USER MOD reduce.3.24.130724 H: found=0, std=0, add=840, rem=0, adj=24 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 X(o=0,f=0) USER MOD Single : A 9 SER OG : rot -32:sc= 0.755 USER MOD Single : A 11 CYS SG : rot 76:sc= 1.12 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot -28:sc= 0.198 USER MOD Single : A 19 HIS : no HE2:sc= -2.09 X(o=-2.1,f=-2.1!) USER MOD Single : A 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 75:sc= 1.19 USER MOD Single : A 27 HIS : no HD1:sc=-0.00321 X(o=-0.0032,f=-0.0032) USER MOD Single : B 6 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 9 SER OG : rot -31:sc= 0.701 USER MOD Single : B 11 CYS SG : rot 78:sc= 1.15 USER MOD Single : B 12 SER OG : rot 180:sc= 0 USER MOD Single : B 16 SER OG : rot -30:sc= 0.273 USER MOD Single : B 19 HIS : no HE2:sc= -2.35 X(o=-2.4,f=-2.1!) USER MOD Single : B 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 24 THR OG1 : rot 80:sc= 1.22 USER MOD Single : B 27 HIS : no HD1:sc=-0.00213 X(o=-0.0021,f=0) USER MOD Single : C 6 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 9 SER OG : rot -26:sc= 0.726 USER MOD Single : C 11 CYS SG : rot 79:sc= 1.16 USER MOD Single : C 12 SER OG : rot 180:sc= 0 USER MOD Single : C 16 SER OG : rot -30:sc= 0.222 USER MOD Single : C 19 HIS : no HE2:sc= -2.18 X(o=-2.2,f=-2.1!) USER MOD Single : C 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 24 THR OG1 : rot 88:sc= 1.15 USER MOD Single : C 27 HIS : no HD1:sc=-0.00438 X(o=-0.0044,f=-0.00075) USER MOD Single : D 6 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : D 9 SER OG : rot -22:sc= 0.682 USER MOD Single : D 11 CYS SG : rot 82:sc= 1.13 USER MOD Single : D 12 SER OG : rot 180:sc= 0 USER MOD Single : D 16 SER OG : rot -29:sc= 0.249 USER MOD Single : D 19 HIS : no HE2:sc= -2.31 X(o=-2.3,f=-2.1!) USER MOD Single : D 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : D 24 THR OG1 : rot 105:sc= 1.2 USER MOD Single : D 27 HIS : no HD1:sc=-0.00561 X(o=-0.0056,f=0) USER MOD ----------------------------------------------------------------- ATOM 40 N GLU A 3 48.886 25.017 8.358 1.00 0.00 N0 ATOM 41 CA GLU A 3 47.683 24.198 8.477 1.00 0.00 C0 ATOM 42 C GLU A 3 47.213 24.141 9.936 1.00 0.00 C0 ATOM 43 O GLU A 3 48.031 24.198 10.853 1.00 0.00 O0 ATOM 44 CB GLU A 3 47.960 22.778 7.975 1.00 0.00 C0 ATOM 45 CG GLU A 3 48.280 22.813 6.476 1.00 0.00 C0 ATOM 46 CD GLU A 3 49.755 23.143 6.251 1.00 0.00 C0 ATOM 47 OE1 GLU A 3 50.489 23.201 7.222 1.00 0.00 O0 ATOM 48 OE2 GLU A 3 50.127 23.333 5.104 1.00 0.00 O1- ATOM 0 HA GLU A 3 46.900 24.651 7.869 1.00 0.00 H new ATOM 0 HB2 GLU A 3 48.795 22.344 8.525 1.00 0.00 H new ATOM 0 HB3 GLU A 3 47.094 22.142 8.157 1.00 0.00 H new ATOM 0 HG2 GLU A 3 48.044 21.849 6.025 1.00 0.00 H new ATOM 0 HG3 GLU A 3 47.655 23.557 5.982 1.00 0.00 H new ATOM 55 N PRO A 4 45.922 24.031 10.173 1.00 0.00 N0 ATOM 56 CA PRO A 4 45.366 23.970 11.559 1.00 0.00 C0 ATOM 57 C PRO A 4 45.613 22.619 12.229 1.00 0.00 C0 ATOM 58 O PRO A 4 45.896 22.551 13.426 1.00 0.00 O0 ATOM 59 CB PRO A 4 43.869 24.204 11.352 1.00 0.00 C0 ATOM 60 CG PRO A 4 43.585 23.716 9.972 1.00 0.00 C0 ATOM 61 CD PRO A 4 44.856 23.950 9.158 1.00 0.00 C0 ATOM 0 HA PRO A 4 45.836 24.699 12.219 1.00 0.00 H new ATOM 0 HB2 PRO A 4 43.280 23.661 12.091 1.00 0.00 H new ATOM 0 HB3 PRO A 4 43.617 25.259 11.456 1.00 0.00 H new ATOM 0 HG2 PRO A 4 43.320 22.659 9.981 1.00 0.00 H new ATOM 0 HG3 PRO A 4 42.742 24.252 9.537 1.00 0.00 H new ATOM 0 HD2 PRO A 4 45.035 23.136 8.456 1.00 0.00 H new ATOM 0 HD3 PRO A 4 44.792 24.868 8.573 1.00 0.00 H new ATOM 69 N PHE A 5 45.503 21.548 11.449 1.00 0.00 N0 ATOM 70 CA PHE A 5 45.713 20.203 11.975 1.00 0.00 C0 ATOM 71 C PHE A 5 46.287 19.294 10.889 1.00 0.00 C0 ATOM 72 O PHE A 5 47.501 19.110 10.801 1.00 0.00 O0 ATOM 73 CB PHE A 5 44.389 19.627 12.485 1.00 0.00 C0 ATOM 74 CG PHE A 5 44.281 19.827 13.978 1.00 0.00 C0 ATOM 75 CD1 PHE A 5 43.559 20.912 14.489 1.00 0.00 C0 ATOM 76 CD2 PHE A 5 44.897 18.924 14.853 1.00 0.00 C0 ATOM 77 CE1 PHE A 5 43.452 21.094 15.873 1.00 0.00 C0 ATOM 78 CE2 PHE A 5 44.792 19.107 16.238 1.00 0.00 C0 ATOM 79 CZ PHE A 5 44.068 20.192 16.749 1.00 0.00 C0 ATOM 0 H PHE A 5 45.271 21.584 10.456 1.00 0.00 H new ATOM 0 HA PHE A 5 46.422 20.258 12.801 1.00 0.00 H new ATOM 0 HB2 PHE A 5 43.553 20.114 11.983 1.00 0.00 H new ATOM 0 HB3 PHE A 5 44.329 18.565 12.247 1.00 0.00 H new ATOM 0 HD1 PHE A 5 43.084 21.609 13.815 1.00 0.00 H new ATOM 0 HD2 PHE A 5 45.453 18.086 14.460 1.00 0.00 H new ATOM 0 HE1 PHE A 5 42.894 21.931 16.265 1.00 0.00 H new ATOM 0 HE2 PHE A 5 45.269 18.411 16.912 1.00 0.00 H new ATOM 0 HZ PHE A 5 43.985 20.332 17.817 1.00 0.00 H new ATOM 89 N GLN A 6 45.410 18.734 10.057 1.00 0.00 N0 ATOM 90 CA GLN A 6 45.846 17.856 8.979 1.00 0.00 C0 ATOM 91 C GLN A 6 44.900 17.967 7.789 1.00 0.00 C0 ATOM 92 O GLN A 6 43.776 18.446 7.920 1.00 0.00 O0 ATOM 93 CB GLN A 6 45.900 16.405 9.459 1.00 0.00 C0 ATOM 94 CG GLN A 6 47.017 16.253 10.492 1.00 0.00 C0 ATOM 95 CD GLN A 6 47.146 14.791 10.907 1.00 0.00 C0 ATOM 96 OE1 GLN A 6 46.216 14.221 11.478 1.00 0.00 O0 ATOM 97 NE2 GLN A 6 48.249 14.145 10.645 1.00 0.00 N0 ATOM 0 H GLN A 6 44.401 18.873 10.110 1.00 0.00 H new ATOM 0 HA GLN A 6 46.845 18.165 8.671 1.00 0.00 H new ATOM 0 HB2 GLN A 6 44.943 16.119 9.897 1.00 0.00 H new ATOM 0 HB3 GLN A 6 46.076 15.738 8.615 1.00 0.00 H new ATOM 0 HG2 GLN A 6 47.960 16.606 10.075 1.00 0.00 H new ATOM 0 HG3 GLN A 6 46.803 16.870 11.365 1.00 0.00 H new ATOM 0 HE21 GLN A 6 49.018 14.620 10.172 1.00 0.00 H new ATOM 0 HE22 GLN A 6 48.342 13.165 10.913 1.00 0.00 H new ATOM 106 N ILE A 7 45.370 17.534 6.628 1.00 0.00 N0 ATOM 107 CA ILE A 7 44.560 17.598 5.418 1.00 0.00 C0 ATOM 108 C ILE A 7 43.328 16.702 5.551 1.00 0.00 C0 ATOM 109 O ILE A 7 42.221 17.087 5.176 1.00 0.00 O0 ATOM 110 CB ILE A 7 45.389 17.145 4.213 1.00 0.00 C0 ATOM 111 CG1 ILE A 7 46.746 17.865 4.203 1.00 0.00 C0 ATOM 112 CG2 ILE A 7 44.634 17.466 2.921 1.00 0.00 C0 ATOM 113 CD1 ILE A 7 46.546 19.376 4.343 1.00 0.00 C0 ATOM 0 H ILE A 7 46.301 17.137 6.497 1.00 0.00 H new ATOM 0 HA ILE A 7 44.236 18.628 5.273 1.00 0.00 H new ATOM 0 HB ILE A 7 45.556 16.070 4.283 1.00 0.00 H new ATOM 0 HG12 ILE A 7 47.367 17.496 5.019 1.00 0.00 H new ATOM 0 HG13 ILE A 7 47.275 17.646 3.276 1.00 0.00 H new ATOM 0 HG21 ILE A 7 45.225 17.143 2.064 1.00 0.00 H new ATOM 0 HG22 ILE A 7 43.677 16.944 2.919 1.00 0.00 H new ATOM 0 HG23 ILE A 7 44.461 18.540 2.858 1.00 0.00 H new ATOM 0 HD11 ILE A 7 47.516 19.874 4.334 1.00 0.00 H new ATOM 0 HD12 ILE A 7 45.943 19.742 3.512 1.00 0.00 H new ATOM 0 HD13 ILE A 7 46.037 19.590 5.283 1.00 0.00 H new ATOM 125 N LEU A 8 43.533 15.507 6.098 1.00 0.00 N0 ATOM 126 CA LEU A 8 42.434 14.559 6.290 1.00 0.00 C0 ATOM 127 C LEU A 8 41.473 15.056 7.368 1.00 0.00 C0 ATOM 128 O LEU A 8 40.258 14.861 7.275 1.00 0.00 O0 ATOM 129 CB LEU A 8 42.983 13.189 6.702 1.00 0.00 C0 ATOM 130 CG LEU A 8 43.089 12.265 5.484 1.00 0.00 C0 ATOM 131 CD1 LEU A 8 41.687 11.861 5.013 1.00 0.00 C0 ATOM 132 CD2 LEU A 8 43.827 12.982 4.348 1.00 0.00 C0 ATOM 0 H LEU A 8 44.443 15.171 6.415 1.00 0.00 H new ATOM 0 HA LEU A 8 41.897 14.471 5.346 1.00 0.00 H new ATOM 0 HB2 LEU A 8 43.964 13.307 7.163 1.00 0.00 H new ATOM 0 HB3 LEU A 8 42.331 12.740 7.451 1.00 0.00 H new ATOM 0 HG LEU A 8 43.645 11.371 5.765 1.00 0.00 H new ATOM 0 HD11 LEU A 8 41.769 11.204 4.147 1.00 0.00 H new ATOM 0 HD12 LEU A 8 41.170 11.338 5.817 1.00 0.00 H new ATOM 0 HD13 LEU A 8 41.124 12.753 4.739 1.00 0.00 H new ATOM 0 HD21 LEU A 8 43.899 12.319 3.485 1.00 0.00 H new ATOM 0 HD22 LEU A 8 43.279 13.882 4.069 1.00 0.00 H new ATOM 0 HD23 LEU A 8 44.829 13.255 4.680 1.00 0.00 H new ATOM 144 N SER A 9 42.028 15.711 8.384 1.00 0.00 N0 ATOM 145 CA SER A 9 41.209 16.239 9.470 1.00 0.00 C0 ATOM 146 C SER A 9 40.361 17.404 8.976 1.00 0.00 C0 ATOM 147 O SER A 9 39.181 17.509 9.301 1.00 0.00 O0 ATOM 148 CB SER A 9 42.099 16.699 10.625 1.00 0.00 C0 ATOM 149 OG SER A 9 42.946 17.747 10.177 1.00 0.00 O0 ATOM 0 H SER A 9 43.028 15.887 8.478 1.00 0.00 H new ATOM 0 HA SER A 9 40.549 15.447 9.823 1.00 0.00 H new ATOM 0 HB2 SER A 9 41.485 17.043 11.457 1.00 0.00 H new ATOM 0 HB3 SER A 9 42.697 15.865 10.993 1.00 0.00 H new ATOM 0 HG SER A 9 43.158 17.614 9.229 1.00 0.00 H new ATOM 155 N ILE A 10 40.971 18.271 8.174 1.00 0.00 N0 ATOM 156 CA ILE A 10 40.261 19.419 7.629 1.00 0.00 C0 ATOM 157 C ILE A 10 39.153 18.967 6.687 1.00 0.00 C0 ATOM 158 O ILE A 10 38.053 19.516 6.709 1.00 0.00 O0 ATOM 159 CB ILE A 10 41.232 20.341 6.890 1.00 0.00 C0 ATOM 160 CG1 ILE A 10 41.959 21.230 7.910 1.00 0.00 C0 ATOM 161 CG2 ILE A 10 40.461 21.213 5.893 1.00 0.00 C0 ATOM 162 CD1 ILE A 10 41.032 22.361 8.386 1.00 0.00 C0 ATOM 0 H ILE A 10 41.948 18.200 7.890 1.00 0.00 H new ATOM 0 HA ILE A 10 39.812 19.968 8.456 1.00 0.00 H new ATOM 0 HB ILE A 10 41.962 19.743 6.345 1.00 0.00 H new ATOM 0 HG12 ILE A 10 42.280 20.631 8.762 1.00 0.00 H new ATOM 0 HG13 ILE A 10 42.858 21.652 7.460 1.00 0.00 H new ATOM 0 HG21 ILE A 10 41.157 21.868 5.369 1.00 0.00 H new ATOM 0 HG22 ILE A 10 39.949 20.576 5.172 1.00 0.00 H new ATOM 0 HG23 ILE A 10 39.728 21.816 6.428 1.00 0.00 H new ATOM 0 HD11 ILE A 10 41.559 22.984 9.109 1.00 0.00 H new ATOM 0 HD12 ILE A 10 40.733 22.969 7.533 1.00 0.00 H new ATOM 0 HD13 ILE A 10 40.146 21.932 8.855 1.00 0.00 H new ATOM 174 N CYS A 11 39.448 17.967 5.861 1.00 0.00 N0 ATOM 175 CA CYS A 11 38.452 17.467 4.925 1.00 0.00 C0 ATOM 176 C CYS A 11 37.232 16.967 5.689 1.00 0.00 C0 ATOM 177 O CYS A 11 36.101 17.333 5.375 1.00 0.00 O0 ATOM 178 CB CYS A 11 39.039 16.329 4.088 1.00 0.00 C0 ATOM 179 SG CYS A 11 40.278 16.998 2.951 1.00 0.00 S0 ATOM 0 H CYS A 11 40.352 17.496 5.822 1.00 0.00 H new ATOM 0 HA CYS A 11 38.154 18.278 4.260 1.00 0.00 H new ATOM 0 HB2 CYS A 11 39.492 15.581 4.738 1.00 0.00 H new ATOM 0 HB3 CYS A 11 38.248 15.829 3.529 1.00 0.00 H new ATOM 0 HG CYS A 11 41.370 17.262 3.605 1.00 0.00 H new ATOM 185 N SER A 12 37.465 16.130 6.692 1.00 0.00 N0 ATOM 186 CA SER A 12 36.367 15.593 7.487 1.00 0.00 C0 ATOM 187 C SER A 12 35.584 16.719 8.159 1.00 0.00 C0 ATOM 188 O SER A 12 34.356 16.671 8.237 1.00 0.00 O0 ATOM 189 CB SER A 12 36.908 14.640 8.554 1.00 0.00 C0 ATOM 190 OG SER A 12 35.825 14.129 9.320 1.00 0.00 O0 ATOM 0 H SER A 12 38.392 15.811 6.972 1.00 0.00 H new ATOM 0 HA SER A 12 35.698 15.050 6.820 1.00 0.00 H new ATOM 0 HB2 SER A 12 37.454 13.822 8.084 1.00 0.00 H new ATOM 0 HB3 SER A 12 37.612 15.163 9.202 1.00 0.00 H new ATOM 0 HG SER A 12 36.168 13.517 10.004 1.00 0.00 H new ATOM 196 N PHE A 13 36.302 17.724 8.654 1.00 0.00 N0 ATOM 197 CA PHE A 13 35.662 18.849 9.329 1.00 0.00 C0 ATOM 198 C PHE A 13 34.700 19.578 8.391 1.00 0.00 C0 ATOM 199 O PHE A 13 33.531 19.792 8.729 1.00 0.00 O0 ATOM 200 CB PHE A 13 36.734 19.826 9.825 1.00 0.00 C0 ATOM 201 CG PHE A 13 36.082 20.995 10.529 1.00 0.00 C0 ATOM 202 CD1 PHE A 13 35.508 20.817 11.793 1.00 0.00 C0 ATOM 203 CD2 PHE A 13 36.062 22.257 9.922 1.00 0.00 C0 ATOM 204 CE1 PHE A 13 34.912 21.901 12.449 1.00 0.00 C0 ATOM 205 CE2 PHE A 13 35.465 23.340 10.578 1.00 0.00 C0 ATOM 206 CZ PHE A 13 34.889 23.162 11.843 1.00 0.00 C0 ATOM 0 H PHE A 13 37.319 17.782 8.601 1.00 0.00 H new ATOM 0 HA PHE A 13 35.091 18.463 10.174 1.00 0.00 H new ATOM 0 HB2 PHE A 13 37.416 19.316 10.505 1.00 0.00 H new ATOM 0 HB3 PHE A 13 37.329 20.183 8.985 1.00 0.00 H new ATOM 0 HD1 PHE A 13 35.525 19.844 12.262 1.00 0.00 H new ATOM 0 HD2 PHE A 13 36.507 22.395 8.948 1.00 0.00 H new ATOM 0 HE1 PHE A 13 34.469 21.764 13.424 1.00 0.00 H new ATOM 0 HE2 PHE A 13 35.448 24.313 10.109 1.00 0.00 H new ATOM 0 HZ PHE A 13 34.428 23.997 12.350 1.00 0.00 H new ATOM 216 N ILE A 14 35.185 19.948 7.208 1.00 0.00 N0 ATOM 217 CA ILE A 14 34.344 20.646 6.242 1.00 0.00 C0 ATOM 218 C ILE A 14 33.227 19.730 5.756 1.00 0.00 C0 ATOM 219 O ILE A 14 32.126 20.187 5.450 1.00 0.00 O0 ATOM 220 CB ILE A 14 35.181 21.155 5.060 1.00 0.00 C0 ATOM 221 CG1 ILE A 14 34.286 21.945 4.103 1.00 0.00 C0 ATOM 222 CG2 ILE A 14 35.822 19.984 4.312 1.00 0.00 C0 ATOM 223 CD1 ILE A 14 35.156 22.733 3.123 1.00 0.00 C0 ATOM 0 H ILE A 14 36.142 19.779 6.899 1.00 0.00 H new ATOM 0 HA ILE A 14 33.895 21.509 6.734 1.00 0.00 H new ATOM 0 HB ILE A 14 35.972 21.800 5.443 1.00 0.00 H new ATOM 0 HG12 ILE A 14 33.630 21.266 3.558 1.00 0.00 H new ATOM 0 HG13 ILE A 14 33.646 22.625 4.665 1.00 0.00 H new ATOM 0 HG21 ILE A 14 36.411 20.364 3.478 1.00 0.00 H new ATOM 0 HG22 ILE A 14 36.470 19.429 4.991 1.00 0.00 H new ATOM 0 HG23 ILE A 14 35.042 19.323 3.934 1.00 0.00 H new ATOM 0 HD11 ILE A 14 34.518 23.296 2.441 1.00 0.00 H new ATOM 0 HD12 ILE A 14 35.794 23.423 3.676 1.00 0.00 H new ATOM 0 HD13 ILE A 14 35.777 22.043 2.552 1.00 0.00 H new ATOM 235 N LEU A 15 33.510 18.435 5.702 1.00 0.00 N0 ATOM 236 CA LEU A 15 32.512 17.469 5.266 1.00 0.00 C0 ATOM 237 C LEU A 15 31.324 17.488 6.221 1.00 0.00 C0 ATOM 238 O LEU A 15 30.204 17.806 5.825 1.00 0.00 O0 ATOM 239 CB LEU A 15 33.129 16.070 5.222 1.00 0.00 C0 ATOM 240 CG LEU A 15 33.936 15.910 3.931 1.00 0.00 C0 ATOM 241 CD1 LEU A 15 34.937 14.764 4.090 1.00 0.00 C0 ATOM 242 CD2 LEU A 15 32.986 15.594 2.772 1.00 0.00 C0 ATOM 0 H LEU A 15 34.413 18.033 5.952 1.00 0.00 H new ATOM 0 HA LEU A 15 32.167 17.735 4.267 1.00 0.00 H new ATOM 0 HB2 LEU A 15 33.773 15.917 6.088 1.00 0.00 H new ATOM 0 HB3 LEU A 15 32.346 15.314 5.270 1.00 0.00 H new ATOM 0 HG LEU A 15 34.473 16.836 3.724 1.00 0.00 H new ATOM 0 HD11 LEU A 15 35.511 14.652 3.170 1.00 0.00 H new ATOM 0 HD12 LEU A 15 35.614 14.984 4.915 1.00 0.00 H new ATOM 0 HD13 LEU A 15 34.400 13.838 4.298 1.00 0.00 H new ATOM 0 HD21 LEU A 15 33.560 15.480 1.852 1.00 0.00 H new ATOM 0 HD22 LEU A 15 32.450 14.668 2.983 1.00 0.00 H new ATOM 0 HD23 LEU A 15 32.271 16.408 2.655 1.00 0.00 H new ATOM 254 N SER A 16 31.568 17.123 7.473 1.00 0.00 N0 ATOM 255 CA SER A 16 30.502 17.086 8.464 1.00 0.00 C0 ATOM 256 C SER A 16 29.749 18.411 8.502 1.00 0.00 C0 ATOM 257 O SER A 16 28.530 18.432 8.677 1.00 0.00 O0 ATOM 258 CB SER A 16 31.085 16.795 9.843 1.00 0.00 C0 ATOM 259 OG SER A 16 31.980 17.839 10.205 1.00 0.00 O0 ATOM 0 H SER A 16 32.486 16.851 7.824 1.00 0.00 H new ATOM 0 HA SER A 16 29.805 16.296 8.185 1.00 0.00 H new ATOM 0 HB2 SER A 16 30.285 16.715 10.579 1.00 0.00 H new ATOM 0 HB3 SER A 16 31.608 15.839 9.835 1.00 0.00 H new ATOM 0 HG SER A 16 32.369 18.232 9.396 1.00 0.00 H new ATOM 265 N ALA A 17 30.468 19.516 8.329 1.00 0.00 N0 ATOM 266 CA ALA A 17 29.822 20.825 8.342 1.00 0.00 C0 ATOM 267 C ALA A 17 28.799 20.919 7.211 1.00 0.00 C0 ATOM 268 O ALA A 17 27.665 21.348 7.416 1.00 0.00 O0 ATOM 269 CB ALA A 17 30.872 21.925 8.177 1.00 0.00 C0 ATOM 0 H ALA A 17 31.477 19.534 8.181 1.00 0.00 H new ATOM 0 HA ALA A 17 29.311 20.954 9.296 1.00 0.00 H new ATOM 0 HB1 ALA A 17 30.383 22.899 8.188 1.00 0.00 H new ATOM 0 HB2 ALA A 17 31.589 21.870 8.996 1.00 0.00 H new ATOM 0 HB3 ALA A 17 31.393 21.791 7.229 1.00 0.00 H new ATOM 275 N LEU A 18 29.216 20.512 6.019 1.00 0.00 N0 ATOM 276 CA LEU A 18 28.340 20.549 4.849 1.00 0.00 C0 ATOM 277 C LEU A 18 27.168 19.589 5.024 1.00 0.00 C0 ATOM 278 O LEU A 18 26.052 19.869 4.593 1.00 0.00 O0 ATOM 279 CB LEU A 18 29.130 20.173 3.596 1.00 0.00 C0 ATOM 280 CG LEU A 18 30.156 21.267 3.290 1.00 0.00 C0 ATOM 281 CD1 LEU A 18 31.091 20.795 2.175 1.00 0.00 C0 ATOM 282 CD2 LEU A 18 29.434 22.539 2.842 1.00 0.00 C0 ATOM 0 H LEU A 18 30.153 20.153 5.834 1.00 0.00 H new ATOM 0 HA LEU A 18 27.949 21.561 4.742 1.00 0.00 H new ATOM 0 HB2 LEU A 18 29.634 19.218 3.744 1.00 0.00 H new ATOM 0 HB3 LEU A 18 28.453 20.048 2.751 1.00 0.00 H new ATOM 0 HG LEU A 18 30.737 21.477 4.188 1.00 0.00 H new ATOM 0 HD11 LEU A 18 31.821 21.575 1.958 1.00 0.00 H new ATOM 0 HD12 LEU A 18 31.610 19.891 2.494 1.00 0.00 H new ATOM 0 HD13 LEU A 18 30.509 20.583 1.278 1.00 0.00 H new ATOM 0 HD21 LEU A 18 30.167 23.316 2.625 1.00 0.00 H new ATOM 0 HD22 LEU A 18 28.851 22.330 1.945 1.00 0.00 H new ATOM 0 HD23 LEU A 18 28.769 22.879 3.636 1.00 0.00 H new ATOM 294 N HIS A 19 27.441 18.460 5.655 1.00 0.00 N0 ATOM 295 CA HIS A 19 26.419 17.446 5.894 1.00 0.00 C0 ATOM 296 C HIS A 19 25.354 17.946 6.864 1.00 0.00 C0 ATOM 297 O HIS A 19 24.162 17.674 6.697 1.00 0.00 O0 ATOM 298 CB HIS A 19 27.088 16.183 6.447 1.00 0.00 C0 ATOM 299 CG HIS A 19 26.279 15.623 7.585 1.00 0.00 C0 ATOM 300 ND1 HIS A 19 25.345 14.615 7.406 1.00 0.00 N0 ATOM 301 CD2 HIS A 19 26.262 15.914 8.927 1.00 0.00 C0 ATOM 302 CE1 HIS A 19 24.808 14.340 8.610 1.00 0.00 C0 ATOM 303 NE2 HIS A 19 25.333 15.103 9.572 1.00 0.00 N0 ATOM 0 H HIS A 19 28.365 18.218 6.014 1.00 0.00 H new ATOM 0 HA HIS A 19 25.922 17.221 4.950 1.00 0.00 H new ATOM 0 HB2 HIS A 19 27.183 15.438 5.657 1.00 0.00 H new ATOM 0 HB3 HIS A 19 28.097 16.416 6.788 1.00 0.00 H new ATOM 0 HD1 HIS A 19 25.107 14.163 6.523 1.00 0.00 H new ATOM 0 HD2 HIS A 19 26.877 16.660 9.409 1.00 0.00 H new ATOM 0 HE1 HIS A 19 24.046 13.593 8.777 1.00 0.00 H new ATOM 311 N PHE A 20 25.790 18.704 7.859 1.00 0.00 N0 ATOM 312 CA PHE A 20 24.875 19.258 8.847 1.00 0.00 C0 ATOM 313 C PHE A 20 24.082 20.422 8.262 1.00 0.00 C0 ATOM 314 O PHE A 20 22.907 20.605 8.573 1.00 0.00 O0 ATOM 315 CB PHE A 20 25.663 19.736 10.071 1.00 0.00 C0 ATOM 316 CG PHE A 20 25.221 18.968 11.293 1.00 0.00 C0 ATOM 317 CD1 PHE A 20 25.846 17.762 11.632 1.00 0.00 C0 ATOM 318 CD2 PHE A 20 24.181 19.464 12.089 1.00 0.00 C0 ATOM 319 CE1 PHE A 20 25.430 17.051 12.766 1.00 0.00 C0 ATOM 320 CE2 PHE A 20 23.766 18.755 13.222 1.00 0.00 C0 ATOM 321 CZ PHE A 20 24.388 17.549 13.562 1.00 0.00 C0 ATOM 0 H PHE A 20 26.769 18.949 8.004 1.00 0.00 H new ATOM 0 HA PHE A 20 24.175 18.477 9.143 1.00 0.00 H new ATOM 0 HB2 PHE A 20 26.731 19.593 9.906 1.00 0.00 H new ATOM 0 HB3 PHE A 20 25.504 20.804 10.224 1.00 0.00 H new ATOM 0 HD1 PHE A 20 26.649 17.379 11.019 1.00 0.00 H new ATOM 0 HD2 PHE A 20 23.699 20.395 11.828 1.00 0.00 H new ATOM 0 HE1 PHE A 20 25.912 16.120 13.027 1.00 0.00 H new ATOM 0 HE2 PHE A 20 22.964 19.140 13.835 1.00 0.00 H new ATOM 0 HZ PHE A 20 24.066 17.002 14.436 1.00 0.00 H new ATOM 331 N MET A 21 24.732 21.205 7.410 1.00 0.00 N0 ATOM 332 CA MET A 21 24.084 22.352 6.787 1.00 0.00 C0 ATOM 333 C MET A 21 23.064 21.928 5.737 1.00 0.00 C0 ATOM 334 O MET A 21 21.913 22.366 5.761 1.00 0.00 O0 ATOM 335 CB MET A 21 25.151 23.233 6.140 1.00 0.00 C0 ATOM 336 CG MET A 21 25.931 23.949 7.243 1.00 0.00 C0 ATOM 337 SD MET A 21 27.186 25.025 6.513 1.00 0.00 S0 ATOM 338 CE MET A 21 27.721 25.803 8.056 1.00 0.00 C0 ATOM 0 H MET A 21 25.705 21.067 7.135 1.00 0.00 H new ATOM 0 HA MET A 21 23.549 22.903 7.560 1.00 0.00 H new ATOM 0 HB2 MET A 21 25.824 22.627 5.533 1.00 0.00 H new ATOM 0 HB3 MET A 21 24.687 23.959 5.473 1.00 0.00 H new ATOM 0 HG2 MET A 21 25.250 24.536 7.859 1.00 0.00 H new ATOM 0 HG3 MET A 21 26.404 23.218 7.899 1.00 0.00 H new ATOM 0 HE1 MET A 21 28.511 26.523 7.845 1.00 0.00 H new ATOM 0 HE2 MET A 21 26.877 26.315 8.517 1.00 0.00 H new ATOM 0 HE3 MET A 21 28.098 25.040 8.737 1.00 0.00 H new ATOM 348 N ALA A 22 23.508 21.093 4.808 1.00 0.00 N0 ATOM 349 CA ALA A 22 22.642 20.631 3.731 1.00 0.00 C0 ATOM 350 C ALA A 22 21.454 19.854 4.278 1.00 0.00 C0 ATOM 351 O ALA A 22 20.325 20.043 3.824 1.00 0.00 O0 ATOM 352 CB ALA A 22 23.429 19.754 2.762 1.00 0.00 C0 ATOM 0 H ALA A 22 24.458 20.723 4.778 1.00 0.00 H new ATOM 0 HA ALA A 22 22.267 21.507 3.203 1.00 0.00 H new ATOM 0 HB1 ALA A 22 22.771 19.415 1.962 1.00 0.00 H new ATOM 0 HB2 ALA A 22 24.251 20.329 2.337 1.00 0.00 H new ATOM 0 HB3 ALA A 22 23.828 18.890 3.294 1.00 0.00 H new ATOM 358 N TRP A 23 21.701 18.994 5.261 1.00 0.00 N0 ATOM 359 CA TRP A 23 20.612 18.224 5.842 1.00 0.00 C0 ATOM 360 C TRP A 23 19.745 19.110 6.735 1.00 0.00 C0 ATOM 361 O TRP A 23 18.554 18.854 6.894 1.00 0.00 O0 ATOM 362 CB TRP A 23 21.140 17.022 6.628 1.00 0.00 C0 ATOM 363 CG TRP A 23 21.601 15.959 5.671 1.00 0.00 C0 ATOM 364 CD1 TRP A 23 22.824 15.390 5.675 1.00 0.00 C0 ATOM 365 CD2 TRP A 23 20.864 15.338 4.570 1.00 0.00 C0 ATOM 366 NE1 TRP A 23 22.886 14.449 4.660 1.00 0.00 N0 ATOM 367 CE2 TRP A 23 21.703 14.384 3.949 1.00 0.00 C0 ATOM 368 CE3 TRP A 23 19.560 15.505 4.060 1.00 0.00 C0 ATOM 369 CZ2 TRP A 23 21.268 13.625 2.859 1.00 0.00 C0 ATOM 370 CZ3 TRP A 23 19.121 14.744 2.963 1.00 0.00 C0 ATOM 371 CH2 TRP A 23 19.973 13.806 2.365 1.00 0.00 C0 ATOM 0 H TRP A 23 22.622 18.816 5.662 1.00 0.00 H new ATOM 0 HA TRP A 23 19.997 17.846 5.025 1.00 0.00 H new ATOM 0 HB2 TRP A 23 21.964 17.329 7.272 1.00 0.00 H new ATOM 0 HB3 TRP A 23 20.359 16.627 7.277 1.00 0.00 H new ATOM 0 HD1 TRP A 23 23.625 15.629 6.359 1.00 0.00 H new ATOM 0 HE1 TRP A 23 23.705 13.874 4.462 1.00 0.00 H new ATOM 0 HE3 TRP A 23 18.894 16.223 4.516 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 21.928 12.903 2.401 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 18.121 14.883 2.579 1.00 0.00 H new ATOM 0 HH2 TRP A 23 19.629 13.223 1.523 1.00 0.00 H new ATOM 382 N THR A 24 20.337 20.160 7.300 1.00 0.00 N0 ATOM 383 CA THR A 24 19.581 21.074 8.152 1.00 0.00 C0 ATOM 384 C THR A 24 18.507 21.801 7.343 1.00 0.00 C0 ATOM 385 O THR A 24 17.325 21.752 7.677 1.00 0.00 O0 ATOM 386 CB THR A 24 20.525 22.102 8.785 1.00 0.00 C0 ATOM 387 OG1 THR A 24 21.063 21.571 9.988 1.00 0.00 O0 ATOM 388 CG2 THR A 24 19.761 23.394 9.088 1.00 0.00 C0 ATOM 0 H THR A 24 21.323 20.397 7.186 1.00 0.00 H new ATOM 0 HA THR A 24 19.098 20.491 8.936 1.00 0.00 H new ATOM 0 HB THR A 24 21.335 22.323 8.090 1.00 0.00 H new ATOM 0 HG1 THR A 24 21.742 20.898 9.773 1.00 0.00 H new ATOM 0 HG21 THR A 24 20.438 24.120 9.538 1.00 0.00 H new ATOM 0 HG22 THR A 24 19.354 23.802 8.163 1.00 0.00 H new ATOM 0 HG23 THR A 24 18.946 23.181 9.780 1.00 0.00 H new ATOM 396 N ILE A 25 18.929 22.474 6.275 1.00 0.00 N0 ATOM 397 CA ILE A 25 17.995 23.210 5.427 1.00 0.00 C0 ATOM 398 C ILE A 25 17.036 22.261 4.711 1.00 0.00 C0 ATOM 399 O ILE A 25 15.836 22.521 4.628 1.00 0.00 O0 ATOM 400 CB ILE A 25 18.764 24.038 4.400 1.00 0.00 C0 ATOM 401 CG1 ILE A 25 19.530 25.154 5.118 1.00 0.00 C0 ATOM 402 CG2 ILE A 25 17.781 24.656 3.405 1.00 0.00 C0 ATOM 403 CD1 ILE A 25 20.518 25.808 4.148 1.00 0.00 C0 ATOM 0 H ILE A 25 19.903 22.525 5.978 1.00 0.00 H new ATOM 0 HA ILE A 25 17.409 23.873 6.064 1.00 0.00 H new ATOM 0 HB ILE A 25 19.466 23.397 3.867 1.00 0.00 H new ATOM 0 HG12 ILE A 25 18.833 25.900 5.500 1.00 0.00 H new ATOM 0 HG13 ILE A 25 20.064 24.748 5.977 1.00 0.00 H new ATOM 0 HG21 ILE A 25 18.329 25.247 2.672 1.00 0.00 H new ATOM 0 HG22 ILE A 25 17.232 23.864 2.896 1.00 0.00 H new ATOM 0 HG23 ILE A 25 17.080 25.298 3.938 1.00 0.00 H new ATOM 0 HD11 ILE A 25 21.061 26.601 4.662 1.00 0.00 H new ATOM 0 HD12 ILE A 25 21.224 25.059 3.788 1.00 0.00 H new ATOM 0 HD13 ILE A 25 19.973 26.229 3.303 1.00 0.00 H new ATOM 415 N GLY A 26 17.575 21.162 4.195 1.00 0.00 N0 ATOM 416 CA GLY A 26 16.761 20.179 3.485 1.00 0.00 C0 ATOM 417 C GLY A 26 15.697 19.590 4.404 1.00 0.00 C0 ATOM 418 O GLY A 26 14.572 19.320 3.982 1.00 0.00 O0 ATOM 0 H GLY A 26 18.566 20.929 4.254 1.00 0.00 H new ATOM 0 HA2 GLY A 26 16.285 20.649 2.624 1.00 0.00 H new ATOM 0 HA3 GLY A 26 17.398 19.382 3.101 1.00 0.00 H new ATOM 422 N HIS A 27 16.064 19.404 5.665 1.00 0.00 N0 ATOM 423 CA HIS A 27 15.146 18.859 6.657 1.00 0.00 C0 ATOM 424 C HIS A 27 14.085 19.882 7.045 1.00 0.00 C0 ATOM 425 O HIS A 27 12.932 19.533 7.295 1.00 0.00 O0 ATOM 426 CB HIS A 27 15.918 18.435 7.903 1.00 0.00 C0 ATOM 427 CG HIS A 27 14.941 18.118 8.997 1.00 0.00 C0 ATOM 428 ND1 HIS A 27 14.197 16.950 9.011 1.00 0.00 N0 ATOM 429 CD2 HIS A 27 14.560 18.821 10.112 1.00 0.00 C0 ATOM 430 CE1 HIS A 27 13.411 16.983 10.102 1.00 0.00 C0 ATOM 431 NE2 HIS A 27 13.592 18.103 10.808 1.00 0.00 N0 ATOM 0 H HIS A 27 16.993 19.623 6.026 1.00 0.00 H new ATOM 0 HA HIS A 27 14.650 17.994 6.217 1.00 0.00 H new ATOM 0 HB2 HIS A 27 16.536 17.564 7.685 1.00 0.00 H new ATOM 0 HB3 HIS A 27 16.591 19.232 8.218 1.00 0.00 H new ATOM 0 HD2 HIS A 27 14.951 19.784 10.405 1.00 0.00 H new ATOM 0 HE1 HIS A 27 12.718 16.200 10.374 1.00 0.00 H new ATOM 0 HE2 HIS A 27 13.122 18.374 11.672 1.00 0.00 H new ATOM 439 N LEU A 28 14.487 21.148 7.102 1.00 0.00 N0 ATOM 440 CA LEU A 28 13.571 22.220 7.471 1.00 0.00 C0 ATOM 441 C LEU A 28 12.433 22.334 6.461 1.00 0.00 C0 ATOM 442 O LEU A 28 12.662 22.344 5.251 1.00 0.00 O0 ATOM 443 CB LEU A 28 14.328 23.550 7.532 1.00 0.00 C0 ATOM 444 CG LEU A 28 13.468 24.603 8.235 1.00 0.00 C0 ATOM 445 CD1 LEU A 28 13.420 24.308 9.737 1.00 0.00 C0 ATOM 446 CD2 LEU A 28 14.074 25.990 8.004 1.00 0.00 C0 ATOM 0 H LEU A 28 15.438 21.455 6.898 1.00 0.00 H new ATOM 0 HA LEU A 28 13.150 21.988 8.449 1.00 0.00 H new ATOM 0 HB2 LEU A 28 15.269 23.419 8.067 1.00 0.00 H new ATOM 0 HB3 LEU A 28 14.577 23.884 6.525 1.00 0.00 H new ATOM 0 HG LEU A 28 12.456 24.575 7.830 1.00 0.00 H new ATOM 0 HD11 LEU A 28 12.807 25.059 10.236 1.00 0.00 H new ATOM 0 HD12 LEU A 28 12.988 23.320 9.900 1.00 0.00 H new ATOM 0 HD13 LEU A 28 14.430 24.334 10.145 1.00 0.00 H new ATOM 0 HD21 LEU A 28 13.463 26.742 8.504 1.00 0.00 H new ATOM 0 HD22 LEU A 28 15.086 26.017 8.409 1.00 0.00 H new ATOM 0 HD23 LEU A 28 14.105 26.200 6.935 1.00 0.00 H new ATOM 594 N GLU B 3 41.811 19.102 29.491 1.00 0.00 N0 ATOM 595 CA GLU B 3 41.000 18.539 28.415 1.00 0.00 C0 ATOM 596 C GLU B 3 41.064 17.007 28.440 1.00 0.00 C0 ATOM 597 O GLU B 3 42.081 16.435 28.830 1.00 0.00 O0 ATOM 598 CB GLU B 3 41.496 19.049 27.059 1.00 0.00 C0 ATOM 599 CG GLU B 3 41.291 20.565 26.971 1.00 0.00 C0 ATOM 600 CD GLU B 3 42.454 21.303 27.633 1.00 0.00 C0 ATOM 601 OE1 GLU B 3 43.414 20.650 28.008 1.00 0.00 O0 ATOM 602 OE2 GLU B 3 42.366 22.514 27.753 1.00 0.00 O1- ATOM 0 HA GLU B 3 39.967 18.854 28.563 1.00 0.00 H new ATOM 0 HB2 GLU B 3 42.551 18.807 26.932 1.00 0.00 H new ATOM 0 HB3 GLU B 3 40.956 18.552 26.253 1.00 0.00 H new ATOM 0 HG2 GLU B 3 41.209 20.867 25.927 1.00 0.00 H new ATOM 0 HG3 GLU B 3 40.355 20.840 27.457 1.00 0.00 H new ATOM 609 N PRO B 4 40.009 16.332 28.036 1.00 0.00 N0 ATOM 610 CA PRO B 4 39.972 14.838 28.022 1.00 0.00 C0 ATOM 611 C PRO B 4 40.799 14.241 26.885 1.00 0.00 C0 ATOM 612 O PRO B 4 41.457 13.215 27.054 1.00 0.00 O0 ATOM 613 CB PRO B 4 38.488 14.519 27.835 1.00 0.00 C0 ATOM 614 CG PRO B 4 37.927 15.692 27.106 1.00 0.00 C0 ATOM 615 CD PRO B 4 38.744 16.908 27.545 1.00 0.00 C0 ATOM 0 HA PRO B 4 40.400 14.414 28.930 1.00 0.00 H new ATOM 0 HB2 PRO B 4 38.351 13.599 27.266 1.00 0.00 H new ATOM 0 HB3 PRO B 4 37.991 14.377 28.795 1.00 0.00 H new ATOM 0 HG2 PRO B 4 37.995 15.548 26.028 1.00 0.00 H new ATOM 0 HG3 PRO B 4 36.872 15.828 27.343 1.00 0.00 H new ATOM 0 HD2 PRO B 4 38.914 17.595 26.716 1.00 0.00 H new ATOM 0 HD3 PRO B 4 38.233 17.471 28.326 1.00 0.00 H new ATOM 623 N PHE B 5 40.756 14.891 25.726 1.00 0.00 N0 ATOM 624 CA PHE B 5 41.501 14.418 24.564 1.00 0.00 C0 ATOM 625 C PHE B 5 41.931 15.597 23.693 1.00 0.00 C0 ATOM 626 O PHE B 5 43.051 16.093 23.815 1.00 0.00 O0 ATOM 627 CB PHE B 5 40.636 13.456 23.743 1.00 0.00 C0 ATOM 628 CG PHE B 5 40.965 12.028 24.109 1.00 0.00 C0 ATOM 629 CD1 PHE B 5 40.167 11.341 25.032 1.00 0.00 C0 ATOM 630 CD2 PHE B 5 42.063 11.390 23.522 1.00 0.00 C0 ATOM 631 CE1 PHE B 5 40.467 10.016 25.367 1.00 0.00 C0 ATOM 632 CE2 PHE B 5 42.364 10.064 23.858 1.00 0.00 C0 ATOM 633 CZ PHE B 5 41.565 9.377 24.780 1.00 0.00 C0 ATOM 0 H PHE B 5 40.217 15.742 25.567 1.00 0.00 H new ATOM 0 HA PHE B 5 42.391 13.893 24.911 1.00 0.00 H new ATOM 0 HB2 PHE B 5 39.580 13.654 23.929 1.00 0.00 H new ATOM 0 HB3 PHE B 5 40.808 13.617 22.679 1.00 0.00 H new ATOM 0 HD1 PHE B 5 39.320 11.834 25.485 1.00 0.00 H new ATOM 0 HD2 PHE B 5 42.678 11.920 22.810 1.00 0.00 H new ATOM 0 HE1 PHE B 5 39.851 9.486 26.079 1.00 0.00 H new ATOM 0 HE2 PHE B 5 43.212 9.572 23.406 1.00 0.00 H new ATOM 0 HZ PHE B 5 41.796 8.354 25.038 1.00 0.00 H new ATOM 643 N GLN B 6 41.034 16.050 22.819 1.00 0.00 N0 ATOM 644 CA GLN B 6 41.332 17.175 21.944 1.00 0.00 C0 ATOM 645 C GLN B 6 40.063 17.967 21.646 1.00 0.00 C0 ATOM 646 O GLN B 6 38.954 17.472 21.834 1.00 0.00 O0 ATOM 647 CB GLN B 6 41.952 16.686 20.635 1.00 0.00 C0 ATOM 648 CG GLN B 6 43.337 16.101 20.916 1.00 0.00 C0 ATOM 649 CD GLN B 6 44.007 15.699 19.606 1.00 0.00 C0 ATOM 650 OE1 GLN B 6 43.516 14.818 18.901 1.00 0.00 O0 ATOM 651 NE2 GLN B 6 45.104 16.301 19.236 1.00 0.00 N0 ATOM 0 H GLN B 6 40.101 15.656 22.700 1.00 0.00 H new ATOM 0 HA GLN B 6 42.045 17.823 22.453 1.00 0.00 H new ATOM 0 HB2 GLN B 6 41.313 15.932 20.177 1.00 0.00 H new ATOM 0 HB3 GLN B 6 42.030 17.511 19.927 1.00 0.00 H new ATOM 0 HG2 GLN B 6 43.952 16.834 21.439 1.00 0.00 H new ATOM 0 HG3 GLN B 6 43.249 15.234 21.571 1.00 0.00 H new ATOM 0 HE21 GLN B 6 45.508 17.031 19.823 1.00 0.00 H new ATOM 0 HE22 GLN B 6 45.557 16.042 18.360 1.00 0.00 H new ATOM 660 N ILE B 7 40.237 19.199 21.192 1.00 0.00 N0 ATOM 661 CA ILE B 7 39.099 20.054 20.882 1.00 0.00 C0 ATOM 662 C ILE B 7 38.288 19.463 19.727 1.00 0.00 C0 ATOM 663 O ILE B 7 37.058 19.443 19.763 1.00 0.00 O0 ATOM 664 CB ILE B 7 39.587 21.452 20.493 1.00 0.00 C0 ATOM 665 CG1 ILE B 7 40.602 21.962 21.526 1.00 0.00 C0 ATOM 666 CG2 ILE B 7 38.397 22.412 20.434 1.00 0.00 C0 ATOM 667 CD1 ILE B 7 40.036 21.819 22.939 1.00 0.00 C0 ATOM 0 H ILE B 7 41.148 19.628 21.031 1.00 0.00 H new ATOM 0 HA ILE B 7 38.466 20.121 21.767 1.00 0.00 H new ATOM 0 HB ILE B 7 40.066 21.401 19.515 1.00 0.00 H new ATOM 0 HG12 ILE B 7 41.532 21.400 21.441 1.00 0.00 H new ATOM 0 HG13 ILE B 7 40.841 23.007 21.326 1.00 0.00 H new ATOM 0 HG21 ILE B 7 38.746 23.407 20.157 1.00 0.00 H new ATOM 0 HG22 ILE B 7 37.681 22.059 19.692 1.00 0.00 H new ATOM 0 HG23 ILE B 7 37.916 22.455 21.411 1.00 0.00 H new ATOM 0 HD11 ILE B 7 40.766 22.184 23.662 1.00 0.00 H new ATOM 0 HD12 ILE B 7 39.118 22.401 23.024 1.00 0.00 H new ATOM 0 HD13 ILE B 7 39.820 20.770 23.140 1.00 0.00 H new ATOM 679 N LEU B 8 38.992 18.975 18.709 1.00 0.00 N0 ATOM 680 CA LEU B 8 38.334 18.376 17.548 1.00 0.00 C0 ATOM 681 C LEU B 8 37.671 17.054 17.925 1.00 0.00 C0 ATOM 682 O LEU B 8 36.600 16.712 17.416 1.00 0.00 O0 ATOM 683 CB LEU B 8 39.355 18.125 16.433 1.00 0.00 C0 ATOM 684 CG LEU B 8 39.325 19.266 15.410 1.00 0.00 C0 ATOM 685 CD1 LEU B 8 38.026 19.204 14.600 1.00 0.00 C0 ATOM 686 CD2 LEU B 8 39.417 20.615 16.131 1.00 0.00 C0 ATOM 0 H LEU B 8 40.011 18.981 18.663 1.00 0.00 H new ATOM 0 HA LEU B 8 37.571 19.071 17.197 1.00 0.00 H new ATOM 0 HB2 LEU B 8 40.354 18.038 16.860 1.00 0.00 H new ATOM 0 HB3 LEU B 8 39.136 17.179 15.938 1.00 0.00 H new ATOM 0 HG LEU B 8 40.175 19.160 14.736 1.00 0.00 H new ATOM 0 HD11 LEU B 8 38.010 20.017 13.875 1.00 0.00 H new ATOM 0 HD12 LEU B 8 37.969 18.250 14.076 1.00 0.00 H new ATOM 0 HD13 LEU B 8 37.173 19.301 15.272 1.00 0.00 H new ATOM 0 HD21 LEU B 8 39.395 21.422 15.398 1.00 0.00 H new ATOM 0 HD22 LEU B 8 38.573 20.721 16.813 1.00 0.00 H new ATOM 0 HD23 LEU B 8 40.348 20.663 16.696 1.00 0.00 H new ATOM 698 N SER B 9 38.311 16.318 18.830 1.00 0.00 N0 ATOM 699 CA SER B 9 37.772 15.038 19.273 1.00 0.00 C0 ATOM 700 C SER B 9 36.513 15.255 20.103 1.00 0.00 C0 ATOM 701 O SER B 9 35.522 14.543 19.944 1.00 0.00 O0 ATOM 702 CB SER B 9 38.813 14.284 20.100 1.00 0.00 C0 ATOM 703 OG SER B 9 39.132 15.041 21.258 1.00 0.00 O0 ATOM 0 H SER B 9 39.194 16.583 19.266 1.00 0.00 H new ATOM 0 HA SER B 9 37.520 14.445 18.394 1.00 0.00 H new ATOM 0 HB2 SER B 9 38.427 13.306 20.386 1.00 0.00 H new ATOM 0 HB3 SER B 9 39.710 14.111 19.506 1.00 0.00 H new ATOM 0 HG SER B 9 39.040 15.996 21.060 1.00 0.00 H new ATOM 709 N ILE B 10 36.556 16.250 20.980 1.00 0.00 N0 ATOM 710 CA ILE B 10 35.410 16.561 21.822 1.00 0.00 C0 ATOM 711 C ILE B 10 34.237 17.040 20.978 1.00 0.00 C0 ATOM 712 O ILE B 10 33.093 16.658 21.224 1.00 0.00 O0 ATOM 713 CB ILE B 10 35.782 17.628 22.854 1.00 0.00 C0 ATOM 714 CG1 ILE B 10 36.510 16.961 24.030 1.00 0.00 C0 ATOM 715 CG2 ILE B 10 34.514 18.328 23.354 1.00 0.00 C0 ATOM 716 CD1 ILE B 10 35.502 16.236 24.938 1.00 0.00 C0 ATOM 0 H ILE B 10 37.367 16.851 21.126 1.00 0.00 H new ATOM 0 HA ILE B 10 35.114 15.651 22.344 1.00 0.00 H new ATOM 0 HB ILE B 10 36.437 18.369 22.395 1.00 0.00 H new ATOM 0 HG12 ILE B 10 37.248 16.252 23.655 1.00 0.00 H new ATOM 0 HG13 ILE B 10 37.053 17.712 24.604 1.00 0.00 H new ATOM 0 HG21 ILE B 10 34.783 19.087 24.089 1.00 0.00 H new ATOM 0 HG22 ILE B 10 34.004 18.800 22.514 1.00 0.00 H new ATOM 0 HG23 ILE B 10 33.852 17.595 23.815 1.00 0.00 H new ATOM 0 HD11 ILE B 10 36.031 15.767 25.768 1.00 0.00 H new ATOM 0 HD12 ILE B 10 34.781 16.954 25.327 1.00 0.00 H new ATOM 0 HD13 ILE B 10 34.979 15.472 24.363 1.00 0.00 H new ATOM 728 N CYS B 11 34.523 17.875 19.983 1.00 0.00 N0 ATOM 729 CA CYS B 11 33.466 18.384 19.123 1.00 0.00 C0 ATOM 730 C CYS B 11 32.757 17.224 18.437 1.00 0.00 C0 ATOM 731 O CYS B 11 31.530 17.137 18.455 1.00 0.00 O0 ATOM 732 CB CYS B 11 34.053 19.328 18.070 1.00 0.00 C0 ATOM 733 SG CYS B 11 34.612 20.849 18.873 1.00 0.00 S0 ATOM 0 H CYS B 11 35.461 18.207 19.757 1.00 0.00 H new ATOM 0 HA CYS B 11 32.749 18.935 19.732 1.00 0.00 H new ATOM 0 HB2 CYS B 11 34.886 18.847 17.558 1.00 0.00 H new ATOM 0 HB3 CYS B 11 33.303 19.558 17.313 1.00 0.00 H new ATOM 0 HG CYS B 11 35.752 20.636 19.460 1.00 0.00 H new ATOM 739 N SER B 12 33.533 16.332 17.831 1.00 0.00 N0 ATOM 740 CA SER B 12 32.953 15.185 17.143 1.00 0.00 C0 ATOM 741 C SER B 12 32.139 14.329 18.111 1.00 0.00 C0 ATOM 742 O SER B 12 31.069 13.829 17.761 1.00 0.00 O0 ATOM 743 CB SER B 12 34.058 14.335 16.517 1.00 0.00 C0 ATOM 744 OG SER B 12 33.476 13.221 15.852 1.00 0.00 O0 ATOM 0 H SER B 12 34.551 16.379 17.802 1.00 0.00 H new ATOM 0 HA SER B 12 32.292 15.556 16.360 1.00 0.00 H new ATOM 0 HB2 SER B 12 34.636 14.932 15.812 1.00 0.00 H new ATOM 0 HB3 SER B 12 34.749 13.993 17.287 1.00 0.00 H new ATOM 0 HG SER B 12 34.183 12.675 15.448 1.00 0.00 H new ATOM 750 N PHE B 13 32.658 14.155 19.325 1.00 0.00 N0 ATOM 751 CA PHE B 13 31.973 13.345 20.329 1.00 0.00 C0 ATOM 752 C PHE B 13 30.594 13.918 20.650 1.00 0.00 C0 ATOM 753 O PHE B 13 29.588 13.205 20.601 1.00 0.00 O0 ATOM 754 CB PHE B 13 32.820 13.292 21.606 1.00 0.00 C0 ATOM 755 CG PHE B 13 32.123 12.454 22.653 1.00 0.00 C0 ATOM 756 CD1 PHE B 13 32.063 11.062 22.508 1.00 0.00 C0 ATOM 757 CD2 PHE B 13 31.545 13.066 23.773 1.00 0.00 C0 ATOM 758 CE1 PHE B 13 31.426 10.283 23.481 1.00 0.00 C0 ATOM 759 CE2 PHE B 13 30.907 12.286 24.746 1.00 0.00 C0 ATOM 760 CZ PHE B 13 30.847 10.896 24.600 1.00 0.00 C0 ATOM 0 H PHE B 13 33.542 14.560 19.635 1.00 0.00 H new ATOM 0 HA PHE B 13 31.840 12.340 19.930 1.00 0.00 H new ATOM 0 HB2 PHE B 13 33.801 12.871 21.385 1.00 0.00 H new ATOM 0 HB3 PHE B 13 32.984 14.300 21.986 1.00 0.00 H new ATOM 0 HD1 PHE B 13 32.508 10.590 21.645 1.00 0.00 H new ATOM 0 HD2 PHE B 13 31.591 14.139 23.886 1.00 0.00 H new ATOM 0 HE1 PHE B 13 31.381 9.210 23.369 1.00 0.00 H new ATOM 0 HE2 PHE B 13 30.461 12.758 25.609 1.00 0.00 H new ATOM 0 HZ PHE B 13 30.354 10.295 25.350 1.00 0.00 H new ATOM 770 N ILE B 14 30.545 15.210 20.970 1.00 0.00 N0 ATOM 771 CA ILE B 14 29.274 15.850 21.290 1.00 0.00 C0 ATOM 772 C ILE B 14 28.373 15.880 20.063 1.00 0.00 C0 ATOM 773 O ILE B 14 27.152 15.800 20.176 1.00 0.00 O0 ATOM 774 CB ILE B 14 29.502 17.269 21.831 1.00 0.00 C0 ATOM 775 CG1 ILE B 14 28.156 17.886 22.226 1.00 0.00 C0 ATOM 776 CG2 ILE B 14 30.175 18.146 20.773 1.00 0.00 C0 ATOM 777 CD1 ILE B 14 28.398 19.138 23.070 1.00 0.00 C0 ATOM 0 H ILE B 14 31.358 15.825 21.014 1.00 0.00 H new ATOM 0 HA ILE B 14 28.780 15.267 22.067 1.00 0.00 H new ATOM 0 HB ILE B 14 30.153 17.212 22.703 1.00 0.00 H new ATOM 0 HG12 ILE B 14 27.585 18.141 21.333 1.00 0.00 H new ATOM 0 HG13 ILE B 14 27.564 17.164 22.788 1.00 0.00 H new ATOM 0 HG21 ILE B 14 30.328 19.148 21.175 1.00 0.00 H new ATOM 0 HG22 ILE B 14 31.137 17.713 20.500 1.00 0.00 H new ATOM 0 HG23 ILE B 14 29.539 18.203 19.889 1.00 0.00 H new ATOM 0 HD11 ILE B 14 27.441 19.578 23.351 1.00 0.00 H new ATOM 0 HD12 ILE B 14 28.952 18.869 23.969 1.00 0.00 H new ATOM 0 HD13 ILE B 14 28.973 19.861 22.492 1.00 0.00 H new ATOM 789 N LEU B 15 28.982 15.978 18.887 1.00 0.00 N0 ATOM 790 CA LEU B 15 28.219 15.999 17.649 1.00 0.00 C0 ATOM 791 C LEU B 15 27.450 14.691 17.495 1.00 0.00 C0 ATOM 792 O LEU B 15 26.221 14.684 17.469 1.00 0.00 O0 ATOM 793 CB LEU B 15 29.165 16.197 16.462 1.00 0.00 C0 ATOM 794 CG LEU B 15 29.522 17.681 16.340 1.00 0.00 C0 ATOM 795 CD1 LEU B 15 30.806 17.835 15.521 1.00 0.00 C0 ATOM 796 CD2 LEU B 15 28.382 18.424 15.635 1.00 0.00 C0 ATOM 0 H LEU B 15 29.993 16.044 18.767 1.00 0.00 H new ATOM 0 HA LEU B 15 27.509 16.825 17.677 1.00 0.00 H new ATOM 0 HB2 LEU B 15 30.069 15.604 16.600 1.00 0.00 H new ATOM 0 HB3 LEU B 15 28.692 15.848 15.544 1.00 0.00 H new ATOM 0 HG LEU B 15 29.672 18.098 17.336 1.00 0.00 H new ATOM 0 HD11 LEU B 15 31.058 18.892 15.435 1.00 0.00 H new ATOM 0 HD12 LEU B 15 31.620 17.307 16.018 1.00 0.00 H new ATOM 0 HD13 LEU B 15 30.655 17.416 14.526 1.00 0.00 H new ATOM 0 HD21 LEU B 15 28.635 19.481 15.548 1.00 0.00 H new ATOM 0 HD22 LEU B 15 28.234 18.003 14.641 1.00 0.00 H new ATOM 0 HD23 LEU B 15 27.465 18.317 16.215 1.00 0.00 H new ATOM 808 N SER B 16 28.180 13.590 17.370 1.00 0.00 N0 ATOM 809 CA SER B 16 27.549 12.289 17.198 1.00 0.00 C0 ATOM 810 C SER B 16 26.500 12.046 18.278 1.00 0.00 C0 ATOM 811 O SER B 16 25.451 11.462 18.010 1.00 0.00 O0 ATOM 812 CB SER B 16 28.605 11.188 17.259 1.00 0.00 C0 ATOM 813 OG SER B 16 29.225 11.203 18.538 1.00 0.00 O0 ATOM 0 H SER B 16 29.200 13.571 17.384 1.00 0.00 H new ATOM 0 HA SER B 16 27.058 12.274 16.225 1.00 0.00 H new ATOM 0 HB2 SER B 16 28.145 10.217 17.076 1.00 0.00 H new ATOM 0 HB3 SER B 16 29.351 11.340 16.479 1.00 0.00 H new ATOM 0 HG SER B 16 29.218 12.116 18.894 1.00 0.00 H new ATOM 819 N ALA B 17 26.776 12.500 19.497 1.00 0.00 N0 ATOM 820 CA ALA B 17 25.822 12.316 20.586 1.00 0.00 C0 ATOM 821 C ALA B 17 24.507 13.024 20.260 1.00 0.00 C0 ATOM 822 O ALA B 17 23.428 12.456 20.407 1.00 0.00 O0 ATOM 823 CB ALA B 17 26.399 12.881 21.885 1.00 0.00 C0 ATOM 0 H ALA B 17 27.634 12.988 19.753 1.00 0.00 H new ATOM 0 HA ALA B 17 25.632 11.250 20.709 1.00 0.00 H new ATOM 0 HB1 ALA B 17 25.682 12.740 22.693 1.00 0.00 H new ATOM 0 HB2 ALA B 17 27.326 12.361 22.128 1.00 0.00 H new ATOM 0 HB3 ALA B 17 26.601 13.945 21.761 1.00 0.00 H new ATOM 829 N LEU B 18 24.616 14.270 19.816 1.00 0.00 N0 ATOM 830 CA LEU B 18 23.438 15.061 19.468 1.00 0.00 C0 ATOM 831 C LEU B 18 22.714 14.450 18.274 1.00 0.00 C0 ATOM 832 O LEU B 18 21.488 14.477 18.198 1.00 0.00 O0 ATOM 833 CB LEU B 18 23.855 16.496 19.139 1.00 0.00 C0 ATOM 834 CG LEU B 18 24.365 17.183 20.407 1.00 0.00 C0 ATOM 835 CD1 LEU B 18 24.985 18.534 20.043 1.00 0.00 C0 ATOM 836 CD2 LEU B 18 23.203 17.403 21.379 1.00 0.00 C0 ATOM 0 H LEU B 18 25.504 14.755 19.688 1.00 0.00 H new ATOM 0 HA LEU B 18 22.760 15.066 20.322 1.00 0.00 H new ATOM 0 HB2 LEU B 18 24.633 16.494 18.376 1.00 0.00 H new ATOM 0 HB3 LEU B 18 23.008 17.047 18.729 1.00 0.00 H new ATOM 0 HG LEU B 18 25.117 16.551 20.880 1.00 0.00 H new ATOM 0 HD11 LEU B 18 25.348 19.023 20.947 1.00 0.00 H new ATOM 0 HD12 LEU B 18 25.816 18.379 19.355 1.00 0.00 H new ATOM 0 HD13 LEU B 18 24.233 19.163 19.567 1.00 0.00 H new ATOM 0 HD21 LEU B 18 23.571 17.893 22.281 1.00 0.00 H new ATOM 0 HD22 LEU B 18 22.448 18.032 20.907 1.00 0.00 H new ATOM 0 HD23 LEU B 18 22.762 16.442 21.642 1.00 0.00 H new ATOM 848 N HIS B 19 23.488 13.909 17.348 1.00 0.00 N0 ATOM 849 CA HIS B 19 22.932 13.289 16.149 1.00 0.00 C0 ATOM 850 C HIS B 19 22.140 12.032 16.489 1.00 0.00 C0 ATOM 851 O HIS B 19 21.089 11.766 15.901 1.00 0.00 O0 ATOM 852 CB HIS B 19 24.078 12.953 15.187 1.00 0.00 C0 ATOM 853 CG HIS B 19 23.878 11.585 14.598 1.00 0.00 C0 ATOM 854 ND1 HIS B 19 23.267 11.387 13.369 1.00 0.00 N0 ATOM 855 CD2 HIS B 19 24.211 10.335 15.054 1.00 0.00 C0 ATOM 856 CE1 HIS B 19 23.250 10.063 13.131 1.00 0.00 C0 ATOM 857 NE2 HIS B 19 23.814 9.375 14.127 1.00 0.00 N0 ATOM 0 H HIS B 19 24.506 13.885 17.401 1.00 0.00 H new ATOM 0 HA HIS B 19 22.243 13.990 15.677 1.00 0.00 H new ATOM 0 HB2 HIS B 19 24.124 13.696 14.391 1.00 0.00 H new ATOM 0 HB3 HIS B 19 25.030 12.993 15.716 1.00 0.00 H new ATOM 0 HD1 HIS B 19 22.897 12.114 12.756 1.00 0.00 H new ATOM 0 HD2 HIS B 19 24.706 10.127 15.991 1.00 0.00 H new ATOM 0 HE1 HIS B 19 22.832 9.612 12.243 1.00 0.00 H new ATOM 865 N PHE B 20 22.639 11.281 17.458 1.00 0.00 N0 ATOM 866 CA PHE B 20 21.973 10.060 17.888 1.00 0.00 C0 ATOM 867 C PHE B 20 20.734 10.382 18.717 1.00 0.00 C0 ATOM 868 O PHE B 20 19.722 9.688 18.633 1.00 0.00 O0 ATOM 869 CB PHE B 20 22.939 9.211 18.716 1.00 0.00 C0 ATOM 870 CG PHE B 20 23.159 7.882 18.035 1.00 0.00 C0 ATOM 871 CD1 PHE B 20 24.182 7.737 17.091 1.00 0.00 C0 ATOM 872 CD2 PHE B 20 22.339 6.793 18.351 1.00 0.00 C0 ATOM 873 CE1 PHE B 20 24.385 6.503 16.463 1.00 0.00 C0 ATOM 874 CE2 PHE B 20 22.542 5.559 17.724 1.00 0.00 C0 ATOM 875 CZ PHE B 20 23.566 5.415 16.780 1.00 0.00 C0 ATOM 0 H PHE B 20 23.500 11.494 17.961 1.00 0.00 H new ATOM 0 HA PHE B 20 21.663 9.505 17.003 1.00 0.00 H new ATOM 0 HB2 PHE B 20 23.889 9.733 18.832 1.00 0.00 H new ATOM 0 HB3 PHE B 20 22.536 9.056 19.717 1.00 0.00 H new ATOM 0 HD1 PHE B 20 24.815 8.578 16.847 1.00 0.00 H new ATOM 0 HD2 PHE B 20 21.549 6.905 19.079 1.00 0.00 H new ATOM 0 HE1 PHE B 20 25.174 6.391 15.734 1.00 0.00 H new ATOM 0 HE2 PHE B 20 21.909 4.718 17.968 1.00 0.00 H new ATOM 0 HZ PHE B 20 23.723 4.462 16.296 1.00 0.00 H new ATOM 885 N MET B 21 20.822 11.435 19.518 1.00 0.00 N0 ATOM 886 CA MET B 21 19.708 11.840 20.365 1.00 0.00 C0 ATOM 887 C MET B 21 18.571 12.453 19.555 1.00 0.00 C0 ATOM 888 O MET B 21 17.414 12.049 19.684 1.00 0.00 O0 ATOM 889 CB MET B 21 20.209 12.851 21.393 1.00 0.00 C0 ATOM 890 CG MET B 21 21.060 12.117 22.430 1.00 0.00 C0 ATOM 891 SD MET B 21 21.646 13.282 23.683 1.00 0.00 S0 ATOM 892 CE MET B 21 22.404 12.054 24.773 1.00 0.00 C0 ATOM 0 H MET B 21 21.651 12.023 19.599 1.00 0.00 H new ATOM 0 HA MET B 21 19.316 10.952 20.861 1.00 0.00 H new ATOM 0 HB2 MET B 21 20.797 13.628 20.904 1.00 0.00 H new ATOM 0 HB3 MET B 21 19.367 13.346 21.877 1.00 0.00 H new ATOM 0 HG2 MET B 21 20.474 11.328 22.901 1.00 0.00 H new ATOM 0 HG3 MET B 21 21.908 11.637 21.943 1.00 0.00 H new ATOM 0 HE1 MET B 21 22.841 12.555 25.637 1.00 0.00 H new ATOM 0 HE2 MET B 21 21.645 11.348 25.109 1.00 0.00 H new ATOM 0 HE3 MET B 21 23.183 11.518 24.231 1.00 0.00 H new ATOM 902 N ALA B 22 18.913 13.442 18.741 1.00 0.00 N0 ATOM 903 CA ALA B 22 17.920 14.133 17.929 1.00 0.00 C0 ATOM 904 C ALA B 22 17.246 13.176 16.960 1.00 0.00 C0 ATOM 905 O ALA B 22 16.026 13.216 16.792 1.00 0.00 O0 ATOM 906 CB ALA B 22 18.574 15.278 17.157 1.00 0.00 C0 ATOM 0 H ALA B 22 19.867 13.783 18.625 1.00 0.00 H new ATOM 0 HA ALA B 22 17.160 14.538 18.597 1.00 0.00 H new ATOM 0 HB1 ALA B 22 17.822 15.787 16.554 1.00 0.00 H new ATOM 0 HB2 ALA B 22 19.015 15.985 17.859 1.00 0.00 H new ATOM 0 HB3 ALA B 22 19.352 14.880 16.506 1.00 0.00 H new ATOM 912 N TRP B 23 18.031 12.306 16.331 1.00 0.00 N0 ATOM 913 CA TRP B 23 17.456 11.351 15.396 1.00 0.00 C0 ATOM 914 C TRP B 23 16.706 10.252 16.143 1.00 0.00 C0 ATOM 915 O TRP B 23 15.755 9.680 15.617 1.00 0.00 O0 ATOM 916 CB TRP B 23 18.532 10.750 14.489 1.00 0.00 C0 ATOM 917 CG TRP B 23 18.946 11.764 13.459 1.00 0.00 C0 ATOM 918 CD1 TRP B 23 20.214 12.163 13.229 1.00 0.00 C0 ATOM 919 CD2 TRP B 23 18.105 12.515 12.527 1.00 0.00 C0 ATOM 920 NE1 TRP B 23 20.214 13.095 12.207 1.00 0.00 N0 ATOM 921 CE2 TRP B 23 18.936 13.350 11.746 1.00 0.00 C0 ATOM 922 CE3 TRP B 23 16.717 12.549 12.285 1.00 0.00 C0 ATOM 923 CZ2 TRP B 23 18.413 14.189 10.759 1.00 0.00 C0 ATOM 924 CZ3 TRP B 23 16.187 13.394 11.296 1.00 0.00 C0 ATOM 925 CH2 TRP B 23 17.032 14.213 10.534 1.00 0.00 C0 ATOM 0 H TRP B 23 19.042 12.244 16.448 1.00 0.00 H new ATOM 0 HA TRP B 23 16.746 11.885 14.765 1.00 0.00 H new ATOM 0 HB2 TRP B 23 19.394 10.446 15.082 1.00 0.00 H new ATOM 0 HB3 TRP B 23 18.151 9.854 13.999 1.00 0.00 H new ATOM 0 HD1 TRP B 23 21.088 11.812 13.757 1.00 0.00 H new ATOM 0 HE1 TRP B 23 21.055 13.540 11.838 1.00 0.00 H new ATOM 0 HE3 TRP B 23 16.056 11.921 12.864 1.00 0.00 H new ATOM 0 HZ2 TRP B 23 19.070 14.815 10.173 1.00 0.00 H new ATOM 0 HZ3 TRP B 23 15.121 13.413 11.121 1.00 0.00 H new ATOM 0 HH2 TRP B 23 16.618 14.861 9.775 1.00 0.00 H new ATOM 936 N THR B 24 17.122 9.967 17.376 1.00 0.00 N0 ATOM 937 CA THR B 24 16.453 8.942 18.173 1.00 0.00 C0 ATOM 938 C THR B 24 15.014 9.358 18.480 1.00 0.00 C0 ATOM 939 O THR B 24 14.069 8.633 18.175 1.00 0.00 O0 ATOM 940 CB THR B 24 17.212 8.719 19.485 1.00 0.00 C0 ATOM 941 OG1 THR B 24 18.239 7.761 19.279 1.00 0.00 O0 ATOM 942 CG2 THR B 24 16.249 8.220 20.566 1.00 0.00 C0 ATOM 0 H THR B 24 17.908 10.424 17.839 1.00 0.00 H new ATOM 0 HA THR B 24 16.439 8.015 17.600 1.00 0.00 H new ATOM 0 HB THR B 24 17.653 9.661 19.811 1.00 0.00 H new ATOM 0 HG1 THR B 24 19.008 8.192 18.851 1.00 0.00 H new ATOM 0 HG21 THR B 24 16.795 8.064 21.496 1.00 0.00 H new ATOM 0 HG22 THR B 24 15.466 8.961 20.726 1.00 0.00 H new ATOM 0 HG23 THR B 24 15.799 7.280 20.247 1.00 0.00 H new ATOM 950 N ILE B 25 14.858 10.529 19.090 1.00 0.00 N0 ATOM 951 CA ILE B 25 13.531 11.029 19.440 1.00 0.00 C0 ATOM 952 C ILE B 25 12.707 11.329 18.188 1.00 0.00 C0 ATOM 953 O ILE B 25 11.523 11.000 18.119 1.00 0.00 O0 ATOM 954 CB ILE B 25 13.656 12.292 20.289 1.00 0.00 C0 ATOM 955 CG1 ILE B 25 14.255 11.932 21.652 1.00 0.00 C0 ATOM 956 CG2 ILE B 25 12.269 12.907 20.494 1.00 0.00 C0 ATOM 957 CD1 ILE B 25 14.646 13.210 22.398 1.00 0.00 C0 ATOM 0 H ILE B 25 15.627 11.146 19.351 1.00 0.00 H new ATOM 0 HA ILE B 25 13.018 10.255 20.011 1.00 0.00 H new ATOM 0 HB ILE B 25 14.303 13.008 19.782 1.00 0.00 H new ATOM 0 HG12 ILE B 25 13.533 11.364 22.238 1.00 0.00 H new ATOM 0 HG13 ILE B 25 15.130 11.295 21.519 1.00 0.00 H new ATOM 0 HG21 ILE B 25 12.357 13.809 21.100 1.00 0.00 H new ATOM 0 HG22 ILE B 25 11.837 13.161 19.526 1.00 0.00 H new ATOM 0 HG23 ILE B 25 11.624 12.190 21.002 1.00 0.00 H new ATOM 0 HD11 ILE B 25 15.072 12.950 23.367 1.00 0.00 H new ATOM 0 HD12 ILE B 25 15.383 13.761 21.814 1.00 0.00 H new ATOM 0 HD13 ILE B 25 13.762 13.830 22.545 1.00 0.00 H new ATOM 969 N GLY B 26 13.343 11.956 17.204 1.00 0.00 N0 ATOM 970 CA GLY B 26 12.662 12.297 15.958 1.00 0.00 C0 ATOM 971 C GLY B 26 12.167 11.043 15.249 1.00 0.00 C0 ATOM 972 O GLY B 26 11.092 11.034 14.649 1.00 0.00 O0 ATOM 0 H GLY B 26 14.323 12.237 17.243 1.00 0.00 H new ATOM 0 HA2 GLY B 26 11.821 12.957 16.168 1.00 0.00 H new ATOM 0 HA3 GLY B 26 13.342 12.844 15.305 1.00 0.00 H new ATOM 976 N HIS B 27 12.960 9.983 15.333 1.00 0.00 N0 ATOM 977 CA HIS B 27 12.609 8.713 14.712 1.00 0.00 C0 ATOM 978 C HIS B 27 11.480 8.024 15.471 1.00 0.00 C0 ATOM 979 O HIS B 27 10.619 7.378 14.875 1.00 0.00 O0 ATOM 980 CB HIS B 27 13.828 7.795 14.676 1.00 0.00 C0 ATOM 981 CG HIS B 27 13.391 6.418 14.271 1.00 0.00 C0 ATOM 982 ND1 HIS B 27 13.060 6.100 12.963 1.00 0.00 N0 ATOM 983 CD2 HIS B 27 13.205 5.270 14.997 1.00 0.00 C0 ATOM 984 CE1 HIS B 27 12.695 4.805 12.943 1.00 0.00 C0 ATOM 985 NE2 HIS B 27 12.764 4.251 14.157 1.00 0.00 N0 ATOM 0 H HIS B 27 13.853 9.978 15.826 1.00 0.00 H new ATOM 0 HA HIS B 27 12.271 8.918 13.696 1.00 0.00 H new ATOM 0 HB2 HIS B 27 14.567 8.178 13.972 1.00 0.00 H new ATOM 0 HB3 HIS B 27 14.306 7.765 15.655 1.00 0.00 H new ATOM 0 HD2 HIS B 27 13.375 5.171 16.059 1.00 0.00 H new ATOM 0 HE1 HIS B 27 12.384 4.277 12.054 1.00 0.00 H new ATOM 0 HE2 HIS B 27 12.542 3.289 14.413 1.00 0.00 H new ATOM 993 N LEU B 28 11.500 8.156 16.794 1.00 0.00 N0 ATOM 994 CA LEU B 28 10.484 7.536 17.635 1.00 0.00 C0 ATOM 995 C LEU B 28 9.100 8.091 17.314 1.00 0.00 C0 ATOM 996 O LEU B 28 8.913 9.304 17.215 1.00 0.00 O0 ATOM 997 CB LEU B 28 10.804 7.795 19.110 1.00 0.00 C0 ATOM 998 CG LEU B 28 9.951 6.880 19.992 1.00 0.00 C0 ATOM 999 CD1 LEU B 28 10.477 5.444 19.902 1.00 0.00 C0 ATOM 1000 CD2 LEU B 28 10.025 7.363 21.444 1.00 0.00 C0 ATOM 0 H LEU B 28 12.207 8.685 17.305 1.00 0.00 H new ATOM 0 HA LEU B 28 10.485 6.464 17.438 1.00 0.00 H new ATOM 0 HB2 LEU B 28 11.862 7.615 19.299 1.00 0.00 H new ATOM 0 HB3 LEU B 28 10.609 8.839 19.356 1.00 0.00 H new ATOM 0 HG LEU B 28 8.916 6.906 19.651 1.00 0.00 H new ATOM 0 HD11 LEU B 28 9.869 4.794 20.531 1.00 0.00 H new ATOM 0 HD12 LEU B 28 10.425 5.102 18.868 1.00 0.00 H new ATOM 0 HD13 LEU B 28 11.512 5.414 20.243 1.00 0.00 H new ATOM 0 HD21 LEU B 28 9.418 6.713 22.075 1.00 0.00 H new ATOM 0 HD22 LEU B 28 11.060 7.336 21.784 1.00 0.00 H new ATOM 0 HD23 LEU B 28 9.649 8.384 21.507 1.00 0.00 H new ATOM 1148 N GLU C 3 44.569 -3.362 24.020 1.00 0.00 N0 ATOM 1149 CA GLU C 3 43.634 -2.620 23.181 1.00 0.00 C0 ATOM 1150 C GLU C 3 44.123 -2.587 21.728 1.00 0.00 C0 ATOM 1151 O GLU C 3 45.328 -2.589 21.479 1.00 0.00 O0 ATOM 1152 CB GLU C 3 43.483 -1.186 23.700 1.00 0.00 C0 ATOM 1153 CG GLU C 3 42.849 -1.207 25.095 1.00 0.00 C0 ATOM 1154 CD GLU C 3 43.914 -1.445 26.165 1.00 0.00 C0 ATOM 1155 OE1 GLU C 3 45.085 -1.453 25.823 1.00 0.00 O0 ATOM 1156 OE2 GLU C 3 43.540 -1.614 27.315 1.00 0.00 O1- ATOM 0 HA GLU C 3 42.668 -3.123 23.219 1.00 0.00 H new ATOM 0 HB2 GLU C 3 44.457 -0.699 23.740 1.00 0.00 H new ATOM 0 HB3 GLU C 3 42.864 -0.605 23.017 1.00 0.00 H new ATOM 0 HG2 GLU C 3 42.341 -0.261 25.284 1.00 0.00 H new ATOM 0 HG3 GLU C 3 42.093 -1.991 25.145 1.00 0.00 H new ATOM 1163 N PRO C 4 43.224 -2.558 20.767 1.00 0.00 N0 ATOM 1164 CA PRO C 4 43.599 -2.524 19.321 1.00 0.00 C0 ATOM 1165 C PRO C 4 44.127 -1.160 18.883 1.00 0.00 C0 ATOM 1166 O PRO C 4 45.061 -1.070 18.086 1.00 0.00 O0 ATOM 1167 CB PRO C 4 42.289 -2.853 18.604 1.00 0.00 C0 ATOM 1168 CG PRO C 4 41.213 -2.388 19.527 1.00 0.00 C0 ATOM 1169 CD PRO C 4 41.761 -2.546 20.945 1.00 0.00 C0 ATOM 0 HA PRO C 4 44.407 -3.220 19.096 1.00 0.00 H new ATOM 0 HB2 PRO C 4 42.229 -2.346 17.641 1.00 0.00 H new ATOM 0 HB3 PRO C 4 42.205 -3.922 18.407 1.00 0.00 H new ATOM 0 HG2 PRO C 4 40.951 -1.349 19.326 1.00 0.00 H new ATOM 0 HG3 PRO C 4 40.306 -2.977 19.394 1.00 0.00 H new ATOM 0 HD2 PRO C 4 41.445 -1.725 21.588 1.00 0.00 H new ATOM 0 HD3 PRO C 4 41.408 -3.468 21.408 1.00 0.00 H new ATOM 1177 N PHE C 5 43.518 -0.100 19.407 1.00 0.00 N0 ATOM 1178 CA PHE C 5 43.929 1.257 19.064 1.00 0.00 C0 ATOM 1179 C PHE C 5 43.696 2.197 20.246 1.00 0.00 C0 ATOM 1180 O PHE C 5 44.609 2.455 21.031 1.00 0.00 O0 ATOM 1181 CB PHE C 5 43.139 1.751 17.847 1.00 0.00 C0 ATOM 1182 CG PHE C 5 43.954 1.551 16.592 1.00 0.00 C0 ATOM 1183 CD1 PHE C 5 43.738 0.425 15.789 1.00 0.00 C0 ATOM 1184 CD2 PHE C 5 44.922 2.494 16.229 1.00 0.00 C0 ATOM 1185 CE1 PHE C 5 44.489 0.243 14.622 1.00 0.00 C0 ATOM 1186 CE2 PHE C 5 45.674 2.312 15.063 1.00 0.00 C0 ATOM 1187 CZ PHE C 5 45.458 1.187 14.259 1.00 0.00 C0 ATOM 0 H PHE C 5 42.742 -0.154 20.067 1.00 0.00 H new ATOM 0 HA PHE C 5 44.992 1.249 18.824 1.00 0.00 H new ATOM 0 HB2 PHE C 5 42.196 1.209 17.770 1.00 0.00 H new ATOM 0 HB3 PHE C 5 42.891 2.806 17.966 1.00 0.00 H new ATOM 0 HD1 PHE C 5 42.992 -0.303 16.070 1.00 0.00 H new ATOM 0 HD2 PHE C 5 45.089 3.363 16.849 1.00 0.00 H new ATOM 0 HE1 PHE C 5 44.321 -0.625 14.002 1.00 0.00 H new ATOM 0 HE2 PHE C 5 46.421 3.040 14.783 1.00 0.00 H new ATOM 0 HZ PHE C 5 46.038 1.047 13.359 1.00 0.00 H new ATOM 1197 N GLN C 6 42.470 2.699 20.374 1.00 0.00 N0 ATOM 1198 CA GLN C 6 42.132 3.598 21.469 1.00 0.00 C0 ATOM 1199 C GLN C 6 40.670 3.424 21.868 1.00 0.00 C0 ATOM 1200 O GLN C 6 39.873 2.877 21.111 1.00 0.00 O0 ATOM 1201 CB GLN C 6 42.385 5.051 21.065 1.00 0.00 C0 ATOM 1202 CG GLN C 6 43.887 5.277 20.894 1.00 0.00 C0 ATOM 1203 CD GLN C 6 44.161 6.745 20.587 1.00 0.00 C0 ATOM 1204 OE1 GLN C 6 43.725 7.259 19.557 1.00 0.00 O0 ATOM 1205 NE2 GLN C 6 44.857 7.458 21.431 1.00 0.00 N0 ATOM 0 H GLN C 6 41.700 2.499 19.736 1.00 0.00 H new ATOM 0 HA GLN C 6 42.765 3.351 22.321 1.00 0.00 H new ATOM 0 HB2 GLN C 6 41.864 5.277 20.135 1.00 0.00 H new ATOM 0 HB3 GLN C 6 41.989 5.725 21.824 1.00 0.00 H new ATOM 0 HG2 GLN C 6 44.413 4.982 21.802 1.00 0.00 H new ATOM 0 HG3 GLN C 6 44.268 4.651 20.087 1.00 0.00 H new ATOM 0 HE21 GLN C 6 45.217 7.030 22.284 1.00 0.00 H new ATOM 0 HE22 GLN C 6 45.040 8.443 21.237 1.00 0.00 H new ATOM 1214 N ILE C 7 40.333 3.883 23.063 1.00 0.00 N0 ATOM 1215 CA ILE C 7 38.967 3.764 23.557 1.00 0.00 C0 ATOM 1216 C ILE C 7 38.013 4.582 22.685 1.00 0.00 C0 ATOM 1217 O ILE C 7 36.923 4.125 22.341 1.00 0.00 O0 ATOM 1218 CB ILE C 7 38.889 4.266 25.002 1.00 0.00 C0 ATOM 1219 CG1 ILE C 7 40.009 3.631 25.841 1.00 0.00 C0 ATOM 1220 CG2 ILE C 7 37.532 3.893 25.601 1.00 0.00 C0 ATOM 1221 CD1 ILE C 7 40.010 2.111 25.660 1.00 0.00 C0 ATOM 0 H ILE C 7 40.980 4.339 23.706 1.00 0.00 H new ATOM 0 HA ILE C 7 38.675 2.715 23.519 1.00 0.00 H new ATOM 0 HB ILE C 7 39.007 5.350 25.008 1.00 0.00 H new ATOM 0 HG12 ILE C 7 40.974 4.041 25.542 1.00 0.00 H new ATOM 0 HG13 ILE C 7 39.870 3.879 26.893 1.00 0.00 H new ATOM 0 HG21 ILE C 7 37.477 4.251 26.629 1.00 0.00 H new ATOM 0 HG22 ILE C 7 36.737 4.353 25.014 1.00 0.00 H new ATOM 0 HG23 ILE C 7 37.414 2.810 25.587 1.00 0.00 H new ATOM 0 HD11 ILE C 7 40.808 1.674 26.260 1.00 0.00 H new ATOM 0 HD12 ILE C 7 39.051 1.706 25.982 1.00 0.00 H new ATOM 0 HD13 ILE C 7 40.172 1.870 24.609 1.00 0.00 H new ATOM 1233 N LEU C 8 38.439 5.790 22.327 1.00 0.00 N0 ATOM 1234 CA LEU C 8 37.622 6.666 21.488 1.00 0.00 C0 ATOM 1235 C LEU C 8 37.519 6.113 20.069 1.00 0.00 C0 ATOM 1236 O LEU C 8 36.478 6.229 19.417 1.00 0.00 O0 ATOM 1237 CB LEU C 8 38.236 8.069 21.434 1.00 0.00 C0 ATOM 1238 CG LEU C 8 37.549 8.995 22.445 1.00 0.00 C0 ATOM 1239 CD1 LEU C 8 36.124 9.311 21.976 1.00 0.00 C0 ATOM 1240 CD2 LEU C 8 37.500 8.321 23.821 1.00 0.00 C0 ATOM 0 H LEU C 8 39.339 6.184 22.602 1.00 0.00 H new ATOM 0 HA LEU C 8 36.625 6.717 21.925 1.00 0.00 H new ATOM 0 HB2 LEU C 8 39.303 8.014 21.649 1.00 0.00 H new ATOM 0 HB3 LEU C 8 38.134 8.479 20.429 1.00 0.00 H new ATOM 0 HG LEU C 8 38.117 9.922 22.520 1.00 0.00 H new ATOM 0 HD11 LEU C 8 35.641 9.969 22.698 1.00 0.00 H new ATOM 0 HD12 LEU C 8 36.162 9.804 21.004 1.00 0.00 H new ATOM 0 HD13 LEU C 8 35.555 8.385 21.892 1.00 0.00 H new ATOM 0 HD21 LEU C 8 37.011 8.985 24.534 1.00 0.00 H new ATOM 0 HD22 LEU C 8 36.940 7.389 23.750 1.00 0.00 H new ATOM 0 HD23 LEU C 8 38.515 8.110 24.159 1.00 0.00 H new ATOM 1252 N SER C 9 38.603 5.500 19.602 1.00 0.00 N0 ATOM 1253 CA SER C 9 38.621 4.925 18.262 1.00 0.00 C0 ATOM 1254 C SER C 9 37.707 3.708 18.196 1.00 0.00 C0 ATOM 1255 O SER C 9 36.960 3.532 17.236 1.00 0.00 O0 ATOM 1256 CB SER C 9 40.045 4.524 17.879 1.00 0.00 C0 ATOM 1257 OG SER C 9 40.512 3.530 18.779 1.00 0.00 O0 ATOM 0 H SER C 9 39.471 5.390 20.126 1.00 0.00 H new ATOM 0 HA SER C 9 38.261 5.676 17.558 1.00 0.00 H new ATOM 0 HB2 SER C 9 40.066 4.144 16.857 1.00 0.00 H new ATOM 0 HB3 SER C 9 40.700 5.394 17.909 1.00 0.00 H new ATOM 0 HG SER C 9 40.040 3.615 19.634 1.00 0.00 H new ATOM 1263 N ILE C 10 37.765 2.878 19.232 1.00 0.00 N0 ATOM 1264 CA ILE C 10 36.931 1.688 19.287 1.00 0.00 C0 ATOM 1265 C ILE C 10 35.459 2.066 19.371 1.00 0.00 C0 ATOM 1266 O ILE C 10 34.619 1.449 18.717 1.00 0.00 O0 ATOM 1267 CB ILE C 10 37.317 0.824 20.491 1.00 0.00 C0 ATOM 1268 CG1 ILE C 10 38.554 -0.015 20.132 1.00 0.00 C0 ATOM 1269 CG2 ILE C 10 36.151 -0.097 20.862 1.00 0.00 C0 ATOM 1270 CD1 ILE C 10 38.151 -1.200 19.236 1.00 0.00 C0 ATOM 0 H ILE C 10 38.376 3.008 20.038 1.00 0.00 H new ATOM 0 HA ILE C 10 37.092 1.116 18.373 1.00 0.00 H new ATOM 0 HB ILE C 10 37.546 1.463 21.344 1.00 0.00 H new ATOM 0 HG12 ILE C 10 39.287 0.606 19.618 1.00 0.00 H new ATOM 0 HG13 ILE C 10 39.030 -0.382 21.041 1.00 0.00 H new ATOM 0 HG21 ILE C 10 36.430 -0.710 21.719 1.00 0.00 H new ATOM 0 HG22 ILE C 10 35.278 0.505 21.115 1.00 0.00 H new ATOM 0 HG23 ILE C 10 35.914 -0.742 20.016 1.00 0.00 H new ATOM 0 HD11 ILE C 10 39.036 -1.787 18.989 1.00 0.00 H new ATOM 0 HD12 ILE C 10 37.435 -1.829 19.765 1.00 0.00 H new ATOM 0 HD13 ILE C 10 37.696 -0.825 18.319 1.00 0.00 H new ATOM 1282 N CYS C 11 35.150 3.080 20.174 1.00 0.00 N0 ATOM 1283 CA CYS C 11 33.769 3.512 20.315 1.00 0.00 C0 ATOM 1284 C CYS C 11 33.220 3.937 18.959 1.00 0.00 C0 ATOM 1285 O CYS C 11 32.146 3.499 18.549 1.00 0.00 O0 ATOM 1286 CB CYS C 11 33.681 4.683 21.298 1.00 0.00 C0 ATOM 1287 SG CYS C 11 34.033 4.089 22.971 1.00 0.00 S0 ATOM 0 H CYS C 11 35.826 3.608 20.727 1.00 0.00 H new ATOM 0 HA CYS C 11 33.177 2.681 20.699 1.00 0.00 H new ATOM 0 HB2 CYS C 11 34.392 5.461 21.019 1.00 0.00 H new ATOM 0 HB3 CYS C 11 32.688 5.130 21.260 1.00 0.00 H new ATOM 0 HG CYS C 11 35.317 3.955 23.123 1.00 0.00 H new ATOM 1293 N SER C 12 33.961 4.792 18.263 1.00 0.00 N0 ATOM 1294 CA SER C 12 33.525 5.263 16.954 1.00 0.00 C0 ATOM 1295 C SER C 12 33.356 4.092 15.987 1.00 0.00 C0 ATOM 1296 O SER C 12 32.414 4.064 15.194 1.00 0.00 O0 ATOM 1297 CB SER C 12 34.546 6.249 16.386 1.00 0.00 C0 ATOM 1298 OG SER C 12 34.105 6.697 15.108 1.00 0.00 O0 ATOM 0 H SER C 12 34.855 5.169 18.578 1.00 0.00 H new ATOM 0 HA SER C 12 32.563 5.762 17.074 1.00 0.00 H new ATOM 0 HB2 SER C 12 34.665 7.097 17.061 1.00 0.00 H new ATOM 0 HB3 SER C 12 35.522 5.771 16.300 1.00 0.00 H new ATOM 0 HG SER C 12 34.756 7.331 14.741 1.00 0.00 H new ATOM 1304 N PHE C 13 34.279 3.136 16.051 1.00 0.00 N0 ATOM 1305 CA PHE C 13 34.225 1.975 15.166 1.00 0.00 C0 ATOM 1306 C PHE C 13 32.934 1.187 15.373 1.00 0.00 C0 ATOM 1307 O PHE C 13 32.208 0.902 14.416 1.00 0.00 O0 ATOM 1308 CB PHE C 13 35.431 1.069 15.439 1.00 0.00 C0 ATOM 1309 CG PHE C 13 35.388 -0.136 14.526 1.00 0.00 C0 ATOM 1310 CD1 PHE C 13 35.672 0.009 13.163 1.00 0.00 C0 ATOM 1311 CD2 PHE C 13 35.075 -1.399 15.045 1.00 0.00 C0 ATOM 1312 CE1 PHE C 13 35.641 -1.107 12.319 1.00 0.00 C0 ATOM 1313 CE2 PHE C 13 35.044 -2.516 14.201 1.00 0.00 C0 ATOM 1314 CZ PHE C 13 35.326 -2.369 12.837 1.00 0.00 C0 ATOM 0 H PHE C 13 35.066 3.141 16.700 1.00 0.00 H new ATOM 0 HA PHE C 13 34.250 2.326 14.134 1.00 0.00 H new ATOM 0 HB2 PHE C 13 36.356 1.623 15.281 1.00 0.00 H new ATOM 0 HB3 PHE C 13 35.427 0.747 16.480 1.00 0.00 H new ATOM 0 HD1 PHE C 13 35.915 0.982 12.763 1.00 0.00 H new ATOM 0 HD2 PHE C 13 34.857 -1.511 16.097 1.00 0.00 H new ATOM 0 HE1 PHE C 13 35.860 -0.995 11.267 1.00 0.00 H new ATOM 0 HE2 PHE C 13 34.803 -3.490 14.601 1.00 0.00 H new ATOM 0 HZ PHE C 13 35.300 -3.229 12.185 1.00 0.00 H new ATOM 1324 N ILE C 14 32.639 0.841 16.626 1.00 0.00 N0 ATOM 1325 CA ILE C 14 31.425 0.090 16.926 1.00 0.00 C0 ATOM 1326 C ILE C 14 30.193 0.932 16.621 1.00 0.00 C0 ATOM 1327 O ILE C 14 29.153 0.406 16.230 1.00 0.00 O0 ATOM 1328 CB ILE C 14 31.420 -0.370 18.391 1.00 0.00 C0 ATOM 1329 CG1 ILE C 14 30.172 -1.217 18.653 1.00 0.00 C0 ATOM 1330 CG2 ILE C 14 31.428 0.835 19.332 1.00 0.00 C0 ATOM 1331 CD1 ILE C 14 30.326 -1.953 19.986 1.00 0.00 C0 ATOM 0 H ILE C 14 33.215 1.065 17.437 1.00 0.00 H new ATOM 0 HA ILE C 14 31.402 -0.797 16.293 1.00 0.00 H new ATOM 0 HB ILE C 14 32.315 -0.963 18.577 1.00 0.00 H new ATOM 0 HG12 ILE C 14 29.287 -0.582 18.676 1.00 0.00 H new ATOM 0 HG13 ILE C 14 30.029 -1.933 17.844 1.00 0.00 H new ATOM 0 HG21 ILE C 14 31.424 0.489 20.366 1.00 0.00 H new ATOM 0 HG22 ILE C 14 32.322 1.431 19.152 1.00 0.00 H new ATOM 0 HG23 ILE C 14 30.543 1.445 19.150 1.00 0.00 H new ATOM 0 HD11 ILE C 14 29.438 -2.556 20.173 1.00 0.00 H new ATOM 0 HD12 ILE C 14 31.202 -2.600 19.945 1.00 0.00 H new ATOM 0 HD13 ILE C 14 30.448 -1.227 20.790 1.00 0.00 H new ATOM 1343 N LEU C 15 30.319 2.243 16.787 1.00 0.00 N0 ATOM 1344 CA LEU C 15 29.209 3.142 16.511 1.00 0.00 C0 ATOM 1345 C LEU C 15 28.826 3.050 15.038 1.00 0.00 C0 ATOM 1346 O LEU C 15 27.710 2.659 14.701 1.00 0.00 O0 ATOM 1347 CB LEU C 15 29.604 4.577 16.864 1.00 0.00 C0 ATOM 1348 CG LEU C 15 29.475 4.782 18.375 1.00 0.00 C0 ATOM 1349 CD1 LEU C 15 30.313 5.989 18.803 1.00 0.00 C0 ATOM 1350 CD2 LEU C 15 28.006 5.035 18.733 1.00 0.00 C0 ATOM 0 H LEU C 15 31.171 2.703 17.108 1.00 0.00 H new ATOM 0 HA LEU C 15 28.352 2.853 17.119 1.00 0.00 H new ATOM 0 HB2 LEU C 15 30.628 4.773 16.545 1.00 0.00 H new ATOM 0 HB3 LEU C 15 28.964 5.283 16.334 1.00 0.00 H new ATOM 0 HG LEU C 15 29.830 3.890 18.891 1.00 0.00 H new ATOM 0 HD11 LEU C 15 30.220 6.133 19.879 1.00 0.00 H new ATOM 0 HD12 LEU C 15 31.359 5.814 18.549 1.00 0.00 H new ATOM 0 HD13 LEU C 15 29.958 6.880 18.285 1.00 0.00 H new ATOM 0 HD21 LEU C 15 27.914 5.181 19.809 1.00 0.00 H new ATOM 0 HD22 LEU C 15 27.653 5.926 18.214 1.00 0.00 H new ATOM 0 HD23 LEU C 15 27.405 4.178 18.430 1.00 0.00 H new ATOM 1362 N SER C 16 29.749 3.438 14.165 1.00 0.00 N0 ATOM 1363 CA SER C 16 29.481 3.411 12.734 1.00 0.00 C0 ATOM 1364 C SER C 16 28.969 2.041 12.301 1.00 0.00 C0 ATOM 1365 O SER C 16 28.097 1.945 11.438 1.00 0.00 O0 ATOM 1366 CB SER C 16 30.756 3.740 11.963 1.00 0.00 C0 ATOM 1367 OG SER C 16 31.742 2.754 12.239 1.00 0.00 O0 ATOM 0 H SER C 16 30.679 3.771 14.420 1.00 0.00 H new ATOM 0 HA SER C 16 28.715 4.155 12.517 1.00 0.00 H new ATOM 0 HB2 SER C 16 30.549 3.774 10.893 1.00 0.00 H new ATOM 0 HB3 SER C 16 31.122 4.726 12.248 1.00 0.00 H new ATOM 0 HG SER C 16 31.604 2.397 13.141 1.00 0.00 H new ATOM 1373 N ALA C 17 29.501 0.983 12.904 1.00 0.00 N0 ATOM 1374 CA ALA C 17 29.059 -0.363 12.556 1.00 0.00 C0 ATOM 1375 C ALA C 17 27.572 -0.525 12.859 1.00 0.00 C0 ATOM 1376 O ALA C 17 26.807 -1.023 12.035 1.00 0.00 O0 ATOM 1377 CB ALA C 17 29.861 -1.395 13.350 1.00 0.00 C0 ATOM 0 H ALA C 17 30.224 1.028 13.622 1.00 0.00 H new ATOM 0 HA ALA C 17 29.223 -0.521 11.490 1.00 0.00 H new ATOM 0 HB1 ALA C 17 29.526 -2.398 13.086 1.00 0.00 H new ATOM 0 HB2 ALA C 17 30.920 -1.292 13.114 1.00 0.00 H new ATOM 0 HB3 ALA C 17 29.709 -1.231 14.417 1.00 0.00 H new ATOM 1383 N LEU C 18 27.174 -0.096 14.052 1.00 0.00 N0 ATOM 1384 CA LEU C 18 25.778 -0.191 14.471 1.00 0.00 C0 ATOM 1385 C LEU C 18 24.894 0.693 13.600 1.00 0.00 C0 ATOM 1386 O LEU C 18 23.757 0.341 13.291 1.00 0.00 O0 ATOM 1387 CB LEU C 18 25.645 0.230 15.936 1.00 0.00 C0 ATOM 1388 CG LEU C 18 26.341 -0.800 16.829 1.00 0.00 C0 ATOM 1389 CD1 LEU C 18 26.403 -0.274 18.264 1.00 0.00 C0 ATOM 1390 CD2 LEU C 18 25.562 -2.117 16.803 1.00 0.00 C0 ATOM 0 H LEU C 18 27.796 0.320 14.745 1.00 0.00 H new ATOM 0 HA LEU C 18 25.454 -1.226 14.360 1.00 0.00 H new ATOM 0 HB2 LEU C 18 26.089 1.214 16.084 1.00 0.00 H new ATOM 0 HB3 LEU C 18 24.593 0.311 16.208 1.00 0.00 H new ATOM 0 HG LEU C 18 27.352 -0.971 16.459 1.00 0.00 H new ATOM 0 HD11 LEU C 18 26.899 -1.008 18.899 1.00 0.00 H new ATOM 0 HD12 LEU C 18 26.963 0.661 18.285 1.00 0.00 H new ATOM 0 HD13 LEU C 18 25.392 -0.100 18.632 1.00 0.00 H new ATOM 0 HD21 LEU C 18 26.061 -2.847 17.440 1.00 0.00 H new ATOM 0 HD22 LEU C 18 24.549 -1.948 17.169 1.00 0.00 H new ATOM 0 HD23 LEU C 18 25.520 -2.495 15.781 1.00 0.00 H new ATOM 1402 N HIS C 19 25.428 1.842 13.219 1.00 0.00 N0 ATOM 1403 CA HIS C 19 24.696 2.789 12.385 1.00 0.00 C0 ATOM 1404 C HIS C 19 24.445 2.225 10.991 1.00 0.00 C0 ATOM 1405 O HIS C 19 23.375 2.420 10.408 1.00 0.00 O0 ATOM 1406 CB HIS C 19 25.497 4.094 12.294 1.00 0.00 C0 ATOM 1407 CG HIS C 19 25.497 4.607 10.880 1.00 0.00 C0 ATOM 1408 ND1 HIS C 19 24.588 5.553 10.433 1.00 0.00 N0 ATOM 1409 CD2 HIS C 19 26.297 4.319 9.803 1.00 0.00 C0 ATOM 1410 CE1 HIS C 19 24.860 5.798 9.138 1.00 0.00 C0 ATOM 1411 NE2 HIS C 19 25.894 5.072 8.705 1.00 0.00 N0 ATOM 0 H HIS C 19 26.368 2.145 13.473 1.00 0.00 H new ATOM 0 HA HIS C 19 23.724 2.979 12.840 1.00 0.00 H new ATOM 0 HB2 HIS C 19 25.065 4.841 12.960 1.00 0.00 H new ATOM 0 HB3 HIS C 19 26.521 3.925 12.627 1.00 0.00 H new ATOM 0 HD1 HIS C 19 23.847 5.985 10.985 1.00 0.00 H new ATOM 0 HD2 HIS C 19 27.116 3.614 9.807 1.00 0.00 H new ATOM 0 HE1 HIS C 19 24.310 6.496 8.524 1.00 0.00 H new ATOM 1419 N PHE C 20 25.428 1.502 10.475 1.00 0.00 N0 ATOM 1420 CA PHE C 20 25.310 0.894 9.158 1.00 0.00 C0 ATOM 1421 C PHE C 20 24.386 -0.318 9.197 1.00 0.00 C0 ATOM 1422 O PHE C 20 23.639 -0.572 8.254 1.00 0.00 O0 ATOM 1423 CB PHE C 20 26.694 0.469 8.662 1.00 0.00 C0 ATOM 1424 CG PHE C 20 27.031 1.212 7.392 1.00 0.00 C0 ATOM 1425 CD1 PHE C 20 27.676 2.452 7.453 1.00 0.00 C0 ATOM 1426 CD2 PHE C 20 26.701 0.655 6.150 1.00 0.00 C0 ATOM 1427 CE1 PHE C 20 27.991 3.136 6.273 1.00 0.00 C0 ATOM 1428 CE2 PHE C 20 27.016 1.339 4.971 1.00 0.00 C0 ATOM 1429 CZ PHE C 20 27.661 2.580 5.033 1.00 0.00 C0 ATOM 0 H PHE C 20 26.314 1.322 10.947 1.00 0.00 H new ATOM 0 HA PHE C 20 24.884 1.630 8.476 1.00 0.00 H new ATOM 0 HB2 PHE C 20 27.444 0.676 9.426 1.00 0.00 H new ATOM 0 HB3 PHE C 20 26.712 -0.606 8.481 1.00 0.00 H new ATOM 0 HD1 PHE C 20 27.931 2.882 8.411 1.00 0.00 H new ATOM 0 HD2 PHE C 20 26.203 -0.302 6.102 1.00 0.00 H new ATOM 0 HE1 PHE C 20 28.489 4.093 6.320 1.00 0.00 H new ATOM 0 HE2 PHE C 20 26.762 0.910 4.013 1.00 0.00 H new ATOM 0 HZ PHE C 20 27.904 3.108 4.123 1.00 0.00 H new ATOM 1439 N MET C 21 24.444 -1.063 10.293 1.00 0.00 N0 ATOM 1440 CA MET C 21 23.613 -2.251 10.446 1.00 0.00 C0 ATOM 1441 C MET C 21 22.147 -1.896 10.670 1.00 0.00 C0 ATOM 1442 O MET C 21 21.262 -2.407 9.982 1.00 0.00 O0 ATOM 1443 CB MET C 21 24.129 -3.067 11.628 1.00 0.00 C0 ATOM 1444 CG MET C 21 25.448 -3.730 11.231 1.00 0.00 C0 ATOM 1445 SD MET C 21 26.074 -4.728 12.602 1.00 0.00 S0 ATOM 1446 CE MET C 21 27.464 -5.464 11.707 1.00 0.00 C0 ATOM 0 H MET C 21 25.055 -0.867 11.086 1.00 0.00 H new ATOM 0 HA MET C 21 23.673 -2.830 9.524 1.00 0.00 H new ATOM 0 HB2 MET C 21 24.276 -2.423 12.495 1.00 0.00 H new ATOM 0 HB3 MET C 21 23.397 -3.823 11.913 1.00 0.00 H new ATOM 0 HG2 MET C 21 25.299 -4.357 10.352 1.00 0.00 H new ATOM 0 HG3 MET C 21 26.180 -2.969 10.960 1.00 0.00 H new ATOM 0 HE1 MET C 21 28.010 -6.135 12.371 1.00 0.00 H new ATOM 0 HE2 MET C 21 27.089 -6.026 10.851 1.00 0.00 H new ATOM 0 HE3 MET C 21 28.131 -4.675 11.359 1.00 0.00 H new ATOM 1456 N ALA C 22 21.905 -1.037 11.649 1.00 0.00 N0 ATOM 1457 CA ALA C 22 20.546 -0.634 11.984 1.00 0.00 C0 ATOM 1458 C ALA C 22 19.879 0.068 10.812 1.00 0.00 C0 ATOM 1459 O ALA C 22 18.714 -0.195 10.511 1.00 0.00 O0 ATOM 1460 CB ALA C 22 20.551 0.287 13.199 1.00 0.00 C0 ATOM 0 H ALA C 22 22.629 -0.606 12.224 1.00 0.00 H new ATOM 0 HA ALA C 22 19.978 -1.535 12.217 1.00 0.00 H new ATOM 0 HB1 ALA C 22 19.529 0.580 13.438 1.00 0.00 H new ATOM 0 HB2 ALA C 22 20.987 -0.236 14.050 1.00 0.00 H new ATOM 0 HB3 ALA C 22 21.141 1.176 12.979 1.00 0.00 H new ATOM 1466 N TRP C 23 20.616 0.949 10.140 1.00 0.00 N0 ATOM 1467 CA TRP C 23 20.049 1.651 9.001 1.00 0.00 C0 ATOM 1468 C TRP C 23 19.931 0.715 7.799 1.00 0.00 C0 ATOM 1469 O TRP C 23 19.056 0.894 6.956 1.00 0.00 O0 ATOM 1470 CB TRP C 23 20.878 2.885 8.642 1.00 0.00 C0 ATOM 1471 CG TRP C 23 20.624 3.973 9.647 1.00 0.00 C0 ATOM 1472 CD1 TRP C 23 21.577 4.616 10.352 1.00 0.00 C0 ATOM 1473 CD2 TRP C 23 19.345 4.544 10.072 1.00 0.00 C0 ATOM 1474 NE1 TRP C 23 20.975 5.555 11.171 1.00 0.00 N0 ATOM 1475 CE2 TRP C 23 19.599 5.544 11.038 1.00 0.00 C0 ATOM 1476 CE3 TRP C 23 18.004 4.295 9.714 1.00 0.00 C0 ATOM 1477 CZ2 TRP C 23 18.564 6.273 11.629 1.00 0.00 C0 ATOM 1478 CZ3 TRP C 23 16.962 5.023 10.308 1.00 0.00 C0 ATOM 1479 CH2 TRP C 23 17.240 6.011 11.263 1.00 0.00 C0 ATOM 0 H TRP C 23 21.583 1.187 10.360 1.00 0.00 H new ATOM 0 HA TRP C 23 19.050 1.988 9.278 1.00 0.00 H new ATOM 0 HB2 TRP C 23 21.938 2.631 8.626 1.00 0.00 H new ATOM 0 HB3 TRP C 23 20.618 3.232 7.642 1.00 0.00 H new ATOM 0 HD1 TRP C 23 22.639 4.428 10.288 1.00 0.00 H new ATOM 0 HE1 TRP C 23 21.484 6.179 11.797 1.00 0.00 H new ATOM 0 HE3 TRP C 23 17.777 3.538 8.977 1.00 0.00 H new ATOM 0 HZ2 TRP C 23 18.785 7.034 12.363 1.00 0.00 H new ATOM 0 HZ3 TRP C 23 15.939 4.821 10.028 1.00 0.00 H new ATOM 0 HH2 TRP C 23 16.433 6.569 11.715 1.00 0.00 H new ATOM 1490 N THR C 24 20.799 -0.293 7.732 1.00 0.00 N0 ATOM 1491 CA THR C 24 20.748 -1.248 6.630 1.00 0.00 C0 ATOM 1492 C THR C 24 19.441 -2.042 6.667 1.00 0.00 C0 ATOM 1493 O THR C 24 18.689 -2.065 5.695 1.00 0.00 O0 ATOM 1494 CB THR C 24 21.934 -2.214 6.718 1.00 0.00 C0 ATOM 1495 OG1 THR C 24 23.056 -1.648 6.056 1.00 0.00 O0 ATOM 1496 CG2 THR C 24 21.569 -3.550 6.064 1.00 0.00 C0 ATOM 0 H THR C 24 21.535 -0.467 8.417 1.00 0.00 H new ATOM 0 HA THR C 24 20.799 -0.694 5.693 1.00 0.00 H new ATOM 0 HB THR C 24 22.179 -2.387 7.766 1.00 0.00 H new ATOM 0 HG1 THR C 24 23.558 -1.088 6.684 1.00 0.00 H new ATOM 0 HG21 THR C 24 22.417 -4.231 6.131 1.00 0.00 H new ATOM 0 HG22 THR C 24 20.713 -3.985 6.579 1.00 0.00 H new ATOM 0 HG23 THR C 24 21.317 -3.385 5.016 1.00 0.00 H new ATOM 1504 N ILE C 25 19.182 -2.694 7.797 1.00 0.00 N0 ATOM 1505 CA ILE C 25 17.965 -3.489 7.949 1.00 0.00 C0 ATOM 1506 C ILE C 25 16.721 -2.604 7.921 1.00 0.00 C0 ATOM 1507 O ILE C 25 15.723 -2.938 7.284 1.00 0.00 O0 ATOM 1508 CB ILE C 25 18.014 -4.270 9.260 1.00 0.00 C0 ATOM 1509 CG1 ILE C 25 19.112 -5.335 9.178 1.00 0.00 C0 ATOM 1510 CG2 ILE C 25 16.665 -4.952 9.497 1.00 0.00 C0 ATOM 1511 CD1 ILE C 25 19.360 -5.929 10.567 1.00 0.00 C0 ATOM 0 H ILE C 25 19.792 -2.689 8.615 1.00 0.00 H new ATOM 0 HA ILE C 25 17.908 -4.185 7.112 1.00 0.00 H new ATOM 0 HB ILE C 25 18.228 -3.587 10.082 1.00 0.00 H new ATOM 0 HG12 ILE C 25 18.818 -6.121 8.483 1.00 0.00 H new ATOM 0 HG13 ILE C 25 20.031 -4.895 8.791 1.00 0.00 H new ATOM 0 HG21 ILE C 25 16.699 -5.510 10.433 1.00 0.00 H new ATOM 0 HG22 ILE C 25 15.881 -4.197 9.553 1.00 0.00 H new ATOM 0 HG23 ILE C 25 16.453 -5.635 8.675 1.00 0.00 H new ATOM 0 HD11 ILE C 25 20.142 -6.686 10.505 1.00 0.00 H new ATOM 0 HD12 ILE C 25 19.673 -5.139 11.250 1.00 0.00 H new ATOM 0 HD13 ILE C 25 18.442 -6.385 10.937 1.00 0.00 H new ATOM 1523 N GLY C 26 16.787 -1.475 8.620 1.00 0.00 N0 ATOM 1524 CA GLY C 26 15.662 -0.548 8.672 1.00 0.00 C0 ATOM 1525 C GLY C 26 15.324 -0.025 7.281 1.00 0.00 C0 ATOM 1526 O GLY C 26 14.157 0.169 6.940 1.00 0.00 O0 ATOM 0 H GLY C 26 17.604 -1.181 9.156 1.00 0.00 H new ATOM 0 HA2 GLY C 26 14.792 -1.049 9.098 1.00 0.00 H new ATOM 0 HA3 GLY C 26 15.903 0.287 9.330 1.00 0.00 H new ATOM 1530 N HIS C 27 16.359 0.192 6.481 1.00 0.00 N0 ATOM 1531 CA HIS C 27 16.187 0.681 5.119 1.00 0.00 C0 ATOM 1532 C HIS C 27 15.618 -0.405 4.214 1.00 0.00 C0 ATOM 1533 O HIS C 27 14.820 -0.128 3.317 1.00 0.00 O0 ATOM 1534 CB HIS C 27 17.526 1.155 4.561 1.00 0.00 C0 ATOM 1535 CG HIS C 27 17.378 1.414 3.090 1.00 0.00 C0 ATOM 1536 ND1 HIS C 27 16.728 2.535 2.597 1.00 0.00 N0 ATOM 1537 CD2 HIS C 27 17.771 0.693 1.992 1.00 0.00 C0 ATOM 1538 CE1 HIS C 27 16.750 2.457 1.254 1.00 0.00 C0 ATOM 1539 NE2 HIS C 27 17.373 1.354 0.832 1.00 0.00 N0 ATOM 0 H HIS C 27 17.330 0.037 6.752 1.00 0.00 H new ATOM 0 HA HIS C 27 15.485 1.514 5.147 1.00 0.00 H new ATOM 0 HB2 HIS C 27 17.847 2.062 5.073 1.00 0.00 H new ATOM 0 HB3 HIS C 27 18.294 0.402 4.735 1.00 0.00 H new ATOM 0 HD2 HIS C 27 18.307 -0.244 2.022 1.00 0.00 H new ATOM 0 HE1 HIS C 27 16.316 3.197 0.597 1.00 0.00 H new ATOM 0 HE2 HIS C 27 17.525 1.059 -0.132 1.00 0.00 H new ATOM 1547 N LEU C 28 16.043 -1.642 4.447 1.00 0.00 N0 ATOM 1548 CA LEU C 28 15.584 -2.769 3.643 1.00 0.00 C0 ATOM 1549 C LEU C 28 14.075 -2.956 3.782 1.00 0.00 C0 ATOM 1550 O LEU C 28 13.539 -2.955 4.891 1.00 0.00 O0 ATOM 1551 CB LEU C 28 16.296 -4.048 4.089 1.00 0.00 C0 ATOM 1552 CG LEU C 28 16.080 -5.150 3.050 1.00 0.00 C0 ATOM 1553 CD1 LEU C 28 16.919 -4.855 1.804 1.00 0.00 C0 ATOM 1554 CD2 LEU C 28 16.500 -6.498 3.643 1.00 0.00 C0 ATOM 0 H LEU C 28 16.703 -1.890 5.184 1.00 0.00 H new ATOM 0 HA LEU C 28 15.817 -2.561 2.599 1.00 0.00 H new ATOM 0 HB2 LEU C 28 17.362 -3.857 4.214 1.00 0.00 H new ATOM 0 HB3 LEU C 28 15.914 -4.369 5.058 1.00 0.00 H new ATOM 0 HG LEU C 28 15.026 -5.186 2.774 1.00 0.00 H new ATOM 0 HD11 LEU C 28 16.763 -5.642 1.066 1.00 0.00 H new ATOM 0 HD12 LEU C 28 16.618 -3.896 1.382 1.00 0.00 H new ATOM 0 HD13 LEU C 28 17.974 -4.817 2.076 1.00 0.00 H new ATOM 0 HD21 LEU C 28 16.347 -7.284 2.904 1.00 0.00 H new ATOM 0 HD22 LEU C 28 17.553 -6.461 3.920 1.00 0.00 H new ATOM 0 HD23 LEU C 28 15.899 -6.709 4.528 1.00 0.00 H new ATOM 1702 N GLU D 3 51.407 2.662 2.803 1.00 0.00 N0 ATOM 1703 CA GLU D 3 50.080 3.148 3.168 1.00 0.00 C0 ATOM 1704 C GLU D 3 50.041 4.680 3.142 1.00 0.00 C0 ATOM 1705 O GLU D 3 51.048 5.332 3.422 1.00 0.00 O0 ATOM 1706 CB GLU D 3 49.704 2.654 4.568 1.00 0.00 C0 ATOM 1707 CG GLU D 3 49.589 1.126 4.564 1.00 0.00 C0 ATOM 1708 CD GLU D 3 50.964 0.484 4.744 1.00 0.00 C0 ATOM 1709 OE1 GLU D 3 51.913 1.210 4.993 1.00 0.00 O0 ATOM 1710 OE2 GLU D 3 51.047 -0.729 4.632 1.00 0.00 O1- ATOM 0 HA GLU D 3 49.364 2.762 2.442 1.00 0.00 H new ATOM 0 HB2 GLU D 3 50.457 2.970 5.290 1.00 0.00 H new ATOM 0 HB3 GLU D 3 48.759 3.098 4.879 1.00 0.00 H new ATOM 0 HG2 GLU D 3 48.923 0.804 5.365 1.00 0.00 H new ATOM 0 HG3 GLU D 3 49.145 0.792 3.626 1.00 0.00 H new ATOM 1717 N PRO D 4 48.912 5.271 2.811 1.00 0.00 N0 ATOM 1718 CA PRO D 4 48.771 6.759 2.755 1.00 0.00 C0 ATOM 1719 C PRO D 4 48.723 7.395 4.142 1.00 0.00 C0 ATOM 1720 O PRO D 4 49.286 8.467 4.365 1.00 0.00 O0 ATOM 1721 CB PRO D 4 47.451 6.966 2.015 1.00 0.00 C0 ATOM 1722 CG PRO D 4 46.648 5.743 2.301 1.00 0.00 C0 ATOM 1723 CD PRO D 4 47.647 4.597 2.467 1.00 0.00 C0 ATOM 0 HA PRO D 4 49.623 7.230 2.264 1.00 0.00 H new ATOM 0 HB2 PRO D 4 46.940 7.863 2.364 1.00 0.00 H new ATOM 0 HB3 PRO D 4 47.615 7.089 0.944 1.00 0.00 H new ATOM 0 HG2 PRO D 4 46.052 5.872 3.205 1.00 0.00 H new ATOM 0 HG3 PRO D 4 45.952 5.537 1.488 1.00 0.00 H new ATOM 0 HD2 PRO D 4 47.336 3.908 3.252 1.00 0.00 H new ATOM 0 HD3 PRO D 4 47.742 4.015 1.550 1.00 0.00 H new ATOM 1731 N PHE D 5 48.041 6.728 5.068 1.00 0.00 N0 ATOM 1732 CA PHE D 5 47.915 7.235 6.431 1.00 0.00 C0 ATOM 1733 C PHE D 5 47.820 6.076 7.422 1.00 0.00 C0 ATOM 1734 O PHE D 5 48.823 5.664 8.004 1.00 0.00 O0 ATOM 1735 CB PHE D 5 46.668 8.119 6.548 1.00 0.00 C0 ATOM 1736 CG PHE D 5 47.054 9.571 6.404 1.00 0.00 C0 ATOM 1737 CD1 PHE D 5 46.918 10.212 5.167 1.00 0.00 C0 ATOM 1738 CD2 PHE D 5 47.541 10.279 7.508 1.00 0.00 C0 ATOM 1739 CE1 PHE D 5 47.269 11.561 5.035 1.00 0.00 C0 ATOM 1740 CE2 PHE D 5 47.894 11.627 7.377 1.00 0.00 C0 ATOM 1741 CZ PHE D 5 47.757 12.268 6.139 1.00 0.00 C0 ATOM 0 H PHE D 5 47.569 5.839 4.901 1.00 0.00 H new ATOM 0 HA PHE D 5 48.799 7.828 6.665 1.00 0.00 H new ATOM 0 HB2 PHE D 5 45.945 7.848 5.779 1.00 0.00 H new ATOM 0 HB3 PHE D 5 46.185 7.956 7.511 1.00 0.00 H new ATOM 0 HD1 PHE D 5 46.542 9.666 4.314 1.00 0.00 H new ATOM 0 HD2 PHE D 5 47.645 9.785 8.463 1.00 0.00 H new ATOM 0 HE1 PHE D 5 47.163 12.056 4.081 1.00 0.00 H new ATOM 0 HE2 PHE D 5 48.272 12.172 8.229 1.00 0.00 H new ATOM 0 HZ PHE D 5 48.028 13.308 6.037 1.00 0.00 H new ATOM 1751 N GLN D 6 46.610 5.549 7.606 1.00 0.00 N0 ATOM 1752 CA GLN D 6 46.403 4.434 8.521 1.00 0.00 C0 ATOM 1753 C GLN D 6 45.263 3.549 8.030 1.00 0.00 C0 ATOM 1754 O GLN D 6 44.453 3.965 7.204 1.00 0.00 O0 ATOM 1755 CB GLN D 6 46.087 4.947 9.926 1.00 0.00 C0 ATOM 1756 CG GLN D 6 47.324 5.635 10.506 1.00 0.00 C0 ATOM 1757 CD GLN D 6 47.055 6.065 11.944 1.00 0.00 C0 ATOM 1758 OE1 GLN D 6 46.182 6.897 12.192 1.00 0.00 O0 ATOM 1759 NE2 GLN D 6 47.753 5.538 12.912 1.00 0.00 N0 ATOM 0 H GLN D 6 45.766 5.875 7.136 1.00 0.00 H new ATOM 0 HA GLN D 6 47.320 3.847 8.556 1.00 0.00 H new ATOM 0 HB2 GLN D 6 45.252 5.646 9.890 1.00 0.00 H new ATOM 0 HB3 GLN D 6 45.783 4.120 10.567 1.00 0.00 H new ATOM 0 HG2 GLN D 6 48.176 4.956 10.474 1.00 0.00 H new ATOM 0 HG3 GLN D 6 47.585 6.503 9.901 1.00 0.00 H new ATOM 0 HE21 GLN D 6 48.476 4.849 12.703 1.00 0.00 H new ATOM 0 HE22 GLN D 6 47.576 5.815 13.878 1.00 0.00 H new ATOM 1768 N ILE D 7 45.214 2.325 8.535 1.00 0.00 N0 ATOM 1769 CA ILE D 7 44.174 1.386 8.134 1.00 0.00 C0 ATOM 1770 C ILE D 7 42.798 1.899 8.564 1.00 0.00 C0 ATOM 1771 O ILE D 7 41.832 1.827 7.805 1.00 0.00 O0 ATOM 1772 CB ILE D 7 44.429 0.021 8.777 1.00 0.00 C0 ATOM 1773 CG1 ILE D 7 45.892 -0.399 8.563 1.00 0.00 C0 ATOM 1774 CG2 ILE D 7 43.503 -1.023 8.150 1.00 0.00 C0 ATOM 1775 CD1 ILE D 7 46.267 -0.280 7.084 1.00 0.00 C0 ATOM 0 H ILE D 7 45.877 1.960 9.219 1.00 0.00 H new ATOM 0 HA ILE D 7 44.195 1.289 7.049 1.00 0.00 H new ATOM 0 HB ILE D 7 44.230 0.091 9.846 1.00 0.00 H new ATOM 0 HG12 ILE D 7 46.550 0.229 9.164 1.00 0.00 H new ATOM 0 HG13 ILE D 7 46.036 -1.425 8.900 1.00 0.00 H new ATOM 0 HG21 ILE D 7 43.686 -1.994 8.609 1.00 0.00 H new ATOM 0 HG22 ILE D 7 42.465 -0.734 8.314 1.00 0.00 H new ATOM 0 HG23 ILE D 7 43.697 -1.085 7.079 1.00 0.00 H new ATOM 0 HD11 ILE D 7 47.306 -0.580 6.947 1.00 0.00 H new ATOM 0 HD12 ILE D 7 45.621 -0.927 6.492 1.00 0.00 H new ATOM 0 HD13 ILE D 7 46.142 0.753 6.759 1.00 0.00 H new ATOM 1787 N LEU D 8 42.724 2.422 9.784 1.00 0.00 N0 ATOM 1788 CA LEU D 8 41.467 2.955 10.309 1.00 0.00 C0 ATOM 1789 C LEU D 8 41.072 4.233 9.573 1.00 0.00 C0 ATOM 1790 O LEU D 8 39.888 4.490 9.337 1.00 0.00 O0 ATOM 1791 CB LEU D 8 41.605 3.262 11.804 1.00 0.00 C0 ATOM 1792 CG LEU D 8 41.049 2.105 12.643 1.00 0.00 C0 ATOM 1793 CD1 LEU D 8 39.522 2.062 12.519 1.00 0.00 C0 ATOM 1794 CD2 LEU D 8 41.642 0.778 12.160 1.00 0.00 C0 ATOM 0 H LEU D 8 43.514 2.489 10.426 1.00 0.00 H new ATOM 0 HA LEU D 8 40.694 2.202 10.158 1.00 0.00 H new ATOM 0 HB2 LEU D 8 42.653 3.428 12.052 1.00 0.00 H new ATOM 0 HB3 LEU D 8 41.071 4.182 12.043 1.00 0.00 H new ATOM 0 HG LEU D 8 41.322 2.260 13.687 1.00 0.00 H new ATOM 0 HD11 LEU D 8 39.131 1.238 13.117 1.00 0.00 H new ATOM 0 HD12 LEU D 8 39.101 3.002 12.877 1.00 0.00 H new ATOM 0 HD13 LEU D 8 39.246 1.915 11.475 1.00 0.00 H new ATOM 0 HD21 LEU D 8 41.242 -0.039 12.761 1.00 0.00 H new ATOM 0 HD22 LEU D 8 41.379 0.621 11.114 1.00 0.00 H new ATOM 0 HD23 LEU D 8 42.727 0.806 12.261 1.00 0.00 H new ATOM 1806 N SER D 9 42.075 5.024 9.202 1.00 0.00 N0 ATOM 1807 CA SER D 9 41.822 6.269 8.485 1.00 0.00 C0 ATOM 1808 C SER D 9 41.321 5.975 7.076 1.00 0.00 C0 ATOM 1809 O SER D 9 40.387 6.611 6.592 1.00 0.00 O0 ATOM 1810 CB SER D 9 43.097 7.107 8.416 1.00 0.00 C0 ATOM 1811 OG SER D 9 44.093 6.394 7.699 1.00 0.00 O0 ATOM 0 H SER D 9 43.059 4.828 9.383 1.00 0.00 H new ATOM 0 HA SER D 9 41.057 6.829 9.023 1.00 0.00 H new ATOM 0 HB2 SER D 9 42.893 8.059 7.927 1.00 0.00 H new ATOM 0 HB3 SER D 9 43.450 7.335 9.422 1.00 0.00 H new ATOM 0 HG SER D 9 43.883 5.437 7.712 1.00 0.00 H new ATOM 1817 N ILE D 10 41.944 4.996 6.427 1.00 0.00 N0 ATOM 1818 CA ILE D 10 41.547 4.616 5.080 1.00 0.00 C0 ATOM 1819 C ILE D 10 40.138 4.042 5.076 1.00 0.00 C0 ATOM 1820 O ILE D 10 39.343 4.343 4.186 1.00 0.00 O0 ATOM 1821 CB ILE D 10 42.530 3.595 4.505 1.00 0.00 C0 ATOM 1822 CG1 ILE D 10 43.769 4.331 3.972 1.00 0.00 C0 ATOM 1823 CG2 ILE D 10 41.859 2.813 3.371 1.00 0.00 C0 ATOM 1824 CD1 ILE D 10 43.454 4.994 2.620 1.00 0.00 C0 ATOM 0 H ILE D 10 42.720 4.456 6.810 1.00 0.00 H new ATOM 0 HA ILE D 10 41.559 5.510 4.456 1.00 0.00 H new ATOM 0 HB ILE D 10 42.831 2.896 5.286 1.00 0.00 H new ATOM 0 HG12 ILE D 10 44.089 5.086 4.690 1.00 0.00 H new ATOM 0 HG13 ILE D 10 44.596 3.630 3.857 1.00 0.00 H new ATOM 0 HG21 ILE D 10 42.562 2.087 2.964 1.00 0.00 H new ATOM 0 HG22 ILE D 10 40.983 2.292 3.757 1.00 0.00 H new ATOM 0 HG23 ILE D 10 41.554 3.503 2.584 1.00 0.00 H new ATOM 0 HD11 ILE D 10 44.340 5.512 2.254 1.00 0.00 H new ATOM 0 HD12 ILE D 10 43.157 4.231 1.901 1.00 0.00 H new ATOM 0 HD13 ILE D 10 42.642 5.710 2.746 1.00 0.00 H new ATOM 1836 N CYS D 11 39.831 3.215 6.071 1.00 0.00 N0 ATOM 1837 CA CYS D 11 38.507 2.617 6.150 1.00 0.00 C0 ATOM 1838 C CYS D 11 37.452 3.712 6.243 1.00 0.00 C0 ATOM 1839 O CYS D 11 36.474 3.708 5.498 1.00 0.00 O0 ATOM 1840 CB CYS D 11 38.413 1.703 7.374 1.00 0.00 C0 ATOM 1841 SG CYS D 11 39.440 0.237 7.108 1.00 0.00 S0 ATOM 0 H CYS D 11 40.470 2.949 6.820 1.00 0.00 H new ATOM 0 HA CYS D 11 38.333 2.024 5.252 1.00 0.00 H new ATOM 0 HB2 CYS D 11 38.744 2.236 8.266 1.00 0.00 H new ATOM 0 HB3 CYS D 11 37.377 1.409 7.544 1.00 0.00 H new ATOM 0 HG CYS D 11 40.678 0.517 7.390 1.00 0.00 H new ATOM 1847 N SER D 12 37.653 4.649 7.163 1.00 0.00 N0 ATOM 1848 CA SER D 12 36.702 5.741 7.335 1.00 0.00 C0 ATOM 1849 C SER D 12 36.570 6.552 6.048 1.00 0.00 C0 ATOM 1850 O SER D 12 35.472 6.970 5.677 1.00 0.00 O0 ATOM 1851 CB SER D 12 37.158 6.659 8.471 1.00 0.00 C0 ATOM 1852 OG SER D 12 36.222 7.719 8.623 1.00 0.00 O0 ATOM 0 H SER D 12 38.454 4.675 7.793 1.00 0.00 H new ATOM 0 HA SER D 12 35.731 5.311 7.581 1.00 0.00 H new ATOM 0 HB2 SER D 12 37.239 6.094 9.400 1.00 0.00 H new ATOM 0 HB3 SER D 12 38.148 7.061 8.254 1.00 0.00 H new ATOM 0 HG SER D 12 36.510 8.308 9.351 1.00 0.00 H new ATOM 1858 N PHE D 13 37.695 6.781 5.376 1.00 0.00 N0 ATOM 1859 CA PHE D 13 37.692 7.554 4.138 1.00 0.00 C0 ATOM 1860 C PHE D 13 36.818 6.889 3.077 1.00 0.00 C0 ATOM 1861 O PHE D 13 35.935 7.527 2.497 1.00 0.00 O0 ATOM 1862 CB PHE D 13 39.126 7.687 3.612 1.00 0.00 C0 ATOM 1863 CG PHE D 13 39.135 8.488 2.331 1.00 0.00 C0 ATOM 1864 CD1 PHE D 13 38.907 9.869 2.368 1.00 0.00 C0 ATOM 1865 CD2 PHE D 13 39.379 7.852 1.107 1.00 0.00 C0 ATOM 1866 CE1 PHE D 13 38.923 10.613 1.183 1.00 0.00 C0 ATOM 1867 CE2 PHE D 13 39.395 8.598 -0.080 1.00 0.00 C0 ATOM 1868 CZ PHE D 13 39.167 9.979 -0.041 1.00 0.00 C0 ATOM 0 H PHE D 13 38.614 6.445 5.665 1.00 0.00 H new ATOM 0 HA PHE D 13 37.282 8.541 4.351 1.00 0.00 H new ATOM 0 HB2 PHE D 13 39.752 8.174 4.359 1.00 0.00 H new ATOM 0 HB3 PHE D 13 39.550 6.699 3.435 1.00 0.00 H new ATOM 0 HD1 PHE D 13 38.719 10.360 3.311 1.00 0.00 H new ATOM 0 HD2 PHE D 13 39.555 6.787 1.078 1.00 0.00 H new ATOM 0 HE1 PHE D 13 38.747 11.678 1.213 1.00 0.00 H new ATOM 0 HE2 PHE D 13 39.583 8.108 -1.024 1.00 0.00 H new ATOM 0 HZ PHE D 13 39.179 10.555 -0.955 1.00 0.00 H new ATOM 1878 N ILE D 14 37.053 5.602 2.832 1.00 0.00 N0 ATOM 1879 CA ILE D 14 36.268 4.878 1.841 1.00 0.00 C0 ATOM 1880 C ILE D 14 34.819 4.762 2.297 1.00 0.00 C0 ATOM 1881 O ILE D 14 33.904 4.739 1.477 1.00 0.00 O0 ATOM 1882 CB ILE D 14 36.867 3.486 1.584 1.00 0.00 C0 ATOM 1883 CG1 ILE D 14 36.067 2.780 0.484 1.00 0.00 C0 ATOM 1884 CG2 ILE D 14 36.835 2.644 2.860 1.00 0.00 C0 ATOM 1885 CD1 ILE D 14 36.846 1.560 -0.011 1.00 0.00 C0 ATOM 0 H ILE D 14 37.770 5.047 3.299 1.00 0.00 H new ATOM 0 HA ILE D 14 36.294 5.436 0.905 1.00 0.00 H new ATOM 0 HB ILE D 14 37.904 3.604 1.268 1.00 0.00 H new ATOM 0 HG12 ILE D 14 35.094 2.472 0.868 1.00 0.00 H new ATOM 0 HG13 ILE D 14 35.881 3.466 -0.342 1.00 0.00 H new ATOM 0 HG21 ILE D 14 37.263 1.662 2.659 1.00 0.00 H new ATOM 0 HG22 ILE D 14 37.415 3.140 3.638 1.00 0.00 H new ATOM 0 HG23 ILE D 14 35.804 2.529 3.194 1.00 0.00 H new ATOM 0 HD11 ILE D 14 36.277 1.058 -0.793 1.00 0.00 H new ATOM 0 HD12 ILE D 14 37.808 1.880 -0.411 1.00 0.00 H new ATOM 0 HD13 ILE D 14 37.009 0.871 0.818 1.00 0.00 H new ATOM 1897 N LEU D 15 34.612 4.697 3.609 1.00 0.00 N0 ATOM 1898 CA LEU D 15 33.261 4.589 4.138 1.00 0.00 C0 ATOM 1899 C LEU D 15 32.462 5.838 3.779 1.00 0.00 C0 ATOM 1900 O LEU D 15 31.438 5.755 3.102 1.00 0.00 O0 ATOM 1901 CB LEU D 15 33.324 4.439 5.660 1.00 0.00 C0 ATOM 1902 CG LEU D 15 33.641 2.987 6.017 1.00 0.00 C0 ATOM 1903 CD1 LEU D 15 34.194 2.918 7.444 1.00 0.00 C0 ATOM 1904 CD2 LEU D 15 32.361 2.152 5.930 1.00 0.00 C0 ATOM 0 H LEU D 15 35.350 4.717 4.313 1.00 0.00 H new ATOM 0 HA LEU D 15 32.772 3.717 3.704 1.00 0.00 H new ATOM 0 HB2 LEU D 15 34.087 5.100 6.070 1.00 0.00 H new ATOM 0 HB3 LEU D 15 32.374 4.735 6.105 1.00 0.00 H new ATOM 0 HG LEU D 15 34.383 2.596 5.320 1.00 0.00 H new ATOM 0 HD11 LEU D 15 34.420 1.882 7.697 1.00 0.00 H new ATOM 0 HD12 LEU D 15 35.104 3.514 7.511 1.00 0.00 H new ATOM 0 HD13 LEU D 15 33.452 3.309 8.141 1.00 0.00 H new ATOM 0 HD21 LEU D 15 32.585 1.116 6.184 1.00 0.00 H new ATOM 0 HD22 LEU D 15 31.622 2.545 6.628 1.00 0.00 H new ATOM 0 HD23 LEU D 15 31.964 2.199 4.916 1.00 0.00 H new ATOM 1916 N SER D 16 32.923 6.990 4.249 1.00 0.00 N0 ATOM 1917 CA SER D 16 32.221 8.239 3.980 1.00 0.00 C0 ATOM 1918 C SER D 16 32.005 8.425 2.484 1.00 0.00 C0 ATOM 1919 O SER D 16 30.965 8.930 2.060 1.00 0.00 O0 ATOM 1920 CB SER D 16 33.025 9.413 4.528 1.00 0.00 C0 ATOM 1921 OG SER D 16 34.285 9.467 3.871 1.00 0.00 O0 ATOM 0 H SER D 16 33.769 7.086 4.811 1.00 0.00 H new ATOM 0 HA SER D 16 31.249 8.199 4.472 1.00 0.00 H new ATOM 0 HB2 SER D 16 32.481 10.345 4.373 1.00 0.00 H new ATOM 0 HB3 SER D 16 33.167 9.301 5.603 1.00 0.00 H new ATOM 0 HG SER D 16 34.549 8.564 3.595 1.00 0.00 H new ATOM 1927 N ALA D 17 32.978 8.009 1.683 1.00 0.00 N0 ATOM 1928 CA ALA D 17 32.850 8.138 0.237 1.00 0.00 C0 ATOM 1929 C ALA D 17 31.650 7.332 -0.259 1.00 0.00 C0 ATOM 1930 O ALA D 17 30.836 7.824 -1.039 1.00 0.00 O0 ATOM 1931 CB ALA D 17 34.124 7.638 -0.445 1.00 0.00 C0 ATOM 0 H ALA D 17 33.850 7.587 2.002 1.00 0.00 H new ATOM 0 HA ALA D 17 32.699 9.189 -0.010 1.00 0.00 H new ATOM 0 HB1 ALA D 17 34.021 7.737 -1.526 1.00 0.00 H new ATOM 0 HB2 ALA D 17 34.974 8.229 -0.105 1.00 0.00 H new ATOM 0 HB3 ALA D 17 34.286 6.590 -0.191 1.00 0.00 H new ATOM 1937 N LEU D 18 31.555 6.092 0.203 1.00 0.00 N0 ATOM 1938 CA LEU D 18 30.457 5.212 -0.191 1.00 0.00 C0 ATOM 1939 C LEU D 18 29.126 5.750 0.318 1.00 0.00 C0 ATOM 1940 O LEU D 18 28.100 5.634 -0.349 1.00 0.00 O0 ATOM 1941 CB LEU D 18 30.692 3.806 0.364 1.00 0.00 C0 ATOM 1942 CG LEU D 18 31.902 3.177 -0.330 1.00 0.00 C0 ATOM 1943 CD1 LEU D 18 32.272 1.869 0.373 1.00 0.00 C0 ATOM 1944 CD2 LEU D 18 31.565 2.889 -1.794 1.00 0.00 C0 ATOM 0 H LEU D 18 32.222 5.671 0.850 1.00 0.00 H new ATOM 0 HA LEU D 18 30.422 5.171 -1.280 1.00 0.00 H new ATOM 0 HB2 LEU D 18 30.860 3.852 1.440 1.00 0.00 H new ATOM 0 HB3 LEU D 18 29.808 3.189 0.206 1.00 0.00 H new ATOM 0 HG LEU D 18 32.743 3.868 -0.282 1.00 0.00 H new ATOM 0 HD11 LEU D 18 33.134 1.421 -0.122 1.00 0.00 H new ATOM 0 HD12 LEU D 18 32.517 2.073 1.415 1.00 0.00 H new ATOM 0 HD13 LEU D 18 31.429 1.180 0.327 1.00 0.00 H new ATOM 0 HD21 LEU D 18 32.429 2.441 -2.285 1.00 0.00 H new ATOM 0 HD22 LEU D 18 30.722 2.200 -1.845 1.00 0.00 H new ATOM 0 HD23 LEU D 18 31.304 3.820 -2.297 1.00 0.00 H new ATOM 1956 N HIS D 19 29.159 6.332 1.505 1.00 0.00 N0 ATOM 1957 CA HIS D 19 27.960 6.892 2.121 1.00 0.00 C0 ATOM 1958 C HIS D 19 27.443 8.095 1.339 1.00 0.00 C0 ATOM 1959 O HIS D 19 26.233 8.279 1.180 1.00 0.00 O0 ATOM 1960 CB HIS D 19 28.283 7.296 3.564 1.00 0.00 C0 ATOM 1961 CG HIS D 19 27.679 8.637 3.876 1.00 0.00 C0 ATOM 1962 ND1 HIS D 19 26.446 8.771 4.492 1.00 0.00 N0 ATOM 1963 CD2 HIS D 19 28.135 9.915 3.668 1.00 0.00 C0 ATOM 1964 CE1 HIS D 19 26.202 10.088 4.633 1.00 0.00 C0 ATOM 1965 NE2 HIS D 19 27.201 10.830 4.146 1.00 0.00 N0 ATOM 0 H HIS D 19 30.005 6.431 2.066 1.00 0.00 H new ATOM 0 HA HIS D 19 27.176 6.135 2.114 1.00 0.00 H new ATOM 0 HB2 HIS D 19 27.897 6.546 4.254 1.00 0.00 H new ATOM 0 HB3 HIS D 19 29.363 7.334 3.706 1.00 0.00 H new ATOM 0 HD1 HIS D 19 25.834 8.010 4.786 1.00 0.00 H new ATOM 0 HD2 HIS D 19 29.076 10.172 3.204 1.00 0.00 H new ATOM 0 HE1 HIS D 19 25.309 10.494 5.084 1.00 0.00 H new ATOM 1973 N PHE D 20 28.368 8.893 0.829 1.00 0.00 N0 ATOM 1974 CA PHE D 20 28.010 10.069 0.051 1.00 0.00 C0 ATOM 1975 C PHE D 20 27.534 9.674 -1.344 1.00 0.00 C0 ATOM 1976 O PHE D 20 26.627 10.292 -1.899 1.00 0.00 O0 ATOM 1977 CB PHE D 20 29.219 11.000 -0.066 1.00 0.00 C0 ATOM 1978 CG PHE D 20 28.900 12.332 0.572 1.00 0.00 C0 ATOM 1979 CD1 PHE D 20 29.146 12.536 1.934 1.00 0.00 C0 ATOM 1980 CD2 PHE D 20 28.357 13.363 -0.204 1.00 0.00 C0 ATOM 1981 CE1 PHE D 20 28.849 13.773 2.522 1.00 0.00 C0 ATOM 1982 CE2 PHE D 20 28.061 14.600 0.383 1.00 0.00 C0 ATOM 1983 CZ PHE D 20 28.307 14.805 1.747 1.00 0.00 C0 ATOM 0 H PHE D 20 29.372 8.748 0.940 1.00 0.00 H new ATOM 0 HA PHE D 20 27.197 10.584 0.563 1.00 0.00 H new ATOM 0 HB2 PHE D 20 30.085 10.551 0.421 1.00 0.00 H new ATOM 0 HB3 PHE D 20 29.481 11.142 -1.115 1.00 0.00 H new ATOM 0 HD1 PHE D 20 29.565 11.740 2.532 1.00 0.00 H new ATOM 0 HD2 PHE D 20 28.166 13.205 -1.255 1.00 0.00 H new ATOM 0 HE1 PHE D 20 29.038 13.930 3.574 1.00 0.00 H new ATOM 0 HE2 PHE D 20 27.643 15.396 -0.216 1.00 0.00 H new ATOM 0 HZ PHE D 20 28.079 15.758 2.200 1.00 0.00 H new ATOM 1993 N MET D 21 28.150 8.640 -1.902 1.00 0.00 N0 ATOM 1994 CA MET D 21 27.788 8.170 -3.233 1.00 0.00 C0 ATOM 1995 C MET D 21 26.436 7.464 -3.238 1.00 0.00 C0 ATOM 1996 O MET D 21 25.558 7.788 -4.041 1.00 0.00 O0 ATOM 1997 CB MET D 21 28.867 7.212 -3.732 1.00 0.00 C0 ATOM 1998 CG MET D 21 30.118 8.021 -4.079 1.00 0.00 C0 ATOM 1999 SD MET D 21 31.411 6.920 -4.700 1.00 0.00 S0 ATOM 2000 CE MET D 21 32.585 8.216 -5.163 1.00 0.00 C0 ATOM 0 H MET D 21 28.900 8.112 -1.456 1.00 0.00 H new ATOM 0 HA MET D 21 27.711 9.036 -3.891 1.00 0.00 H new ATOM 0 HB2 MET D 21 29.097 6.470 -2.967 1.00 0.00 H new ATOM 0 HB3 MET D 21 28.514 6.668 -4.608 1.00 0.00 H new ATOM 0 HG2 MET D 21 29.878 8.774 -4.830 1.00 0.00 H new ATOM 0 HG3 MET D 21 30.474 8.553 -3.197 1.00 0.00 H new ATOM 0 HE1 MET D 21 33.483 7.761 -5.581 1.00 0.00 H new ATOM 0 HE2 MET D 21 32.130 8.870 -5.907 1.00 0.00 H new ATOM 0 HE3 MET D 21 32.850 8.799 -4.281 1.00 0.00 H new ATOM 2010 N ALA D 22 26.292 6.489 -2.354 1.00 0.00 N0 ATOM 2011 CA ALA D 22 25.058 5.718 -2.272 1.00 0.00 C0 ATOM 2012 C ALA D 22 23.878 6.610 -1.921 1.00 0.00 C0 ATOM 2013 O ALA D 22 22.803 6.479 -2.507 1.00 0.00 O0 ATOM 2014 CB ALA D 22 25.196 4.609 -1.233 1.00 0.00 C0 ATOM 0 H ALA D 22 27.010 6.212 -1.685 1.00 0.00 H new ATOM 0 HA ALA D 22 24.874 5.273 -3.250 1.00 0.00 H new ATOM 0 HB1 ALA D 22 24.267 4.041 -1.182 1.00 0.00 H new ATOM 0 HB2 ALA D 22 26.013 3.945 -1.516 1.00 0.00 H new ATOM 0 HB3 ALA D 22 25.407 5.048 -0.258 1.00 0.00 H new ATOM 2020 N TRP D 23 24.076 7.524 -0.975 1.00 0.00 N0 ATOM 2021 CA TRP D 23 22.996 8.420 -0.591 1.00 0.00 C0 ATOM 2022 C TRP D 23 22.767 9.475 -1.670 1.00 0.00 C0 ATOM 2023 O TRP D 23 21.654 9.971 -1.829 1.00 0.00 O0 ATOM 2024 CB TRP D 23 23.276 9.082 0.758 1.00 0.00 C0 ATOM 2025 CG TRP D 23 23.061 8.086 1.863 1.00 0.00 C0 ATOM 2026 CD1 TRP D 23 23.967 7.776 2.815 1.00 0.00 C0 ATOM 2027 CD2 TRP D 23 21.883 7.263 2.134 1.00 0.00 C0 ATOM 2028 NE1 TRP D 23 23.420 6.831 3.664 1.00 0.00 N0 ATOM 2029 CE2 TRP D 23 22.140 6.478 3.283 1.00 0.00 C0 ATOM 2030 CE3 TRP D 23 20.630 7.124 1.505 1.00 0.00 C0 ATOM 2031 CZ2 TRP D 23 21.189 5.589 3.790 1.00 0.00 C0 ATOM 2032 CZ3 TRP D 23 19.673 6.229 2.009 1.00 0.00 C0 ATOM 2033 CH2 TRP D 23 19.951 5.462 3.150 1.00 0.00 C0 ATOM 0 H TRP D 23 24.953 7.661 -0.472 1.00 0.00 H new ATOM 0 HA TRP D 23 22.089 7.825 -0.488 1.00 0.00 H new ATOM 0 HB2 TRP D 23 24.300 9.456 0.786 1.00 0.00 H new ATOM 0 HB3 TRP D 23 22.619 9.941 0.896 1.00 0.00 H new ATOM 0 HD1 TRP D 23 24.958 8.197 2.900 1.00 0.00 H new ATOM 0 HE1 TRP D 23 23.903 6.442 4.474 1.00 0.00 H new ATOM 0 HE3 TRP D 23 20.404 7.711 0.627 1.00 0.00 H new ATOM 0 HZ2 TRP D 23 21.408 5.003 4.671 1.00 0.00 H new ATOM 0 HZ3 TRP D 23 18.717 6.130 1.515 1.00 0.00 H new ATOM 0 HH2 TRP D 23 19.211 4.775 3.534 1.00 0.00 H new ATOM 2044 N THR D 24 23.814 9.804 -2.425 1.00 0.00 N0 ATOM 2045 CA THR D 24 23.683 10.789 -3.495 1.00 0.00 C0 ATOM 2046 C THR D 24 22.743 10.277 -4.585 1.00 0.00 C0 ATOM 2047 O THR D 24 21.758 10.929 -4.926 1.00 0.00 O0 ATOM 2048 CB THR D 24 25.057 11.087 -4.105 1.00 0.00 C0 ATOM 2049 OG1 THR D 24 25.692 12.116 -3.358 1.00 0.00 O0 ATOM 2050 CG2 THR D 24 24.896 11.530 -5.561 1.00 0.00 C0 ATOM 0 H THR D 24 24.749 9.409 -2.318 1.00 0.00 H new ATOM 0 HA THR D 24 23.267 11.703 -3.070 1.00 0.00 H new ATOM 0 HB THR D 24 25.668 10.185 -4.074 1.00 0.00 H new ATOM 0 HG1 THR D 24 26.393 11.726 -2.795 1.00 0.00 H new ATOM 0 HG21 THR D 24 25.877 11.740 -5.988 1.00 0.00 H new ATOM 0 HG22 THR D 24 24.414 10.736 -6.132 1.00 0.00 H new ATOM 0 HG23 THR D 24 24.282 12.430 -5.602 1.00 0.00 H new ATOM 2058 N ILE D 25 23.058 9.105 -5.130 1.00 0.00 N0 ATOM 2059 CA ILE D 25 22.236 8.517 -6.185 1.00 0.00 C0 ATOM 2060 C ILE D 25 20.851 8.139 -5.659 1.00 0.00 C0 ATOM 2061 O ILE D 25 19.839 8.381 -6.317 1.00 0.00 O0 ATOM 2062 CB ILE D 25 22.925 7.278 -6.754 1.00 0.00 C0 ATOM 2063 CG1 ILE D 25 24.193 7.701 -7.503 1.00 0.00 C0 ATOM 2064 CG2 ILE D 25 21.979 6.568 -7.722 1.00 0.00 C0 ATOM 2065 CD1 ILE D 25 25.036 6.465 -7.831 1.00 0.00 C0 ATOM 0 H ILE D 25 23.869 8.547 -4.862 1.00 0.00 H new ATOM 0 HA ILE D 25 22.114 9.261 -6.972 1.00 0.00 H new ATOM 0 HB ILE D 25 23.188 6.602 -5.940 1.00 0.00 H new ATOM 0 HG12 ILE D 25 23.927 8.225 -8.421 1.00 0.00 H new ATOM 0 HG13 ILE D 25 24.771 8.396 -6.895 1.00 0.00 H new ATOM 0 HG21 ILE D 25 22.470 5.684 -8.128 1.00 0.00 H new ATOM 0 HG22 ILE D 25 21.074 6.269 -7.193 1.00 0.00 H new ATOM 0 HG23 ILE D 25 21.717 7.244 -8.536 1.00 0.00 H new ATOM 0 HD11 ILE D 25 25.937 6.770 -8.364 1.00 0.00 H new ATOM 0 HD12 ILE D 25 25.315 5.959 -6.907 1.00 0.00 H new ATOM 0 HD13 ILE D 25 24.457 5.785 -8.456 1.00 0.00 H new ATOM 2077 N GLY D 26 20.817 7.544 -4.471 1.00 0.00 N0 ATOM 2078 CA GLY D 26 19.553 7.135 -3.865 1.00 0.00 C0 ATOM 2079 C GLY D 26 18.650 8.341 -3.625 1.00 0.00 C0 ATOM 2080 O GLY D 26 17.432 8.262 -3.780 1.00 0.00 O0 ATOM 0 H GLY D 26 21.644 7.335 -3.911 1.00 0.00 H new ATOM 0 HA2 GLY D 26 19.048 6.421 -4.515 1.00 0.00 H new ATOM 0 HA3 GLY D 26 19.746 6.626 -2.921 1.00 0.00 H new ATOM 2084 N HIS D 27 19.266 9.456 -3.258 1.00 0.00 N0 ATOM 2085 CA HIS D 27 18.531 10.688 -3.005 1.00 0.00 C0 ATOM 2086 C HIS D 27 18.034 11.308 -4.308 1.00 0.00 C0 ATOM 2087 O HIS D 27 16.947 11.885 -4.359 1.00 0.00 O0 ATOM 2088 CB HIS D 27 19.424 11.691 -2.279 1.00 0.00 C0 ATOM 2089 CG HIS D 27 18.740 13.026 -2.257 1.00 0.00 C0 ATOM 2090 ND1 HIS D 27 17.676 13.301 -1.412 1.00 0.00 N0 ATOM 2091 CD2 HIS D 27 18.946 14.168 -2.986 1.00 0.00 C0 ATOM 2092 CE1 HIS D 27 17.284 14.565 -1.654 1.00 0.00 C0 ATOM 2093 NE2 HIS D 27 18.025 15.140 -2.605 1.00 0.00 N0 ATOM 0 H HIS D 27 20.275 9.533 -3.129 1.00 0.00 H new ATOM 0 HA HIS D 27 17.670 10.443 -2.383 1.00 0.00 H new ATOM 0 HB2 HIS D 27 19.622 11.352 -1.262 1.00 0.00 H new ATOM 0 HB3 HIS D 27 20.388 11.770 -2.782 1.00 0.00 H new ATOM 0 HD2 HIS D 27 19.707 14.295 -3.741 1.00 0.00 H new ATOM 0 HE1 HIS D 27 16.469 15.055 -1.142 1.00 0.00 H new ATOM 0 HE2 HIS D 27 17.935 16.087 -2.973 1.00 0.00 H new ATOM 2101 N LEU D 28 18.843 11.193 -5.355 1.00 0.00 N0 ATOM 2102 CA LEU D 28 18.489 11.752 -6.655 1.00 0.00 C0 ATOM 2103 C LEU D 28 17.225 11.093 -7.202 1.00 0.00 C0 ATOM 2104 O LEU D 28 17.100 9.869 -7.198 1.00 0.00 O0 ATOM 2105 CB LEU D 28 19.640 11.539 -7.641 1.00 0.00 C0 ATOM 2106 CG LEU D 28 19.421 12.403 -8.885 1.00 0.00 C0 ATOM 2107 CD1 LEU D 28 19.692 13.871 -8.545 1.00 0.00 C0 ATOM 2108 CD2 LEU D 28 20.376 11.950 -9.993 1.00 0.00 C0 ATOM 0 H LEU D 28 19.746 10.719 -5.330 1.00 0.00 H new ATOM 0 HA LEU D 28 18.302 12.819 -6.531 1.00 0.00 H new ATOM 0 HB2 LEU D 28 20.588 11.798 -7.169 1.00 0.00 H new ATOM 0 HB3 LEU D 28 19.700 10.488 -7.923 1.00 0.00 H new ATOM 0 HG LEU D 28 18.391 12.296 -9.225 1.00 0.00 H new ATOM 0 HD11 LEU D 28 19.536 14.485 -9.432 1.00 0.00 H new ATOM 0 HD12 LEU D 28 19.012 14.193 -7.756 1.00 0.00 H new ATOM 0 HD13 LEU D 28 20.721 13.982 -8.204 1.00 0.00 H new ATOM 0 HD21 LEU D 28 20.222 12.564 -10.880 1.00 0.00 H new ATOM 0 HD22 LEU D 28 21.406 12.057 -9.652 1.00 0.00 H new ATOM 0 HD23 LEU D 28 20.181 10.906 -10.237 1.00 0.00 H new