 16.708 17.498 1.00 0.00 C0 ATOM 794 CG LEU B 15 29.491 18.185 17.522 1.00 0.00 C0 ATOM 795 CD1 LEU B 15 30.656 18.422 16.562 1.00 0.00 C0 ATOM 796 CD2 LEU B 15 28.292 19.036 17.083 1.00 0.00 C0 ATOM 0 H LEU B 15 29.942 16.528 19.813 1.00 0.00 H new ATOM 0 HA LEU B 15 27.441 17.208 18.752 1.00 0.00 H new ATOM 0 HB2 LEU B 15 29.998 16.086 17.556 1.00 0.00 H new ATOM 0 HB3 LEU B 15 28.607 16.465 16.559 1.00 0.00 H new ATOM 0 HG LEU B 15 29.786 18.465 18.533 1.00 0.00 H new ATOM 0 HD11 LEU B 15 30.932 19.476 16.578 1.00 0.00 H new ATOM 0 HD12 LEU B 15 31.510 17.818 16.870 1.00 0.00 H new ATOM 0 HD13 LEU B 15 30.358 18.141 15.552 1.00 0.00 H new ATOM 0 HD21 LEU B 15 28.568 20.090 17.100 1.00 0.00 H new ATOM 0 HD22 LEU B 15 27.997 18.755 16.072 1.00 0.00 H new ATOM 0 HD23 LEU B 15 27.458 18.868 17.764 1.00 0.00 H new ATOM 808 N SER B 16 28.238 14.019 18.281 1.00 0.00 N0 ATOM 809 CA SER B 16 27.662 12.699 18.045 1.00 0.00 C0 ATOM 810 C SER B 16 26.551 12.423 19.050 1.00 0.00 C0 ATOM 811 O SER B 16 25.539 11.803 18.718 1.00 0.00 O0 ATOM 812 CB SER B 16 28.740 11.627 18.167 1.00 0.00 C0 ATOM 813 OG SER B 16 29.651 11.759 17.083 1.00 0.00 O0 ATOM 0 H SER B 16 29.258 14.040 18.299 1.00 0.00 H new ATOM 0 HA SER B 16 27.246 12.676 17.038 1.00 0.00 H new ATOM 0 HB2 SER B 16 29.267 11.729 19.116 1.00 0.00 H new ATOM 0 HB3 SER B 16 28.287 10.636 18.159 1.00 0.00 H new ATOM 0 HG SER B 16 30.294 12.472 17.281 1.00 0.00 H new ATOM 819 N ALA B 17 26.741 12.881 20.281 1.00 0.00 N0 ATOM 820 CA ALA B 17 25.735 12.667 21.313 1.00 0.00 C0 ATOM 821 C ALA B 17 24.400 13.298 20.907 1.00 0.00 C0 ATOM 822 O ALA B 17 23.361 12.638 20.891 1.00 0.00 O0 ATOM 823 CB ALA B 17 26.217 13.294 22.623 1.00 0.00 C0 ATOM 0 H ALA B 17 27.568 13.395 20.586 1.00 0.00 H new ATOM 0 HA ALA B 17 25.587 11.595 21.443 1.00 0.00 H new ATOM 0 HB1 ALA B 17 25.468 13.137 23.399 1.00 0.00 H new ATOM 0 HB2 ALA B 17 27.155 12.829 22.925 1.00 0.00 H new ATOM 0 HB3 ALA B 17 26.372 14.363 22.479 1.00 0.00 H new ATOM 829 N LEU B 18 24.438 14.580 20.568 1.00 0.00 N0 ATOM 830 CA LEU B 18 23.226 15.288 20.165 1.00 0.00 C0 ATOM 831 C LEU B 18 22.748 14.805 18.802 1.00 0.00 C0 ATOM 832 O LEU B 18 21.581 14.974 18.444 1.00 0.00 O0 ATOM 833 CB LEU B 18 23.493 16.792 20.099 1.00 0.00 C0 ATOM 834 CG LEU B 18 24.082 17.265 21.426 1.00 0.00 C0 ATOM 835 CD1 LEU B 18 24.327 18.773 21.368 1.00 0.00 C0 ATOM 836 CD2 LEU B 18 23.108 16.952 22.565 1.00 0.00 C0 ATOM 0 H LEU B 18 25.285 15.148 20.563 1.00 0.00 H new ATOM 0 HA LEU B 18 22.453 15.085 20.906 1.00 0.00 H new ATOM 0 HB2 LEU B 18 24.182 17.014 19.284 1.00 0.00 H new ATOM 0 HB3 LEU B 18 22.567 17.327 19.889 1.00 0.00 H new ATOM 0 HG LEU B 18 25.025 16.748 21.604 1.00 0.00 H new ATOM 0 HD11 LEU B 18 24.747 19.110 22.316 1.00 0.00 H new ATOM 0 HD12 LEU B 18 25.025 18.998 20.561 1.00 0.00 H new ATOM 0 HD13 LEU B 18 23.384 19.288 21.186 1.00 0.00 H new ATOM 0 HD21 LEU B 18 23.532 17.291 23.510 1.00 0.00 H new ATOM 0 HD22 LEU B 18 22.163 17.465 22.387 1.00 0.00 H new ATOM 0 HD23 LEU B 18 22.935 15.877 22.610 1.00 0.00 H new ATOM 848 N HIS B 19 23.654 14.196 18.054 1.00 0.00 N0 ATOM 849 CA HIS B 19 23.323 13.683 16.742 1.00 0.00 C0 ATOM 850 C HIS B 19 22.390 12.489 16.839 1.00 0.00 C0 ATOM 851 O HIS B 19 21.397 12.416 16.125 1.00 0.00 O0 ATOM 852 CB HIS B 19 24.600 13.279 16.008 1.00 0.00 C0 ATOM 853 CG HIS B 19 24.243 12.519 14.765 1.00 0.00 C0 ATOM 854 ND1 HIS B 19 24.038 13.144 13.545 1.00 0.00 N0 ATOM 855 CD2 HIS B 19 24.046 11.182 14.542 1.00 0.00 C0 ATOM 856 CE1 HIS B 19 23.734 12.189 12.647 1.00 0.00 C0 ATOM 857 NE2 HIS B 19 23.726 10.974 13.203 1.00 0.00 N0 ATOM 0 H HIS B 19 24.623 14.047 18.336 1.00 0.00 H new ATOM 0 HA HIS B 19 22.813 14.471 16.188 1.00 0.00 H new ATOM 0 HB2 HIS B 19 25.180 14.165 15.751 1.00 0.00 H new ATOM 0 HB3 HIS B 19 25.226 12.665 16.656 1.00 0.00 H new ATOM 0 HD2 HIS B 19 24.127 10.408 15.290 1.00 0.00 H new ATOM 0 HE1 HIS B 19 23.523 12.381 11.605 1.00 0.00 H new ATOM 0 HE2 HIS B 19 23.528 10.085 12.745 1.00 0.00 H new ATOM 865 N PHE B 20 22.702 11.573 17.746 1.00 0.00 N0 ATOM 866 CA PHE B 20 21.872 10.395 17.931 1.00 0.00 C0 ATOM 867 C PHE B 20 20.630 10.733 18.740 1.00 0.00 C0 ATOM 868 O PHE B 20 19.617 10.048 18.646 1.00 0.00 O0 ATOM 869 CB PHE B 20 22.668 9.300 18.640 1.00 0.00 C0 ATOM 870 CG PHE B 20 22.845 8.125 17.707 1.00 0.00 C0 ATOM 871 CD1 PHE B 20 23.759 8.196 16.648 1.00 0.00 C0 ATOM 872 CD2 PHE B 20 22.089 6.964 17.902 1.00 0.00 C0 ATOM 873 CE1 PHE B 20 23.914 7.103 15.784 1.00 0.00 C0 ATOM 874 CE2 PHE B 20 22.244 5.872 17.039 1.00 0.00 C0 ATOM 875 CZ PHE B 20 23.156 5.940 15.979 1.00 0.00 C0 ATOM 0 H PHE B 20 23.516 11.623 18.359 1.00 0.00 H new ATOM 0 HA PHE B 20 21.561 10.037 16.949 1.00 0.00 H new ATOM 0 HB2 PHE B 20 23.641 9.684 18.948 1.00 0.00 H new ATOM 0 HB3 PHE B 20 22.148 8.985 19.545 1.00 0.00 H new ATOM 0 HD1 PHE B 20 24.344 9.092 16.497 1.00 0.00 H new ATOM 0 HD2 PHE B 20 21.385 6.910 18.719 1.00 0.00 H new ATOM 0 HE1 PHE B 20 24.618 7.157 14.967 1.00 0.00 H new ATOM 0 HE2 PHE B 20 21.660 4.977 17.191 1.00 0.00 H new ATOM 0 HZ PHE B 20 23.275 5.098 15.313 1.00 0.00 H new ATOM 885 N MET B 21 20.704 11.801 19.524 1.00 0.00 N0 ATOM 886 CA MET B 21 19.564 12.211 20.333 1.00 0.00 C0 ATOM 887 C MET B 21 18.445 12.771 19.457 1.00 0.00 C0 ATOM 888 O MET B 21 17.328 12.249 19.439 1.00 0.00 O0 ATOM 889 CB MET B 21 20.011 13.273 21.335 1.00 0.00 C0 ATOM 890 CG MET B 21 20.797 12.599 22.464 1.00 0.00 C0 ATOM 891 SD MET B 21 19.671 11.630 23.498 1.00 0.00 S0 ATOM 892 CE MET B 21 20.900 11.067 24.703 1.00 0.00 C0 ATOM 0 H MET B 21 21.530 12.392 19.617 1.00 0.00 H new ATOM 0 HA MET B 21 19.181 11.338 20.861 1.00 0.00 H new ATOM 0 HB2 MET B 21 20.631 14.020 20.839 1.00 0.00 H new ATOM 0 HB3 MET B 21 19.145 13.796 21.740 1.00 0.00 H new ATOM 0 HG2 MET B 21 21.570 11.953 22.047 1.00 0.00 H new ATOM 0 HG3 MET B 21 21.303 13.352 23.068 1.00 0.00 H new ATOM 0 HE1 MET B 21 20.415 10.440 25.451 1.00 0.00 H new ATOM 0 HE2 MET B 21 21.673 10.492 24.193 1.00 0.00 H new ATOM 0 HE3 MET B 21 21.353 11.930 25.191 1.00 0.00 H new ATOM 902 N ALA B 22 18.752 13.840 18.738 1.00 0.00 N0 ATOM 903 CA ALA B 22 17.763 14.470 17.870 1.00 0.00 C0 ATOM 904 C ALA B 22 17.349 13.531 16.741 1.00 0.00 C0 ATOM 905 O ALA B 22 16.168 13.439 16.398 1.00 0.00 O0 ATOM 906 CB ALA B 22 18.323 15.764 17.284 1.00 0.00 C0 ATOM 0 H ALA B 22 19.668 14.288 18.736 1.00 0.00 H new ATOM 0 HA ALA B 22 16.883 14.697 18.472 1.00 0.00 H new ATOM 0 HB1 ALA B 22 17.575 16.224 16.638 1.00 0.00 H new ATOM 0 HB2 ALA B 22 18.576 16.450 18.092 1.00 0.00 H new ATOM 0 HB3 ALA B 22 19.218 15.543 16.702 1.00 0.00 H new ATOM 912 N TRP B 23 18.326 12.845 16.157 1.00 0.00 N0 ATOM 913 CA TRP B 23 18.043 11.928 15.060 1.00 0.00 C0 ATOM 914 C TRP B 23 17.125 10.798 15.529 1.00 0.00 C0 ATOM 915 O TRP B 23 16.235 10.368 14.795 1.00 0.00 O0 ATOM 916 CB TRP B 23 19.346 11.356 14.504 1.00 0.00 C0 ATOM 917 CG TRP B 23 19.091 10.695 13.193 1.00 0.00 C0 ATOM 918 CD1 TRP B 23 19.260 11.284 11.985 1.00 0.00 C0 ATOM 919 CD2 TRP B 23 18.611 9.344 12.926 1.00 0.00 C0 ATOM 920 NE1 TRP B 23 18.926 10.378 10.996 1.00 0.00 N0 ATOM 921 CE2 TRP B 23 18.518 9.169 11.525 1.00 0.00 C0 ATOM 922 CE3 TRP B 23 18.254 8.262 13.753 1.00 0.00 C0 ATOM 923 CZ2 TRP B 23 18.087 7.966 10.963 1.00 0.00 C0 ATOM 924 CZ3 TRP B 23 17.819 7.050 13.190 1.00 0.00 C0 ATOM 925 CH2 TRP B 23 17.736 6.903 11.797 1.00 0.00 C0 ATOM 0 H TRP B 23 19.309 12.905 16.421 1.00 0.00 H new ATOM 0 HA TRP B 23 17.534 12.479 14.269 1.00 0.00 H new ATOM 0 HB2 TRP B 23 20.080 12.152 14.383 1.00 0.00 H new ATOM 0 HB3 TRP B 23 19.767 10.638 15.207 1.00 0.00 H new ATOM 0 HD1 TRP B 23 19.600 12.296 11.821 1.00 0.00 H new ATOM 0 HE1 TRP B 23 18.975 10.578 9.997 1.00 0.00 H new ATOM 0 HE3 TRP B 23 18.315 8.364 14.826 1.00 0.00 H new ATOM 0 HZ2 TRP B 23 18.026 7.858 9.890 1.00 0.00 H new ATOM 0 HZ3 TRP B 23 17.547 6.227 13.834 1.00 0.00 H new ATOM 0 HH2 TRP B 23 17.401 5.969 11.371 1.00 0.00 H new ATOM 936 N THR B 24 17.331 10.343 16.765 1.00 0.00 N0 ATOM 937 CA THR B 24 16.496 9.285 17.331 1.00 0.00 C0 ATOM 938 C THR B 24 15.060 9.761 17.510 1.00 0.00 C0 ATOM 939 O THR B 24 14.113 9.041 17.191 1.00 0.00 O0 ATOM 940 CB THR B 24 17.060 8.832 18.682 1.00 0.00 C0 ATOM 941 OG1 THR B 24 18.198 8.011 18.467 1.00 0.00 O0 ATOM 942 CG2 THR B 24 15.995 8.056 19.458 1.00 0.00 C0 ATOM 0 H THR B 24 18.062 10.687 17.388 1.00 0.00 H new ATOM 0 HA THR B 24 16.500 8.445 16.637 1.00 0.00 H new ATOM 0 HB THR B 24 17.351 9.707 19.264 1.00 0.00 H new ATOM 0 HG1 THR B 24 19.008 8.504 18.712 1.00 0.00 H new ATOM 0 HG21 THR B 24 16.403 7.737 20.417 1.00 0.00 H new ATOM 0 HG22 THR B 24 15.129 8.696 19.627 1.00 0.00 H new ATOM 0 HG23 THR B 24 15.692 7.180 18.884 1.00 0.00 H new ATOM 950 N ILE B 25 14.900 10.976 18.022 1.00 0.00 N0 ATOM 951 CA ILE B 25 13.566 11.530 18.236 1.00 0.00 C0 ATOM 952 C ILE B 25 12.814 11.635 16.913 1.00 0.00 C0 ATOM 953 O ILE B 25 11.636 11.287 16.828 1.00 0.00 O0 ATOM 954 CB ILE B 25 13.675 12.911 18.882 1.00 0.00 C0 ATOM 955 CG1 ILE B 25 14.195 12.763 20.314 1.00 0.00 C0 ATOM 956 CG2 ILE B 25 12.295 13.575 18.908 1.00 0.00 C0 ATOM 957 CD1 ILE B 25 14.606 14.135 20.854 1.00 0.00 C0 ATOM 0 H ILE B 25 15.667 11.591 18.294 1.00 0.00 H new ATOM 0 HA ILE B 25 13.014 10.864 18.900 1.00 0.00 H new ATOM 0 HB ILE B 25 14.364 13.528 18.305 1.00 0.00 H new ATOM 0 HG12 ILE B 25 13.424 12.327 20.949 1.00 0.00 H new ATOM 0 HG13 ILE B 25 15.046 12.083 20.334 1.00 0.00 H new ATOM 0 HG21 ILE B 25 12.374 14.560 19.369 1.00 0.00 H new ATOM 0 HG22 ILE B 25 11.922 13.680 17.889 1.00 0.00 H new ATOM 0 HG23 ILE B 25 11.605 12.959 19.485 1.00 0.00 H new ATOM 0 HD11 ILE B 25 14.976 14.029 21.874 1.00 0.00 H new ATOM 0 HD12 ILE B 25 15.391 14.553 20.225 1.00 0.00 H new ATOM 0 HD13 ILE B 25 13.743 14.801 20.849 1.00 0.00 H new ATOM 969 N GLY B 26 13.505 12.110 15.881 1.00 0.00 N0 ATOM 970 CA GLY B 26 12.896 12.250 14.562 1.00 0.00 C0 ATOM 971 C GLY B 26 12.472 10.890 14.012 1.00 0.00 C0 ATOM 972 O GLY B 26 11.397 10.752 13.427 1.00 0.00 O0 ATOM 0 H GLY B 26 14.481 12.403 15.931 1.00 0.00 H new ATOM 0 HA2 GLY B 26 12.029 12.908 14.625 1.00 0.00 H new ATOM 0 HA3 GLY B 26 13.603 12.719 13.878 1.00 0.00 H new ATOM 976 N HIS B 27 13.322 9.889 14.212 1.00 0.00 N0 ATOM 977 CA HIS B 27 13.033 8.540 13.740 1.00 0.00 C0 ATOM 978 C HIS B 27 11.752 8.008 14.371 1.00 0.00 C0 ATOM 979 O HIS B 27 10.925 7.393 13.698 1.00 0.00 O0 ATOM 980 CB HIS B 27 14.196 7.608 14.079 1.00 0.00 C0 ATOM 981 CG HIS B 27 13.780 6.183 13.846 1.00 0.00 C0 ATOM 982 ND1 HIS B 27 13.607 5.659 12.575 1.00 0.00 N0 ATOM 983 CD2 HIS B 27 13.491 5.162 14.715 1.00 0.00 C0 ATOM 984 CE1 HIS B 27 13.229 4.375 12.714 1.00 0.00 C0 ATOM 985 NE2 HIS B 27 13.143 4.021 13.999 1.00 0.00 N0 ATOM 0 H HIS B 27 14.214 9.986 14.696 1.00 0.00 H new ATOM 0 HA HIS B 27 12.900 8.578 12.659 1.00 0.00 H new ATOM 0 HB2 HIS B 27 15.062 7.851 13.463 1.00 0.00 H new ATOM 0 HB3 HIS B 27 14.495 7.745 15.118 1.00 0.00 H new ATOM 0 HD2 HIS B 27 13.528 5.233 15.792 1.00 0.00 H new ATOM 0 HE1 HIS B 27 13.021 3.712 11.887 1.00 0.00 H new ATOM 0 HE2 HIS B 27 12.879 3.110 14.375 1.00 0.00 H new ATOM 993 N LEU B 28 11.593 8.247 15.667 1.00 0.00 N0 ATOM 994 CA LEU B 28 10.409 7.785 16.380 1.00 0.00 C0 ATOM 995 C LEU B 28 9.189 8.618 15.994 1.00 0.00 C0 ATOM 996 O LEU B 28 9.286 9.832 15.818 1.00 0.00 O0 ATOM 997 CB LEU B 28 10.643 7.888 17.888 1.00 0.00 C0 ATOM 998 CG LEU B 28 11.755 6.921 18.297 1.00 0.00 C0 ATOM 999 CD1 LEU B 28 12.187 7.223 19.733 1.00 0.00 C0 ATOM 1000 CD2 LEU B 28 11.235 5.483 18.215 1.00 0.00 C0 ATOM 0 H LEU B 28 12.265 8.755 16.243 1.00 0.00 H new ATOM 0 HA LEU B 28 10.223 6.746 16.108 1.00 0.00 H new ATOM 0 HB2 LEU B 28 10.917 8.909 18.156 1.00 0.00 H new ATOM 0 HB3 LEU B 28 9.725 7.653 18.426 1.00 0.00 H new ATOM 0 HG LEU B 28 12.606 7.040 17.627 1.00 0.00 H new ATOM 0 HD11 LEU B 28 12.980 6.535 20.027 1.00 0.00 H new ATOM 0 HD12 LEU B 28 12.554 8.247 19.795 1.00 0.00 H new ATOM 0 HD13 LEU B 28 11.335 7.102 20.402 1.00 0.00 H new ATOM 0 HD21 LEU B 28 12.027 4.793 18.506 1.00 0.00 H new ATOM 0 HD22 LEU B 28 10.385 5.365 18.887 1.00 0.00 H new ATOM 0 HD23 LEU B 28 10.923 5.267 17.193 1.00 0.00 H new ATOM 1148 N GLU C 3 44.385 -4.893 21.648 1.00 0.00 N0 ATOM 1149 CA GLU C 3 43.858 -3.583 21.314 1.00 0.00 C0 ATOM 1150 C GLU C 3 44.348 -3.149 19.923 1.00 0.00 C0 ATOM 1151 O GLU C 3 45.561 -3.080 19.692 1.00 0.00 O0 ATOM 1152 CB GLU C 3 44.307 -2.566 22.362 1.00 0.00 C0 ATOM 1153 CG GLU C 3 43.606 -2.871 23.686 1.00 0.00 C0 ATOM 1154 CD GLU C 3 42.276 -2.130 23.750 1.00 0.00 C0 ATOM 1155 OE1 GLU C 3 42.303 -0.912 23.812 1.00 0.00 O0 ATOM 1156 OE2 GLU C 3 41.250 -2.790 23.733 1.00 0.00 O1- ATOM 0 HA GLU C 3 42.769 -3.633 21.301 1.00 0.00 H new ATOM 0 HB2 GLU C 3 45.389 -2.610 22.490 1.00 0.00 H new ATOM 0 HB3 GLU C 3 44.066 -1.555 22.033 1.00 0.00 H new ATOM 0 HG2 GLU C 3 43.440 -3.944 23.781 1.00 0.00 H new ATOM 0 HG3 GLU C 3 44.240 -2.572 24.521 1.00 0.00 H new ATOM 1163 N PRO C 4 43.455 -2.859 18.996 1.00 0.00 N0 ATOM 1164 CA PRO C 4 43.849 -2.433 17.622 1.00 0.00 C0 ATOM 1165 C PRO C 4 44.438 -1.027 17.596 1.00 0.00 C0 ATOM 1166 O PRO C 4 45.329 -0.735 16.800 1.00 0.00 O0 ATOM 1167 CB PRO C 4 42.538 -2.488 16.832 1.00 0.00 C0 ATOM 1168 CG PRO C 4 41.458 -2.315 17.844 1.00 0.00 C0 ATOM 1169 CD PRO C 4 41.987 -2.902 19.149 1.00 0.00 C0 ATOM 0 HA PRO C 4 44.630 -3.072 17.209 1.00 0.00 H new ATOM 0 HB2 PRO C 4 42.500 -1.701 16.079 1.00 0.00 H new ATOM 0 HB3 PRO C 4 42.436 -3.438 16.307 1.00 0.00 H new ATOM 0 HG2 PRO C 4 41.207 -1.261 17.967 1.00 0.00 H new ATOM 0 HG3 PRO C 4 40.547 -2.825 17.530 1.00 0.00 H new ATOM 0 HD2 PRO C 4 41.659 -2.319 20.010 1.00 0.00 H new ATOM 0 HD3 PRO C 4 41.632 -3.921 19.300 1.00 0.00 H new ATOM 1177 N PHE C 5 43.931 -0.162 18.471 1.00 0.00 N0 ATOM 1178 CA PHE C 5 44.413 1.212 18.540 1.00 0.00 C0 ATOM 1179 C PHE C 5 44.170 1.797 19.926 1.00 0.00 C0 ATOM 1180 O PHE C 5 45.080 1.867 20.751 1.00 0.00 O0 ATOM 1181 CB PHE C 5 43.698 2.069 17.492 1.00 0.00 C0 ATOM 1182 CG PHE C 5 44.303 1.815 16.133 1.00 0.00 C0 ATOM 1183 CD1 PHE C 5 43.609 1.046 15.190 1.00 0.00 C0 ATOM 1184 CD2 PHE C 5 45.558 2.346 15.817 1.00 0.00 C0 ATOM 1185 CE1 PHE C 5 44.172 0.810 13.931 1.00 0.00 C0 ATOM 1186 CE2 PHE C 5 46.121 2.109 14.558 1.00 0.00 C0 ATOM 1187 CZ PHE C 5 45.429 1.341 13.615 1.00 0.00 C0 ATOM 0 H PHE C 5 43.192 -0.387 19.137 1.00 0.00 H new ATOM 0 HA PHE C 5 45.485 1.211 18.341 1.00 0.00 H new ATOM 0 HB2 PHE C 5 42.634 1.832 17.478 1.00 0.00 H new ATOM 0 HB3 PHE C 5 43.786 3.125 17.749 1.00 0.00 H new ATOM 0 HD1 PHE C 5 42.640 0.636 15.434 1.00 0.00 H new ATOM 0 HD2 PHE C 5 46.092 2.939 16.545 1.00 0.00 H new ATOM 0 HE1 PHE C 5 43.637 0.218 13.203 1.00 0.00 H new ATOM 0 HE2 PHE C 5 47.090 2.519 14.314 1.00 0.00 H new ATOM 0 HZ PHE C 5 45.864 1.158 12.644 1.00 0.00 H new ATOM 1197 N GLN C 6 42.936 2.223 20.172 1.00 0.00 N0 ATOM 1198 CA GLN C 6 42.574 2.807 21.457 1.00 0.00 C0 ATOM 1199 C GLN C 6 41.114 2.511 21.787 1.00 0.00 C0 ATOM 1200 O GLN C 6 40.346 2.083 20.924 1.00 0.00 O0 ATOM 1201 CB GLN C 6 42.795 4.322 21.424 1.00 0.00 C0 ATOM 1202 CG GLN C 6 44.264 4.618 21.116 1.00 0.00 C0 ATOM 1203 CD GLN C 6 44.534 6.115 21.233 1.00 0.00 C0 ATOM 1204 OE1 GLN C 6 43.659 6.929 20.940 1.00 0.00 O0 ATOM 1205 NE2 GLN C 6 45.702 6.527 21.647 1.00 0.00 N0 ATOM 0 H GLN C 6 42.171 2.175 19.499 1.00 0.00 H new ATOM 0 HA GLN C 6 43.206 2.365 22.227 1.00 0.00 H new ATOM 0 HB2 GLN C 6 42.155 4.777 20.668 1.00 0.00 H new ATOM 0 HB3 GLN C 6 42.518 4.761 22.382 1.00 0.00 H new ATOM 0 HG2 GLN C 6 44.906 4.070 21.806 1.00 0.00 H new ATOM 0 HG3 GLN C 6 44.509 4.274 20.111 1.00 0.00 H new ATOM 0 HE21 GLN C 6 46.425 5.850 21.889 1.00 0.00 H new ATOM 0 HE22 GLN C 6 45.891 7.526 21.728 1.00 0.00 H new ATOM 1214 N ILE C 7 40.739 2.747 23.040 1.00 0.00 N0 ATOM 1215 CA ILE C 7 39.368 2.509 23.482 1.00 0.00 C0 ATOM 1216 C ILE C 7 38.385 3.344 22.655 1.00 0.00 C0 ATOM 1217 O ILE C 7 37.292 2.893 22.313 1.00 0.00 O0 ATOM 1218 CB ILE C 7 39.230 2.866 24.962 1.00 0.00 C0 ATOM 1219 CG1 ILE C 7 39.995 1.845 25.810 1.00 0.00 C0 ATOM 1220 CG2 ILE C 7 37.750 2.848 25.355 1.00 0.00 C0 ATOM 1221 CD1 ILE C 7 40.127 2.359 27.247 1.00 0.00 C0 ATOM 0 H ILE C 7 41.362 3.102 23.766 1.00 0.00 H new ATOM 0 HA ILE C 7 39.136 1.453 23.341 1.00 0.00 H new ATOM 0 HB ILE C 7 39.641 3.861 25.134 1.00 0.00 H new ATOM 0 HG12 ILE C 7 39.473 0.888 25.803 1.00 0.00 H new ATOM 0 HG13 ILE C 7 40.983 1.672 25.384 1.00 0.00 H new ATOM 0 HG21 ILE C 7 37.651 3.102 26.410 1.00 0.00 H new ATOM 0 HG22 ILE C 7 37.205 3.575 24.753 1.00 0.00 H new ATOM 0 HG23 ILE C 7 37.340 1.853 25.181 1.00 0.00 H new ATOM 0 HD11 ILE C 7 40.672 1.629 27.846 1.00 0.00 H new ATOM 0 HD12 ILE C 7 40.669 3.305 27.247 1.00 0.00 H new ATOM 0 HD13 ILE C 7 39.135 2.509 27.672 1.00 0.00 H new ATOM 1233 N LEU C 8 38.781 4.570 22.345 1.00 0.00 N0 ATOM 1234 CA LEU C 8 37.934 5.464 21.562 1.00 0.00 C0 ATOM 1235 C LEU C 8 37.825 4.981 20.112 1.00 0.00 C0 ATOM 1236 O LEU C 8 36.769 5.100 19.477 1.00 0.00 O0 ATOM 1237 CB LEU C 8 38.510 6.881 21.590 1.00 0.00 C0 ATOM 1238 CG LEU C 8 37.394 7.897 21.340 1.00 0.00 C0 ATOM 1239 CD1 LEU C 8 37.643 9.148 22.185 1.00 0.00 C0 ATOM 1240 CD2 LEU C 8 37.373 8.279 19.858 1.00 0.00 C0 ATOM 0 H LEU C 8 39.678 4.969 22.621 1.00 0.00 H new ATOM 0 HA LEU C 8 36.937 5.466 22.003 1.00 0.00 H new ATOM 0 HB2 LEU C 8 38.981 7.073 22.554 1.00 0.00 H new ATOM 0 HB3 LEU C 8 39.285 6.984 20.831 1.00 0.00 H new ATOM 0 HG LEU C 8 36.435 7.457 21.616 1.00 0.00 H new ATOM 0 HD11 LEU C 8 36.848 9.872 22.007 1.00 0.00 H new ATOM 0 HD12 LEU C 8 37.657 8.877 23.241 1.00 0.00 H new ATOM 0 HD13 LEU C 8 38.602 9.588 21.910 1.00 0.00 H new ATOM 0 HD21 LEU C 8 36.578 9.003 19.680 1.00 0.00 H new ATOM 0 HD22 LEU C 8 38.332 8.718 19.582 1.00 0.00 H new ATOM 0 HD23 LEU C 8 37.195 7.389 19.255 1.00 0.00 H new ATOM 1252 N SER C 9 38.920 4.416 19.607 1.00 0.00 N0 ATOM 1253 CA SER C 9 38.952 3.901 18.237 1.00 0.00 C0 ATOM 1254 C SER C 9 38.046 2.679 18.096 1.00 0.00 C0 ATOM 1255 O SER C 9 37.282 2.563 17.133 1.00 0.00 O0 ATOM 1256 CB SER C 9 40.378 3.521 17.850 1.00 0.00 C0 ATOM 1257 OG SER C 9 40.397 3.071 16.502 1.00 0.00 O0 ATOM 0 H SER C 9 39.793 4.303 20.122 1.00 0.00 H new ATOM 0 HA SER C 9 38.592 4.686 17.573 1.00 0.00 H new ATOM 0 HB2 SER C 9 41.040 4.379 17.968 1.00 0.00 H new ATOM 0 HB3 SER C 9 40.750 2.739 18.512 1.00 0.00 H new ATOM 0 HG SER C 9 41.325 2.980 16.200 1.00 0.00 H new ATOM 1263 N ILE C 10 38.125 1.771 19.067 1.00 0.00 N0 ATOM 1264 CA ILE C 10 37.302 0.570 19.033 1.00 0.00 C0 ATOM 1265 C ILE C 10 35.839 0.930 19.248 1.00 0.00 C0 ATOM 1266 O ILE C 10 34.947 0.264 18.720 1.00 0.00 O0 ATOM 1267 CB ILE C 10 37.766 -0.424 20.106 1.00 0.00 C0 ATOM 1268 CG1 ILE C 10 37.670 0.230 21.481 1.00 0.00 C0 ATOM 1269 CG2 ILE C 10 39.218 -0.816 19.832 1.00 0.00 C0 ATOM 1270 CD1 ILE C 10 37.993 -0.791 22.574 1.00 0.00 C0 ATOM 0 H ILE C 10 38.743 1.844 19.876 1.00 0.00 H new ATOM 0 HA ILE C 10 37.408 0.102 18.054 1.00 0.00 H new ATOM 0 HB ILE C 10 37.133 -1.311 20.081 1.00 0.00 H new ATOM 0 HG12 ILE C 10 38.362 1.070 21.542 1.00 0.00 H new ATOM 0 HG13 ILE C 10 36.668 0.631 21.632 1.00 0.00 H new ATOM 0 HG21 ILE C 10 39.554 -1.522 20.591 1.00 0.00 H new ATOM 0 HG22 ILE C 10 39.290 -1.279 18.848 1.00 0.00 H new ATOM 0 HG23 ILE C 10 39.847 0.074 19.861 1.00 0.00 H new ATOM 0 HD11 ILE C 10 37.921 -0.313 23.551 1.00 0.00 H new ATOM 0 HD12 ILE C 10 37.284 -1.617 22.521 1.00 0.00 H new ATOM 0 HD13 ILE C 10 39.004 -1.171 22.429 1.00 0.00 H new ATOM 1282 N CYS C 11 35.591 1.991 20.017 1.00 0.00 N0 ATOM 1283 CA CYS C 11 34.224 2.420 20.274 1.00 0.00 C0 ATOM 1284 C CYS C 11 33.562 2.844 18.969 1.00 0.00 C0 ATOM 1285 O CYS C 11 32.478 2.370 18.629 1.00 0.00 O0 ATOM 1286 CB CYS C 11 34.224 3.589 21.257 1.00 0.00 C0 ATOM 1287 SG CYS C 11 32.519 4.092 21.592 1.00 0.00 S0 ATOM 0 H CYS C 11 36.310 2.559 20.465 1.00 0.00 H new ATOM 0 HA CYS C 11 33.665 1.590 20.706 1.00 0.00 H new ATOM 0 HB2 CYS C 11 34.718 3.299 22.184 1.00 0.00 H new ATOM 0 HB3 CYS C 11 34.787 4.426 20.844 1.00 0.00 H new ATOM 0 HG CYS C 11 32.516 5.086 22.430 1.00 0.00 H new ATOM 1293 N SER C 12 34.223 3.738 18.237 1.00 0.00 N0 ATOM 1294 CA SER C 12 33.683 4.214 16.968 1.00 0.00 C0 ATOM 1295 C SER C 12 33.503 3.052 15.997 1.00 0.00 C0 ATOM 1296 O SER C 12 32.544 3.019 15.226 1.00 0.00 O0 ATOM 1297 CB SER C 12 34.610 5.257 16.352 1.00 0.00 C0 ATOM 1298 OG SER C 12 34.053 5.705 15.122 1.00 0.00 O0 ATOM 0 H SER C 12 35.122 4.143 18.497 1.00 0.00 H new ATOM 0 HA SER C 12 32.712 4.671 17.161 1.00 0.00 H new ATOM 0 HB2 SER C 12 34.738 6.097 17.035 1.00 0.00 H new ATOM 0 HB3 SER C 12 35.598 4.829 16.184 1.00 0.00 H new ATOM 0 HG SER C 12 34.643 6.377 14.721 1.00 0.00 H new ATOM 1304 N PHE C 13 34.431 2.102 16.042 1.00 0.00 N0 ATOM 1305 CA PHE C 13 34.359 0.936 15.166 1.00 0.00 C0 ATOM 1306 C PHE C 13 33.059 0.158 15.390 1.00 0.00 C0 ATOM 1307 O PHE C 13 32.321 -0.130 14.441 1.00 0.00 O0 ATOM 1308 CB PHE C 13 35.551 0.018 15.437 1.00 0.00 C0 ATOM 1309 CG PHE C 13 35.322 -1.319 14.772 1.00 0.00 C0 ATOM 1310 CD1 PHE C 13 35.399 -1.437 13.380 1.00 0.00 C0 ATOM 1311 CD2 PHE C 13 35.034 -2.446 15.555 1.00 0.00 C0 ATOM 1312 CE1 PHE C 13 35.189 -2.680 12.770 1.00 0.00 C0 ATOM 1313 CE2 PHE C 13 34.824 -3.688 14.945 1.00 0.00 C0 ATOM 1314 CZ PHE C 13 34.901 -3.806 13.552 1.00 0.00 C0 ATOM 0 H PHE C 13 35.235 2.115 16.669 1.00 0.00 H new ATOM 0 HA PHE C 13 34.381 1.283 14.133 1.00 0.00 H new ATOM 0 HB2 PHE C 13 36.466 0.472 15.058 1.00 0.00 H new ATOM 0 HB3 PHE C 13 35.683 -0.116 16.511 1.00 0.00 H new ATOM 0 HD1 PHE C 13 35.620 -0.570 12.776 1.00 0.00 H new ATOM 0 HD2 PHE C 13 34.974 -2.356 16.630 1.00 0.00 H new ATOM 0 HE1 PHE C 13 35.249 -2.771 11.695 1.00 0.00 H new ATOM 0 HE2 PHE C 13 34.603 -4.556 15.549 1.00 0.00 H new ATOM 0 HZ PHE C 13 34.739 -4.764 13.081 1.00 0.00 H new ATOM 1324 N ILE C 14 32.770 -0.157 16.649 1.00 0.00 N0 ATOM 1325 CA ILE C 14 31.555 -0.887 16.981 1.00 0.00 C0 ATOM 1326 C ILE C 14 30.326 -0.039 16.676 1.00 0.00 C0 ATOM 1327 O ILE C 14 29.322 -0.542 16.177 1.00 0.00 O0 ATOM 1328 CB ILE C 14 31.563 -1.275 18.464 1.00 0.00 C0 ATOM 1329 CG1 ILE C 14 32.716 -2.251 18.730 1.00 0.00 C0 ATOM 1330 CG2 ILE C 14 30.230 -1.941 18.829 1.00 0.00 C0 ATOM 1331 CD1 ILE C 14 32.343 -3.659 18.252 1.00 0.00 C0 ATOM 0 H ILE C 14 33.356 0.080 17.449 1.00 0.00 H new ATOM 0 HA ILE C 14 31.517 -1.792 16.375 1.00 0.00 H new ATOM 0 HB ILE C 14 31.697 -0.381 19.073 1.00 0.00 H new ATOM 0 HG12 ILE C 14 33.615 -1.911 18.216 1.00 0.00 H new ATOM 0 HG13 ILE C 14 32.946 -2.270 19.795 1.00 0.00 H new ATOM 0 HG21 ILE C 14 30.238 -2.216 19.884 1.00 0.00 H new ATOM 0 HG22 ILE C 14 29.412 -1.245 18.641 1.00 0.00 H new ATOM 0 HG23 ILE C 14 30.092 -2.836 18.222 1.00 0.00 H new ATOM 0 HD11 ILE C 14 33.171 -4.341 18.447 1.00 0.00 H new ATOM 0 HD12 ILE C 14 31.457 -4.002 18.786 1.00 0.00 H new ATOM 0 HD13 ILE C 14 32.136 -3.637 17.182 1.00 0.00 H new ATOM 1343 N LEU C 15 30.417 1.255 16.972 1.00 0.00 N0 ATOM 1344 CA LEU C 15 29.303 2.154 16.709 1.00 0.00 C0 ATOM 1345 C LEU C 15 28.951 2.114 15.233 1.00 0.00 C0 ATOM 1346 O LEU C 15 27.846 1.727 14.871 1.00 0.00 O0 ATOM 1347 CB LEU C 15 29.667 3.580 17.121 1.00 0.00 C0 ATOM 1348 CG LEU C 15 29.618 3.693 18.644 1.00 0.00 C0 ATOM 1349 CD1 LEU C 15 30.289 4.996 19.078 1.00 0.00 C0 ATOM 1350 CD2 LEU C 15 28.157 3.693 19.113 1.00 0.00 C0 ATOM 0 H LEU C 15 31.237 1.697 17.387 1.00 0.00 H new ATOM 0 HA LEU C 15 28.441 1.831 17.292 1.00 0.00 H new ATOM 0 HB2 LEU C 15 30.663 3.833 16.758 1.00 0.00 H new ATOM 0 HB3 LEU C 15 28.974 4.290 16.670 1.00 0.00 H new ATOM 0 HG LEU C 15 30.142 2.846 19.087 1.00 0.00 H new ATOM 0 HD11 LEU C 15 30.255 5.078 20.164 1.00 0.00 H new ATOM 0 HD12 LEU C 15 31.327 4.999 18.746 1.00 0.00 H new ATOM 0 HD13 LEU C 15 29.764 5.841 18.633 1.00 0.00 H new ATOM 0 HD21 LEU C 15 28.124 3.774 20.200 1.00 0.00 H new ATOM 0 HD22 LEU C 15 27.633 4.540 18.670 1.00 0.00 H new ATOM 0 HD23 LEU C 15 27.675 2.766 18.803 1.00 0.00 H new ATOM 1362 N SER C 16 29.886 2.539 14.387 1.00 0.00 N0 ATOM 1363 CA SER C 16 29.649 2.561 12.948 1.00 0.00 C0 ATOM 1364 C SER C 16 29.056 1.235 12.493 1.00 0.00 C0 ATOM 1365 O SER C 16 28.206 1.198 11.603 1.00 0.00 O0 ATOM 1366 CB SER C 16 30.958 2.815 12.206 1.00 0.00 C0 ATOM 1367 OG SER C 16 31.385 4.147 12.463 1.00 0.00 O0 ATOM 0 H SER C 16 30.808 2.870 14.671 1.00 0.00 H new ATOM 0 HA SER C 16 28.946 3.363 12.724 1.00 0.00 H new ATOM 0 HB2 SER C 16 31.719 2.106 12.532 1.00 0.00 H new ATOM 0 HB3 SER C 16 30.819 2.664 11.135 1.00 0.00 H new ATOM 0 HG SER C 16 31.807 4.191 13.347 1.00 0.00 H new ATOM 1373 N ALA C 17 29.506 0.146 13.102 1.00 0.00 N0 ATOM 1374 CA ALA C 17 28.996 -1.169 12.736 1.00 0.00 C0 ATOM 1375 C ALA C 17 27.482 -1.247 12.961 1.00 0.00 C0 ATOM 1376 O ALA C 17 26.719 -1.589 12.058 1.00 0.00 O0 ATOM 1377 CB ALA C 17 29.692 -2.232 13.587 1.00 0.00 C0 ATOM 0 H ALA C 17 30.211 0.145 13.839 1.00 0.00 H new ATOM 0 HA ALA C 17 29.198 -1.342 11.679 1.00 0.00 H new ATOM 0 HB1 ALA C 17 29.314 -3.218 13.318 1.00 0.00 H new ATOM 0 HB2 ALA C 17 30.767 -2.194 13.409 1.00 0.00 H new ATOM 0 HB3 ALA C 17 29.492 -2.042 14.642 1.00 0.00 H new ATOM 1383 N LEU C 18 27.051 -0.912 14.169 1.00 0.00 N0 ATOM 1384 CA LEU C 18 25.630 -0.949 14.498 1.00 0.00 C0 ATOM 1385 C LEU C 18 24.882 0.163 13.778 1.00 0.00 C0 ATOM 1386 O LEU C 18 23.665 0.092 13.603 1.00 0.00 O0 ATOM 1387 CB LEU C 18 25.436 -0.790 16.007 1.00 0.00 C0 ATOM 1388 CG LEU C 18 26.276 -1.832 16.741 1.00 0.00 C0 ATOM 1389 CD1 LEU C 18 26.065 -1.690 18.249 1.00 0.00 C0 ATOM 1390 CD2 LEU C 18 25.860 -3.238 16.302 1.00 0.00 C0 ATOM 0 H LEU C 18 27.658 -0.614 14.933 1.00 0.00 H new ATOM 0 HA LEU C 18 25.232 -1.911 14.176 1.00 0.00 H new ATOM 0 HB2 LEU C 18 25.728 0.213 16.318 1.00 0.00 H new ATOM 0 HB3 LEU C 18 24.383 -0.909 16.264 1.00 0.00 H new ATOM 0 HG LEU C 18 27.328 -1.675 16.502 1.00 0.00 H new ATOM 0 HD11 LEU C 18 26.665 -2.434 18.772 1.00 0.00 H new ATOM 0 HD12 LEU C 18 26.367 -0.692 18.566 1.00 0.00 H new ATOM 0 HD13 LEU C 18 25.012 -1.842 18.485 1.00 0.00 H new ATOM 0 HD21 LEU C 18 26.463 -3.977 16.829 1.00 0.00 H new ATOM 0 HD22 LEU C 18 24.807 -3.395 16.536 1.00 0.00 H new ATOM 0 HD23 LEU C 18 26.013 -3.344 15.228 1.00 0.00 H new ATOM 1402 N HIS C 19 25.619 1.178 13.358 1.00 0.00 N0 ATOM 1403 CA HIS C 19 25.029 2.296 12.654 1.00 0.00 C0 ATOM 1404 C HIS C 19 24.546 1.881 11.276 1.00 0.00 C0 ATOM 1405 O HIS C 19 23.432 2.210 10.880 1.00 0.00 O0 ATOM 1406 CB HIS C 19 26.051 3.422 12.521 1.00 0.00 C0 ATOM 1407 CG HIS C 19 25.527 4.466 11.579 1.00 0.00 C0 ATOM 1408 ND1 HIS C 19 24.767 5.542 12.011 1.00 0.00 N0 ATOM 1409 CD2 HIS C 19 25.643 4.605 10.223 1.00 0.00 C0 ATOM 1410 CE1 HIS C 19 24.459 6.279 10.928 1.00 0.00 C0 ATOM 1411 NE2 HIS C 19 24.969 5.751 9.810 1.00 0.00 N0 ATOM 0 H HIS C 19 26.627 1.247 13.494 1.00 0.00 H new ATOM 0 HA HIS C 19 24.171 2.645 13.229 1.00 0.00 H new ATOM 0 HB2 HIS C 19 26.249 3.865 13.497 1.00 0.00 H new ATOM 0 HB3 HIS C 19 26.997 3.027 12.152 1.00 0.00 H new ATOM 0 HD2 HIS C 19 26.176 3.928 9.572 1.00 0.00 H new ATOM 0 HE1 HIS C 19 23.872 7.185 10.958 1.00 0.00 H new ATOM 0 HE2 HIS C 19 24.883 6.111 8.859 1.00 0.00 H new ATOM 1419 N PHE C 20 25.378 1.136 10.561 1.00 0.00 N0 ATOM 1420 CA PHE C 20 25.012 0.674 9.233 1.00 0.00 C0 ATOM 1421 C PHE C 20 24.068 -0.513 9.317 1.00 0.00 C0 ATOM 1422 O PHE C 20 23.310 -0.774 8.389 1.00 0.00 O0 ATOM 1423 CB PHE C 20 26.264 0.280 8.456 1.00 0.00 C0 ATOM 1424 CG PHE C 20 26.444 1.211 7.282 1.00 0.00 C0 ATOM 1425 CD1 PHE C 20 26.903 2.518 7.483 1.00 0.00 C0 ATOM 1426 CD2 PHE C 20 26.148 0.762 5.991 1.00 0.00 C0 ATOM 1427 CE1 PHE C 20 27.068 3.374 6.390 1.00 0.00 C0 ATOM 1428 CE2 PHE C 20 26.310 1.619 4.899 1.00 0.00 C0 ATOM 1429 CZ PHE C 20 26.771 2.924 5.098 1.00 0.00 C0 ATOM 0 H PHE C 20 26.302 0.842 10.876 1.00 0.00 H new ATOM 0 HA PHE C 20 24.504 1.487 8.715 1.00 0.00 H new ATOM 0 HB2 PHE C 20 27.137 0.325 9.106 1.00 0.00 H new ATOM 0 HB3 PHE C 20 26.179 -0.749 8.107 1.00 0.00 H new ATOM 0 HD1 PHE C 20 27.129 2.865 8.481 1.00 0.00 H new ATOM 0 HD2 PHE C 20 25.794 -0.247 5.838 1.00 0.00 H new ATOM 0 HE1 PHE C 20 27.424 4.382 6.542 1.00 0.00 H new ATOM 0 HE2 PHE C 20 26.079 1.274 3.902 1.00 0.00 H new ATOM 0 HZ PHE C 20 26.898 3.586 4.254 1.00 0.00 H new ATOM 1439 N MET C 21 24.100 -1.221 10.439 1.00 0.00 N0 ATOM 1440 CA MET C 21 23.225 -2.371 10.617 1.00 0.00 C0 ATOM 1441 C MET C 21 21.771 -1.934 10.782 1.00 0.00 C0 ATOM 1442 O MET C 21 20.901 -2.303 9.991 1.00 0.00 O0 ATOM 1443 CB MET C 21 23.669 -3.154 11.851 1.00 0.00 C0 ATOM 1444 CG MET C 21 24.935 -3.946 11.513 1.00 0.00 C0 ATOM 1445 SD MET C 21 24.526 -5.306 10.389 1.00 0.00 S0 ATOM 1446 CE MET C 21 26.189 -6.017 10.280 1.00 0.00 C0 ATOM 0 H MET C 21 24.714 -1.023 11.229 1.00 0.00 H new ATOM 0 HA MET C 21 23.293 -3.001 9.730 1.00 0.00 H new ATOM 0 HB2 MET C 21 23.862 -2.472 12.680 1.00 0.00 H new ATOM 0 HB3 MET C 21 22.877 -3.830 12.172 1.00 0.00 H new ATOM 0 HG2 MET C 21 25.673 -3.290 11.051 1.00 0.00 H new ATOM 0 HG3 MET C 21 25.384 -4.339 12.425 1.00 0.00 H new ATOM 0 HE1 MET C 21 26.171 -6.887 9.623 1.00 0.00 H new ATOM 0 HE2 MET C 21 26.877 -5.273 9.878 1.00 0.00 H new ATOM 0 HE3 MET C 21 26.521 -6.319 11.273 1.00 0.00 H new ATOM 1456 N ALA C 22 21.516 -1.148 11.820 1.00 0.00 N0 ATOM 1457 CA ALA C 22 20.164 -0.673 12.088 1.00 0.00 C0 ATOM 1458 C ALA C 22 19.675 0.243 10.968 1.00 0.00 C0 ATOM 1459 O ALA C 22 18.521 0.159 10.543 1.00 0.00 O0 ATOM 1460 CB ALA C 22 20.125 0.074 13.420 1.00 0.00 C0 ATOM 0 H ALA C 22 22.220 -0.828 12.485 1.00 0.00 H new ATOM 0 HA ALA C 22 19.504 -1.539 12.139 1.00 0.00 H new ATOM 0 HB1 ALA C 22 19.111 0.425 13.611 1.00 0.00 H new ATOM 0 HB2 ALA C 22 20.434 -0.596 14.222 1.00 0.00 H new ATOM 0 HB3 ALA C 22 20.802 0.927 13.379 1.00 0.00 H new ATOM 1466 N TRP C 23 20.555 1.126 10.504 1.00 0.00 N0 ATOM 1467 CA TRP C 23 20.189 2.056 9.444 1.00 0.00 C0 ATOM 1468 C TRP C 23 19.825 1.297 8.167 1.00 0.00 C0 ATOM 1469 O TRP C 23 18.895 1.678 7.453 1.00 0.00 O0 ATOM 1470 CB TRP C 23 21.339 3.024 9.177 1.00 0.00 C0 ATOM 1471 CG TRP C 23 20.857 4.167 8.350 1.00 0.00 C0 ATOM 1472 CD1 TRP C 23 20.450 5.360 8.842 1.00 0.00 C0 ATOM 1473 CD2 TRP C 23 20.706 4.250 6.901 1.00 0.00 C0 ATOM 1474 NE1 TRP C 23 20.069 6.172 7.789 1.00 0.00 N0 ATOM 1475 CE2 TRP C 23 20.207 5.533 6.574 1.00 0.00 C0 ATOM 1476 CE3 TRP C 23 20.954 3.348 5.848 1.00 0.00 C0 ATOM 1477 CZ2 TRP C 23 19.963 5.909 5.252 1.00 0.00 C0 ATOM 1478 CZ3 TRP C 23 20.707 3.724 4.517 1.00 0.00 C0 ATOM 1479 CH2 TRP C 23 20.214 5.003 4.220 1.00 0.00 C0 ATOM 0 H TRP C 23 21.514 1.216 10.841 1.00 0.00 H new ATOM 0 HA TRP C 23 19.317 2.626 9.765 1.00 0.00 H new ATOM 0 HB2 TRP C 23 21.744 3.391 10.120 1.00 0.00 H new ATOM 0 HB3 TRP C 23 22.149 2.507 8.662 1.00 0.00 H new ATOM 0 HD1 TRP C 23 20.426 5.634 9.887 1.00 0.00 H new ATOM 0 HE1 TRP C 23 19.728 7.127 7.898 1.00 0.00 H new ATOM 0 HE3 TRP C 23 21.336 2.362 6.065 1.00 0.00 H new ATOM 0 HZ2 TRP C 23 19.582 6.895 5.029 1.00 0.00 H new ATOM 0 HZ3 TRP C 23 20.898 3.024 3.717 1.00 0.00 H new ATOM 0 HH2 TRP C 23 20.029 5.287 3.194 1.00 0.00 H new ATOM 1490 N THR C 24 20.544 0.207 7.900 1.00 0.00 N0 ATOM 1491 CA THR C 24 20.267 -0.615 6.722 1.00 0.00 C0 ATOM 1492 C THR C 24 18.899 -1.277 6.829 1.00 0.00 C0 ATOM 1493 O THR C 24 18.137 -1.305 5.861 1.00 0.00 O0 ATOM 1494 CB THR C 24 21.347 -1.690 6.562 1.00 0.00 C0 ATOM 1495 OG1 THR C 24 22.528 -1.097 6.046 1.00 0.00 O0 ATOM 1496 CG2 THR C 24 20.854 -2.786 5.616 1.00 0.00 C0 ATOM 0 H THR C 24 21.316 -0.125 8.478 1.00 0.00 H new ATOM 0 HA THR C 24 20.271 0.036 5.848 1.00 0.00 H new ATOM 0 HB THR C 24 21.562 -2.136 7.533 1.00 0.00 H new ATOM 0 HG1 THR C 24 22.961 -0.566 6.747 1.00 0.00 H new ATOM 0 HG21 THR C 24 21.627 -3.547 5.507 1.00 0.00 H new ATOM 0 HG22 THR C 24 19.952 -3.241 6.025 1.00 0.00 H new ATOM 0 HG23 THR C 24 20.632 -2.352 4.641 1.00 0.00 H new ATOM 1504 N ILE C 25 18.590 -1.810 8.006 1.00 0.00 N0 ATOM 1505 CA ILE C 25 17.304 -2.467 8.215 1.00 0.00 C0 ATOM 1506 C ILE C 25 16.159 -1.483 7.994 1.00 0.00 C0 ATOM 1507 O ILE C 25 15.163 -1.809 7.348 1.00 0.00 O0 ATOM 1508 CB ILE C 25 17.235 -3.034 9.634 1.00 0.00 C0 ATOM 1509 CG1 ILE C 25 18.220 -4.199 9.763 1.00 0.00 C0 ATOM 1510 CG2 ILE C 25 15.816 -3.532 9.919 1.00 0.00 C0 ATOM 1511 CD1 ILE C 25 18.391 -4.563 11.239 1.00 0.00 C0 ATOM 0 H ILE C 25 19.203 -1.801 8.821 1.00 0.00 H new ATOM 0 HA ILE C 25 17.208 -3.281 7.496 1.00 0.00 H new ATOM 0 HB ILE C 25 17.495 -2.254 10.350 1.00 0.00 H new ATOM 0 HG12 ILE C 25 17.855 -5.061 9.205 1.00 0.00 H new ATOM 0 HG13 ILE C 25 19.183 -3.925 9.331 1.00 0.00 H new ATOM 0 HG21 ILE C 25 15.768 -3.936 10.930 1.00 0.00 H new ATOM 0 HG22 ILE C 25 15.114 -2.703 9.826 1.00 0.00 H new ATOM 0 HG23 ILE C 25 15.554 -4.312 9.204 1.00 0.00 H new ATOM 0 HD11 ILE C 25 19.092 -5.392 11.330 1.00 0.00 H new ATOM 0 HD12 ILE C 25 18.776 -3.701 11.784 1.00 0.00 H new ATOM 0 HD13 ILE C 25 17.427 -4.855 11.656 1.00 0.00 H new ATOM 1523 N GLY C 26 16.311 -0.276 8.530 1.00 0.00 N0 ATOM 1524 CA GLY C 26 15.286 0.753 8.380 1.00 0.00 C0 ATOM 1525 C GLY C 26 15.094 1.121 6.911 1.00 0.00 C0 ATOM 1526 O GLY C 26 13.969 1.298 6.445 1.00 0.00 O0 ATOM 0 H GLY C 26 17.128 0.013 9.069 1.00 0.00 H new ATOM 0 HA2 GLY C 26 14.344 0.396 8.796 1.00 0.00 H new ATOM 0 HA3 GLY C 26 15.569 1.640 8.947 1.00 0.00 H new ATOM 1530 N HIS C 27 16.205 1.224 6.188 1.00 0.00 N0 ATOM 1531 CA HIS C 27 16.158 1.565 4.770 1.00 0.00 C0 ATOM 1532 C HIS C 27 15.357 0.531 3.990 1.00 0.00 C0 ATOM 1533 O HIS C 27 14.557 0.878 3.120 1.00 0.00 O0 ATOM 1534 CB HIS C 27 17.577 1.645 4.207 1.00 0.00 C0 ATOM 1535 CG HIS C 27 17.515 1.719 2.707 1.00 0.00 C0 ATOM 1536 ND1 HIS C 27 17.084 2.851 2.035 1.00 0.00 N0 ATOM 1537 CD2 HIS C 27 17.821 0.800 1.735 1.00 0.00 C0 ATOM 1538 CE1 HIS C 27 17.142 2.588 0.717 1.00 0.00 C0 ATOM 1539 NE2 HIS C 27 17.584 1.351 0.479 1.00 0.00 N0 ATOM 0 H HIS C 27 17.144 1.077 6.558 1.00 0.00 H new ATOM 0 HA HIS C 27 15.669 2.534 4.667 1.00 0.00 H new ATOM 0 HB2 HIS C 27 18.089 2.521 4.605 1.00 0.00 H new ATOM 0 HB3 HIS C 27 18.152 0.772 4.516 1.00 0.00 H new ATOM 0 HD2 HIS C 27 18.190 -0.199 1.917 1.00 0.00 H new ATOM 0 HE1 HIS C 27 16.865 3.291 -0.054 1.00 0.00 H new ATOM 0 HE2 HIS C 27 17.719 0.905 -0.428 1.00 0.00 H new ATOM 1547 N LEU C 28 15.575 -0.741 4.303 1.00 0.00 N0 ATOM 1548 CA LEU C 28 14.868 -1.817 3.623 1.00 0.00 C0 ATOM 1549 C LEU C 28 13.410 -1.873 4.073 1.00 0.00 C0 ATOM 1550 O LEU C 28 13.106 -1.671 5.249 1.00 0.00 O0 ATOM 1551 CB LEU C 28 15.549 -3.153 3.928 1.00 0.00 C0 ATOM 1552 CG LEU C 28 16.954 -3.158 3.323 1.00 0.00 C0 ATOM 1553 CD1 LEU C 28 17.734 -4.355 3.864 1.00 0.00 C0 ATOM 1554 CD2 LEU C 28 16.853 -3.263 1.799 1.00 0.00 C0 ATOM 0 H LEU C 28 16.232 -1.050 5.019 1.00 0.00 H new ATOM 0 HA LEU C 28 14.895 -1.626 2.550 1.00 0.00 H new ATOM 0 HB2 LEU C 28 15.605 -3.307 5.006 1.00 0.00 H new ATOM 0 HB3 LEU C 28 14.962 -3.975 3.518 1.00 0.00 H new ATOM 0 HG LEU C 28 17.469 -2.235 3.590 1.00 0.00 H new ATOM 0 HD11 LEU C 28 18.736 -4.361 3.434 1.00 0.00 H new ATOM 0 HD12 LEU C 28 17.805 -4.283 4.949 1.00 0.00 H new ATOM 0 HD13 LEU C 28 17.218 -5.277 3.595 1.00 0.00 H new ATOM 0 HD21 LEU C 28 17.854 -3.267 1.367 1.00 0.00 H new ATOM 0 HD22 LEU C 28 16.339 -4.186 1.531 1.00 0.00 H new ATOM 0 HD23 LEU C 28 16.294 -2.411 1.412 1.00 0.00 H new ATOM 1702 N GLU D 3 51.009 4.804 1.000 1.00 0.00 N0 ATOM 1703 CA GLU D 3 50.051 4.922 2.083 1.00 0.00 C0 ATOM 1704 C GLU D 3 49.907 6.392 2.512 1.00 0.00 C0 ATOM 1705 O GLU D 3 50.901 7.023 2.885 1.00 0.00 O0 ATOM 1706 CB GLU D 3 50.514 4.080 3.271 1.00 0.00 C0 ATOM 1707 CG GLU D 3 50.411 2.600 2.904 1.00 0.00 C0 ATOM 1708 CD GLU D 3 49.025 2.074 3.260 1.00 0.00 C0 ATOM 1709 OE1 GLU D 3 48.724 2.012 4.440 1.00 0.00 O0 ATOM 1710 OE2 GLU D 3 48.285 1.745 2.348 1.00 0.00 O1- ATOM 0 HA GLU D 3 49.082 4.562 1.738 1.00 0.00 H new ATOM 0 HB2 GLU D 3 51.542 4.332 3.533 1.00 0.00 H new ATOM 0 HB3 GLU D 3 49.900 4.294 4.146 1.00 0.00 H new ATOM 0 HG2 GLU D 3 50.598 2.466 1.838 1.00 0.00 H new ATOM 0 HG3 GLU D 3 51.174 2.030 3.435 1.00 0.00 H new ATOM 1717 N PRO D 4 48.714 6.952 2.467 1.00 0.00 N0 ATOM 1718 CA PRO D 4 48.490 8.373 2.862 1.00 0.00 C0 ATOM 1719 C PRO D 4 48.611 8.582 4.367 1.00 0.00 C0 ATOM 1720 O PRO D 4 49.065 9.632 4.820 1.00 0.00 O0 ATOM 1721 CB PRO D 4 47.064 8.664 2.385 1.00 0.00 C0 ATOM 1722 CG PRO D 4 46.379 7.342 2.346 1.00 0.00 C0 ATOM 1723 CD PRO D 4 47.455 6.305 2.042 1.00 0.00 C0 ATOM 0 HA PRO D 4 49.235 9.038 2.425 1.00 0.00 H new ATOM 0 HB2 PRO D 4 46.556 9.349 3.063 1.00 0.00 H new ATOM 0 HB3 PRO D 4 47.067 9.133 1.401 1.00 0.00 H new ATOM 0 HG2 PRO D 4 45.893 7.129 3.298 1.00 0.00 H new ATOM 0 HG3 PRO D 4 45.602 7.330 1.582 1.00 0.00 H new ATOM 0 HD2 PRO D 4 47.280 5.378 2.588 1.00 0.00 H new ATOM 0 HD3 PRO D 4 47.476 6.052 0.982 1.00 0.00 H new ATOM 1731 N PHE D 5 48.201 7.577 5.134 1.00 0.00 N0 ATOM 1732 CA PHE D 5 48.266 7.662 6.588 1.00 0.00 C0 ATOM 1733 C PHE D 5 48.341 6.272 7.206 1.00 0.00 C0 ATOM 1734 O PHE D 5 49.414 5.810 7.592 1.00 0.00 O0 ATOM 1735 CB PHE D 5 47.031 8.391 7.127 1.00 0.00 C0 ATOM 1736 CG PHE D 5 47.196 9.878 6.927 1.00 0.00 C0 ATOM 1737 CD1 PHE D 5 46.477 10.535 5.921 1.00 0.00 C0 ATOM 1738 CD2 PHE D 5 48.069 10.600 7.748 1.00 0.00 C0 ATOM 1739 CE1 PHE D 5 46.634 11.913 5.735 1.00 0.00 C0 ATOM 1740 CE2 PHE D 5 48.225 11.978 7.564 1.00 0.00 C0 ATOM 1741 CZ PHE D 5 47.508 12.635 6.557 1.00 0.00 C0 ATOM 0 H PHE D 5 47.823 6.700 4.776 1.00 0.00 H new ATOM 0 HA PHE D 5 49.165 8.217 6.857 1.00 0.00 H new ATOM 0 HB2 PHE D 5 46.136 8.041 6.612 1.00 0.00 H new ATOM 0 HB3 PHE D 5 46.898 8.168 8.186 1.00 0.00 H new ATOM 0 HD1 PHE D 5 45.801 9.978 5.289 1.00 0.00 H new ATOM 0 HD2 PHE D 5 48.623 10.093 8.524 1.00 0.00 H new ATOM 0 HE1 PHE D 5 46.081 12.420 4.958 1.00 0.00 H new ATOM 0 HE2 PHE D 5 48.898 12.535 8.199 1.00 0.00 H new ATOM 0 HZ PHE D 5 47.629 13.699 6.414 1.00 0.00 H new ATOM 1751 N GLN D 6 47.191 5.607 7.299 1.00 0.00 N0 ATOM 1752 CA GLN D 6 47.128 4.272 7.874 1.00 0.00 C0 ATOM 1753 C GLN D 6 46.007 3.466 7.225 1.00 0.00 C0 ATOM 1754 O GLN D 6 45.150 4.017 6.532 1.00 0.00 O0 ATOM 1755 CB GLN D 6 46.886 4.361 9.383 1.00 0.00 C0 ATOM 1756 CG GLN D 6 48.021 5.152 10.038 1.00 0.00 C0 ATOM 1757 CD GLN D 6 47.877 5.117 11.556 1.00 0.00 C0 ATOM 1758 OE1 GLN D 6 46.760 5.083 12.075 1.00 0.00 O0 ATOM 1759 NE2 GLN D 6 48.945 5.124 12.304 1.00 0.00 N0 ATOM 0 H GLN D 6 46.293 5.973 6.983 1.00 0.00 H new ATOM 0 HA GLN D 6 48.078 3.771 7.689 1.00 0.00 H new ATOM 0 HB2 GLN D 6 45.930 4.846 9.580 1.00 0.00 H new ATOM 0 HB3 GLN D 6 46.831 3.361 9.813 1.00 0.00 H new ATOM 0 HG2 GLN D 6 48.983 4.731 9.747 1.00 0.00 H new ATOM 0 HG3 GLN D 6 48.005 6.184 9.687 1.00 0.00 H new ATOM 0 HE21 GLN D 6 49.869 5.152 11.873 1.00 0.00 H new ATOM 0 HE22 GLN D 6 48.856 5.101 13.320 1.00 0.00 H new ATOM 1768 N ILE D 7 46.021 2.158 7.458 1.00 0.00 N0 ATOM 1769 CA ILE D 7 45.002 1.273 6.897 1.00 0.00 C0 ATOM 1770 C ILE D 7 43.606 1.701 7.361 1.00 0.00 C0 ATOM 1771 O ILE D 7 42.636 1.653 6.602 1.00 0.00 O0 ATOM 1772 CB ILE D 7 45.268 -0.168 7.330 1.00 0.00 C0 ATOM 1773 CG1 ILE D 7 46.528 -0.690 6.632 1.00 0.00 C0 ATOM 1774 CG2 ILE D 7 44.073 -1.045 6.947 1.00 0.00 C0 ATOM 1775 CD1 ILE D 7 46.978 -2.000 7.287 1.00 0.00 C0 ATOM 0 H ILE D 7 46.723 1.687 8.029 1.00 0.00 H new ATOM 0 HA ILE D 7 45.047 1.338 5.810 1.00 0.00 H new ATOM 0 HB ILE D 7 45.412 -0.200 8.410 1.00 0.00 H new ATOM 0 HG12 ILE D 7 46.328 -0.852 5.573 1.00 0.00 H new ATOM 0 HG13 ILE D 7 47.324 0.052 6.696 1.00 0.00 H new ATOM 0 HG21 ILE D 7 44.262 -2.073 7.256 1.00 0.00 H new ATOM 0 HG22 ILE D 7 43.176 -0.676 7.445 1.00 0.00 H new ATOM 0 HG23 ILE D 7 43.928 -1.011 5.867 1.00 0.00 H new ATOM 0 HD11 ILE D 7 47.874 -2.367 6.787 1.00 0.00 H new ATOM 0 HD12 ILE D 7 47.196 -1.824 8.340 1.00 0.00 H new ATOM 0 HD13 ILE D 7 46.184 -2.742 7.200 1.00 0.00 H new ATOM 1787 N LEU D 8 43.512 2.116 8.615 1.00 0.00 N0 ATOM 1788 CA LEU D 8 42.235 2.551 9.174 1.00 0.00 C0 ATOM 1789 C LEU D 8 41.792 3.880 8.555 1.00 0.00 C0 ATOM 1790 O LEU D 8 40.598 4.113 8.327 1.00 0.00 O0 ATOM 1791 CB LEU D 8 42.359 2.706 10.693 1.00 0.00 C0 ATOM 1792 CG LEU D 8 40.983 2.546 11.341 1.00 0.00 C0 ATOM 1793 CD1 LEU D 8 41.132 1.824 12.681 1.00 0.00 C0 ATOM 1794 CD2 LEU D 8 40.363 3.925 11.572 1.00 0.00 C0 ATOM 0 H LEU D 8 44.298 2.162 9.264 1.00 0.00 H new ATOM 0 HA LEU D 8 41.484 1.795 8.943 1.00 0.00 H new ATOM 0 HB2 LEU D 8 43.047 1.960 11.089 1.00 0.00 H new ATOM 0 HB3 LEU D 8 42.775 3.684 10.936 1.00 0.00 H new ATOM 0 HG LEU D 8 40.338 1.964 10.683 1.00 0.00 H new ATOM 0 HD11 LEU D 8 40.152 1.710 13.144 1.00 0.00 H new ATOM 0 HD12 LEU D 8 41.573 0.841 12.517 1.00 0.00 H new ATOM 0 HD13 LEU D 8 41.778 2.406 13.338 1.00 0.00 H new ATOM 0 HD21 LEU D 8 39.382 3.810 12.034 1.00 0.00 H new ATOM 0 HD22 LEU D 8 41.008 4.508 12.229 1.00 0.00 H new ATOM 0 HD23 LEU D 8 40.256 4.441 10.618 1.00 0.00 H new ATOM 1806 N SER D 9 42.769 4.737 8.267 1.00 0.00 N0 ATOM 1807 CA SER D 9 42.489 6.040 7.662 1.00 0.00 C0 ATOM 1808 C SER D 9 41.974 5.876 6.233 1.00 0.00 C0 ATOM 1809 O SER D 9 40.998 6.516 5.832 1.00 0.00 O0 ATOM 1810 CB SER D 9 43.752 6.898 7.649 1.00 0.00 C0 ATOM 1811 OG SER D 9 43.449 8.176 7.105 1.00 0.00 O0 ATOM 0 H SER D 9 43.757 4.555 8.441 1.00 0.00 H new ATOM 0 HA SER D 9 41.721 6.531 8.260 1.00 0.00 H new ATOM 0 HB2 SER D 9 44.143 7.005 8.661 1.00 0.00 H new ATOM 0 HB3 SER D 9 44.528 6.413 7.057 1.00 0.00 H new ATOM 0 HG SER D 9 44.135 8.819 7.379 1.00 0.00 H new ATOM 1817 N ILE D 10 42.628 5.003 5.467 1.00 0.00 N0 ATOM 1818 CA ILE D 10 42.217 4.766 4.091 1.00 0.00 C0 ATOM 1819 C ILE D 10 40.869 4.060 4.057 1.00 0.00 C0 ATOM 1820 O ILE D 10 40.081 4.258 3.134 1.00 0.00 O0 ATOM 1821 CB ILE D 10 43.273 3.928 3.357 1.00 0.00 C0 ATOM 1822 CG1 ILE D 10 43.459 2.597 4.079 1.00 0.00 C0 ATOM 1823 CG2 ILE D 10 44.600 4.689 3.350 1.00 0.00 C0 ATOM 1824 CD1 ILE D 10 44.402 1.692 3.282 1.00 0.00 C0 ATOM 0 H ILE D 10 43.433 4.457 5.774 1.00 0.00 H new ATOM 0 HA ILE D 10 42.121 5.727 3.586 1.00 0.00 H new ATOM 0 HB ILE D 10 42.947 3.743 2.333 1.00 0.00 H new ATOM 0 HG12 ILE D 10 43.864 2.769 5.076 1.00 0.00 H new ATOM 0 HG13 ILE D 10 42.494 2.106 4.207 1.00 0.00 H new ATOM 0 HG21 ILE D 10 45.355 4.099 2.830 1.00 0.00 H new ATOM 0 HG22 ILE D 10 44.470 5.643 2.839 1.00 0.00 H new ATOM 0 HG23 ILE D 10 44.922 4.868 4.376 1.00 0.00 H new ATOM 0 HD11 ILE D 10 44.527 0.745 3.807 1.00 0.00 H new ATOM 0 HD12 ILE D 10 43.980 1.506 2.294 1.00 0.00 H new ATOM 0 HD13 ILE D 10 45.371 2.179 3.177 1.00 0.00 H new ATOM 1836 N CYS D 11 40.601 3.238 5.074 1.00 0.00 N0 ATOM 1837 CA CYS D 11 39.336 2.521 5.140 1.00 0.00 C0 ATOM 1838 C CYS D 11 38.186 3.514 5.254 1.00 0.00 C0 ATOM 1839 O CYS D 11 37.231 3.466 4.477 1.00 0.00 O0 ATOM 1840 CB CYS D 11 39.330 1.583 6.346 1.00 0.00 C0 ATOM 1841 SG CYS D 11 37.764 0.680 6.394 1.00 0.00 S0 ATOM 0 H CYS D 11 41.237 3.057 5.851 1.00 0.00 H new ATOM 0 HA CYS D 11 39.213 1.932 4.231 1.00 0.00 H new ATOM 0 HB2 CYS D 11 40.164 0.884 6.282 1.00 0.00 H new ATOM 0 HB3 CYS D 11 39.462 2.153 7.265 1.00 0.00 H new ATOM 0 HG CYS D 11 37.756 -0.121 7.418 1.00 0.00 H new ATOM 1847 N SER D 12 38.285 4.420 6.224 1.00 0.00 N0 ATOM 1848 CA SER D 12 37.241 5.422 6.423 1.00 0.00 C0 ATOM 1849 C SER D 12 37.088 6.283 5.176 1.00 0.00 C0 ATOM 1850 O SER D 12 35.979 6.678 4.817 1.00 0.00 O0 ATOM 1851 CB SER D 12 37.573 6.305 7.621 1.00 0.00 C0 ATOM 1852 OG SER D 12 36.536 7.263 7.793 1.00 0.00 O0 ATOM 0 H SER D 12 39.066 4.481 6.877 1.00 0.00 H new ATOM 0 HA SER D 12 36.301 4.904 6.614 1.00 0.00 H new ATOM 0 HB2 SER D 12 37.676 5.697 8.520 1.00 0.00 H new ATOM 0 HB3 SER D 12 38.528 6.808 7.465 1.00 0.00 H new ATOM 0 HG SER D 12 36.742 7.833 8.563 1.00 0.00 H new ATOM 1858 N PHE D 13 38.208 6.572 4.522 1.00 0.00 N0 ATOM 1859 CA PHE D 13 38.182 7.385 3.309 1.00 0.00 C0 ATOM 1860 C PHE D 13 37.306 6.738 2.233 1.00 0.00 C0 ATOM 1861 O PHE D 13 36.408 7.377 1.674 1.00 0.00 O0 ATOM 1862 CB PHE D 13 39.604 7.549 2.774 1.00 0.00 C0 ATOM 1863 CG PHE D 13 39.558 8.109 1.371 1.00 0.00 C0 ATOM 1864 CD1 PHE D 13 39.200 9.445 1.157 1.00 0.00 C0 ATOM 1865 CD2 PHE D 13 39.880 7.289 0.282 1.00 0.00 C0 ATOM 1866 CE1 PHE D 13 39.161 9.960 -0.145 1.00 0.00 C0 ATOM 1867 CE2 PHE D 13 39.842 7.803 -1.019 1.00 0.00 C0 ATOM 1868 CZ PHE D 13 39.482 9.139 -1.232 1.00 0.00 C0 ATOM 0 H PHE D 13 39.136 6.260 4.807 1.00 0.00 H new ATOM 0 HA PHE D 13 37.762 8.359 3.558 1.00 0.00 H new ATOM 0 HB2 PHE D 13 40.173 8.215 3.423 1.00 0.00 H new ATOM 0 HB3 PHE D 13 40.117 6.587 2.776 1.00 0.00 H new ATOM 0 HD1 PHE D 13 38.954 10.079 1.996 1.00 0.00 H new ATOM 0 HD2 PHE D 13 40.158 6.258 0.447 1.00 0.00 H new ATOM 0 HE1 PHE D 13 38.883 10.991 -0.310 1.00 0.00 H new ATOM 0 HE2 PHE D 13 40.090 7.170 -1.858 1.00 0.00 H new ATOM 0 HZ PHE D 13 39.452 9.536 -2.236 1.00 0.00 H new ATOM 1878 N ILE D 14 37.557 5.460 1.960 1.00 0.00 N0 ATOM 1879 CA ILE D 14 36.782 4.740 0.961 1.00 0.00 C0 ATOM 1880 C ILE D 14 35.335 4.592 1.418 1.00 0.00 C0 ATOM 1881 O ILE D 14 34.408 4.708 0.615 1.00 0.00 O0 ATOM 1882 CB ILE D 14 37.392 3.354 0.720 1.00 0.00 C0 ATOM 1883 CG1 ILE D 14 38.795 3.510 0.119 1.00 0.00 C0 ATOM 1884 CG2 ILE D 14 36.504 2.560 -0.250 1.00 0.00 C0 ATOM 1885 CD1 ILE D 14 38.700 3.848 -1.375 1.00 0.00 C0 ATOM 0 H ILE D 14 38.285 4.908 2.414 1.00 0.00 H new ATOM 0 HA ILE D 14 36.803 5.308 0.031 1.00 0.00 H new ATOM 0 HB ILE D 14 37.459 2.819 1.667 1.00 0.00 H new ATOM 0 HG12 ILE D 14 39.337 4.297 0.643 1.00 0.00 H new ATOM 0 HG13 ILE D 14 39.361 2.588 0.255 1.00 0.00 H new ATOM 0 HG21 ILE D 14 36.940 1.575 -0.419 1.00 0.00 H new ATOM 0 HG22 ILE D 14 35.508 2.447 0.178 1.00 0.00 H new ATOM 0 HG23 ILE D 14 36.433 3.093 -1.198 1.00 0.00 H new ATOM 0 HD11 ILE D 14 39.703 3.956 -1.788 1.00 0.00 H new ATOM 0 HD12 ILE D 14 38.177 3.047 -1.897 1.00 0.00 H new ATOM 0 HD13 ILE D 14 38.153 4.782 -1.503 1.00 0.00 H new ATOM 1897 N LEU D 15 35.146 4.337 2.712 1.00 0.00 N0 ATOM 1898 CA LEU D 15 33.795 4.180 3.235 1.00 0.00 C0 ATOM 1899 C LEU D 15 32.996 5.448 2.990 1.00 0.00 C0 ATOM 1900 O LEU D 15 31.977 5.416 2.310 1.00 0.00 O0 ATOM 1901 CB LEU D 15 33.853 3.900 4.738 1.00 0.00 C0 ATOM 1902 CG LEU D 15 34.287 2.455 4.967 1.00 0.00 C0 ATOM 1903 CD1 LEU D 15 34.666 2.265 6.436 1.00 0.00 C0 ATOM 1904 CD2 LEU D 15 33.130 1.511 4.615 1.00 0.00 C0 ATOM 0 H LEU D 15 35.892 4.237 3.400 1.00 0.00 H new ATOM 0 HA LEU D 15 33.313 3.345 2.727 1.00 0.00 H new ATOM 0 HB2 LEU D 15 34.553 4.582 5.220 1.00 0.00 H new ATOM 0 HB3 LEU D 15 32.876 4.074 5.190 1.00 0.00 H new ATOM 0 HG LEU D 15 35.146 2.230 4.335 1.00 0.00 H new ATOM 0 HD11 LEU D 15 34.976 1.233 6.601 1.00 0.00 H new ATOM 0 HD12 LEU D 15 35.487 2.936 6.690 1.00 0.00 H new ATOM 0 HD13 LEU D 15 33.805 2.490 7.066 1.00 0.00 H new ATOM 0 HD21 LEU D 15 33.440 0.479 4.779 1.00 0.00 H new ATOM 0 HD22 LEU D 15 32.271 1.737 5.247 1.00 0.00 H new ATOM 0 HD23 LEU D 15 32.856 1.646 3.569 1.00 0.00 H new ATOM 1916 N SER D 16 33.455 6.561 3.554 1.00 0.00 N0 ATOM 1917 CA SER D 16 32.755 7.829 3.390 1.00 0.00 C0 ATOM 1918 C SER D 16 32.442 8.069 1.922 1.00 0.00 C0 ATOM 1919 O SER D 16 31.388 8.610 1.580 1.00 0.00 O0 ATOM 1920 CB SER D 16 33.609 8.975 3.928 1.00 0.00 C0 ATOM 1921 OG SER D 16 33.700 8.863 5.342 1.00 0.00 O0 ATOM 0 H SER D 16 34.300 6.611 4.123 1.00 0.00 H new ATOM 0 HA SER D 16 31.821 7.786 3.951 1.00 0.00 H new ATOM 0 HB2 SER D 16 34.604 8.943 3.484 1.00 0.00 H new ATOM 0 HB3 SER D 16 33.168 9.933 3.654 1.00 0.00 H new ATOM 0 HG SER D 16 34.383 8.199 5.574 1.00 0.00 H new ATOM 1927 N ALA D 17 33.358 7.665 1.051 1.00 0.00 N0 ATOM 1928 CA ALA D 17 33.150 7.849 -0.378 1.00 0.00 C0 ATOM 1929 C ALA D 17 31.884 7.120 -0.840 1.00 0.00 C0 ATOM 1930 O ALA D 17 30.995 7.711 -1.453 1.00 0.00 O0 ATOM 1931 CB ALA D 17 34.360 7.300 -1.133 1.00 0.00 C0 ATOM 0 H ALA D 17 34.238 7.215 1.304 1.00 0.00 H new ATOM 0 HA ALA D 17 33.030 8.913 -0.584 1.00 0.00 H new ATOM 0 HB1 ALA D 17 34.212 7.434 -2.205 1.00 0.00 H new ATOM 0 HB2 ALA D 17 35.257 7.835 -0.821 1.00 0.00 H new ATOM 0 HB3 ALA D 17 34.475 6.239 -0.913 1.00 0.00 H new ATOM 1937 N LEU D 18 31.805 5.833 -0.531 1.00 0.00 N0 ATOM 1938 CA LEU D 18 30.645 5.035 -0.921 1.00 0.00 C0 ATOM 1939 C LEU D 18 29.418 5.441 -0.119 1.00 0.00 C0 ATOM 1940 O LEU D 18 28.283 5.184 -0.525 1.00 0.00 O0 ATOM 1941 CB LEU D 18 30.926 3.550 -0.689 1.00 0.00 C0 ATOM 1942 CG LEU D 18 32.221 3.160 -1.396 1.00 0.00 C0 ATOM 1943 CD1 LEU D 18 32.490 1.671 -1.185 1.00 0.00 C0 ATOM 1944 CD2 LEU D 18 32.100 3.447 -2.895 1.00 0.00 C0 ATOM 0 H LEU D 18 32.521 5.321 -0.017 1.00 0.00 H new ATOM 0 HA LEU D 18 30.454 5.212 -1.979 1.00 0.00 H new ATOM 0 HB2 LEU D 18 31.007 3.347 0.379 1.00 0.00 H new ATOM 0 HB3 LEU D 18 30.098 2.949 -1.066 1.00 0.00 H new ATOM 0 HG LEU D 18 33.044 3.742 -0.982 1.00 0.00 H new ATOM 0 HD11 LEU D 18 33.415 1.393 -1.690 1.00 0.00 H new ATOM 0 HD12 LEU D 18 32.583 1.466 -0.119 1.00 0.00 H new ATOM 0 HD13 LEU D 18 31.664 1.090 -1.595 1.00 0.00 H new ATOM 0 HD21 LEU D 18 33.027 3.167 -3.395 1.00 0.00 H new ATOM 0 HD22 LEU D 18 31.275 2.869 -3.311 1.00 0.00 H new ATOM 0 HD23 LEU D 18 31.912 4.510 -3.048 1.00 0.00 H new ATOM 1956 N HIS D 19 29.653 6.081 1.014 1.00 0.00 N0 ATOM 1957 CA HIS D 19 28.571 6.527 1.864 1.00 0.00 C0 ATOM 1958 C HIS D 19 27.797 7.661 1.215 1.00 0.00 C0 ATOM 1959 O HIS D 19 26.570 7.647 1.197 1.00 0.00 O0 ATOM 1960 CB HIS D 19 29.126 6.987 3.210 1.00 0.00 C0 ATOM 1961 CG HIS D 19 28.045 7.679 3.986 1.00 0.00 C0 ATOM 1962 ND1 HIS D 19 27.199 7.001 4.850 1.00 0.00 N0 ATOM 1963 CD2 HIS D 19 27.658 8.992 4.033 1.00 0.00 C0 ATOM 1964 CE1 HIS D 19 26.352 7.903 5.378 1.00 0.00 C0 ATOM 1965 NE2 HIS D 19 26.589 9.134 4.913 1.00 0.00 N0 ATOM 0 H HIS D 19 30.585 6.302 1.364 1.00 0.00 H new ATOM 0 HA HIS D 19 27.890 5.690 2.015 1.00 0.00 H new ATOM 0 HB2 HIS D 19 29.502 6.132 3.772 1.00 0.00 H new ATOM 0 HB3 HIS D 19 29.968 7.662 3.057 1.00 0.00 H new ATOM 0 HD2 HIS D 19 28.113 9.795 3.472 1.00 0.00 H new ATOM 0 HE1 HIS D 19 25.576 7.662 6.090 1.00 0.00 H new ATOM 0 HE2 HIS D 19 26.093 9.993 5.152 1.00 0.00 H new ATOM 1973 N PHE D 20 28.521 8.624 0.663 1.00 0.00 N0 ATOM 1974 CA PHE D 20 27.883 9.752 0.005 1.00 0.00 C0 ATOM 1975 C PHE D 20 27.395 9.361 -1.380 1.00 0.00 C0 ATOM 1976 O PHE D 20 26.478 9.976 -1.915 1.00 0.00 O0 ATOM 1977 CB PHE D 20 28.863 10.918 -0.101 1.00 0.00 C0 ATOM 1978 CG PHE D 20 28.366 12.068 0.740 1.00 0.00 C0 ATOM 1979 CD1 PHE D 20 28.472 12.018 2.135 1.00 0.00 C0 ATOM 1980 CD2 PHE D 20 27.793 13.182 0.119 1.00 0.00 C0 ATOM 1981 CE1 PHE D 20 28.003 13.085 2.909 1.00 0.00 C0 ATOM 1982 CE2 PHE D 20 27.326 14.250 0.894 1.00 0.00 C0 ATOM 1983 CZ PHE D 20 27.429 14.201 2.288 1.00 0.00 C0 ATOM 0 H PHE D 20 29.541 8.647 0.658 1.00 0.00 H new ATOM 0 HA PHE D 20 27.024 10.057 0.602 1.00 0.00 H new ATOM 0 HB2 PHE D 20 29.852 10.608 0.236 1.00 0.00 H new ATOM 0 HB3 PHE D 20 28.963 11.230 -1.141 1.00 0.00 H new ATOM 0 HD1 PHE D 20 28.915 11.157 2.613 1.00 0.00 H new ATOM 0 HD2 PHE D 20 27.711 13.218 -0.957 1.00 0.00 H new ATOM 0 HE1 PHE D 20 28.084 13.048 3.985 1.00 0.00 H new ATOM 0 HE2 PHE D 20 26.886 15.112 0.415 1.00 0.00 H new ATOM 0 HZ PHE D 20 27.066 15.024 2.885 1.00 0.00 H new ATOM 1993 N MET D 21 27.998 8.329 -1.953 1.00 0.00 N0 ATOM 1994 CA MET D 21 27.598 7.873 -3.277 1.00 0.00 C0 ATOM 1995 C MET D 21 26.220 7.213 -3.237 1.00 0.00 C0 ATOM 1996 O MET D 21 25.278 7.661 -3.894 1.00 0.00 O0 ATOM 1997 CB MET D 21 28.629 6.876 -3.802 1.00 0.00 C0 ATOM 1998 CG MET D 21 29.882 7.638 -4.245 1.00 0.00 C0 ATOM 1999 SD MET D 21 29.528 8.566 -5.759 1.00 0.00 S0 ATOM 2000 CE MET D 21 31.189 9.248 -5.999 1.00 0.00 C0 ATOM 0 H MET D 21 28.757 7.797 -1.528 1.00 0.00 H new ATOM 0 HA MET D 21 27.544 8.737 -3.939 1.00 0.00 H new ATOM 0 HB2 MET D 21 28.883 6.154 -3.026 1.00 0.00 H new ATOM 0 HB3 MET D 21 28.216 6.313 -4.639 1.00 0.00 H new ATOM 0 HG2 MET D 21 30.203 8.319 -3.457 1.00 0.00 H new ATOM 0 HG3 MET D 21 30.702 6.940 -4.418 1.00 0.00 H new ATOM 0 HE1 MET D 21 31.202 9.867 -6.896 1.00 0.00 H new ATOM 0 HE2 MET D 21 31.462 9.855 -5.135 1.00 0.00 H new ATOM 0 HE3 MET D 21 31.904 8.433 -6.110 1.00 0.00 H new ATOM 2010 N ALA D 22 26.115 6.142 -2.463 1.00 0.00 N0 ATOM 2011 CA ALA D 22 24.851 5.422 -2.349 1.00 0.00 C0 ATOM 2012 C ALA D 22 23.779 6.294 -1.700 1.00 0.00 C0 ATOM 2013 O ALA D 22 22.624 6.297 -2.133 1.00 0.00 O0 ATOM 2014 CB ALA D 22 25.044 4.147 -1.532 1.00 0.00 C0 ATOM 0 H ALA D 22 26.879 5.754 -1.910 1.00 0.00 H new ATOM 0 HA ALA D 22 24.520 5.161 -3.354 1.00 0.00 H new ATOM 0 HB1 ALA D 22 24.094 3.618 -1.453 1.00 0.00 H new ATOM 0 HB2 ALA D 22 25.776 3.507 -2.024 1.00 0.00 H new ATOM 0 HB3 ALA D 22 25.399 4.405 -0.534 1.00 0.00 H new ATOM 2020 N TRP D 23 24.164 7.022 -0.658 1.00 0.00 N0 ATOM 2021 CA TRP D 23 23.218 7.881 0.042 1.00 0.00 C0 ATOM 2022 C TRP D 23 22.681 8.964 -0.894 1.00 0.00 C0 ATOM 2023 O TRP D 23 21.502 9.312 -0.842 1.00 0.00 O0 ATOM 2024 CB TRP D 23 23.886 8.519 1.258 1.00 0.00 C0 ATOM 2025 CG TRP D 23 22.850 9.118 2.150 1.00 0.00 C0 ATOM 2026 CD1 TRP D 23 22.310 8.501 3.227 1.00 0.00 C0 ATOM 2027 CD2 TRP D 23 22.213 10.426 2.064 1.00 0.00 C0 ATOM 2028 NE1 TRP D 23 21.389 9.349 3.812 1.00 0.00 N0 ATOM 2029 CE2 TRP D 23 21.291 10.546 3.131 1.00 0.00 C0 ATOM 2030 CE3 TRP D 23 22.342 11.509 1.176 1.00 0.00 C0 ATOM 2031 CZ2 TRP D 23 20.527 11.698 3.312 1.00 0.00 C0 ATOM 2032 CZ3 TRP D 23 21.573 12.671 1.354 1.00 0.00 C0 ATOM 2033 CH2 TRP D 23 20.666 12.765 2.421 1.00 0.00 C0 ATOM 0 H TRP D 23 25.113 7.035 -0.283 1.00 0.00 H new ATOM 0 HA TRP D 23 22.381 7.270 0.379 1.00 0.00 H new ATOM 0 HB2 TRP D 23 24.459 7.770 1.804 1.00 0.00 H new ATOM 0 HB3 TRP D 23 24.590 9.287 0.936 1.00 0.00 H new ATOM 0 HD1 TRP D 23 22.558 7.508 3.573 1.00 0.00 H new ATOM 0 HE1 TRP D 23 20.848 9.119 4.645 1.00 0.00 H new ATOM 0 HE3 TRP D 23 23.037 11.447 0.352 1.00 0.00 H new ATOM 0 HZ2 TRP D 23 19.832 11.765 4.136 1.00 0.00 H new ATOM 0 HZ3 TRP D 23 21.680 13.497 0.666 1.00 0.00 H new ATOM 0 HH2 TRP D 23 20.077 13.660 2.553 1.00 0.00 H new ATOM 2044 N THR D 24 23.551 9.474 -1.768 1.00 0.00 N0 ATOM 2045 CA THR D 24 23.144 10.494 -2.732 1.00 0.00 C0 ATOM 2046 C THR D 24 22.137 9.932 -3.729 1.00 0.00 C0 ATOM 2047 O THR D 24 21.137 10.579 -4.045 1.00 0.00 O0 ATOM 2048 CB THR D 24 24.368 11.027 -3.485 1.00 0.00 C0 ATOM 2049 OG1 THR D 24 25.091 11.910 -2.642 1.00 0.00 O0 ATOM 2050 CG2 THR D 24 23.923 11.759 -4.752 1.00 0.00 C0 ATOM 0 H THR D 24 24.532 9.200 -1.827 1.00 0.00 H new ATOM 0 HA THR D 24 22.672 11.308 -2.182 1.00 0.00 H new ATOM 0 HB THR D 24 25.010 10.193 -3.769 1.00 0.00 H new ATOM 0 HG1 THR D 24 25.707 11.395 -2.081 1.00 0.00 H new ATOM 0 HG21 THR D 24 24.798 12.135 -5.282 1.00 0.00 H new ATOM 0 HG22 THR D 24 23.377 11.071 -5.397 1.00 0.00 H new ATOM 0 HG23 THR D 24 23.276 12.594 -4.482 1.00 0.00 H new ATOM 2058 N ILE D 25 22.402 8.727 -4.221 1.00 0.00 N0 ATOM 2059 CA ILE D 25 21.502 8.097 -5.182 1.00 0.00 C0 ATOM 2060 C ILE D 25 20.119 7.897 -4.567 1.00 0.00 C0 ATOM 2061 O ILE D 25 19.101 8.165 -5.206 1.00 0.00 O0 ATOM 2062 CB ILE D 25 22.072 6.748 -5.619 1.00 0.00 C0 ATOM 2063 CG1 ILE D 25 23.331 6.978 -6.458 1.00 0.00 C0 ATOM 2064 CG2 ILE D 25 21.033 5.998 -6.456 1.00 0.00 C0 ATOM 2065 CD1 ILE D 25 24.080 5.653 -6.632 1.00 0.00 C0 ATOM 0 H ILE D 25 23.222 8.172 -3.975 1.00 0.00 H new ATOM 0 HA ILE D 25 21.408 8.749 -6.050 1.00 0.00 H new ATOM 0 HB ILE D 25 22.321 6.157 -4.738 1.00 0.00 H new ATOM 0 HG12 ILE D 25 23.062 7.386 -7.432 1.00 0.00 H new ATOM 0 HG13 ILE D 25 23.975 7.711 -5.972 1.00 0.00 H new ATOM 0 HG21 ILE D 25 21.441 5.036 -6.767 1.00 0.00 H new ATOM 0 HG22 ILE D 25 20.135 5.835 -5.860 1.00 0.00 H new ATOM 0 HG23 ILE D 25 20.782 6.587 -7.338 1.00 0.00 H new ATOM 0 HD11 ILE D 25 24.977 5.818 -7.230 1.00 0.00 H new ATOM 0 HD12 ILE D 25 24.362 5.263 -5.654 1.00 0.00 H new ATOM 0 HD13 ILE D 25 23.435 4.934 -7.136 1.00 0.00 H new ATOM 2077 N GLY D 26 20.092 7.435 -3.321 1.00 0.00 N0 ATOM 2078 CA GLY D 26 18.828 7.211 -2.625 1.00 0.00 C0 ATOM 2079 C GLY D 26 18.063 8.521 -2.452 1.00 0.00 C0 ATOM 2080 O GLY D 26 16.845 8.570 -2.624 1.00 0.00 O0 ATOM 0 H GLY D 26 20.924 7.210 -2.775 1.00 0.00 H new ATOM 0 HA2 GLY D 26 18.220 6.501 -3.186 1.00 0.00 H new ATOM 0 HA3 GLY D 26 19.019 6.765 -1.649 1.00 0.00 H new ATOM 2084 N HIS D 27 18.791 9.580 -2.116 1.00 0.00 N0 ATOM 2085 CA HIS D 27 18.181 10.892 -1.926 1.00 0.00 C0 ATOM 2086 C HIS D 27 17.495 11.361 -3.203 1.00 0.00 C0 ATOM 2087 O HIS D 27 16.388 11.899 -3.162 1.00 0.00 O0 ATOM 2088 CB HIS D 27 19.247 11.907 -1.515 1.00 0.00 C0 ATOM 2089 CG HIS D 27 18.673 13.293 -1.592 1.00 0.00 C0 ATOM 2090 ND1 HIS D 27 17.739 13.763 -0.680 1.00 0.00 N0 ATOM 2091 CD2 HIS D 27 18.887 14.323 -2.474 1.00 0.00 C0 ATOM 2092 CE1 HIS D 27 17.428 15.024 -1.033 1.00 0.00 C0 ATOM 2093 NE2 HIS D 27 18.100 15.415 -2.119 1.00 0.00 N0 ATOM 0 H HIS D 27 19.800 9.557 -1.970 1.00 0.00 H new ATOM 0 HA HIS D 27 17.432 10.810 -1.138 1.00 0.00 H new ATOM 0 HB2 HIS D 27 19.591 11.700 -0.502 1.00 0.00 H new ATOM 0 HB3 HIS D 27 20.115 11.824 -2.169 1.00 0.00 H new ATOM 0 HD2 HIS D 27 19.563 14.291 -3.315 1.00 0.00 H new ATOM 0 HE1 HIS D 27 16.721 15.644 -0.502 1.00 0.00 H new ATOM 0 HE2 HIS D 27 18.048 16.319 -2.588 1.00 0.00 H new ATOM 2101 N LEU D 28 18.157 11.156 -4.335 1.00 0.00 N0 ATOM 2102 CA LEU D 28 17.601 11.565 -5.619 1.00 0.00 C0 ATOM 2103 C LEU D 28 16.456 10.643 -6.027 1.00 0.00 C0 ATOM 2104 O LEU D 28 16.516 9.433 -5.815 1.00 0.00 O0 ATOM 2105 CB LEU D 28 18.695 11.528 -6.687 1.00 0.00 C0 ATOM 2106 CG LEU D 28 19.759 12.579 -6.364 1.00 0.00 C0 ATOM 2107 CD1 LEU D 28 20.981 12.353 -7.254 1.00 0.00 C0 ATOM 2108 CD2 LEU D 28 19.192 13.977 -6.624 1.00 0.00 C0 ATOM 0 H LEU D 28 19.074 10.712 -4.391 1.00 0.00 H new ATOM 0 HA LEU D 28 17.215 12.580 -5.524 1.00 0.00 H new ATOM 0 HB2 LEU D 28 19.147 10.537 -6.725 1.00 0.00 H new ATOM 0 HB3 LEU D 28 18.265 11.720 -7.670 1.00 0.00 H new ATOM 0 HG LEU D 28 20.049 12.494 -5.317 1.00 0.00 H new ATOM 0 HD11 LEU D 28 21.741 13.101 -7.026 1.00 0.00 H new ATOM 0 HD12 LEU D 28 21.385 11.357 -7.071 1.00 0.00 H new ATOM 0 HD13 LEU D 28 20.690 12.440 -8.301 1.00 0.00 H new ATOM 0 HD21 LEU D 28 19.950 14.726 -6.394 1.00 0.00 H new ATOM 0 HD22 LEU D 28 18.903 14.063 -7.671 1.00 0.00 H new ATOM 0 HD23 LEU D 28 18.319 14.139 -5.992 1.00 0.00 H new