USER MOD reduce.3.24.130724 H: found=0, std=0, add=770, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 766 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 Set 1.1: C 19 HIS : no HD1:sc= 0 K(o=0,f=-0.59) USER MOD Set 1.2: D 19 HIS : no HD1:sc= 0 K(o=0,f=-0.74) USER MOD Single : A 6 GLN : amide:sc= 0 X(o=0,f=-0.49) USER MOD Single : A 9 SER OG : rot 180:sc= -0.157 USER MOD Single : A 11 CYS SG : rot 88:sc= 0.985 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot -150:sc= 0 USER MOD Single : A 19 HIS : no HD1:sc= 0 X(o=0,f=-0.32) USER MOD Single : A 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot -97:sc= 0.225 USER MOD Single : A 27 HIS : no HD1:sc= -0.293 K(o=-0.29,f=-1.2) USER MOD Single : B 6 GLN : amide:sc= -0.0118 X(o=-0.012,f=-0.39) USER MOD Single : B 9 SER OG : rot 180:sc= -0.0204 USER MOD Single : B 11 CYS SG : rot 88:sc= 0.823 USER MOD Single : B 12 SER OG : rot 180:sc= 0 USER MOD Single : B 16 SER OG : rot -140:sc= 0 USER MOD Single : B 19 HIS : no HD1:sc= 0 K(o=0,f=-1.4!) USER MOD Single : B 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 24 THR OG1 : rot -90:sc= 0.202 USER MOD Single : B 27 HIS : no HD1:sc= -0.308 K(o=-0.31,f=-1.1) USER MOD Single : C 6 GLN : amide:sc=-0.00897 X(o=-0.009,f=-0.46) USER MOD Single : C 9 SER OG : rot 180:sc=-0.00449 USER MOD Single : C 11 CYS SG : rot 87:sc= 0.933 USER MOD Single : C 12 SER OG : rot 180:sc= 0 USER MOD Single : C 16 SER OG : rot -140:sc= 0 USER MOD Single : C 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 24 THR OG1 : rot -94:sc= 0.217 USER MOD Single : C 27 HIS : no HD1:sc= -0.328 K(o=-0.33,f=-1.1) USER MOD Single : D 6 GLN : amide:sc= -0.0151 X(o=-0.015,f=-0.49) USER MOD Single : D 9 SER OG : rot 180:sc= -0.0356 USER MOD Single : D 11 CYS SG : rot 88:sc= 0.865 USER MOD Single : D 12 SER OG : rot 180:sc= 0 USER MOD Single : D 16 SER OG : rot -140:sc= 0 USER MOD Single : D 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : D 24 THR OG1 : rot -89:sc= 0.185 USER MOD Single : D 27 HIS : no HD1:sc= -0.342 K(o=-0.34,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 69 N PHE A 5 8.390 12.827 6.813 1.00 0.00 N0 ATOM 70 CA PHE A 5 9.702 12.230 7.057 1.00 0.00 C0 ATOM 71 C PHE A 5 10.551 12.234 5.786 1.00 0.00 C0 ATOM 72 O PHE A 5 11.757 11.999 5.835 1.00 0.00 O0 ATOM 73 CB PHE A 5 9.538 10.793 7.555 1.00 0.00 C0 ATOM 74 CG PHE A 5 9.849 9.827 6.433 1.00 0.00 C0 ATOM 75 CD1 PHE A 5 11.033 9.083 6.463 1.00 0.00 C0 ATOM 76 CD2 PHE A 5 8.953 9.674 5.368 1.00 0.00 C0 ATOM 77 CE1 PHE A 5 11.324 8.184 5.428 1.00 0.00 C0 ATOM 78 CE2 PHE A 5 9.244 8.777 4.331 1.00 0.00 C0 ATOM 79 CZ PHE A 5 10.430 8.030 4.362 1.00 0.00 C0 ATOM 0 HA PHE A 5 10.209 12.826 7.816 1.00 0.00 H new ATOM 0 HB2 PHE A 5 10.204 10.612 8.399 1.00 0.00 H new ATOM 0 HB3 PHE A 5 8.520 10.635 7.912 1.00 0.00 H new ATOM 0 HD1 PHE A 5 11.724 9.201 7.285 1.00 0.00 H new ATOM 0 HD2 PHE A 5 8.038 10.247 5.346 1.00 0.00 H new ATOM 0 HE1 PHE A 5 12.238 7.610 5.453 1.00 0.00 H new ATOM 0 HE2 PHE A 5 8.554 8.661 3.508 1.00 0.00 H new ATOM 0 HZ PHE A 5 10.654 7.337 3.565 1.00 0.00 H new ATOM 89 N GLN A 6 9.920 12.502 4.646 1.00 0.00 N0 ATOM 90 CA GLN A 6 10.639 12.529 3.379 1.00 0.00 C0 ATOM 91 C GLN A 6 11.739 13.584 3.405 1.00 0.00 C0 ATOM 92 O GLN A 6 12.820 13.377 2.853 1.00 0.00 O0 ATOM 93 CB GLN A 6 9.670 12.844 2.238 1.00 0.00 C0 ATOM 94 CG GLN A 6 10.406 12.766 0.898 1.00 0.00 C0 ATOM 95 CD GLN A 6 9.516 13.307 -0.213 1.00 0.00 C0 ATOM 96 OE1 GLN A 6 8.931 14.380 -0.072 1.00 0.00 O0 ATOM 97 NE2 GLN A 6 9.382 12.628 -1.318 1.00 0.00 N0 ATOM 0 H GLN A 6 8.922 12.702 4.575 1.00 0.00 H new ATOM 0 HA GLN A 6 11.090 11.549 3.222 1.00 0.00 H new ATOM 0 HB2 GLN A 6 8.839 12.139 2.249 1.00 0.00 H new ATOM 0 HB3 GLN A 6 9.245 13.839 2.373 1.00 0.00 H new ATOM 0 HG2 GLN A 6 11.331 13.340 0.947 1.00 0.00 H new ATOM 0 HG3 GLN A 6 10.683 11.734 0.684 1.00 0.00 H new ATOM 0 HE21 GLN A 6 9.868 11.739 -1.432 1.00 0.00 H new ATOM 0 HE22 GLN A 6 8.791 12.986 -2.068 1.00 0.00 H new ATOM 106 N ILE A 7 11.453 14.719 4.037 1.00 0.00 N0 ATOM 107 CA ILE A 7 12.426 15.802 4.110 1.00 0.00 C0 ATOM 108 C ILE A 7 13.713 15.333 4.782 1.00 0.00 C0 ATOM 109 O ILE A 7 14.810 15.713 4.370 1.00 0.00 O0 ATOM 110 CB ILE A 7 11.842 16.992 4.885 1.00 0.00 C0 ATOM 111 CG1 ILE A 7 11.506 16.574 6.323 1.00 0.00 C0 ATOM 112 CG2 ILE A 7 10.562 17.470 4.196 1.00 0.00 C0 ATOM 113 CD1 ILE A 7 12.626 16.998 7.283 1.00 0.00 C0 ATOM 0 H ILE A 7 10.565 14.911 4.501 1.00 0.00 H new ATOM 0 HA ILE A 7 12.658 16.115 3.092 1.00 0.00 H new ATOM 0 HB ILE A 7 12.579 17.795 4.905 1.00 0.00 H new ATOM 0 HG12 ILE A 7 10.565 17.030 6.630 1.00 0.00 H new ATOM 0 HG13 ILE A 7 11.368 15.494 6.371 1.00 0.00 H new ATOM 0 HG21 ILE A 7 10.147 18.315 4.746 1.00 0.00 H new ATOM 0 HG22 ILE A 7 10.791 17.778 3.176 1.00 0.00 H new ATOM 0 HG23 ILE A 7 9.835 16.658 4.175 1.00 0.00 H new ATOM 0 HD11 ILE A 7 12.370 16.693 8.298 1.00 0.00 H new ATOM 0 HD12 ILE A 7 13.560 16.521 6.986 1.00 0.00 H new ATOM 0 HD13 ILE A 7 12.744 18.081 7.248 1.00 0.00 H new ATOM 125 N LEU A 8 13.577 14.506 5.814 1.00 0.00 N0 ATOM 126 CA LEU A 8 14.732 13.995 6.533 1.00 0.00 C0 ATOM 127 C LEU A 8 15.486 12.972 5.690 1.00 0.00 C0 ATOM 128 O LEU A 8 16.712 12.893 5.737 1.00 0.00 O0 ATOM 129 CB LEU A 8 14.280 13.355 7.851 1.00 0.00 C0 ATOM 130 CG LEU A 8 15.498 12.880 8.650 1.00 0.00 C0 ATOM 131 CD1 LEU A 8 16.362 14.082 9.043 1.00 0.00 C0 ATOM 132 CD2 LEU A 8 15.024 12.162 9.916 1.00 0.00 C0 ATOM 0 H LEU A 8 12.679 14.178 6.168 1.00 0.00 H new ATOM 0 HA LEU A 8 15.404 14.827 6.745 1.00 0.00 H new ATOM 0 HB2 LEU A 8 13.709 14.075 8.437 1.00 0.00 H new ATOM 0 HB3 LEU A 8 13.618 12.513 7.647 1.00 0.00 H new ATOM 0 HG LEU A 8 16.087 12.198 8.037 1.00 0.00 H new ATOM 0 HD11 LEU A 8 17.227 13.738 9.611 1.00 0.00 H new ATOM 0 HD12 LEU A 8 16.700 14.597 8.144 1.00 0.00 H new ATOM 0 HD13 LEU A 8 15.775 14.767 9.655 1.00 0.00 H new ATOM 0 HD21 LEU A 8 15.888 11.823 10.487 1.00 0.00 H new ATOM 0 HD22 LEU A 8 14.434 12.848 10.524 1.00 0.00 H new ATOM 0 HD23 LEU A 8 14.412 11.304 9.640 1.00 0.00 H new ATOM 144 N SER A 9 14.736 12.200 4.914 1.00 0.00 N0 ATOM 145 CA SER A 9 15.333 11.184 4.050 1.00 0.00 C0 ATOM 146 C SER A 9 16.159 11.832 2.943 1.00 0.00 C0 ATOM 147 O SER A 9 17.305 11.452 2.705 1.00 0.00 O0 ATOM 148 CB SER A 9 14.240 10.318 3.428 1.00 0.00 C0 ATOM 149 OG SER A 9 14.840 9.352 2.577 1.00 0.00 O0 ATOM 0 H SER A 9 13.719 12.255 4.863 1.00 0.00 H new ATOM 0 HA SER A 9 15.989 10.562 4.659 1.00 0.00 H new ATOM 0 HB2 SER A 9 13.662 9.824 4.209 1.00 0.00 H new ATOM 0 HB3 SER A 9 13.546 10.938 2.862 1.00 0.00 H new ATOM 0 HG SER A 9 14.143 8.792 2.176 1.00 0.00 H new ATOM 155 N ILE A 10 15.563 12.803 2.258 1.00 0.00 N0 ATOM 156 CA ILE A 10 16.247 13.485 1.167 1.00 0.00 C0 ATOM 157 C ILE A 10 17.479 14.215 1.687 1.00 0.00 C0 ATOM 158 O ILE A 10 18.543 14.169 1.068 1.00 0.00 O0 ATOM 159 CB ILE A 10 15.303 14.486 0.493 1.00 0.00 C0 ATOM 160 CG1 ILE A 10 14.160 13.727 -0.186 1.00 0.00 C0 ATOM 161 CG2 ILE A 10 16.075 15.291 -0.561 1.00 0.00 C0 ATOM 162 CD1 ILE A 10 13.048 14.710 -0.555 1.00 0.00 C0 ATOM 0 H ILE A 10 14.615 13.133 2.438 1.00 0.00 H new ATOM 0 HA ILE A 10 16.558 12.738 0.436 1.00 0.00 H new ATOM 0 HB ILE A 10 14.898 15.165 1.243 1.00 0.00 H new ATOM 0 HG12 ILE A 10 14.525 13.221 -1.080 1.00 0.00 H new ATOM 0 HG13 ILE A 10 13.773 12.957 0.481 1.00 0.00 H new ATOM 0 HG21 ILE A 10 15.402 16.003 -1.040 1.00 0.00 H new ATOM 0 HG22 ILE A 10 16.892 15.830 -0.081 1.00 0.00 H new ATOM 0 HG23 ILE A 10 16.480 14.613 -1.312 1.00 0.00 H new ATOM 0 HD11 ILE A 10 12.233 14.172 -1.039 1.00 0.00 H new ATOM 0 HD12 ILE A 10 12.677 15.196 0.348 1.00 0.00 H new ATOM 0 HD13 ILE A 10 13.441 15.464 -1.237 1.00 0.00 H new ATOM 174 N CYS A 11 17.332 14.888 2.826 1.00 0.00 N0 ATOM 175 CA CYS A 11 18.448 15.619 3.408 1.00 0.00 C0 ATOM 176 C CYS A 11 19.597 14.672 3.731 1.00 0.00 C0 ATOM 177 O CYS A 11 20.745 14.938 3.378 1.00 0.00 O0 ATOM 178 CB CYS A 11 17.996 16.325 4.686 1.00 0.00 C0 ATOM 179 SG CYS A 11 16.897 17.698 4.260 1.00 0.00 S0 ATOM 0 H CYS A 11 16.462 14.941 3.356 1.00 0.00 H new ATOM 0 HA CYS A 11 18.792 16.358 2.684 1.00 0.00 H new ATOM 0 HB2 CYS A 11 17.480 15.622 5.340 1.00 0.00 H new ATOM 0 HB3 CYS A 11 18.862 16.695 5.235 1.00 0.00 H new ATOM 0 HG CYS A 11 15.671 17.269 4.197 1.00 0.00 H new ATOM 185 N SER A 12 19.289 13.575 4.416 1.00 0.00 N0 ATOM 186 CA SER A 12 20.318 12.612 4.787 1.00 0.00 C0 ATOM 187 C SER A 12 21.000 12.065 3.544 1.00 0.00 C0 ATOM 188 O SER A 12 22.215 11.917 3.512 1.00 0.00 O0 ATOM 189 CB SER A 12 19.702 11.464 5.582 1.00 0.00 C0 ATOM 190 OG SER A 12 20.717 10.527 5.914 1.00 0.00 O0 ATOM 0 H SER A 12 18.347 13.333 4.722 1.00 0.00 H new ATOM 0 HA SER A 12 21.059 13.118 5.406 1.00 0.00 H new ATOM 0 HB2 SER A 12 19.232 11.845 6.489 1.00 0.00 H new ATOM 0 HB3 SER A 12 18.920 10.979 4.997 1.00 0.00 H new ATOM 0 HG SER A 12 20.326 9.789 6.426 1.00 0.00 H new ATOM 196 N PHE A 13 20.211 11.752 2.527 1.00 0.00 N0 ATOM 197 CA PHE A 13 20.761 11.213 1.292 1.00 0.00 C0 ATOM 198 C PHE A 13 21.770 12.184 0.685 1.00 0.00 C0 ATOM 199 O PHE A 13 22.869 11.787 0.296 1.00 0.00 O0 ATOM 200 CB PHE A 13 19.631 10.959 0.294 1.00 0.00 C0 ATOM 201 CG PHE A 13 20.209 10.452 -1.005 1.00 0.00 C0 ATOM 202 CD1 PHE A 13 20.789 9.180 -1.060 1.00 0.00 C0 ATOM 203 CD2 PHE A 13 20.158 11.251 -2.154 1.00 0.00 C0 ATOM 204 CE1 PHE A 13 21.321 8.705 -2.266 1.00 0.00 C0 ATOM 205 CE2 PHE A 13 20.690 10.777 -3.358 1.00 0.00 C0 ATOM 206 CZ PHE A 13 21.271 9.503 -3.415 1.00 0.00 C0 ATOM 0 H PHE A 13 19.197 11.861 2.531 1.00 0.00 H new ATOM 0 HA PHE A 13 21.270 10.276 1.517 1.00 0.00 H new ATOM 0 HB2 PHE A 13 18.930 10.231 0.701 1.00 0.00 H new ATOM 0 HB3 PHE A 13 19.071 11.878 0.121 1.00 0.00 H new ATOM 0 HD1 PHE A 13 20.827 8.565 -0.173 1.00 0.00 H new ATOM 0 HD2 PHE A 13 19.708 12.232 -2.111 1.00 0.00 H new ATOM 0 HE1 PHE A 13 21.770 7.723 -2.309 1.00 0.00 H new ATOM 0 HE2 PHE A 13 20.653 11.393 -4.244 1.00 0.00 H new ATOM 0 HZ PHE A 13 21.680 9.137 -4.345 1.00 0.00 H new ATOM 216 N ILE A 14 21.387 13.453 0.601 1.00 0.00 N0 ATOM 217 CA ILE A 14 22.264 14.472 0.032 1.00 0.00 C0 ATOM 218 C ILE A 14 23.545 14.605 0.853 1.00 0.00 C0 ATOM 219 O ILE A 14 24.644 14.666 0.299 1.00 0.00 O0 ATOM 220 CB ILE A 14 21.537 15.820 -0.006 1.00 0.00 C0 ATOM 221 CG1 ILE A 14 20.371 15.745 -1.004 1.00 0.00 C0 ATOM 222 CG2 ILE A 14 22.515 16.922 -0.435 1.00 0.00 C0 ATOM 223 CD1 ILE A 14 20.885 15.891 -2.442 1.00 0.00 C0 ATOM 0 H ILE A 14 20.481 13.800 0.917 1.00 0.00 H new ATOM 0 HA ILE A 14 22.530 14.170 -0.981 1.00 0.00 H new ATOM 0 HB ILE A 14 21.150 16.051 0.986 1.00 0.00 H new ATOM 0 HG12 ILE A 14 19.850 14.794 -0.893 1.00 0.00 H new ATOM 0 HG13 ILE A 14 19.648 16.532 -0.788 1.00 0.00 H new ATOM 0 HG21 ILE A 14 21.995 17.880 -0.461 1.00 0.00 H new ATOM 0 HG22 ILE A 14 23.338 16.975 0.277 1.00 0.00 H new ATOM 0 HG23 ILE A 14 22.907 16.695 -1.426 1.00 0.00 H new ATOM 0 HD11 ILE A 14 20.046 15.836 -3.136 1.00 0.00 H new ATOM 0 HD12 ILE A 14 21.385 16.853 -2.554 1.00 0.00 H new ATOM 0 HD13 ILE A 14 21.590 15.088 -2.660 1.00 0.00 H new ATOM 235 N LEU A 15 23.393 14.658 2.170 1.00 0.00 N0 ATOM 236 CA LEU A 15 24.535 14.795 3.068 1.00 0.00 C0 ATOM 237 C LEU A 15 25.423 13.551 3.022 1.00 0.00 C0 ATOM 238 O LEU A 15 26.628 13.628 3.241 1.00 0.00 O0 ATOM 239 CB LEU A 15 24.030 15.008 4.500 1.00 0.00 C0 ATOM 240 CG LEU A 15 23.326 16.365 4.606 1.00 0.00 C0 ATOM 241 CD1 LEU A 15 22.533 16.428 5.913 1.00 0.00 C0 ATOM 242 CD2 LEU A 15 24.365 17.488 4.600 1.00 0.00 C0 ATOM 0 H LEU A 15 22.490 14.608 2.641 1.00 0.00 H new ATOM 0 HA LEU A 15 25.127 15.652 2.746 1.00 0.00 H new ATOM 0 HB2 LEU A 15 23.342 14.209 4.775 1.00 0.00 H new ATOM 0 HB3 LEU A 15 24.865 14.965 5.200 1.00 0.00 H new ATOM 0 HG LEU A 15 22.652 16.485 3.758 1.00 0.00 H new ATOM 0 HD11 LEU A 15 22.032 17.393 5.989 1.00 0.00 H new ATOM 0 HD12 LEU A 15 21.789 15.631 5.926 1.00 0.00 H new ATOM 0 HD13 LEU A 15 23.212 16.304 6.757 1.00 0.00 H new ATOM 0 HD21 LEU A 15 23.860 18.451 4.676 1.00 0.00 H new ATOM 0 HD22 LEU A 15 25.039 17.364 5.447 1.00 0.00 H new ATOM 0 HD23 LEU A 15 24.937 17.450 3.673 1.00 0.00 H new ATOM 254 N SER A 16 24.814 12.408 2.725 1.00 0.00 N0 ATOM 255 CA SER A 16 25.548 11.149 2.646 1.00 0.00 C0 ATOM 256 C SER A 16 26.440 11.108 1.407 1.00 0.00 C0 ATOM 257 O SER A 16 27.617 10.734 1.482 1.00 0.00 O0 ATOM 258 CB SER A 16 24.562 9.981 2.606 1.00 0.00 C0 ATOM 259 OG SER A 16 25.283 8.755 2.581 1.00 0.00 O0 ATOM 0 H SER A 16 23.815 12.327 2.535 1.00 0.00 H new ATOM 0 HA SER A 16 26.183 11.068 3.528 1.00 0.00 H new ATOM 0 HB2 SER A 16 23.908 10.013 3.477 1.00 0.00 H new ATOM 0 HB3 SER A 16 23.924 10.059 1.725 1.00 0.00 H new ATOM 0 HG SER A 16 24.763 8.079 2.098 1.00 0.00 H new ATOM 265 N ALA A 17 25.874 11.509 0.271 1.00 0.00 N0 ATOM 266 CA ALA A 17 26.619 11.526 -0.981 1.00 0.00 C0 ATOM 267 C ALA A 17 27.740 12.555 -0.925 1.00 0.00 C0 ATOM 268 O ALA A 17 28.845 12.314 -1.416 1.00 0.00 O0 ATOM 269 CB ALA A 17 25.678 11.846 -2.148 1.00 0.00 C0 ATOM 0 H ALA A 17 24.907 11.825 0.194 1.00 0.00 H new ATOM 0 HA ALA A 17 27.058 10.540 -1.133 1.00 0.00 H new ATOM 0 HB1 ALA A 17 26.244 11.856 -3.079 1.00 0.00 H new ATOM 0 HB2 ALA A 17 24.898 11.086 -2.206 1.00 0.00 H new ATOM 0 HB3 ALA A 17 25.221 12.823 -1.990 1.00 0.00 H new ATOM 275 N LEU A 18 27.466 13.698 -0.303 1.00 0.00 N0 ATOM 276 CA LEU A 18 28.468 14.746 -0.180 1.00 0.00 C0 ATOM 277 C LEU A 18 29.546 14.366 0.832 1.00 0.00 C0 ATOM 278 O LEU A 18 30.704 14.777 0.698 1.00 0.00 O0 ATOM 279 CB LEU A 18 27.794 16.053 0.250 1.00 0.00 C0 ATOM 280 CG LEU A 18 27.082 16.681 -0.950 1.00 0.00 C0 ATOM 281 CD1 LEU A 18 26.049 17.696 -0.459 1.00 0.00 C0 ATOM 282 CD2 LEU A 18 28.108 17.399 -1.828 1.00 0.00 C0 ATOM 0 H LEU A 18 26.565 13.919 0.120 1.00 0.00 H new ATOM 0 HA LEU A 18 28.945 14.877 -1.151 1.00 0.00 H new ATOM 0 HB2 LEU A 18 27.079 15.860 1.050 1.00 0.00 H new ATOM 0 HB3 LEU A 18 28.537 16.744 0.647 1.00 0.00 H new ATOM 0 HG LEU A 18 26.584 15.900 -1.524 1.00 0.00 H new ATOM 0 HD11 LEU A 18 25.543 18.143 -1.315 1.00 0.00 H new ATOM 0 HD12 LEU A 18 25.318 17.194 0.174 1.00 0.00 H new ATOM 0 HD13 LEU A 18 26.550 18.476 0.114 1.00 0.00 H new ATOM 0 HD21 LEU A 18 27.604 17.848 -2.684 1.00 0.00 H new ATOM 0 HD22 LEU A 18 28.601 18.179 -1.248 1.00 0.00 H new ATOM 0 HD23 LEU A 18 28.851 16.683 -2.179 1.00 0.00 H new ATOM 294 N HIS A 19 29.171 13.569 1.833 1.00 0.00 N0 ATOM 295 CA HIS A 19 30.127 13.139 2.845 1.00 0.00 C0 ATOM 296 C HIS A 19 31.171 12.217 2.234 1.00 0.00 C0 ATOM 297 O HIS A 19 32.374 12.408 2.431 1.00 0.00 O0 ATOM 298 CB HIS A 19 29.394 12.409 3.971 1.00 0.00 C0 ATOM 299 CG HIS A 19 30.336 12.171 5.115 1.00 0.00 C0 ATOM 300 ND1 HIS A 19 30.515 13.099 6.128 1.00 0.00 N0 ATOM 301 CD2 HIS A 19 31.163 11.119 5.421 1.00 0.00 C0 ATOM 302 CE1 HIS A 19 31.414 12.593 6.988 1.00 0.00 C0 ATOM 303 NE2 HIS A 19 31.844 11.388 6.605 1.00 0.00 N0 ATOM 0 H HIS A 19 28.224 13.214 1.962 1.00 0.00 H new ATOM 0 HA HIS A 19 30.628 14.019 3.247 1.00 0.00 H new ATOM 0 HB2 HIS A 19 28.541 13.000 4.306 1.00 0.00 H new ATOM 0 HB3 HIS A 19 29.001 11.460 3.607 1.00 0.00 H new ATOM 0 HD2 HIS A 19 31.269 10.220 4.833 1.00 0.00 H new ATOM 0 HE1 HIS A 19 31.749 13.099 7.881 1.00 0.00 H new ATOM 0 HE2 HIS A 19 32.524 10.793 7.078 1.00 0.00 H new ATOM 311 N PHE A 20 30.709 11.221 1.485 1.00 0.00 N0 ATOM 312 CA PHE A 20 31.628 10.284 0.850 1.00 0.00 C0 ATOM 313 C PHE A 20 32.404 10.972 -0.266 1.00 0.00 C0 ATOM 314 O PHE A 20 33.534 10.601 -0.561 1.00 0.00 O0 ATOM 315 CB PHE A 20 30.872 9.074 0.295 1.00 0.00 C0 ATOM 316 CG PHE A 20 31.185 7.853 1.137 1.00 0.00 C0 ATOM 317 CD1 PHE A 20 30.738 7.776 2.464 1.00 0.00 C0 ATOM 318 CD2 PHE A 20 31.927 6.800 0.588 1.00 0.00 C0 ATOM 319 CE1 PHE A 20 31.034 6.643 3.237 1.00 0.00 C0 ATOM 320 CE2 PHE A 20 32.222 5.669 1.362 1.00 0.00 C0 ATOM 321 CZ PHE A 20 31.776 5.590 2.687 1.00 0.00 C0 ATOM 0 H PHE A 20 29.721 11.043 1.305 1.00 0.00 H new ATOM 0 HA PHE A 20 32.332 9.936 1.606 1.00 0.00 H new ATOM 0 HB2 PHE A 20 29.799 9.268 0.301 1.00 0.00 H new ATOM 0 HB3 PHE A 20 31.158 8.897 -0.742 1.00 0.00 H new ATOM 0 HD1 PHE A 20 30.167 8.587 2.890 1.00 0.00 H new ATOM 0 HD2 PHE A 20 32.273 6.859 -0.433 1.00 0.00 H new ATOM 0 HE1 PHE A 20 30.689 6.583 4.259 1.00 0.00 H new ATOM 0 HE2 PHE A 20 32.794 4.858 0.936 1.00 0.00 H new ATOM 0 HZ PHE A 20 32.004 4.719 3.284 1.00 0.00 H new ATOM 331 N MET A 21 31.792 11.978 -0.880 1.00 0.00 N0 ATOM 332 CA MET A 21 32.451 12.707 -1.957 1.00 0.00 C0 ATOM 333 C MET A 21 33.717 13.395 -1.454 1.00 0.00 C0 ATOM 334 O MET A 21 34.807 13.214 -2.014 1.00 0.00 O0 ATOM 335 CB MET A 21 31.491 13.753 -2.521 1.00 0.00 C0 ATOM 336 CG MET A 21 30.738 13.154 -3.711 1.00 0.00 C0 ATOM 337 SD MET A 21 29.694 14.425 -4.473 1.00 0.00 S0 ATOM 338 CE MET A 21 28.566 13.331 -5.383 1.00 0.00 C0 ATOM 0 H MET A 21 30.852 12.304 -0.654 1.00 0.00 H new ATOM 0 HA MET A 21 32.731 11.998 -2.737 1.00 0.00 H new ATOM 0 HB2 MET A 21 30.787 14.070 -1.752 1.00 0.00 H new ATOM 0 HB3 MET A 21 32.043 14.640 -2.833 1.00 0.00 H new ATOM 0 HG2 MET A 21 31.445 12.764 -4.443 1.00 0.00 H new ATOM 0 HG3 MET A 21 30.125 12.315 -3.381 1.00 0.00 H new ATOM 0 HE1 MET A 21 27.836 13.931 -5.926 1.00 0.00 H new ATOM 0 HE2 MET A 21 29.136 12.727 -6.089 1.00 0.00 H new ATOM 0 HE3 MET A 21 28.048 12.677 -4.681 1.00 0.00 H new ATOM 348 N ALA A 22 33.575 14.178 -0.394 1.00 0.00 N0 ATOM 349 CA ALA A 22 34.722 14.878 0.164 1.00 0.00 C0 ATOM 350 C ALA A 22 35.734 13.887 0.723 1.00 0.00 C0 ATOM 351 O ALA A 22 36.940 14.065 0.566 1.00 0.00 O0 ATOM 352 CB ALA A 22 34.270 15.832 1.265 1.00 0.00 C0 ATOM 0 H ALA A 22 32.692 14.343 0.090 1.00 0.00 H new ATOM 0 HA ALA A 22 35.197 15.450 -0.633 1.00 0.00 H new ATOM 0 HB1 ALA A 22 35.136 16.350 1.676 1.00 0.00 H new ATOM 0 HB2 ALA A 22 33.573 16.561 0.851 1.00 0.00 H new ATOM 0 HB3 ALA A 22 33.777 15.267 2.056 1.00 0.00 H new ATOM 358 N TRP A 23 35.235 12.846 1.381 1.00 0.00 N0 ATOM 359 CA TRP A 23 36.111 11.838 1.965 1.00 0.00 C0 ATOM 360 C TRP A 23 36.962 11.169 0.891 1.00 0.00 C0 ATOM 361 O TRP A 23 38.178 11.056 1.035 1.00 0.00 O0 ATOM 362 CB TRP A 23 35.277 10.786 2.691 1.00 0.00 C0 ATOM 363 CG TRP A 23 35.745 10.670 4.103 1.00 0.00 C0 ATOM 364 CD1 TRP A 23 35.173 11.270 5.171 1.00 0.00 C0 ATOM 365 CD2 TRP A 23 36.878 9.908 4.619 1.00 0.00 C0 ATOM 366 NE1 TRP A 23 35.880 10.926 6.310 1.00 0.00 N0 ATOM 367 CE2 TRP A 23 36.941 10.088 6.021 1.00 0.00 C0 ATOM 368 CE3 TRP A 23 37.847 9.088 4.012 1.00 0.00 C0 ATOM 369 CZ2 TRP A 23 37.928 9.475 6.793 1.00 0.00 C0 ATOM 370 CZ3 TRP A 23 38.843 8.469 4.787 1.00 0.00 C0 ATOM 371 CH2 TRP A 23 38.883 8.663 6.174 1.00 0.00 C0 ATOM 0 H TRP A 23 34.239 12.679 1.522 1.00 0.00 H new ATOM 0 HA TRP A 23 36.776 12.330 2.675 1.00 0.00 H new ATOM 0 HB2 TRP A 23 34.223 11.062 2.667 1.00 0.00 H new ATOM 0 HB3 TRP A 23 35.366 9.824 2.187 1.00 0.00 H new ATOM 0 HD1 TRP A 23 34.306 11.913 5.140 1.00 0.00 H new ATOM 0 HE1 TRP A 23 35.647 11.251 7.248 1.00 0.00 H new ATOM 0 HE3 TRP A 23 37.825 8.933 2.943 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 37.954 9.627 7.862 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 39.581 7.841 4.311 1.00 0.00 H new ATOM 0 HH2 TRP A 23 39.651 8.186 6.765 1.00 0.00 H new ATOM 382 N THR A 24 36.315 10.720 -0.180 1.00 0.00 N0 ATOM 383 CA THR A 24 37.027 10.058 -1.266 1.00 0.00 C0 ATOM 384 C THR A 24 38.159 10.944 -1.766 1.00 0.00 C0 ATOM 385 O THR A 24 39.293 10.487 -1.920 1.00 0.00 O0 ATOM 386 CB THR A 24 36.065 9.756 -2.419 1.00 0.00 C0 ATOM 387 OG1 THR A 24 35.135 10.819 -2.547 1.00 0.00 O0 ATOM 388 CG2 THR A 24 35.312 8.452 -2.141 1.00 0.00 C0 ATOM 0 H THR A 24 35.308 10.802 -0.318 1.00 0.00 H new ATOM 0 HA THR A 24 37.443 9.123 -0.891 1.00 0.00 H new ATOM 0 HB THR A 24 36.634 9.652 -3.343 1.00 0.00 H new ATOM 0 HG1 THR A 24 34.306 10.586 -2.079 1.00 0.00 H new ATOM 0 HG21 THR A 24 34.630 8.243 -2.965 1.00 0.00 H new ATOM 0 HG22 THR A 24 36.025 7.633 -2.044 1.00 0.00 H new ATOM 0 HG23 THR A 24 34.744 8.550 -1.216 1.00 0.00 H new ATOM 396 N ILE A 25 37.854 12.215 -2.007 1.00 0.00 N0 ATOM 397 CA ILE A 25 38.875 13.144 -2.476 1.00 0.00 C0 ATOM 398 C ILE A 25 39.968 13.312 -1.427 1.00 0.00 C0 ATOM 399 O ILE A 25 41.146 13.398 -1.754 1.00 0.00 O0 ATOM 400 CB ILE A 25 38.251 14.499 -2.800 1.00 0.00 C0 ATOM 401 CG1 ILE A 25 37.378 14.359 -4.047 1.00 0.00 C0 ATOM 402 CG2 ILE A 25 39.355 15.529 -3.059 1.00 0.00 C0 ATOM 403 CD1 ILE A 25 36.549 15.630 -4.238 1.00 0.00 C0 ATOM 0 H ILE A 25 36.925 12.620 -1.888 1.00 0.00 H new ATOM 0 HA ILE A 25 39.320 12.734 -3.382 1.00 0.00 H new ATOM 0 HB ILE A 25 37.643 14.833 -1.959 1.00 0.00 H new ATOM 0 HG12 ILE A 25 38.003 14.185 -4.923 1.00 0.00 H new ATOM 0 HG13 ILE A 25 36.721 13.495 -3.948 1.00 0.00 H new ATOM 0 HG21 ILE A 25 38.905 16.495 -3.290 1.00 0.00 H new ATOM 0 HG22 ILE A 25 39.980 15.623 -2.171 1.00 0.00 H new ATOM 0 HG23 ILE A 25 39.966 15.203 -3.901 1.00 0.00 H new ATOM 0 HD11 ILE A 25 35.927 15.529 -5.127 1.00 0.00 H new ATOM 0 HD12 ILE A 25 35.913 15.784 -3.366 1.00 0.00 H new ATOM 0 HD13 ILE A 25 37.215 16.485 -4.357 1.00 0.00 H new ATOM 415 N GLY A 26 39.559 13.369 -0.165 1.00 0.00 N0 ATOM 416 CA GLY A 26 40.511 13.540 0.930 1.00 0.00 C0 ATOM 417 C GLY A 26 41.527 12.400 0.959 1.00 0.00 C0 ATOM 418 O GLY A 26 42.733 12.636 1.033 1.00 0.00 O0 ATOM 0 H GLY A 26 38.584 13.300 0.126 1.00 0.00 H new ATOM 0 HA2 GLY A 26 41.031 14.492 0.819 1.00 0.00 H new ATOM 0 HA3 GLY A 26 39.976 13.578 1.879 1.00 0.00 H new ATOM 422 N HIS A 27 41.032 11.168 0.900 1.00 0.00 N0 ATOM 423 CA HIS A 27 41.902 9.996 0.916 1.00 0.00 C0 ATOM 424 C HIS A 27 42.749 9.932 -0.350 1.00 0.00 C0 ATOM 425 O HIS A 27 43.927 9.575 -0.306 1.00 0.00 O0 ATOM 426 CB HIS A 27 41.066 8.722 1.033 1.00 0.00 C0 ATOM 427 CG HIS A 27 41.978 7.540 1.215 1.00 0.00 C0 ATOM 428 ND1 HIS A 27 42.616 6.931 0.147 1.00 0.00 N0 ATOM 429 CD2 HIS A 27 42.369 6.844 2.332 1.00 0.00 C0 ATOM 430 CE1 HIS A 27 43.351 5.916 0.637 1.00 0.00 C0 ATOM 431 NE2 HIS A 27 43.236 5.819 1.964 1.00 0.00 N0 ATOM 0 H HIS A 27 40.036 10.955 0.841 1.00 0.00 H new ATOM 0 HA HIS A 27 42.564 10.078 1.778 1.00 0.00 H new ATOM 0 HB2 HIS A 27 40.381 8.800 1.877 1.00 0.00 H new ATOM 0 HB3 HIS A 27 40.457 8.591 0.139 1.00 0.00 H new ATOM 0 HD2 HIS A 27 42.052 7.059 3.342 1.00 0.00 H new ATOM 0 HE1 HIS A 27 43.959 5.260 0.032 1.00 0.00 H new ATOM 0 HE2 HIS A 27 43.687 5.139 2.577 1.00 0.00 H new ATOM 439 N LEU A 28 42.143 10.283 -1.478 1.00 0.00 N0 ATOM 440 CA LEU A 28 42.849 10.268 -2.752 1.00 0.00 C0 ATOM 441 C LEU A 28 43.948 11.326 -2.786 1.00 0.00 C0 ATOM 442 O LEU A 28 45.016 11.098 -3.353 1.00 0.00 O0 ATOM 443 CB LEU A 28 41.863 10.505 -3.898 1.00 0.00 C0 ATOM 444 CG LEU A 28 40.996 9.258 -4.089 1.00 0.00 C0 ATOM 445 CD1 LEU A 28 39.810 9.593 -4.996 1.00 0.00 C0 ATOM 446 CD2 LEU A 28 41.836 8.150 -4.738 1.00 0.00 C0 ATOM 0 H LEU A 28 41.169 10.580 -1.536 1.00 0.00 H new ATOM 0 HA LEU A 28 43.315 9.290 -2.870 1.00 0.00 H new ATOM 0 HB2 LEU A 28 41.235 11.368 -3.679 1.00 0.00 H new ATOM 0 HB3 LEU A 28 42.404 10.730 -4.817 1.00 0.00 H new ATOM 0 HG LEU A 28 40.628 8.919 -3.121 1.00 0.00 H new ATOM 0 HD11 LEU A 28 39.193 8.705 -5.131 1.00 0.00 H new ATOM 0 HD12 LEU A 28 39.214 10.382 -4.538 1.00 0.00 H new ATOM 0 HD13 LEU A 28 40.177 9.931 -5.965 1.00 0.00 H new ATOM 0 HD21 LEU A 28 41.221 7.260 -4.875 1.00 0.00 H new ATOM 0 HD22 LEU A 28 42.202 8.491 -5.706 1.00 0.00 H new ATOM 0 HD23 LEU A 28 42.682 7.910 -4.094 1.00 0.00 H new ATOM 643 N GLN B 6 11.232 2.153 5.721 1.00 0.00 N0 ATOM 644 CA GLN B 6 12.132 1.012 5.821 1.00 0.00 C0 ATOM 645 C GLN B 6 13.309 1.169 4.862 1.00 0.00 C0 ATOM 646 O GLN B 6 14.437 0.799 5.188 1.00 0.00 O0 ATOM 647 CB GLN B 6 11.378 -0.275 5.483 1.00 0.00 C0 ATOM 648 CG GLN B 6 12.295 -1.483 5.693 1.00 0.00 C0 ATOM 649 CD GLN B 6 11.632 -2.737 5.138 1.00 0.00 C0 ATOM 650 OE1 GLN B 6 11.130 -2.729 4.014 1.00 0.00 O0 ATOM 651 NE2 GLN B 6 11.602 -3.823 5.860 1.00 0.00 N0 ATOM 0 HA GLN B 6 12.510 0.962 6.842 1.00 0.00 H new ATOM 0 HB2 GLN B 6 10.493 -0.365 6.113 1.00 0.00 H new ATOM 0 HB3 GLN B 6 11.032 -0.244 4.450 1.00 0.00 H new ATOM 0 HG2 GLN B 6 13.251 -1.316 5.197 1.00 0.00 H new ATOM 0 HG3 GLN B 6 12.505 -1.611 6.755 1.00 0.00 H new ATOM 0 HE21 GLN B 6 12.018 -3.828 6.791 1.00 0.00 H new ATOM 0 HE22 GLN B 6 11.162 -4.667 5.493 1.00 0.00 H new ATOM 660 N ILE B 7 13.034 1.703 3.675 1.00 0.00 N0 ATOM 661 CA ILE B 7 14.079 1.882 2.675 1.00 0.00 C0 ATOM 662 C ILE B 7 15.206 2.761 3.214 1.00 0.00 C0 ATOM 663 O ILE B 7 16.382 2.505 2.951 1.00 0.00 O0 ATOM 664 CB ILE B 7 13.495 2.514 1.402 1.00 0.00 C0 ATOM 665 CG1 ILE B 7 12.914 3.900 1.714 1.00 0.00 C0 ATOM 666 CG2 ILE B 7 12.376 1.625 0.859 1.00 0.00 C0 ATOM 667 CD1 ILE B 7 13.913 5.000 1.334 1.00 0.00 C0 ATOM 0 H ILE B 7 12.107 2.016 3.385 1.00 0.00 H new ATOM 0 HA ILE B 7 14.487 0.900 2.436 1.00 0.00 H new ATOM 0 HB ILE B 7 14.291 2.612 0.664 1.00 0.00 H new ATOM 0 HG12 ILE B 7 11.982 4.042 1.166 1.00 0.00 H new ATOM 0 HG13 ILE B 7 12.674 3.970 2.775 1.00 0.00 H new ATOM 0 HG21 ILE B 7 11.961 2.073 -0.044 1.00 0.00 H new ATOM 0 HG22 ILE B 7 12.776 0.639 0.624 1.00 0.00 H new ATOM 0 HG23 ILE B 7 11.591 1.529 1.609 1.00 0.00 H new ATOM 0 HD11 ILE B 7 13.484 5.976 1.562 1.00 0.00 H new ATOM 0 HD12 ILE B 7 14.834 4.867 1.901 1.00 0.00 H new ATOM 0 HD13 ILE B 7 14.132 4.940 0.268 1.00 0.00 H new ATOM 679 N LEU B 8 14.841 3.790 3.970 1.00 0.00 N0 ATOM 680 CA LEU B 8 15.826 4.699 4.538 1.00 0.00 C0 ATOM 681 C LEU B 8 16.601 4.020 5.664 1.00 0.00 C0 ATOM 682 O LEU B 8 17.795 4.259 5.843 1.00 0.00 O0 ATOM 683 CB LEU B 8 15.127 5.955 5.067 1.00 0.00 C0 ATOM 684 CG LEU B 8 16.164 6.947 5.600 1.00 0.00 C0 ATOM 685 CD1 LEU B 8 17.067 7.421 4.456 1.00 0.00 C0 ATOM 686 CD2 LEU B 8 15.446 8.153 6.210 1.00 0.00 C0 ATOM 0 H LEU B 8 13.873 4.014 4.203 1.00 0.00 H new ATOM 0 HA LEU B 8 16.531 4.980 3.756 1.00 0.00 H new ATOM 0 HB2 LEU B 8 14.544 6.419 4.272 1.00 0.00 H new ATOM 0 HB3 LEU B 8 14.428 5.686 5.859 1.00 0.00 H new ATOM 0 HG LEU B 8 16.772 6.457 6.360 1.00 0.00 H new ATOM 0 HD11 LEU B 8 17.803 8.127 4.842 1.00 0.00 H new ATOM 0 HD12 LEU B 8 17.580 6.565 4.019 1.00 0.00 H new ATOM 0 HD13 LEU B 8 16.461 7.909 3.693 1.00 0.00 H new ATOM 0 HD21 LEU B 8 16.183 8.861 6.590 1.00 0.00 H new ATOM 0 HD22 LEU B 8 14.837 8.638 5.447 1.00 0.00 H new ATOM 0 HD23 LEU B 8 14.807 7.820 7.028 1.00 0.00 H new ATOM 698 N SER B 9 15.909 3.168 6.409 1.00 0.00 N0 ATOM 699 CA SER B 9 16.533 2.446 7.513 1.00 0.00 C0 ATOM 700 C SER B 9 17.571 1.454 6.995 1.00 0.00 C0 ATOM 701 O SER B 9 18.701 1.413 7.480 1.00 0.00 O0 ATOM 702 CB SER B 9 15.473 1.700 8.318 1.00 0.00 C0 ATOM 703 OG SER B 9 16.104 0.986 9.372 1.00 0.00 O0 ATOM 0 H SER B 9 14.920 2.960 6.271 1.00 0.00 H new ATOM 0 HA SER B 9 17.032 3.173 8.154 1.00 0.00 H new ATOM 0 HB2 SER B 9 14.745 2.403 8.723 1.00 0.00 H new ATOM 0 HB3 SER B 9 14.926 1.012 7.673 1.00 0.00 H new ATOM 0 HG SER B 9 15.427 0.506 9.893 1.00 0.00 H new ATOM 709 N ILE B 10 17.174 0.647 6.016 1.00 0.00 N0 ATOM 710 CA ILE B 10 18.072 -0.352 5.450 1.00 0.00 C0 ATOM 711 C ILE B 10 19.275 0.323 4.802 1.00 0.00 C0 ATOM 712 O ILE B 10 20.411 -0.123 4.968 1.00 0.00 O0 ATOM 713 CB ILE B 10 17.333 -1.199 4.411 1.00 0.00 C0 ATOM 714 CG1 ILE B 10 16.240 -2.015 5.106 1.00 0.00 C0 ATOM 715 CG2 ILE B 10 18.323 -2.155 3.730 1.00 0.00 C0 ATOM 716 CD1 ILE B 10 15.287 -2.587 4.055 1.00 0.00 C0 ATOM 0 H ILE B 10 16.243 0.665 5.601 1.00 0.00 H new ATOM 0 HA ILE B 10 18.420 -0.999 6.255 1.00 0.00 H new ATOM 0 HB ILE B 10 16.884 -0.545 3.663 1.00 0.00 H new ATOM 0 HG12 ILE B 10 16.687 -2.823 5.686 1.00 0.00 H new ATOM 0 HG13 ILE B 10 15.691 -1.386 5.807 1.00 0.00 H new ATOM 0 HG21 ILE B 10 17.796 -2.758 2.990 1.00 0.00 H new ATOM 0 HG22 ILE B 10 19.106 -1.578 3.237 1.00 0.00 H new ATOM 0 HG23 ILE B 10 18.771 -2.809 4.478 1.00 0.00 H new ATOM 0 HD11 ILE B 10 14.508 -3.168 4.548 1.00 0.00 H new ATOM 0 HD12 ILE B 10 14.831 -1.771 3.495 1.00 0.00 H new ATOM 0 HD13 ILE B 10 15.842 -3.230 3.372 1.00 0.00 H new ATOM 728 N CYS B 11 19.019 1.399 4.059 1.00 0.00 N0 ATOM 729 CA CYS B 11 20.098 2.118 3.394 1.00 0.00 C0 ATOM 730 C CYS B 11 21.096 2.652 4.413 1.00 0.00 C0 ATOM 731 O CYS B 11 22.304 2.471 4.262 1.00 0.00 O0 ATOM 732 CB CYS B 11 19.525 3.281 2.587 1.00 0.00 C0 ATOM 733 SG CYS B 11 18.635 2.637 1.150 1.00 0.00 S0 ATOM 0 H CYS B 11 18.088 1.785 3.905 1.00 0.00 H new ATOM 0 HA CYS B 11 20.613 1.426 2.727 1.00 0.00 H new ATOM 0 HB2 CYS B 11 18.853 3.873 3.209 1.00 0.00 H new ATOM 0 HB3 CYS B 11 20.328 3.944 2.264 1.00 0.00 H new ATOM 0 HG CYS B 11 17.404 2.382 1.480 1.00 0.00 H new ATOM 739 N SER B 12 20.592 3.321 5.447 1.00 0.00 N0 ATOM 740 CA SER B 12 21.462 3.881 6.470 1.00 0.00 C0 ATOM 741 C SER B 12 22.270 2.780 7.137 1.00 0.00 C0 ATOM 742 O SER B 12 23.459 2.941 7.386 1.00 0.00 O0 ATOM 743 CB SER B 12 20.633 4.615 7.522 1.00 0.00 C0 ATOM 744 OG SER B 12 21.501 5.139 8.520 1.00 0.00 O0 ATOM 0 H SER B 12 19.596 3.486 5.596 1.00 0.00 H new ATOM 0 HA SER B 12 22.144 4.585 5.994 1.00 0.00 H new ATOM 0 HB2 SER B 12 20.065 5.421 7.057 1.00 0.00 H new ATOM 0 HB3 SER B 12 19.910 3.935 7.972 1.00 0.00 H new ATOM 0 HG SER B 12 20.973 5.612 9.197 1.00 0.00 H new ATOM 750 N PHE B 13 21.617 1.668 7.437 1.00 0.00 N0 ATOM 751 CA PHE B 13 22.294 0.553 8.084 1.00 0.00 C0 ATOM 752 C PHE B 13 23.466 0.071 7.234 1.00 0.00 C0 ATOM 753 O PHE B 13 24.570 -0.128 7.740 1.00 0.00 O0 ATOM 754 CB PHE B 13 21.306 -0.596 8.294 1.00 0.00 C0 ATOM 755 CG PHE B 13 22.022 -1.769 8.913 1.00 0.00 C0 ATOM 756 CD1 PHE B 13 22.485 -1.688 10.231 1.00 0.00 C0 ATOM 757 CD2 PHE B 13 22.215 -2.942 8.174 1.00 0.00 C0 ATOM 758 CE1 PHE B 13 23.145 -2.778 10.810 1.00 0.00 C0 ATOM 759 CE2 PHE B 13 22.876 -4.033 8.753 1.00 0.00 C0 ATOM 760 CZ PHE B 13 23.340 -3.951 10.072 1.00 0.00 C0 ATOM 0 H PHE B 13 20.627 1.513 7.245 1.00 0.00 H new ATOM 0 HA PHE B 13 22.676 0.889 9.048 1.00 0.00 H new ATOM 0 HB2 PHE B 13 20.489 -0.274 8.939 1.00 0.00 H new ATOM 0 HB3 PHE B 13 20.864 -0.888 7.341 1.00 0.00 H new ATOM 0 HD1 PHE B 13 22.333 -0.784 10.802 1.00 0.00 H new ATOM 0 HD2 PHE B 13 21.854 -3.006 7.158 1.00 0.00 H new ATOM 0 HE1 PHE B 13 23.504 -2.714 11.827 1.00 0.00 H new ATOM 0 HE2 PHE B 13 23.028 -4.937 8.182 1.00 0.00 H new ATOM 0 HZ PHE B 13 23.848 -4.793 10.519 1.00 0.00 H new ATOM 770 N ILE B 14 23.216 -0.122 5.943 1.00 0.00 N0 ATOM 771 CA ILE B 14 24.257 -0.589 5.033 1.00 0.00 C0 ATOM 772 C ILE B 14 25.409 0.411 4.964 1.00 0.00 C0 ATOM 773 O ILE B 14 26.579 0.032 5.025 1.00 0.00 O0 ATOM 774 CB ILE B 14 23.667 -0.790 3.632 1.00 0.00 C0 ATOM 775 CG1 ILE B 14 22.660 -1.950 3.662 1.00 0.00 C0 ATOM 776 CG2 ILE B 14 24.794 -1.106 2.640 1.00 0.00 C0 ATOM 777 CD1 ILE B 14 23.392 -3.298 3.632 1.00 0.00 C0 ATOM 0 H ILE B 14 22.308 0.036 5.505 1.00 0.00 H new ATOM 0 HA ILE B 14 24.643 -1.536 5.409 1.00 0.00 H new ATOM 0 HB ILE B 14 23.158 0.121 3.317 1.00 0.00 H new ATOM 0 HG12 ILE B 14 22.046 -1.883 4.560 1.00 0.00 H new ATOM 0 HG13 ILE B 14 21.986 -1.876 2.809 1.00 0.00 H new ATOM 0 HG21 ILE B 14 24.373 -1.249 1.645 1.00 0.00 H new ATOM 0 HG22 ILE B 14 25.503 -0.278 2.619 1.00 0.00 H new ATOM 0 HG23 ILE B 14 25.308 -2.016 2.951 1.00 0.00 H new ATOM 0 HD11 ILE B 14 22.663 -4.108 3.654 1.00 0.00 H new ATOM 0 HD12 ILE B 14 23.986 -3.369 2.721 1.00 0.00 H new ATOM 0 HD13 ILE B 14 24.047 -3.376 4.500 1.00 0.00 H new ATOM 789 N LEU B 15 25.065 1.687 4.828 1.00 0.00 N0 ATOM 790 CA LEU B 15 26.069 2.745 4.739 1.00 0.00 C0 ATOM 791 C LEU B 15 26.836 2.886 6.055 1.00 0.00 C0 ATOM 792 O LEU B 15 27.998 3.285 6.068 1.00 0.00 O0 ATOM 793 CB LEU B 15 25.378 4.073 4.410 1.00 0.00 C0 ATOM 794 CG LEU B 15 24.791 4.017 2.997 1.00 0.00 C0 ATOM 795 CD1 LEU B 15 23.822 5.185 2.800 1.00 0.00 C0 ATOM 796 CD2 LEU B 15 25.916 4.126 1.965 1.00 0.00 C0 ATOM 0 H LEU B 15 24.101 2.015 4.777 1.00 0.00 H new ATOM 0 HA LEU B 15 26.777 2.484 3.953 1.00 0.00 H new ATOM 0 HB2 LEU B 15 24.588 4.271 5.134 1.00 0.00 H new ATOM 0 HB3 LEU B 15 26.092 4.893 4.485 1.00 0.00 H new ATOM 0 HG LEU B 15 24.264 3.072 2.867 1.00 0.00 H new ATOM 0 HD11 LEU B 15 23.404 5.145 1.794 1.00 0.00 H new ATOM 0 HD12 LEU B 15 23.016 5.116 3.531 1.00 0.00 H new ATOM 0 HD13 LEU B 15 24.355 6.126 2.935 1.00 0.00 H new ATOM 0 HD21 LEU B 15 25.494 4.086 0.961 1.00 0.00 H new ATOM 0 HD22 LEU B 15 26.443 5.071 2.099 1.00 0.00 H new ATOM 0 HD23 LEU B 15 26.614 3.299 2.099 1.00 0.00 H new ATOM 808 N SER B 16 26.178 2.541 7.156 1.00 0.00 N0 ATOM 809 CA SER B 16 26.798 2.624 8.476 1.00 0.00 C0 ATOM 810 C SER B 16 27.856 1.539 8.655 1.00 0.00 C0 ATOM 811 O SER B 16 28.970 1.807 9.123 1.00 0.00 O0 ATOM 812 CB SER B 16 25.728 2.477 9.557 1.00 0.00 C0 ATOM 813 OG SER B 16 26.331 2.613 10.839 1.00 0.00 O0 ATOM 0 H SER B 16 25.216 2.201 7.162 1.00 0.00 H new ATOM 0 HA SER B 16 27.283 3.596 8.565 1.00 0.00 H new ATOM 0 HB2 SER B 16 24.955 3.234 9.424 1.00 0.00 H new ATOM 0 HB3 SER B 16 25.241 1.505 9.473 1.00 0.00 H new ATOM 0 HG SER B 16 25.935 1.964 11.457 1.00 0.00 H new ATOM 819 N ALA B 17 27.505 0.314 8.268 1.00 0.00 N0 ATOM 820 CA ALA B 17 28.426 -0.809 8.378 1.00 0.00 C0 ATOM 821 C ALA B 17 29.617 -0.619 7.444 1.00 0.00 C0 ATOM 822 O ALA B 17 30.756 -0.925 7.803 1.00 0.00 O0 ATOM 823 CB ALA B 17 27.702 -2.117 8.042 1.00 0.00 C0 ATOM 0 H ALA B 17 26.593 0.077 7.877 1.00 0.00 H new ATOM 0 HA ALA B 17 28.792 -0.856 9.403 1.00 0.00 H new ATOM 0 HB1 ALA B 17 28.399 -2.951 8.127 1.00 0.00 H new ATOM 0 HB2 ALA B 17 26.874 -2.263 8.736 1.00 0.00 H new ATOM 0 HB3 ALA B 17 27.317 -2.068 7.023 1.00 0.00 H new ATOM 829 N LEU B 18 29.356 -0.094 6.253 1.00 0.00 N0 ATOM 830 CA LEU B 18 30.418 0.142 5.287 1.00 0.00 C0 ATOM 831 C LEU B 18 31.295 1.320 5.705 1.00 0.00 C0 ATOM 832 O LEU B 18 32.492 1.350 5.398 1.00 0.00 O0 ATOM 833 CB LEU B 18 29.808 0.412 3.908 1.00 0.00 C0 ATOM 834 CG LEU B 18 29.344 -0.908 3.286 1.00 0.00 C0 ATOM 835 CD1 LEU B 18 28.345 -0.623 2.164 1.00 0.00 C0 ATOM 836 CD2 LEU B 18 30.551 -1.645 2.704 1.00 0.00 C0 ATOM 0 H LEU B 18 28.424 0.174 5.936 1.00 0.00 H new ATOM 0 HA LEU B 18 31.046 -0.748 5.244 1.00 0.00 H new ATOM 0 HB2 LEU B 18 28.966 1.099 3.999 1.00 0.00 H new ATOM 0 HB3 LEU B 18 30.543 0.892 3.262 1.00 0.00 H new ATOM 0 HG LEU B 18 28.869 -1.521 4.052 1.00 0.00 H new ATOM 0 HD11 LEU B 18 28.016 -1.564 1.722 1.00 0.00 H new ATOM 0 HD12 LEU B 18 27.484 -0.092 2.570 1.00 0.00 H new ATOM 0 HD13 LEU B 18 28.822 -0.010 1.399 1.00 0.00 H new ATOM 0 HD21 LEU B 18 30.224 -2.585 2.260 1.00 0.00 H new ATOM 0 HD22 LEU B 18 31.021 -1.027 1.939 1.00 0.00 H new ATOM 0 HD23 LEU B 18 31.270 -1.849 3.497 1.00 0.00 H new ATOM 848 N HIS B 19 30.705 2.281 6.415 1.00 0.00 N0 ATOM 849 CA HIS B 19 31.457 3.444 6.870 1.00 0.00 C0 ATOM 850 C HIS B 19 32.494 3.038 7.907 1.00 0.00 C0 ATOM 851 O HIS B 19 33.666 3.409 7.805 1.00 0.00 O0 ATOM 852 CB HIS B 19 30.502 4.473 7.476 1.00 0.00 C0 ATOM 853 CG HIS B 19 31.240 5.756 7.730 1.00 0.00 C0 ATOM 854 ND1 HIS B 19 31.347 6.746 6.769 1.00 0.00 N0 ATOM 855 CD2 HIS B 19 31.913 6.226 8.830 1.00 0.00 C0 ATOM 856 CE1 HIS B 19 32.060 7.753 7.301 1.00 0.00 C0 ATOM 857 NE2 HIS B 19 32.431 7.488 8.556 1.00 0.00 N0 ATOM 0 H HIS B 19 29.721 2.276 6.684 1.00 0.00 H new ATOM 0 HA HIS B 19 31.970 3.882 6.014 1.00 0.00 H new ATOM 0 HB2 HIS B 19 29.666 4.650 6.800 1.00 0.00 H new ATOM 0 HB3 HIS B 19 30.084 4.092 8.407 1.00 0.00 H new ATOM 0 HD2 HIS B 19 32.024 5.697 9.765 1.00 0.00 H new ATOM 0 HE1 HIS B 19 32.303 8.666 6.777 1.00 0.00 H new ATOM 0 HE2 HIS B 19 32.977 8.083 9.180 1.00 0.00 H new ATOM 865 N PHE B 20 32.062 2.264 8.898 1.00 0.00 N0 ATOM 866 CA PHE B 20 32.977 1.815 9.937 1.00 0.00 C0 ATOM 867 C PHE B 20 33.969 0.806 9.375 1.00 0.00 C0 ATOM 868 O PHE B 20 35.092 0.704 9.852 1.00 0.00 O0 ATOM 869 CB PHE B 20 32.206 1.196 11.104 1.00 0.00 C0 ATOM 870 CG PHE B 20 32.276 2.121 12.300 1.00 0.00 C0 ATOM 871 CD1 PHE B 20 31.630 3.363 12.271 1.00 0.00 C0 ATOM 872 CD2 PHE B 20 32.993 1.733 13.438 1.00 0.00 C0 ATOM 873 CE1 PHE B 20 31.700 4.215 13.381 1.00 0.00 C0 ATOM 874 CE2 PHE B 20 33.063 2.584 14.547 1.00 0.00 C0 ATOM 875 CZ PHE B 20 32.417 3.823 14.517 1.00 0.00 C0 ATOM 0 H PHE B 20 31.100 1.940 9.002 1.00 0.00 H new ATOM 0 HA PHE B 20 33.527 2.682 10.303 1.00 0.00 H new ATOM 0 HB2 PHE B 20 31.167 1.029 10.820 1.00 0.00 H new ATOM 0 HB3 PHE B 20 32.627 0.223 11.358 1.00 0.00 H new ATOM 0 HD1 PHE B 20 31.078 3.664 11.393 1.00 0.00 H new ATOM 0 HD2 PHE B 20 33.493 0.776 13.460 1.00 0.00 H new ATOM 0 HE1 PHE B 20 31.201 5.173 13.360 1.00 0.00 H new ATOM 0 HE2 PHE B 20 33.616 2.284 15.425 1.00 0.00 H new ATOM 0 HZ PHE B 20 32.471 4.480 15.373 1.00 0.00 H new ATOM 885 N MET B 21 33.549 0.066 8.357 1.00 0.00 N0 ATOM 886 CA MET B 21 34.422 -0.924 7.741 1.00 0.00 C0 ATOM 887 C MET B 21 35.657 -0.261 7.137 1.00 0.00 C0 ATOM 888 O MET B 21 36.797 -0.639 7.438 1.00 0.00 O0 ATOM 889 CB MET B 21 33.654 -1.665 6.649 1.00 0.00 C0 ATOM 890 CG MET B 21 33.036 -2.934 7.244 1.00 0.00 C0 ATOM 891 SD MET B 21 32.238 -3.898 5.933 1.00 0.00 S0 ATOM 892 CE MET B 21 31.162 -4.926 6.974 1.00 0.00 C0 ATOM 0 H MET B 21 32.619 0.131 7.944 1.00 0.00 H new ATOM 0 HA MET B 21 34.749 -1.625 8.509 1.00 0.00 H new ATOM 0 HB2 MET B 21 32.874 -1.024 6.237 1.00 0.00 H new ATOM 0 HB3 MET B 21 34.323 -1.922 5.827 1.00 0.00 H new ATOM 0 HG2 MET B 21 33.807 -3.532 7.730 1.00 0.00 H new ATOM 0 HG3 MET B 21 32.307 -2.670 8.010 1.00 0.00 H new ATOM 0 HE1 MET B 21 30.580 -5.598 6.343 1.00 0.00 H new ATOM 0 HE2 MET B 21 31.772 -5.512 7.661 1.00 0.00 H new ATOM 0 HE3 MET B 21 30.487 -4.286 7.543 1.00 0.00 H new ATOM 902 N ALA B 22 35.429 0.732 6.290 1.00 0.00 N0 ATOM 903 CA ALA B 22 36.537 1.433 5.659 1.00 0.00 C0 ATOM 904 C ALA B 22 37.362 2.179 6.700 1.00 0.00 C0 ATOM 905 O ALA B 22 38.589 2.202 6.631 1.00 0.00 O0 ATOM 906 CB ALA B 22 36.011 2.413 4.615 1.00 0.00 C0 ATOM 0 H ALA B 22 34.502 1.067 6.027 1.00 0.00 H new ATOM 0 HA ALA B 22 37.176 0.698 5.170 1.00 0.00 H new ATOM 0 HB1 ALA B 22 36.848 2.932 4.149 1.00 0.00 H new ATOM 0 HB2 ALA B 22 35.453 1.868 3.854 1.00 0.00 H new ATOM 0 HB3 ALA B 22 35.356 3.139 5.095 1.00 0.00 H new ATOM 912 N TRP B 23 36.679 2.792 7.662 1.00 0.00 N0 ATOM 913 CA TRP B 23 37.364 3.542 8.708 1.00 0.00 C0 ATOM 914 C TRP B 23 38.301 2.638 9.502 1.00 0.00 C0 ATOM 915 O TRP B 23 39.467 2.971 9.710 1.00 0.00 O0 ATOM 916 CB TRP B 23 36.339 4.170 9.649 1.00 0.00 C0 ATOM 917 CG TRP B 23 36.580 5.642 9.731 1.00 0.00 C0 ATOM 918 CD1 TRP B 23 35.911 6.584 9.031 1.00 0.00 C0 ATOM 919 CD2 TRP B 23 37.549 6.354 10.555 1.00 0.00 C0 ATOM 920 NE1 TRP B 23 36.406 7.831 9.373 1.00 0.00 N0 ATOM 921 CE2 TRP B 23 37.419 7.741 10.309 1.00 0.00 C0 ATOM 922 CE3 TRP B 23 38.520 5.933 11.484 1.00 0.00 C0 ATOM 923 CZ2 TRP B 23 38.222 8.677 10.962 1.00 0.00 C0 ATOM 924 CZ3 TRP B 23 39.330 6.872 12.143 1.00 0.00 C0 ATOM 925 CH2 TRP B 23 39.180 8.242 11.882 1.00 0.00 C0 ATOM 0 H TRP B 23 35.662 2.785 7.739 1.00 0.00 H new ATOM 0 HA TRP B 23 37.957 4.325 8.236 1.00 0.00 H new ATOM 0 HB2 TRP B 23 35.329 3.975 9.288 1.00 0.00 H new ATOM 0 HB3 TRP B 23 36.415 3.722 10.640 1.00 0.00 H new ATOM 0 HD1 TRP B 23 35.120 6.395 8.321 1.00 0.00 H new ATOM 0 HE1 TRP B 23 36.065 8.709 8.982 1.00 0.00 H new ATOM 0 HE3 TRP B 23 38.643 4.880 11.691 1.00 0.00 H new ATOM 0 HZ2 TRP B 23 38.104 9.731 10.758 1.00 0.00 H new ATOM 0 HZ3 TRP B 23 40.071 6.538 12.854 1.00 0.00 H new ATOM 0 HH2 TRP B 23 39.805 8.961 12.392 1.00 0.00 H new ATOM 936 N THR B 24 37.785 1.498 9.950 1.00 0.00 N0 ATOM 937 CA THR B 24 38.588 0.560 10.724 1.00 0.00 C0 ATOM 938 C THR B 24 39.856 0.206 9.964 1.00 0.00 C0 ATOM 939 O THR B 24 40.955 0.247 10.520 1.00 0.00 O0 ATOM 940 CB THR B 24 37.784 -0.713 11.004 1.00 0.00 C0 ATOM 941 OG1 THR B 24 36.983 -1.024 9.875 1.00 0.00 O0 ATOM 942 CG2 THR B 24 36.883 -0.504 12.224 1.00 0.00 C0 ATOM 0 H THR B 24 36.821 1.203 9.792 1.00 0.00 H new ATOM 0 HA THR B 24 38.858 1.029 11.670 1.00 0.00 H new ATOM 0 HB THR B 24 38.473 -1.534 11.203 1.00 0.00 H new ATOM 0 HG1 THR B 24 36.111 -0.585 9.961 1.00 0.00 H new ATOM 0 HG21 THR B 24 36.314 -1.414 12.417 1.00 0.00 H new ATOM 0 HG22 THR B 24 37.497 -0.269 13.094 1.00 0.00 H new ATOM 0 HG23 THR B 24 36.195 0.320 12.032 1.00 0.00 H new ATOM 950 N ILE B 25 39.707 -0.129 8.686 1.00 0.00 N0 ATOM 951 CA ILE B 25 40.866 -0.474 7.871 1.00 0.00 C0 ATOM 952 C ILE B 25 41.801 0.724 7.739 1.00 0.00 C0 ATOM 953 O ILE B 25 43.017 0.578 7.767 1.00 0.00 O0 ATOM 954 CB ILE B 25 40.421 -0.941 6.487 1.00 0.00 C0 ATOM 955 CG1 ILE B 25 39.735 -2.300 6.617 1.00 0.00 C0 ATOM 956 CG2 ILE B 25 41.639 -1.068 5.568 1.00 0.00 C0 ATOM 957 CD1 ILE B 25 39.061 -2.664 5.294 1.00 0.00 C0 ATOM 0 H ILE B 25 38.812 -0.169 8.199 1.00 0.00 H new ATOM 0 HA ILE B 25 41.402 -1.286 8.363 1.00 0.00 H new ATOM 0 HB ILE B 25 39.727 -0.216 6.061 1.00 0.00 H new ATOM 0 HG12 ILE B 25 40.465 -3.063 6.886 1.00 0.00 H new ATOM 0 HG13 ILE B 25 38.995 -2.270 7.417 1.00 0.00 H new ATOM 0 HG21 ILE B 25 41.317 -1.401 4.581 1.00 0.00 H new ATOM 0 HG22 ILE B 25 42.132 -0.100 5.481 1.00 0.00 H new ATOM 0 HG23 ILE B 25 42.337 -1.794 5.987 1.00 0.00 H new ATOM 0 HD11 ILE B 25 38.572 -3.634 5.389 1.00 0.00 H new ATOM 0 HD12 ILE B 25 38.318 -1.907 5.044 1.00 0.00 H new ATOM 0 HD13 ILE B 25 39.811 -2.712 4.505 1.00 0.00 H new ATOM 969 N GLY B 26 41.215 1.905 7.583 1.00 0.00 N0 ATOM 970 CA GLY B 26 42.001 3.125 7.435 1.00 0.00 C0 ATOM 971 C GLY B 26 42.896 3.357 8.651 1.00 0.00 C0 ATOM 972 O GLY B 26 44.093 3.605 8.514 1.00 0.00 O0 ATOM 0 H GLY B 26 40.205 2.044 7.556 1.00 0.00 H new ATOM 0 HA2 GLY B 26 42.614 3.059 6.536 1.00 0.00 H new ATOM 0 HA3 GLY B 26 41.334 3.977 7.304 1.00 0.00 H new ATOM 976 N HIS B 27 42.307 3.268 9.840 1.00 0.00 N0 ATOM 977 CA HIS B 27 43.056 3.463 11.078 1.00 0.00 C0 ATOM 978 C HIS B 27 44.072 2.345 11.280 1.00 0.00 C0 ATOM 979 O HIS B 27 45.193 2.584 11.728 1.00 0.00 O0 ATOM 980 CB HIS B 27 42.100 3.500 12.269 1.00 0.00 C0 ATOM 981 CG HIS B 27 42.865 3.864 13.513 1.00 0.00 C0 ATOM 982 ND1 HIS B 27 43.597 2.931 14.229 1.00 0.00 N0 ATOM 983 CD2 HIS B 27 43.020 5.054 14.181 1.00 0.00 C0 ATOM 984 CE1 HIS B 27 44.156 3.567 15.274 1.00 0.00 C0 ATOM 985 NE2 HIS B 27 43.835 4.863 15.293 1.00 0.00 N0 ATOM 0 H HIS B 27 41.317 3.063 9.973 1.00 0.00 H new ATOM 0 HA HIS B 27 43.588 4.412 11.006 1.00 0.00 H new ATOM 0 HB2 HIS B 27 41.307 4.227 12.091 1.00 0.00 H new ATOM 0 HB3 HIS B 27 41.620 2.529 12.395 1.00 0.00 H new ATOM 0 HD2 HIS B 27 42.577 5.994 13.888 1.00 0.00 H new ATOM 0 HE1 HIS B 27 44.787 3.088 16.008 1.00 0.00 H new ATOM 0 HE2 HIS B 27 44.125 5.563 15.976 1.00 0.00 H new ATOM 993 N LEU B 28 43.675 1.125 10.939 1.00 0.00 N0 ATOM 994 CA LEU B 28 44.558 -0.025 11.080 1.00 0.00 C0 ATOM 995 C LEU B 28 45.741 0.068 10.121 1.00 0.00 C0 ATOM 996 O LEU B 28 46.856 -0.320 10.466 1.00 0.00 O0 ATOM 997 CB LEU B 28 43.779 -1.317 10.821 1.00 0.00 C0 ATOM 998 CG LEU B 28 42.843 -1.590 12.000 1.00 0.00 C0 ATOM 999 CD1 LEU B 28 41.840 -2.679 11.615 1.00 0.00 C0 ATOM 1000 CD2 LEU B 28 43.666 -2.059 13.207 1.00 0.00 C0 ATOM 0 H LEU B 28 42.752 0.907 10.565 1.00 0.00 H new ATOM 0 HA LEU B 28 44.945 -0.032 12.099 1.00 0.00 H new ATOM 0 HB2 LEU B 28 43.205 -1.230 9.899 1.00 0.00 H new ATOM 0 HB3 LEU B 28 44.469 -2.151 10.689 1.00 0.00 H new ATOM 0 HG LEU B 28 42.307 -0.676 12.257 1.00 0.00 H new ATOM 0 HD11 LEU B 28 41.173 -2.873 12.455 1.00 0.00 H new ATOM 0 HD12 LEU B 28 41.255 -2.348 10.757 1.00 0.00 H new ATOM 0 HD13 LEU B 28 42.376 -3.593 11.358 1.00 0.00 H new ATOM 0 HD21 LEU B 28 43.000 -2.254 14.048 1.00 0.00 H new ATOM 0 HD22 LEU B 28 44.202 -2.973 12.949 1.00 0.00 H new ATOM 0 HD23 LEU B 28 44.381 -1.284 13.483 1.00 0.00 H new ATOM 1177 N PHE C 5 9.850 2.706 14.287 1.00 0.00 N0 ATOM 1178 CA PHE C 5 10.950 3.609 13.955 1.00 0.00 C0 ATOM 1179 C PHE C 5 11.866 3.821 15.161 1.00 0.00 C0 ATOM 1180 O PHE C 5 12.971 4.345 15.026 1.00 0.00 O0 ATOM 1181 CB PHE C 5 10.397 4.959 13.493 1.00 0.00 C0 ATOM 1182 CG PHE C 5 10.541 5.974 14.603 1.00 0.00 C0 ATOM 1183 CD1 PHE C 5 11.500 6.988 14.498 1.00 0.00 C0 ATOM 1184 CD2 PHE C 5 9.720 5.901 15.732 1.00 0.00 C0 ATOM 1185 CE1 PHE C 5 11.637 7.930 15.525 1.00 0.00 C0 ATOM 1186 CE2 PHE C 5 9.856 6.842 16.759 1.00 0.00 C0 ATOM 1187 CZ PHE C 5 10.814 7.857 16.655 1.00 0.00 C0 ATOM 0 HA PHE C 5 11.530 3.155 13.151 1.00 0.00 H new ATOM 0 HB2 PHE C 5 10.932 5.298 12.606 1.00 0.00 H new ATOM 0 HB3 PHE C 5 9.348 4.857 13.214 1.00 0.00 H new ATOM 0 HD1 PHE C 5 12.134 7.044 13.625 1.00 0.00 H new ATOM 0 HD2 PHE C 5 8.980 5.118 15.812 1.00 0.00 H new ATOM 0 HE1 PHE C 5 12.377 8.712 15.445 1.00 0.00 H new ATOM 0 HE2 PHE C 5 9.222 6.785 17.631 1.00 0.00 H new ATOM 0 HZ PHE C 5 10.918 8.584 17.447 1.00 0.00 H new ATOM 1197 N GLN C 6 11.408 3.410 16.341 1.00 0.00 N0 ATOM 1198 CA GLN C 6 12.205 3.566 17.551 1.00 0.00 C0 ATOM 1199 C GLN C 6 13.526 2.817 17.427 1.00 0.00 C0 ATOM 1200 O GLN C 6 14.559 3.287 17.899 1.00 0.00 O0 ATOM 1201 CB GLN C 6 11.433 3.023 18.754 1.00 0.00 C0 ATOM 1202 CG GLN C 6 12.224 3.285 20.038 1.00 0.00 C0 ATOM 1203 CD GLN C 6 11.582 2.544 21.203 1.00 0.00 C0 ATOM 1204 OE1 GLN C 6 11.271 1.359 21.089 1.00 0.00 O0 ATOM 1205 NE2 GLN C 6 11.367 3.172 22.326 1.00 0.00 N0 ATOM 0 H GLN C 6 10.498 2.971 16.483 1.00 0.00 H new ATOM 0 HA GLN C 6 12.411 4.627 17.690 1.00 0.00 H new ATOM 0 HB2 GLN C 6 10.454 3.499 18.815 1.00 0.00 H new ATOM 0 HB3 GLN C 6 11.260 1.954 18.634 1.00 0.00 H new ATOM 0 HG2 GLN C 6 13.256 2.958 19.913 1.00 0.00 H new ATOM 0 HG3 GLN C 6 12.251 4.354 20.247 1.00 0.00 H new ATOM 0 HE21 GLN C 6 11.626 4.154 22.419 1.00 0.00 H new ATOM 0 HE22 GLN C 6 10.940 2.681 23.112 1.00 0.00 H new ATOM 1214 N ILE C 7 13.483 1.644 16.801 1.00 0.00 N0 ATOM 1215 CA ILE C 7 14.686 0.836 16.639 1.00 0.00 C0 ATOM 1216 C ILE C 7 15.762 1.609 15.882 1.00 0.00 C0 ATOM 1217 O ILE C 7 16.946 1.513 16.207 1.00 0.00 O0 ATOM 1218 CB ILE C 7 14.358 -0.464 15.890 1.00 0.00 C0 ATOM 1219 CG1 ILE C 7 13.823 -0.145 14.486 1.00 0.00 C0 ATOM 1220 CG2 ILE C 7 13.290 -1.242 16.660 1.00 0.00 C0 ATOM 1221 CD1 ILE C 7 14.939 -0.283 13.442 1.00 0.00 C0 ATOM 0 H ILE C 7 12.638 1.236 16.402 1.00 0.00 H new ATOM 0 HA ILE C 7 15.065 0.592 17.631 1.00 0.00 H new ATOM 0 HB ILE C 7 15.267 -1.059 15.806 1.00 0.00 H new ATOM 0 HG12 ILE C 7 13.002 -0.819 14.241 1.00 0.00 H new ATOM 0 HG13 ILE C 7 13.420 0.868 14.465 1.00 0.00 H new ATOM 0 HG21 ILE C 7 13.058 -2.165 16.128 1.00 0.00 H new ATOM 0 HG22 ILE C 7 13.662 -1.481 17.656 1.00 0.00 H new ATOM 0 HG23 ILE C 7 12.388 -0.635 16.745 1.00 0.00 H new ATOM 0 HD11 ILE C 7 14.542 -0.053 12.453 1.00 0.00 H new ATOM 0 HD12 ILE C 7 15.747 0.410 13.679 1.00 0.00 H new ATOM 0 HD13 ILE C 7 15.322 -1.303 13.451 1.00 0.00 H new ATOM 1233 N LEU C 8 15.350 2.372 14.876 1.00 0.00 N0 ATOM 1234 CA LEU C 8 16.285 3.152 14.082 1.00 0.00 C0 ATOM 1235 C LEU C 8 16.823 4.332 14.885 1.00 0.00 C0 ATOM 1236 O LEU C 8 17.986 4.713 14.750 1.00 0.00 O0 ATOM 1237 CB LEU C 8 15.592 3.653 12.811 1.00 0.00 C0 ATOM 1238 CG LEU C 8 16.590 4.414 11.933 1.00 0.00 C0 ATOM 1239 CD1 LEU C 8 17.694 3.464 11.458 1.00 0.00 C0 ATOM 1240 CD2 LEU C 8 15.859 4.989 10.717 1.00 0.00 C0 ATOM 0 H LEU C 8 14.375 2.465 14.593 1.00 0.00 H new ATOM 0 HA LEU C 8 17.125 2.514 13.807 1.00 0.00 H new ATOM 0 HB2 LEU C 8 15.177 2.811 12.257 1.00 0.00 H new ATOM 0 HB3 LEU C 8 14.758 4.303 13.074 1.00 0.00 H new ATOM 0 HG LEU C 8 17.036 5.223 12.512 1.00 0.00 H new ATOM 0 HD11 LEU C 8 18.401 4.011 10.834 1.00 0.00 H new ATOM 0 HD12 LEU C 8 18.216 3.052 12.322 1.00 0.00 H new ATOM 0 HD13 LEU C 8 17.252 2.653 10.880 1.00 0.00 H new ATOM 0 HD21 LEU C 8 16.567 5.531 10.090 1.00 0.00 H new ATOM 0 HD22 LEU C 8 15.414 4.177 10.143 1.00 0.00 H new ATOM 0 HD23 LEU C 8 15.075 5.669 11.051 1.00 0.00 H new ATOM 1252 N SER C 9 15.965 4.898 15.725 1.00 0.00 N0 ATOM 1253 CA SER C 9 16.356 6.031 16.557 1.00 0.00 C0 ATOM 1254 C SER C 9 17.396 5.611 17.591 1.00 0.00 C0 ATOM 1255 O SER C 9 18.428 6.263 17.747 1.00 0.00 O0 ATOM 1256 CB SER C 9 15.133 6.602 17.271 1.00 0.00 C0 ATOM 1257 OG SER C 9 15.538 7.688 18.093 1.00 0.00 O0 ATOM 0 H SER C 9 14.999 4.594 15.848 1.00 0.00 H new ATOM 0 HA SER C 9 16.791 6.793 15.910 1.00 0.00 H new ATOM 0 HB2 SER C 9 14.395 6.937 16.542 1.00 0.00 H new ATOM 0 HB3 SER C 9 14.656 5.830 17.876 1.00 0.00 H new ATOM 0 HG SER C 9 14.756 8.060 18.553 1.00 0.00 H new ATOM 1263 N ILE C 10 17.112 4.526 18.303 1.00 0.00 N0 ATOM 1264 CA ILE C 10 18.024 4.037 19.330 1.00 0.00 C0 ATOM 1265 C ILE C 10 19.355 3.635 18.710 1.00 0.00 C0 ATOM 1266 O ILE C 10 20.418 3.948 19.248 1.00 0.00 O0 ATOM 1267 CB ILE C 10 17.410 2.836 20.055 1.00 0.00 C0 ATOM 1268 CG1 ILE C 10 16.169 3.289 20.828 1.00 0.00 C0 ATOM 1269 CG2 ILE C 10 18.435 2.251 21.038 1.00 0.00 C0 ATOM 1270 CD1 ILE C 10 15.366 2.062 21.262 1.00 0.00 C0 ATOM 0 H ILE C 10 16.263 3.972 18.189 1.00 0.00 H new ATOM 0 HA ILE C 10 18.195 4.839 20.048 1.00 0.00 H new ATOM 0 HB ILE C 10 17.130 2.076 19.325 1.00 0.00 H new ATOM 0 HG12 ILE C 10 16.463 3.872 21.701 1.00 0.00 H new ATOM 0 HG13 ILE C 10 15.554 3.937 20.204 1.00 0.00 H new ATOM 0 HG21 ILE C 10 17.998 1.396 21.554 1.00 0.00 H new ATOM 0 HG22 ILE C 10 19.322 1.930 20.491 1.00 0.00 H new ATOM 0 HG23 ILE C 10 18.714 3.011 21.768 1.00 0.00 H new ATOM 0 HD11 ILE C 10 14.482 2.382 21.813 1.00 0.00 H new ATOM 0 HD12 ILE C 10 15.060 1.497 20.381 1.00 0.00 H new ATOM 0 HD13 ILE C 10 15.983 1.431 21.902 1.00 0.00 H new ATOM 1282 N CYS C 11 19.294 2.942 17.574 1.00 0.00 N0 ATOM 1283 CA CYS C 11 20.511 2.509 16.901 1.00 0.00 C0 ATOM 1284 C CYS C 11 21.361 3.711 16.509 1.00 0.00 C0 ATOM 1285 O CYS C 11 22.563 3.740 16.772 1.00 0.00 O0 ATOM 1286 CB CYS C 11 20.153 1.709 15.649 1.00 0.00 C0 ATOM 1287 SG CYS C 11 19.463 0.109 16.133 1.00 0.00 S0 ATOM 0 H CYS C 11 18.427 2.673 17.108 1.00 0.00 H new ATOM 0 HA CYS C 11 21.082 1.882 17.586 1.00 0.00 H new ATOM 0 HB2 CYS C 11 19.432 2.261 15.046 1.00 0.00 H new ATOM 0 HB3 CYS C 11 21.039 1.563 15.032 1.00 0.00 H new ATOM 0 HG CYS C 11 18.181 0.226 16.313 1.00 0.00 H new ATOM 1293 N SER C 12 20.741 4.695 15.866 1.00 0.00 N0 ATOM 1294 CA SER C 12 21.470 5.882 15.436 1.00 0.00 C0 ATOM 1295 C SER C 12 22.086 6.584 16.634 1.00 0.00 C0 ATOM 1296 O SER C 12 23.226 7.027 16.582 1.00 0.00 O0 ATOM 1297 CB SER C 12 20.529 6.840 14.707 1.00 0.00 C0 ATOM 1298 OG SER C 12 21.254 7.998 14.315 1.00 0.00 O0 ATOM 0 H SER C 12 19.748 4.695 15.633 1.00 0.00 H new ATOM 0 HA SER C 12 22.265 5.574 14.757 1.00 0.00 H new ATOM 0 HB2 SER C 12 20.099 6.352 13.832 1.00 0.00 H new ATOM 0 HB3 SER C 12 19.699 7.118 15.356 1.00 0.00 H new ATOM 0 HG SER C 12 20.655 8.615 13.845 1.00 0.00 H new ATOM 1304 N PHE C 13 21.322 6.697 17.710 1.00 0.00 N0 ATOM 1305 CA PHE C 13 21.812 7.359 18.910 1.00 0.00 C0 ATOM 1306 C PHE C 13 23.073 6.671 19.425 1.00 0.00 C0 ATOM 1307 O PHE C 13 24.066 7.328 19.737 1.00 0.00 O0 ATOM 1308 CB PHE C 13 20.733 7.327 19.992 1.00 0.00 C0 ATOM 1309 CG PHE C 13 21.263 7.966 21.252 1.00 0.00 C0 ATOM 1310 CD1 PHE C 13 21.512 9.343 21.285 1.00 0.00 C0 ATOM 1311 CD2 PHE C 13 21.498 7.183 22.389 1.00 0.00 C0 ATOM 1312 CE1 PHE C 13 21.998 9.938 22.455 1.00 0.00 C0 ATOM 1313 CE2 PHE C 13 21.985 7.779 23.559 1.00 0.00 C0 ATOM 1314 CZ PHE C 13 22.234 9.156 23.593 1.00 0.00 C0 ATOM 0 H PHE C 13 20.368 6.342 17.778 1.00 0.00 H new ATOM 0 HA PHE C 13 22.053 8.393 18.663 1.00 0.00 H new ATOM 0 HB2 PHE C 13 19.844 7.857 19.649 1.00 0.00 H new ATOM 0 HB3 PHE C 13 20.434 6.298 20.192 1.00 0.00 H new ATOM 0 HD1 PHE C 13 21.329 9.946 20.408 1.00 0.00 H new ATOM 0 HD2 PHE C 13 21.304 6.121 22.364 1.00 0.00 H new ATOM 0 HE1 PHE C 13 22.191 11.000 22.480 1.00 0.00 H new ATOM 0 HE2 PHE C 13 22.169 7.176 24.436 1.00 0.00 H new ATOM 0 HZ PHE C 13 22.608 9.615 24.496 1.00 0.00 H new ATOM 1324 N ILE C 14 23.023 5.347 19.518 1.00 0.00 N0 ATOM 1325 CA ILE C 14 24.166 4.578 20.005 1.00 0.00 C0 ATOM 1326 C ILE C 14 25.375 4.765 19.090 1.00 0.00 C0 ATOM 1327 O ILE C 14 26.493 4.981 19.559 1.00 0.00 O0 ATOM 1328 CB ILE C 14 23.800 3.092 20.075 1.00 0.00 C0 ATOM 1329 CG1 ILE C 14 22.730 2.879 21.157 1.00 0.00 C0 ATOM 1330 CG2 ILE C 14 25.050 2.270 20.413 1.00 0.00 C0 ATOM 1331 CD1 ILE C 14 23.369 2.870 22.551 1.00 0.00 C0 ATOM 0 H ILE C 14 22.210 4.785 19.265 1.00 0.00 H new ATOM 0 HA ILE C 14 24.424 4.939 21.001 1.00 0.00 H new ATOM 0 HB ILE C 14 23.408 2.768 19.111 1.00 0.00 H new ATOM 0 HG12 ILE C 14 21.983 3.670 21.098 1.00 0.00 H new ATOM 0 HG13 ILE C 14 22.211 1.937 20.983 1.00 0.00 H new ATOM 0 HG21 ILE C 14 24.788 1.213 20.462 1.00 0.00 H new ATOM 0 HG22 ILE C 14 25.805 2.421 19.641 1.00 0.00 H new ATOM 0 HG23 ILE C 14 25.447 2.591 21.376 1.00 0.00 H new ATOM 0 HD11 ILE C 14 22.596 2.718 23.305 1.00 0.00 H new ATOM 0 HD12 ILE C 14 24.099 2.063 22.612 1.00 0.00 H new ATOM 0 HD13 ILE C 14 23.867 3.823 22.729 1.00 0.00 H new ATOM 1343 N LEU C 15 25.141 4.672 17.786 1.00 0.00 N0 ATOM 1344 CA LEU C 15 26.212 4.820 16.805 1.00 0.00 C0 ATOM 1345 C LEU C 15 26.763 6.246 16.807 1.00 0.00 C0 ATOM 1346 O LEU C 15 27.933 6.470 16.500 1.00 0.00 O0 ATOM 1347 CB LEU C 15 25.669 4.484 15.411 1.00 0.00 C0 ATOM 1348 CG LEU C 15 25.317 2.995 15.336 1.00 0.00 C0 ATOM 1349 CD1 LEU C 15 24.469 2.732 14.089 1.00 0.00 C0 ATOM 1350 CD2 LEU C 15 26.601 2.164 15.248 1.00 0.00 C0 ATOM 0 H LEU C 15 24.221 4.495 17.383 1.00 0.00 H new ATOM 0 HA LEU C 15 27.021 4.139 17.067 1.00 0.00 H new ATOM 0 HB2 LEU C 15 24.786 5.087 15.200 1.00 0.00 H new ATOM 0 HB3 LEU C 15 26.412 4.730 14.652 1.00 0.00 H new ATOM 0 HG LEU C 15 24.759 2.715 16.230 1.00 0.00 H new ATOM 0 HD11 LEU C 15 24.219 1.672 14.036 1.00 0.00 H new ATOM 0 HD12 LEU C 15 23.552 3.319 14.142 1.00 0.00 H new ATOM 0 HD13 LEU C 15 25.031 3.017 13.200 1.00 0.00 H new ATOM 0 HD21 LEU C 15 26.346 1.105 15.195 1.00 0.00 H new ATOM 0 HD22 LEU C 15 27.158 2.449 14.355 1.00 0.00 H new ATOM 0 HD23 LEU C 15 27.213 2.346 16.131 1.00 0.00 H new ATOM 1362 N SER C 16 25.915 7.203 17.164 1.00 0.00 N0 ATOM 1363 CA SER C 16 26.319 8.605 17.209 1.00 0.00 C0 ATOM 1364 C SER C 16 27.263 8.868 18.378 1.00 0.00 C0 ATOM 1365 O SER C 16 28.302 9.521 18.222 1.00 0.00 O0 ATOM 1366 CB SER C 16 25.080 9.493 17.341 1.00 0.00 C0 ATOM 1367 OG SER C 16 25.475 10.858 17.333 1.00 0.00 O0 ATOM 0 H SER C 16 24.944 7.035 17.427 1.00 0.00 H new ATOM 0 HA SER C 16 26.846 8.839 16.284 1.00 0.00 H new ATOM 0 HB2 SER C 16 24.390 9.298 16.520 1.00 0.00 H new ATOM 0 HB3 SER C 16 24.550 9.262 18.265 1.00 0.00 H new ATOM 0 HG SER C 16 24.942 11.357 17.987 1.00 0.00 H new ATOM 1373 N ALA C 17 26.900 8.345 19.548 1.00 0.00 N0 ATOM 1374 CA ALA C 17 27.718 8.516 20.741 1.00 0.00 C0 ATOM 1375 C ALA C 17 29.052 7.797 20.587 1.00 0.00 C0 ATOM 1376 O ALA C 17 30.097 8.307 20.999 1.00 0.00 O0 ATOM 1377 CB ALA C 17 26.976 7.977 21.969 1.00 0.00 C0 ATOM 0 H ALA C 17 26.048 7.802 19.692 1.00 0.00 H new ATOM 0 HA ALA C 17 27.910 9.580 20.876 1.00 0.00 H new ATOM 0 HB1 ALA C 17 27.596 8.109 22.856 1.00 0.00 H new ATOM 0 HB2 ALA C 17 26.040 8.521 22.096 1.00 0.00 H new ATOM 0 HB3 ALA C 17 26.764 6.917 21.830 1.00 0.00 H new ATOM 1383 N LEU C 18 29.023 6.621 19.969 1.00 0.00 N0 ATOM 1384 CA LEU C 18 30.241 5.854 19.756 1.00 0.00 C0 ATOM 1385 C LEU C 18 31.112 6.488 18.674 1.00 0.00 C0 ATOM 1386 O LEU C 18 32.342 6.374 18.714 1.00 0.00 O0 ATOM 1387 CB LEU C 18 29.883 4.420 19.358 1.00 0.00 C0 ATOM 1388 CG LEU C 18 29.439 3.638 20.596 1.00 0.00 C0 ATOM 1389 CD1 LEU C 18 28.657 2.397 20.166 1.00 0.00 C0 ATOM 1390 CD2 LEU C 18 30.675 3.199 21.386 1.00 0.00 C0 ATOM 0 H LEU C 18 28.175 6.182 19.610 1.00 0.00 H new ATOM 0 HA LEU C 18 30.808 5.848 20.687 1.00 0.00 H new ATOM 0 HB2 LEU C 18 29.086 4.427 18.615 1.00 0.00 H new ATOM 0 HB3 LEU C 18 30.744 3.934 18.898 1.00 0.00 H new ATOM 0 HG LEU C 18 28.806 4.273 21.216 1.00 0.00 H new ATOM 0 HD11 LEU C 18 28.342 1.841 21.049 1.00 0.00 H new ATOM 0 HD12 LEU C 18 27.779 2.700 19.595 1.00 0.00 H new ATOM 0 HD13 LEU C 18 29.292 1.764 19.546 1.00 0.00 H new ATOM 0 HD21 LEU C 18 30.363 2.641 22.269 1.00 0.00 H new ATOM 0 HD22 LEU C 18 31.301 2.565 20.759 1.00 0.00 H new ATOM 0 HD23 LEU C 18 31.242 4.078 21.693 1.00 0.00 H new ATOM 1402 N HIS C 19 30.479 7.166 17.718 1.00 0.00 N0 ATOM 1403 CA HIS C 19 31.218 7.818 16.645 1.00 0.00 C0 ATOM 1404 C HIS C 19 32.045 8.970 17.192 1.00 0.00 C0 ATOM 1405 O HIS C 19 33.242 9.080 16.909 1.00 0.00 O0 ATOM 1406 CB HIS C 19 30.245 8.338 15.587 1.00 0.00 C0 ATOM 1407 CG HIS C 19 31.012 8.797 14.380 1.00 0.00 C0 ATOM 1408 ND1 HIS C 19 31.337 7.938 13.343 1.00 0.00 N0 ATOM 1409 CD2 HIS C 19 31.527 10.021 14.031 1.00 0.00 C0 ATOM 1410 CE1 HIS C 19 32.017 8.648 12.427 1.00 0.00 C0 ATOM 1411 NE2 HIS C 19 32.162 9.923 12.796 1.00 0.00 N0 ATOM 0 H HIS C 19 29.466 7.276 17.666 1.00 0.00 H new ATOM 0 HA HIS C 19 31.890 7.089 16.192 1.00 0.00 H new ATOM 0 HB2 HIS C 19 29.542 7.553 15.307 1.00 0.00 H new ATOM 0 HB3 HIS C 19 29.658 9.162 15.992 1.00 0.00 H new ATOM 0 HD2 HIS C 19 31.451 10.921 14.623 1.00 0.00 H new ATOM 0 HE1 HIS C 19 32.400 8.237 11.504 1.00 0.00 H new ATOM 0 HE2 HIS C 19 32.636 10.666 12.283 1.00 0.00 H new ATOM 1419 N PHE C 20 31.409 9.824 17.987 1.00 0.00 N0 ATOM 1420 CA PHE C 20 32.112 10.959 18.568 1.00 0.00 C0 ATOM 1421 C PHE C 20 33.115 10.487 19.613 1.00 0.00 C0 ATOM 1422 O PHE C 20 34.138 11.126 19.828 1.00 0.00 O0 ATOM 1423 CB PHE C 20 31.123 11.943 19.198 1.00 0.00 C0 ATOM 1424 CG PHE C 20 31.059 13.198 18.354 1.00 0.00 C0 ATOM 1425 CD1 PHE C 20 30.510 13.156 17.065 1.00 0.00 C0 ATOM 1426 CD2 PHE C 20 31.558 14.405 18.862 1.00 0.00 C0 ATOM 1427 CE1 PHE C 20 30.460 14.321 16.286 1.00 0.00 C0 ATOM 1428 CE2 PHE C 20 31.507 15.568 18.083 1.00 0.00 C0 ATOM 1429 CZ PHE C 20 30.958 15.527 16.795 1.00 0.00 C0 ATOM 0 H PHE C 20 30.423 9.753 18.240 1.00 0.00 H new ATOM 0 HA PHE C 20 32.650 11.470 17.769 1.00 0.00 H new ATOM 0 HB2 PHE C 20 30.135 11.488 19.269 1.00 0.00 H new ATOM 0 HB3 PHE C 20 31.434 12.189 20.213 1.00 0.00 H new ATOM 0 HD1 PHE C 20 30.126 12.227 16.672 1.00 0.00 H new ATOM 0 HD2 PHE C 20 31.982 14.438 19.855 1.00 0.00 H new ATOM 0 HE1 PHE C 20 30.037 14.288 15.293 1.00 0.00 H new ATOM 0 HE2 PHE C 20 31.891 16.498 18.476 1.00 0.00 H new ATOM 0 HZ PHE C 20 30.919 16.424 16.195 1.00 0.00 H new ATOM 1439 N MET C 21 32.820 9.363 20.256 1.00 0.00 N0 ATOM 1440 CA MET C 21 33.718 8.824 21.270 1.00 0.00 C0 ATOM 1441 C MET C 21 35.073 8.470 20.664 1.00 0.00 C0 ATOM 1442 O MET C 21 36.123 8.917 21.145 1.00 0.00 O0 ATOM 1443 CB MET C 21 33.092 7.575 21.889 1.00 0.00 C0 ATOM 1444 CG MET C 21 32.304 7.973 23.138 1.00 0.00 C0 ATOM 1445 SD MET C 21 31.669 6.485 23.954 1.00 0.00 S0 ATOM 1446 CE MET C 21 30.374 7.266 24.960 1.00 0.00 C0 ATOM 0 H MET C 21 31.976 8.813 20.096 1.00 0.00 H new ATOM 0 HA MET C 21 33.872 9.583 22.038 1.00 0.00 H new ATOM 0 HB2 MET C 21 32.434 7.089 21.169 1.00 0.00 H new ATOM 0 HB3 MET C 21 33.868 6.855 22.148 1.00 0.00 H new ATOM 0 HG2 MET C 21 32.944 8.530 23.822 1.00 0.00 H new ATOM 0 HG3 MET C 21 31.479 8.631 22.866 1.00 0.00 H new ATOM 0 HE1 MET C 21 29.859 6.504 25.545 1.00 0.00 H new ATOM 0 HE2 MET C 21 30.826 7.996 25.632 1.00 0.00 H new ATOM 0 HE3 MET C 21 29.659 7.767 24.307 1.00 0.00 H new ATOM 1456 N ALA C 22 35.050 7.672 19.604 1.00 0.00 N0 ATOM 1457 CA ALA C 22 36.290 7.278 18.954 1.00 0.00 C0 ATOM 1458 C ALA C 22 36.980 8.487 18.338 1.00 0.00 C0 ATOM 1459 O ALA C 22 38.200 8.616 18.404 1.00 0.00 O0 ATOM 1460 CB ALA C 22 36.009 6.238 17.874 1.00 0.00 C0 ATOM 0 H ALA C 22 34.202 7.292 19.183 1.00 0.00 H new ATOM 0 HA ALA C 22 36.949 6.845 19.706 1.00 0.00 H new ATOM 0 HB1 ALA C 22 36.944 5.950 17.394 1.00 0.00 H new ATOM 0 HB2 ALA C 22 35.548 5.360 18.326 1.00 0.00 H new ATOM 0 HB3 ALA C 22 35.334 6.660 17.130 1.00 0.00 H new ATOM 1466 N TRP C 23 36.191 9.370 17.733 1.00 0.00 N0 ATOM 1467 CA TRP C 23 36.744 10.561 17.101 1.00 0.00 C0 ATOM 1468 C TRP C 23 37.481 11.422 18.122 1.00 0.00 C0 ATOM 1469 O TRP C 23 38.618 11.830 17.891 1.00 0.00 O0 ATOM 1470 CB TRP C 23 35.624 11.373 16.456 1.00 0.00 C0 ATOM 1471 CG TRP C 23 35.942 11.600 15.015 1.00 0.00 C0 ATOM 1472 CD1 TRP C 23 35.457 10.872 13.983 1.00 0.00 C0 ATOM 1473 CD2 TRP C 23 36.808 12.616 14.429 1.00 0.00 C0 ATOM 1474 NE1 TRP C 23 35.970 11.377 12.801 1.00 0.00 N0 ATOM 1475 CE2 TRP C 23 36.808 12.452 13.024 1.00 0.00 C0 ATOM 1476 CE3 TRP C 23 37.586 13.652 14.976 1.00 0.00 C0 ATOM 1477 CZ2 TRP C 23 37.552 13.288 12.191 1.00 0.00 C0 ATOM 1478 CZ3 TRP C 23 38.337 14.496 14.141 1.00 0.00 C0 ATOM 1479 CH2 TRP C 23 38.320 14.314 12.750 1.00 0.00 C0 ATOM 0 H TRP C 23 35.177 9.284 17.668 1.00 0.00 H new ATOM 0 HA TRP C 23 37.453 10.247 16.335 1.00 0.00 H new ATOM 0 HB2 TRP C 23 34.675 10.845 16.552 1.00 0.00 H new ATOM 0 HB3 TRP C 23 35.510 12.328 16.969 1.00 0.00 H new ATOM 0 HD1 TRP C 23 34.781 10.034 14.068 1.00 0.00 H new ATOM 0 HE1 TRP C 23 35.755 11.001 11.877 1.00 0.00 H new ATOM 0 HE3 TRP C 23 37.606 13.800 16.046 1.00 0.00 H new ATOM 0 HZ2 TRP C 23 37.535 13.144 11.121 1.00 0.00 H new ATOM 0 HZ3 TRP C 23 38.930 15.289 14.572 1.00 0.00 H new ATOM 0 HH2 TRP C 23 38.899 14.965 12.112 1.00 0.00 H new ATOM 1490 N THR C 24 36.825 11.703 19.243 1.00 0.00 N0 ATOM 1491 CA THR C 24 37.431 12.523 20.284 1.00 0.00 C0 ATOM 1492 C THR C 24 38.781 11.948 20.685 1.00 0.00 C0 ATOM 1493 O THR C 24 39.776 12.671 20.761 1.00 0.00 O0 ATOM 1494 CB THR C 24 36.512 12.581 21.509 1.00 0.00 C0 ATOM 1495 OG1 THR C 24 35.886 11.320 21.689 1.00 0.00 O0 ATOM 1496 CG2 THR C 24 35.441 13.656 21.308 1.00 0.00 C0 ATOM 0 H THR C 24 35.881 11.378 19.453 1.00 0.00 H new ATOM 0 HA THR C 24 37.574 13.531 19.895 1.00 0.00 H new ATOM 0 HB THR C 24 37.105 12.827 22.390 1.00 0.00 H new ATOM 0 HG1 THR C 24 35.012 11.322 21.245 1.00 0.00 H new ATOM 0 HG21 THR C 24 34.792 13.691 22.183 1.00 0.00 H new ATOM 0 HG22 THR C 24 35.920 14.626 21.172 1.00 0.00 H new ATOM 0 HG23 THR C 24 34.848 13.418 20.425 1.00 0.00 H new ATOM 1504 N ILE C 25 38.818 10.642 20.929 1.00 0.00 N0 ATOM 1505 CA ILE C 25 40.069 9.997 21.308 1.00 0.00 C0 ATOM 1506 C ILE C 25 41.088 10.100 20.178 1.00 0.00 C0 ATOM 1507 O ILE C 25 42.271 10.310 20.416 1.00 0.00 O0 ATOM 1508 CB ILE C 25 39.828 8.529 21.654 1.00 0.00 C0 ATOM 1509 CG1 ILE C 25 39.043 8.451 22.965 1.00 0.00 C0 ATOM 1510 CG2 ILE C 25 41.169 7.807 21.816 1.00 0.00 C0 ATOM 1511 CD1 ILE C 25 38.571 7.016 23.196 1.00 0.00 C0 ATOM 0 H ILE C 25 38.012 10.019 20.873 1.00 0.00 H new ATOM 0 HA ILE C 25 40.463 10.508 22.186 1.00 0.00 H new ATOM 0 HB ILE C 25 39.262 8.052 20.854 1.00 0.00 H new ATOM 0 HG12 ILE C 25 39.669 8.776 23.795 1.00 0.00 H new ATOM 0 HG13 ILE C 25 38.187 9.125 22.928 1.00 0.00 H new ATOM 0 HG21 ILE C 25 40.991 6.760 22.063 1.00 0.00 H new ATOM 0 HG22 ILE C 25 41.731 7.870 20.884 1.00 0.00 H new ATOM 0 HG23 ILE C 25 41.741 8.276 22.617 1.00 0.00 H new ATOM 0 HD11 ILE C 25 38.012 6.963 24.130 1.00 0.00 H new ATOM 0 HD12 ILE C 25 37.929 6.707 22.371 1.00 0.00 H new ATOM 0 HD13 ILE C 25 39.435 6.353 23.252 1.00 0.00 H new ATOM 1523 N GLY C 26 40.613 9.942 18.948 1.00 0.00 N0 ATOM 1524 CA GLY C 26 41.491 10.009 17.786 1.00 0.00 C0 ATOM 1525 C GLY C 26 42.190 11.364 17.698 1.00 0.00 C0 ATOM 1526 O GLY C 26 43.407 11.435 17.534 1.00 0.00 O0 ATOM 0 H GLY C 26 39.632 9.768 18.730 1.00 0.00 H new ATOM 0 HA2 GLY C 26 42.236 9.216 17.844 1.00 0.00 H new ATOM 0 HA3 GLY C 26 40.912 9.836 16.879 1.00 0.00 H new ATOM 1530 N HIS C 27 41.410 12.436 17.812 1.00 0.00 N0 ATOM 1531 CA HIS C 27 41.961 13.786 17.751 1.00 0.00 C0 ATOM 1532 C HIS C 27 42.858 14.062 18.954 1.00 0.00 C0 ATOM 1533 O HIS C 27 43.904 14.697 18.827 1.00 0.00 O0 ATOM 1534 CB HIS C 27 40.827 14.812 17.716 1.00 0.00 C0 ATOM 1535 CG HIS C 27 41.402 16.183 17.487 1.00 0.00 C0 ATOM 1536 ND1 HIS C 27 41.947 16.936 18.515 1.00 0.00 N0 ATOM 1537 CD2 HIS C 27 41.524 16.951 16.355 1.00 0.00 C0 ATOM 1538 CE1 HIS C 27 42.369 18.099 17.987 1.00 0.00 C0 ATOM 1539 NE2 HIS C 27 42.135 18.161 16.674 1.00 0.00 N0 ATOM 0 H HIS C 27 40.400 12.396 17.946 1.00 0.00 H new ATOM 0 HA HIS C 27 42.558 13.869 16.843 1.00 0.00 H new ATOM 0 HB2 HIS C 27 40.122 14.564 16.923 1.00 0.00 H new ATOM 0 HB3 HIS C 27 40.272 14.790 18.654 1.00 0.00 H new ATOM 0 HD2 HIS C 27 41.196 16.661 15.368 1.00 0.00 H new ATOM 0 HE1 HIS C 27 42.840 18.887 18.556 1.00 0.00 H new ATOM 0 HE2 HIS C 27 42.356 18.929 16.041 1.00 0.00 H new ATOM 1547 N LEU C 28 42.442 13.575 20.116 1.00 0.00 N0 ATOM 1548 CA LEU C 28 43.216 13.770 21.336 1.00 0.00 C0 ATOM 1549 C LEU C 28 44.542 13.017 21.273 1.00 0.00 C0 ATOM 1550 O LEU C 28 45.559 13.505 21.763 1.00 0.00 O0 ATOM 1551 CB LEU C 28 42.408 13.299 22.548 1.00 0.00 C0 ATOM 1552 CG LEU C 28 41.278 14.292 22.821 1.00 0.00 C0 ATOM 1553 CD1 LEU C 28 40.282 13.676 23.806 1.00 0.00 C0 ATOM 1554 CD2 LEU C 28 41.862 15.576 23.424 1.00 0.00 C0 ATOM 0 H LEU C 28 41.579 13.046 20.240 1.00 0.00 H new ATOM 0 HA LEU C 28 43.432 14.834 21.434 1.00 0.00 H new ATOM 0 HB2 LEU C 28 41.998 12.306 22.362 1.00 0.00 H new ATOM 0 HB3 LEU C 28 43.055 13.218 23.421 1.00 0.00 H new ATOM 0 HG LEU C 28 40.768 14.526 21.887 1.00 0.00 H new ATOM 0 HD11 LEU C 28 39.477 14.385 24.000 1.00 0.00 H new ATOM 0 HD12 LEU C 28 39.867 12.763 23.380 1.00 0.00 H new ATOM 0 HD13 LEU C 28 40.792 13.442 24.740 1.00 0.00 H new ATOM 0 HD21 LEU C 28 41.057 16.285 23.619 1.00 0.00 H new ATOM 0 HD22 LEU C 28 42.372 15.340 24.358 1.00 0.00 H new ATOM 0 HD23 LEU C 28 42.572 16.017 22.724 1.00 0.00 H new ATOM 1751 N GLN D 6 10.134 13.717 15.088 1.00 0.00 N0 ATOM 1752 CA GLN D 6 10.720 15.045 14.974 1.00 0.00 C0 ATOM 1753 C GLN D 6 11.962 15.163 15.852 1.00 0.00 C0 ATOM 1754 O GLN D 6 12.940 15.805 15.472 1.00 0.00 O0 ATOM 1755 CB GLN D 6 9.701 16.102 15.403 1.00 0.00 C0 ATOM 1756 CG GLN D 6 10.282 17.501 15.181 1.00 0.00 C0 ATOM 1757 CD GLN D 6 9.374 18.545 15.821 1.00 0.00 C0 ATOM 1758 OE1 GLN D 6 8.969 18.392 16.973 1.00 0.00 O0 ATOM 1759 NE2 GLN D 6 9.035 19.604 15.142 1.00 0.00 N0 ATOM 0 HA GLN D 6 11.003 15.205 13.934 1.00 0.00 H new ATOM 0 HB2 GLN D 6 8.780 15.986 14.832 1.00 0.00 H new ATOM 0 HB3 GLN D 6 9.444 15.967 16.454 1.00 0.00 H new ATOM 0 HG2 GLN D 6 11.282 17.562 15.611 1.00 0.00 H new ATOM 0 HG3 GLN D 6 10.382 17.698 14.114 1.00 0.00 H new ATOM 0 HE21 GLN D 6 9.373 19.727 14.187 1.00 0.00 H new ATOM 0 HE22 GLN D 6 8.432 20.310 15.565 1.00 0.00 H new ATOM 1768 N ILE D 7 11.908 14.552 17.033 1.00 0.00 N0 ATOM 1769 CA ILE D 7 13.032 14.614 17.960 1.00 0.00 C0 ATOM 1770 C ILE D 7 14.297 14.046 17.321 1.00 0.00 C0 ATOM 1771 O ILE D 7 15.393 14.572 17.523 1.00 0.00 O0 ATOM 1772 CB ILE D 7 12.706 13.836 19.244 1.00 0.00 C0 ATOM 1773 CG1 ILE D 7 12.457 12.356 18.917 1.00 0.00 C0 ATOM 1774 CG2 ILE D 7 11.449 14.421 19.890 1.00 0.00 C0 ATOM 1775 CD1 ILE D 7 13.716 11.524 19.193 1.00 0.00 C0 ATOM 0 H ILE D 7 11.108 14.015 17.367 1.00 0.00 H new ATOM 0 HA ILE D 7 13.208 15.661 18.208 1.00 0.00 H new ATOM 0 HB ILE D 7 13.550 13.918 19.929 1.00 0.00 H new ATOM 0 HG12 ILE D 7 11.627 11.980 19.516 1.00 0.00 H new ATOM 0 HG13 ILE D 7 12.168 12.252 17.871 1.00 0.00 H new ATOM 0 HG21 ILE D 7 11.218 13.869 20.801 1.00 0.00 H new ATOM 0 HG22 ILE D 7 11.620 15.469 20.134 1.00 0.00 H new ATOM 0 HG23 ILE D 7 10.613 14.342 19.196 1.00 0.00 H new ATOM 0 HD11 ILE D 7 13.520 10.478 18.956 1.00 0.00 H new ATOM 0 HD12 ILE D 7 14.536 11.889 18.575 1.00 0.00 H new ATOM 0 HD13 ILE D 7 13.987 11.613 20.245 1.00 0.00 H new ATOM 1787 N LEU D 8 14.141 12.976 16.550 1.00 0.00 N0 ATOM 1788 CA LEU D 8 15.273 12.345 15.889 1.00 0.00 C0 ATOM 1789 C LEU D 8 15.783 13.212 14.742 1.00 0.00 C0 ATOM 1790 O LEU D 8 16.984 13.273 14.479 1.00 0.00 O0 ATOM 1791 CB LEU D 8 14.865 10.966 15.361 1.00 0.00 C0 ATOM 1792 CG LEU D 8 16.074 10.267 14.729 1.00 0.00 C0 ATOM 1793 CD1 LEU D 8 17.139 10.006 15.797 1.00 0.00 C0 ATOM 1794 CD2 LEU D 8 15.627 8.934 14.122 1.00 0.00 C0 ATOM 0 H LEU D 8 13.242 12.529 16.368 1.00 0.00 H new ATOM 0 HA LEU D 8 16.077 12.230 16.616 1.00 0.00 H new ATOM 0 HB2 LEU D 8 14.468 10.359 16.175 1.00 0.00 H new ATOM 0 HB3 LEU D 8 14.069 11.071 14.624 1.00 0.00 H new ATOM 0 HG LEU D 8 16.494 10.905 13.951 1.00 0.00 H new ATOM 0 HD11 LEU D 8 17.996 9.509 15.342 1.00 0.00 H new ATOM 0 HD12 LEU D 8 17.458 10.953 16.232 1.00 0.00 H new ATOM 0 HD13 LEU D 8 16.723 9.370 16.578 1.00 0.00 H new ATOM 0 HD21 LEU D 8 16.484 8.434 13.671 1.00 0.00 H new ATOM 0 HD22 LEU D 8 15.207 8.301 14.904 1.00 0.00 H new ATOM 0 HD23 LEU D 8 14.871 9.117 13.358 1.00 0.00 H new ATOM 1806 N SER D 9 14.856 13.887 14.074 1.00 0.00 N0 ATOM 1807 CA SER D 9 15.209 14.761 12.961 1.00 0.00 C0 ATOM 1808 C SER D 9 16.008 15.966 13.448 1.00 0.00 C0 ATOM 1809 O SER D 9 17.058 16.293 12.894 1.00 0.00 O0 ATOM 1810 CB SER D 9 13.947 15.243 12.251 1.00 0.00 C0 ATOM 1811 OG SER D 9 14.314 16.110 11.186 1.00 0.00 O0 ATOM 0 H SER D 9 13.858 13.847 14.282 1.00 0.00 H new ATOM 0 HA SER D 9 15.824 14.190 12.265 1.00 0.00 H new ATOM 0 HB2 SER D 9 13.384 14.393 11.866 1.00 0.00 H new ATOM 0 HB3 SER D 9 13.297 15.765 12.953 1.00 0.00 H new ATOM 0 HG SER D 9 13.507 16.422 10.725 1.00 0.00 H new ATOM 1817 N ILE D 10 15.498 16.631 14.480 1.00 0.00 N0 ATOM 1818 CA ILE D 10 16.164 17.807 15.025 1.00 0.00 C0 ATOM 1819 C ILE D 10 17.536 17.434 15.573 1.00 0.00 C0 ATOM 1820 O ILE D 10 18.517 18.147 15.352 1.00 0.00 O0 ATOM 1821 CB ILE D 10 15.315 18.429 16.138 1.00 0.00 C0 ATOM 1822 CG1 ILE D 10 14.011 18.966 15.541 1.00 0.00 C0 ATOM 1823 CG2 ILE D 10 16.089 19.582 16.791 1.00 0.00 C0 ATOM 1824 CD1 ILE D 10 13.024 19.268 16.669 1.00 0.00 C0 ATOM 0 H ILE D 10 14.631 16.377 14.953 1.00 0.00 H new ATOM 0 HA ILE D 10 16.289 18.534 14.223 1.00 0.00 H new ATOM 0 HB ILE D 10 15.090 17.672 16.889 1.00 0.00 H new ATOM 0 HG12 ILE D 10 14.207 19.869 14.963 1.00 0.00 H new ATOM 0 HG13 ILE D 10 13.584 18.235 14.855 1.00 0.00 H new ATOM 0 HG21 ILE D 10 15.484 20.024 17.583 1.00 0.00 H new ATOM 0 HG22 ILE D 10 17.019 19.202 17.214 1.00 0.00 H new ATOM 0 HG23 ILE D 10 16.314 20.340 16.041 1.00 0.00 H new ATOM 0 HD11 ILE D 10 12.095 19.650 16.247 1.00 0.00 H new ATOM 0 HD12 ILE D 10 12.820 18.355 17.228 1.00 0.00 H new ATOM 0 HD13 ILE D 10 13.453 20.014 17.338 1.00 0.00 H new ATOM 1836 N CYS D 11 17.601 16.314 16.289 1.00 0.00 N0 ATOM 1837 CA CYS D 11 18.864 15.867 16.860 1.00 0.00 C0 ATOM 1838 C CYS D 11 19.890 15.612 15.762 1.00 0.00 C0 ATOM 1839 O CYS D 11 21.025 16.081 15.845 1.00 0.00 O0 ATOM 1840 CB CYS D 11 18.648 14.583 17.658 1.00 0.00 C0 ATOM 1841 SG CYS D 11 17.725 14.961 19.168 1.00 0.00 S0 ATOM 0 H CYS D 11 16.804 15.708 16.485 1.00 0.00 H new ATOM 0 HA CYS D 11 19.239 16.650 17.519 1.00 0.00 H new ATOM 0 HB2 CYS D 11 18.102 13.856 17.057 1.00 0.00 H new ATOM 0 HB3 CYS D 11 19.608 14.132 17.909 1.00 0.00 H new ATOM 0 HG CYS D 11 16.450 14.911 18.921 1.00 0.00 H new ATOM 1847 N SER D 12 19.494 14.861 14.739 1.00 0.00 N0 ATOM 1848 CA SER D 12 20.401 14.551 13.643 1.00 0.00 C0 ATOM 1849 C SER D 12 20.869 15.828 12.966 1.00 0.00 C0 ATOM 1850 O SER D 12 22.042 15.969 12.639 1.00 0.00 O0 ATOM 1851 CB SER D 12 19.703 13.658 12.619 1.00 0.00 C0 ATOM 1852 OG SER D 12 20.599 13.382 11.552 1.00 0.00 O0 ATOM 0 H SER D 12 18.561 14.460 14.647 1.00 0.00 H new ATOM 0 HA SER D 12 21.265 14.026 14.050 1.00 0.00 H new ATOM 0 HB2 SER D 12 19.381 12.729 13.089 1.00 0.00 H new ATOM 0 HB3 SER D 12 18.808 14.150 12.240 1.00 0.00 H new ATOM 0 HG SER D 12 20.156 12.808 10.893 1.00 0.00 H new ATOM 1858 N PHE D 13 19.947 16.754 12.750 1.00 0.00 N0 ATOM 1859 CA PHE D 13 20.286 18.013 12.104 1.00 0.00 C0 ATOM 1860 C PHE D 13 21.362 18.750 12.896 1.00 0.00 C0 ATOM 1861 O PHE D 13 22.347 19.223 12.330 1.00 0.00 O0 ATOM 1862 CB PHE D 13 19.038 18.890 11.997 1.00 0.00 C0 ATOM 1863 CG PHE D 13 19.405 20.215 11.378 1.00 0.00 C0 ATOM 1864 CD1 PHE D 13 19.784 20.276 10.032 1.00 0.00 C0 ATOM 1865 CD2 PHE D 13 19.359 21.385 12.145 1.00 0.00 C0 ATOM 1866 CE1 PHE D 13 20.117 21.506 9.453 1.00 0.00 C0 ATOM 1867 CE2 PHE D 13 19.695 22.615 11.567 1.00 0.00 C0 ATOM 1868 CZ PHE D 13 20.073 22.676 10.220 1.00 0.00 C0 ATOM 0 H PHE D 13 18.965 16.659 13.010 1.00 0.00 H new ATOM 0 HA PHE D 13 20.670 17.799 11.107 1.00 0.00 H new ATOM 0 HB2 PHE D 13 18.281 18.391 11.392 1.00 0.00 H new ATOM 0 HB3 PHE D 13 18.604 19.046 12.985 1.00 0.00 H new ATOM 0 HD1 PHE D 13 19.820 19.373 9.440 1.00 0.00 H new ATOM 0 HD2 PHE D 13 19.064 21.339 13.183 1.00 0.00 H new ATOM 0 HE1 PHE D 13 20.408 21.552 8.414 1.00 0.00 H new ATOM 0 HE2 PHE D 13 19.663 23.517 12.160 1.00 0.00 H new ATOM 0 HZ PHE D 13 20.330 23.625 9.773 1.00 0.00 H new ATOM 1878 N ILE D 14 21.163 18.849 14.206 1.00 0.00 N0 ATOM 1879 CA ILE D 14 22.121 19.538 15.067 1.00 0.00 C0 ATOM 1880 C ILE D 14 23.483 18.847 15.028 1.00 0.00 C0 ATOM 1881 O ILE D 14 24.519 19.501 14.907 1.00 0.00 O0 ATOM 1882 CB ILE D 14 21.599 19.561 16.509 1.00 0.00 C0 ATOM 1883 CG1 ILE D 14 20.342 20.440 16.583 1.00 0.00 C0 ATOM 1884 CG2 ILE D 14 22.680 20.122 17.439 1.00 0.00 C0 ATOM 1885 CD1 ILE D 14 20.727 21.925 16.615 1.00 0.00 C0 ATOM 0 H ILE D 14 20.354 18.464 14.693 1.00 0.00 H new ATOM 0 HA ILE D 14 22.238 20.558 14.702 1.00 0.00 H new ATOM 0 HB ILE D 14 21.350 18.547 16.822 1.00 0.00 H new ATOM 0 HG12 ILE D 14 19.702 20.243 15.723 1.00 0.00 H new ATOM 0 HG13 ILE D 14 19.767 20.188 17.474 1.00 0.00 H new ATOM 0 HG21 ILE D 14 22.307 20.137 18.463 1.00 0.00 H new ATOM 0 HG22 ILE D 14 23.568 19.492 17.386 1.00 0.00 H new ATOM 0 HG23 ILE D 14 22.935 21.136 17.131 1.00 0.00 H new ATOM 0 HD11 ILE D 14 19.824 22.534 16.667 1.00 0.00 H new ATOM 0 HD12 ILE D 14 21.348 22.121 17.489 1.00 0.00 H new ATOM 0 HD13 ILE D 14 21.282 22.176 15.711 1.00 0.00 H new ATOM 1897 N LEU D 15 23.469 17.524 15.139 1.00 0.00 N0 ATOM 1898 CA LEU D 15 24.702 16.741 15.126 1.00 0.00 C0 ATOM 1899 C LEU D 15 25.387 16.818 13.761 1.00 0.00 C0 ATOM 1900 O LEU D 15 26.608 16.714 13.662 1.00 0.00 O0 ATOM 1901 CB LEU D 15 24.377 15.279 15.449 1.00 0.00 C0 ATOM 1902 CG LEU D 15 23.893 15.161 16.897 1.00 0.00 C0 ATOM 1903 CD1 LEU D 15 23.252 13.788 17.110 1.00 0.00 C0 ATOM 1904 CD2 LEU D 15 25.080 15.309 17.852 1.00 0.00 C0 ATOM 0 H LEU D 15 22.619 16.970 15.239 1.00 0.00 H new ATOM 0 HA LEU D 15 25.379 17.151 15.875 1.00 0.00 H new ATOM 0 HB2 LEU D 15 23.610 14.909 14.769 1.00 0.00 H new ATOM 0 HB3 LEU D 15 25.261 14.659 15.300 1.00 0.00 H new ATOM 0 HG LEU D 15 23.163 15.946 17.095 1.00 0.00 H new ATOM 0 HD11 LEU D 15 22.907 13.703 18.141 1.00 0.00 H new ATOM 0 HD12 LEU D 15 22.405 13.673 16.433 1.00 0.00 H new ATOM 0 HD13 LEU D 15 23.986 13.008 16.908 1.00 0.00 H new ATOM 0 HD21 LEU D 15 24.732 15.224 18.881 1.00 0.00 H new ATOM 0 HD22 LEU D 15 25.809 14.525 17.650 1.00 0.00 H new ATOM 0 HD23 LEU D 15 25.546 16.284 17.705 1.00 0.00 H new ATOM 1916 N SER D 16 24.592 17.015 12.717 1.00 0.00 N0 ATOM 1917 CA SER D 16 25.121 17.112 11.359 1.00 0.00 C0 ATOM 1918 C SER D 16 25.869 18.425 11.152 1.00 0.00 C0 ATOM 1919 O SER D 16 26.979 18.446 10.605 1.00 0.00 O0 ATOM 1920 CB SER D 16 23.975 17.012 10.352 1.00 0.00 C0 ATOM 1921 OG SER D 16 24.503 17.055 9.032 1.00 0.00 O0 ATOM 0 H SER D 16 23.579 17.111 12.783 1.00 0.00 H new ATOM 0 HA SER D 16 25.821 16.291 11.206 1.00 0.00 H new ATOM 0 HB2 SER D 16 23.422 16.085 10.504 1.00 0.00 H new ATOM 0 HB3 SER D 16 23.272 17.831 10.501 1.00 0.00 H new ATOM 0 HG SER D 16 23.919 17.599 8.463 1.00 0.00 H new ATOM 1927 N ALA D 17 25.261 19.519 11.606 1.00 0.00 N0 ATOM 1928 CA ALA D 17 25.872 20.835 11.480 1.00 0.00 C0 ATOM 1929 C ALA D 17 27.133 20.924 12.330 1.00 0.00 C0 ATOM 1930 O ALA D 17 28.137 21.507 11.915 1.00 0.00 O0 ATOM 1931 CB ALA D 17 24.878 21.920 11.908 1.00 0.00 C0 ATOM 0 H ALA D 17 24.349 19.518 12.063 1.00 0.00 H new ATOM 0 HA ALA D 17 26.144 20.990 10.436 1.00 0.00 H new ATOM 0 HB1 ALA D 17 25.345 22.900 11.810 1.00 0.00 H new ATOM 0 HB2 ALA D 17 23.993 21.874 11.273 1.00 0.00 H new ATOM 0 HB3 ALA D 17 24.588 21.758 12.946 1.00 0.00 H new ATOM 1937 N LEU D 18 27.092 20.325 13.517 1.00 0.00 N0 ATOM 1938 CA LEU D 18 28.244 20.335 14.405 1.00 0.00 C0 ATOM 1939 C LEU D 18 29.349 19.417 13.890 1.00 0.00 C0 ATOM 1940 O LEU D 18 30.535 19.677 14.119 1.00 0.00 O0 ATOM 1941 CB LEU D 18 27.815 19.898 15.809 1.00 0.00 C0 ATOM 1942 CG LEU D 18 27.088 21.051 16.506 1.00 0.00 C0 ATOM 1943 CD1 LEU D 18 26.268 20.509 17.677 1.00 0.00 C0 ATOM 1944 CD2 LEU D 18 28.118 22.050 17.040 1.00 0.00 C0 ATOM 0 H LEU D 18 26.278 19.830 13.882 1.00 0.00 H new ATOM 0 HA LEU D 18 28.639 21.350 14.441 1.00 0.00 H new ATOM 0 HB2 LEU D 18 27.162 19.028 15.746 1.00 0.00 H new ATOM 0 HB3 LEU D 18 28.687 19.600 16.391 1.00 0.00 H new ATOM 0 HG LEU D 18 26.427 21.543 15.793 1.00 0.00 H new ATOM 0 HD11 LEU D 18 25.752 21.332 18.171 1.00 0.00 H new ATOM 0 HD12 LEU D 18 25.536 19.791 17.307 1.00 0.00 H new ATOM 0 HD13 LEU D 18 26.931 20.017 18.389 1.00 0.00 H new ATOM 0 HD21 LEU D 18 27.603 22.872 17.537 1.00 0.00 H new ATOM 0 HD22 LEU D 18 28.775 21.550 17.752 1.00 0.00 H new ATOM 0 HD23 LEU D 18 28.710 22.440 16.212 1.00 0.00 H new ATOM 1956 N HIS D 19 28.962 18.354 13.185 1.00 0.00 N0 ATOM 1957 CA HIS D 19 29.939 17.419 12.641 1.00 0.00 C0 ATOM 1958 C HIS D 19 30.772 18.087 11.559 1.00 0.00 C0 ATOM 1959 O HIS D 19 32.003 18.009 11.572 1.00 0.00 O0 ATOM 1960 CB HIS D 19 29.222 16.202 12.060 1.00 0.00 C0 ATOM 1961 CG HIS D 19 30.228 15.142 11.713 1.00 0.00 C0 ATOM 1962 ND1 HIS D 19 30.638 14.189 12.631 1.00 0.00 N0 ATOM 1963 CD2 HIS D 19 30.919 14.874 10.558 1.00 0.00 C0 ATOM 1964 CE1 HIS D 19 31.536 13.397 12.020 1.00 0.00 C0 ATOM 1965 NE2 HIS D 19 31.744 13.771 10.754 1.00 0.00 N0 ATOM 0 H HIS D 19 27.990 18.123 12.980 1.00 0.00 H new ATOM 0 HA HIS D 19 30.602 17.101 13.446 1.00 0.00 H new ATOM 0 HB2 HIS D 19 28.503 15.813 12.781 1.00 0.00 H new ATOM 0 HB3 HIS D 19 28.660 16.489 11.171 1.00 0.00 H new ATOM 0 HD2 HIS D 19 30.835 15.433 9.638 1.00 0.00 H new ATOM 0 HE1 HIS D 19 32.029 12.561 12.494 1.00 0.00 H new ATOM 0 HE2 HIS D 19 32.373 13.340 10.076 1.00 0.00 H new ATOM 1973 N PHE D 20 30.098 18.752 10.626 1.00 0.00 N0 ATOM 1974 CA PHE D 20 30.804 19.431 9.547 1.00 0.00 C0 ATOM 1975 C PHE D 20 31.557 20.642 10.083 1.00 0.00 C0 ATOM 1976 O PHE D 20 32.586 21.026 9.540 1.00 0.00 O0 ATOM 1977 CB PHE D 20 29.829 19.865 8.451 1.00 0.00 C0 ATOM 1978 CG PHE D 20 30.039 19.007 7.220 1.00 0.00 C0 ATOM 1979 CD1 PHE D 20 29.717 17.644 7.246 1.00 0.00 C0 ATOM 1980 CD2 PHE D 20 30.562 19.578 6.051 1.00 0.00 C0 ATOM 1981 CE1 PHE D 20 29.916 16.854 6.105 1.00 0.00 C0 ATOM 1982 CE2 PHE D 20 30.761 18.788 4.912 1.00 0.00 C0 ATOM 1983 CZ PHE D 20 30.438 17.424 4.938 1.00 0.00 C0 ATOM 0 H PHE D 20 29.082 18.835 10.595 1.00 0.00 H new ATOM 0 HA PHE D 20 31.521 18.731 9.118 1.00 0.00 H new ATOM 0 HB2 PHE D 20 28.802 19.769 8.804 1.00 0.00 H new ATOM 0 HB3 PHE D 20 29.985 20.916 8.206 1.00 0.00 H new ATOM 0 HD1 PHE D 20 29.315 17.201 8.145 1.00 0.00 H new ATOM 0 HD2 PHE D 20 30.812 20.629 6.029 1.00 0.00 H new ATOM 0 HE1 PHE D 20 29.666 15.804 6.127 1.00 0.00 H new ATOM 0 HE2 PHE D 20 31.164 19.230 4.013 1.00 0.00 H new ATOM 0 HZ PHE D 20 30.592 16.815 4.060 1.00 0.00 H new ATOM 1993 N MET D 21 31.043 21.237 11.153 1.00 0.00 N0 ATOM 1994 CA MET D 21 31.692 22.399 11.747 1.00 0.00 C0 ATOM 1995 C MET D 21 33.089 22.044 12.251 1.00 0.00 C0 ATOM 1996 O MET D 21 34.080 22.697 11.896 1.00 0.00 O0 ATOM 1997 CB MET D 21 30.845 22.914 12.909 1.00 0.00 C0 ATOM 1998 CG MET D 21 29.899 24.003 12.400 1.00 0.00 C0 ATOM 1999 SD MET D 21 28.983 24.712 13.794 1.00 0.00 S0 ATOM 2000 CE MET D 21 27.621 25.467 12.860 1.00 0.00 C0 ATOM 0 H MET D 21 30.188 20.938 11.623 1.00 0.00 H new ATOM 0 HA MET D 21 31.787 23.172 10.984 1.00 0.00 H new ATOM 0 HB2 MET D 21 30.274 22.096 13.348 1.00 0.00 H new ATOM 0 HB3 MET D 21 31.488 23.312 13.694 1.00 0.00 H new ATOM 0 HG2 MET D 21 30.466 24.782 11.890 1.00 0.00 H new ATOM 0 HG3 MET D 21 29.205 23.585 11.671 1.00 0.00 H new ATOM 0 HE1 MET D 21 26.937 25.961 13.550 1.00 0.00 H new ATOM 0 HE2 MET D 21 28.022 26.199 12.159 1.00 0.00 H new ATOM 0 HE3 MET D 21 27.085 24.694 12.309 1.00 0.00 H new ATOM 2010 N ALA D 22 33.168 21.007 13.073 1.00 0.00 N0 ATOM 2011 CA ALA D 22 34.453 20.587 13.608 1.00 0.00 C0 ATOM 2012 C ALA D 22 35.360 20.087 12.492 1.00 0.00 C0 ATOM 2013 O ALA D 22 36.558 20.365 12.481 1.00 0.00 O0 ATOM 2014 CB ALA D 22 34.256 19.487 14.647 1.00 0.00 C0 ATOM 0 H ALA D 22 32.371 20.449 13.380 1.00 0.00 H new ATOM 0 HA ALA D 22 34.925 21.447 14.083 1.00 0.00 H new ATOM 0 HB1 ALA D 22 35.225 19.180 15.041 1.00 0.00 H new ATOM 0 HB2 ALA D 22 33.636 19.862 15.461 1.00 0.00 H new ATOM 0 HB3 ALA D 22 33.766 18.631 14.182 1.00 0.00 H new ATOM 2020 N TRP D 23 34.782 19.342 11.554 1.00 0.00 N0 ATOM 2021 CA TRP D 23 35.554 18.802 10.442 1.00 0.00 C0 ATOM 2022 C TRP D 23 36.187 19.923 9.623 1.00 0.00 C0 ATOM 2023 O TRP D 23 37.381 19.888 9.331 1.00 0.00 O0 ATOM 2024 CB TRP D 23 34.649 17.962 9.545 1.00 0.00 C0 ATOM 2025 CG TRP D 23 35.231 16.596 9.396 1.00 0.00 C0 ATOM 2026 CD1 TRP D 23 34.860 15.504 10.101 1.00 0.00 C0 ATOM 2027 CD2 TRP D 23 36.285 16.159 8.486 1.00 0.00 C0 ATOM 2028 NE1 TRP D 23 35.618 14.423 9.683 1.00 0.00 N0 ATOM 2029 CE2 TRP D 23 36.510 14.778 8.690 1.00 0.00 C0 ATOM 2030 CE3 TRP D 23 37.058 16.822 7.515 1.00 0.00 C0 ATOM 2031 CZ2 TRP D 23 37.470 14.077 7.955 1.00 0.00 C0 ATOM 2032 CZ3 TRP D 23 38.024 16.123 6.773 1.00 0.00 C0 ATOM 2033 CH2 TRP D 23 38.229 14.752 6.993 1.00 0.00 C0 ATOM 0 H TRP D 23 33.791 19.101 11.542 1.00 0.00 H new ATOM 0 HA TRP D 23 36.350 18.178 10.849 1.00 0.00 H new ATOM 0 HB2 TRP D 23 33.649 17.899 9.975 1.00 0.00 H new ATOM 0 HB3 TRP D 23 34.547 18.434 8.568 1.00 0.00 H new ATOM 0 HD1 TRP D 23 34.097 15.479 10.865 1.00 0.00 H new ATOM 0 HE1 TRP D 23 35.529 13.480 10.062 1.00 0.00 H new ATOM 0 HE3 TRP D 23 36.907 17.877 7.339 1.00 0.00 H new ATOM 0 HZ2 TRP D 23 37.625 13.022 8.128 1.00 0.00 H new ATOM 0 HZ3 TRP D 23 38.611 16.642 6.030 1.00 0.00 H new ATOM 0 HH2 TRP D 23 38.973 14.218 6.420 1.00 0.00 H new ATOM 2044 N THR D 24 35.380 20.911 9.251 1.00 0.00 N0 ATOM 2045 CA THR D 24 35.877 22.033 8.463 1.00 0.00 C0 ATOM 2046 C THR D 24 37.070 22.672 9.155 1.00 0.00 C0 ATOM 2047 O THR D 24 38.105 22.912 8.530 1.00 0.00 O0 ATOM 2048 CB THR D 24 34.771 23.077 8.279 1.00 0.00 C0 ATOM 2049 OG1 THR D 24 33.999 23.160 9.466 1.00 0.00 O0 ATOM 2050 CG2 THR D 24 33.866 22.679 7.110 1.00 0.00 C0 ATOM 0 H THR D 24 34.387 20.958 9.480 1.00 0.00 H new ATOM 0 HA THR D 24 36.187 21.662 7.486 1.00 0.00 H new ATOM 0 HB THR D 24 35.224 24.045 8.067 1.00 0.00 H new ATOM 0 HG1 THR D 24 33.264 22.513 9.424 1.00 0.00 H new ATOM 0 HG21 THR D 24 33.082 23.426 6.986 1.00 0.00 H new ATOM 0 HG22 THR D 24 34.457 22.618 6.196 1.00 0.00 H new ATOM 0 HG23 THR D 24 33.413 21.709 7.314 1.00 0.00 H new ATOM 2058 N ILE D 25 36.933 22.934 10.451 1.00 0.00 N0 ATOM 2059 CA ILE D 25 38.029 23.533 11.203 1.00 0.00 C0 ATOM 2060 C ILE D 25 39.232 22.598 11.234 1.00 0.00 C0 ATOM 2061 O ILE D 25 40.372 23.036 11.134 1.00 0.00 O0 ATOM 2062 CB ILE D 25 37.582 23.849 12.629 1.00 0.00 C0 ATOM 2063 CG1 ILE D 25 36.578 25.003 12.591 1.00 0.00 C0 ATOM 2064 CG2 ILE D 25 38.793 24.251 13.475 1.00 0.00 C0 ATOM 2065 CD1 ILE D 25 35.929 25.165 13.965 1.00 0.00 C0 ATOM 0 H ILE D 25 36.090 22.745 10.994 1.00 0.00 H new ATOM 0 HA ILE D 25 38.318 24.459 10.707 1.00 0.00 H new ATOM 0 HB ILE D 25 37.117 22.968 13.071 1.00 0.00 H new ATOM 0 HG12 ILE D 25 37.081 25.926 12.304 1.00 0.00 H new ATOM 0 HG13 ILE D 25 35.814 24.809 11.838 1.00 0.00 H new ATOM 0 HG21 ILE D 25 38.469 24.475 14.491 1.00 0.00 H new ATOM 0 HG22 ILE D 25 39.511 23.431 13.496 1.00 0.00 H new ATOM 0 HG23 ILE D 25 39.263 25.133 13.041 1.00 0.00 H new ATOM 0 HD11 ILE D 25 35.214 25.988 13.935 1.00 0.00 H new ATOM 0 HD12 ILE D 25 35.411 24.244 14.234 1.00 0.00 H new ATOM 0 HD13 ILE D 25 36.698 25.379 14.708 1.00 0.00 H new ATOM 2077 N GLY D 26 38.961 21.307 11.384 1.00 0.00 N0 ATOM 2078 CA GLY D 26 40.028 20.312 11.437 1.00 0.00 C0 ATOM 2079 C GLY D 26 40.866 20.331 10.160 1.00 0.00 C0 ATOM 2080 O GLY D 26 42.095 20.378 10.214 1.00 0.00 O0 ATOM 0 H GLY D 26 38.019 20.925 11.471 1.00 0.00 H new ATOM 0 HA2 GLY D 26 40.668 20.507 12.298 1.00 0.00 H new ATOM 0 HA3 GLY D 26 39.597 19.321 11.578 1.00 0.00 H new ATOM 2084 N HIS D 27 40.193 20.297 9.015 1.00 0.00 N0 ATOM 2085 CA HIS D 27 40.880 20.315 7.727 1.00 0.00 C0 ATOM 2086 C HIS D 27 41.578 21.652 7.501 1.00 0.00 C0 ATOM 2087 O HIS D 27 42.687 21.703 6.972 1.00 0.00 O0 ATOM 2088 CB HIS D 27 39.881 20.069 6.596 1.00 0.00 C0 ATOM 2089 CG HIS D 27 40.624 19.928 5.296 1.00 0.00 C0 ATOM 2090 ND1 HIS D 27 41.058 21.026 4.572 1.00 0.00 N0 ATOM 2091 CD2 HIS D 27 41.016 18.826 4.577 1.00 0.00 C0 ATOM 2092 CE1 HIS D 27 41.681 20.567 3.471 1.00 0.00 C0 ATOM 2093 NE2 HIS D 27 41.683 19.232 3.425 1.00 0.00 N0 ATOM 0 H HIS D 27 39.176 20.257 8.951 1.00 0.00 H new ATOM 0 HA HIS D 27 41.630 19.524 7.733 1.00 0.00 H new ATOM 0 HB2 HIS D 27 39.302 19.167 6.797 1.00 0.00 H new ATOM 0 HB3 HIS D 27 39.173 20.895 6.535 1.00 0.00 H new ATOM 0 HD2 HIS D 27 40.834 17.800 4.862 1.00 0.00 H new ATOM 0 HE1 HIS D 27 42.125 21.200 2.717 1.00 0.00 H new ATOM 0 HE2 HIS D 27 42.087 18.638 2.701 1.00 0.00 H new ATOM 2101 N LEU D 28 40.923 22.730 7.913 1.00 0.00 N0 ATOM 2102 CA LEU D 28 41.490 24.063 7.759 1.00 0.00 C0 ATOM 2103 C LEU D 28 42.724 24.242 8.640 1.00 0.00 C0 ATOM 2104 O LEU D 28 43.686 24.896 8.240 1.00 0.00 O0 ATOM 2105 CB LEU D 28 40.442 25.121 8.111 1.00 0.00 C0 ATOM 2106 CG LEU D 28 39.388 25.180 7.004 1.00 0.00 C0 ATOM 2107 CD1 LEU D 28 38.180 25.984 7.490 1.00 0.00 C0 ATOM 2108 CD2 LEU D 28 39.987 25.860 5.766 1.00 0.00 C0 ATOM 0 H LEU D 28 40.004 22.708 8.354 1.00 0.00 H new ATOM 0 HA LEU D 28 41.793 24.184 6.719 1.00 0.00 H new ATOM 0 HB2 LEU D 28 39.971 24.880 9.064 1.00 0.00 H new ATOM 0 HB3 LEU D 28 40.917 26.095 8.228 1.00 0.00 H new ATOM 0 HG LEU D 28 39.072 24.168 6.749 1.00 0.00 H new ATOM 0 HD11 LEU D 28 37.429 26.026 6.701 1.00 0.00 H new ATOM 0 HD12 LEU D 28 37.754 25.504 8.371 1.00 0.00 H new ATOM 0 HD13 LEU D 28 38.495 26.996 7.745 1.00 0.00 H new ATOM 0 HD21 LEU D 28 39.237 25.903 4.976 1.00 0.00 H new ATOM 0 HD22 LEU D 28 40.302 26.871 6.023 1.00 0.00 H new ATOM 0 HD23 LEU D 28 40.848 25.289 5.418 1.00 0.00 H new