USER MOD reduce.3.24.130724 H: found=0, std=0, add=770, rem=0, adj=24 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 Single : A 6 GLN : amide:sc= -0.359 K(o=-0.36,f=-2.7!) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 11 CYS SG : rot 180:sc= 0 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 78:sc= 1.25 USER MOD Single : A 19 HIS : no HE2:sc= -0.14 K(o=-0.14,f=-0.93) USER MOD Single : A 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 83:sc= 1.2 USER MOD Single : A 27 HIS : no HD1:sc= -1.23 X(o=-1.2,f=-1.1) USER MOD Single : B 6 GLN : amide:sc= -0.185 K(o=-0.18,f=-2!) USER MOD Single : B 9 SER OG : rot 180:sc= 0 USER MOD Single : B 11 CYS SG : rot 180:sc= 0 USER MOD Single : B 12 SER OG : rot 180:sc= 0 USER MOD Single : B 16 SER OG : rot 70:sc= 1.23 USER MOD Single : B 19 HIS : no HE2:sc= -0.17 K(o=-0.17,f=-0.87) USER MOD Single : B 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 24 THR OG1 : rot 71:sc= 1.23 USER MOD Single : B 27 HIS : no HD1:sc= -1.24 X(o=-1.2,f=-1.1) USER MOD Single : C 6 GLN : amide:sc= -0.4 K(o=-0.4,f=-2.7!) USER MOD Single : C 9 SER OG : rot 180:sc= 0 USER MOD Single : C 11 CYS SG : rot 180:sc= 0 USER MOD Single : C 12 SER OG : rot 180:sc= 0 USER MOD Single : C 16 SER OG : rot 56:sc= 1.24 USER MOD Single : C 19 HIS : no HE2:sc= -0.197 K(o=-0.2,f=-0.77) USER MOD Single : C 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 24 THR OG1 : rot 75:sc= 1.24 USER MOD Single : C 27 HIS : no HD1:sc= -1.24 X(o=-1.2,f=-1.1) USER MOD Single : D 6 GLN : amide:sc= -0.118 K(o=-0.12,f=-1.9!) USER MOD Single : D 9 SER OG : rot 180:sc= 0 USER MOD Single : D 11 CYS SG : rot 180:sc= 0 USER MOD Single : D 12 SER OG : rot 180:sc= 0 USER MOD Single : D 16 SER OG : rot 88:sc= 1.24 USER MOD Single : D 19 HIS : no HE2:sc= -0.147 K(o=-0.15,f=-0.83) USER MOD Single : D 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : D 24 THR OG1 : rot 75:sc= 1.25 USER MOD Single : D 27 HIS : no HD1:sc= -1.24 X(o=-1.2,f=-1.2) USER MOD ----------------------------------------------------------------- ATOM 69 N PHE A 5 8.946 11.361 6.238 1.00 0.00 N0 ATOM 70 CA PHE A 5 10.050 10.425 6.056 1.00 0.00 C0 ATOM 71 C PHE A 5 10.781 10.716 4.751 1.00 0.00 C0 ATOM 72 O PHE A 5 11.987 10.497 4.641 1.00 0.00 O0 ATOM 73 CB PHE A 5 9.525 8.985 6.036 1.00 0.00 C0 ATOM 74 CG PHE A 5 9.615 8.429 4.633 1.00 0.00 C0 ATOM 75 CD1 PHE A 5 10.747 7.699 4.245 1.00 0.00 C0 ATOM 76 CD2 PHE A 5 8.576 8.644 3.720 1.00 0.00 C0 ATOM 77 CE1 PHE A 5 10.839 7.187 2.946 1.00 0.00 C0 ATOM 78 CE2 PHE A 5 8.669 8.131 2.420 1.00 0.00 C0 ATOM 79 CZ PHE A 5 9.799 7.403 2.033 1.00 0.00 C0 ATOM 0 HA PHE A 5 10.743 10.544 6.889 1.00 0.00 H new ATOM 0 HB2 PHE A 5 10.106 8.367 6.720 1.00 0.00 H new ATOM 0 HB3 PHE A 5 8.492 8.960 6.382 1.00 0.00 H new ATOM 0 HD1 PHE A 5 11.549 7.532 4.949 1.00 0.00 H new ATOM 0 HD2 PHE A 5 7.703 9.205 4.018 1.00 0.00 H new ATOM 0 HE1 PHE A 5 11.712 6.625 2.647 1.00 0.00 H new ATOM 0 HE2 PHE A 5 7.867 8.298 1.716 1.00 0.00 H new ATOM 0 HZ PHE A 5 9.870 7.008 1.030 1.00 0.00 H new ATOM 89 N GLN A 6 10.045 11.220 3.766 1.00 0.00 N0 ATOM 90 CA GLN A 6 10.636 11.539 2.473 1.00 0.00 C0 ATOM 91 C GLN A 6 11.627 12.690 2.606 1.00 0.00 C0 ATOM 92 O GLN A 6 12.698 12.672 1.998 1.00 0.00 O0 ATOM 93 CB GLN A 6 9.538 11.923 1.479 1.00 0.00 C0 ATOM 94 CG GLN A 6 10.121 11.983 0.066 1.00 0.00 C0 ATOM 95 CD GLN A 6 10.347 10.570 -0.464 1.00 0.00 C0 ATOM 96 OE1 GLN A 6 9.671 9.633 -0.038 1.00 0.00 O0 ATOM 97 NE2 GLN A 6 11.254 10.359 -1.378 1.00 0.00 N0 ATOM 0 H GLN A 6 9.046 11.415 3.838 1.00 0.00 H new ATOM 0 HA GLN A 6 11.166 10.658 2.109 1.00 0.00 H new ATOM 0 HB2 GLN A 6 8.728 11.195 1.518 1.00 0.00 H new ATOM 0 HB3 GLN A 6 9.112 12.889 1.748 1.00 0.00 H new ATOM 0 HG2 GLN A 6 9.443 12.524 -0.594 1.00 0.00 H new ATOM 0 HG3 GLN A 6 11.062 12.532 0.075 1.00 0.00 H new ATOM 0 HE21 GLN A 6 11.813 11.136 -1.730 1.00 0.00 H new ATOM 0 HE22 GLN A 6 11.404 9.417 -1.740 1.00 0.00 H new ATOM 106 N ILE A 7 11.263 13.688 3.411 1.00 0.00 N0 ATOM 107 CA ILE A 7 12.126 14.848 3.625 1.00 0.00 C0 ATOM 108 C ILE A 7 13.411 14.438 4.334 1.00 0.00 C0 ATOM 109 O ILE A 7 14.505 14.853 3.955 1.00 0.00 O0 ATOM 110 CB ILE A 7 11.391 15.887 4.470 1.00 0.00 C0 ATOM 111 CG1 ILE A 7 10.202 16.432 3.681 1.00 0.00 C0 ATOM 112 CG2 ILE A 7 12.341 17.040 4.803 1.00 0.00 C0 ATOM 113 CD1 ILE A 7 9.265 17.175 4.628 1.00 0.00 C0 ATOM 0 H ILE A 7 10.381 13.716 3.923 1.00 0.00 H new ATOM 0 HA ILE A 7 12.380 15.274 2.654 1.00 0.00 H new ATOM 0 HB ILE A 7 11.041 15.422 5.392 1.00 0.00 H new ATOM 0 HG12 ILE A 7 10.549 17.102 2.895 1.00 0.00 H new ATOM 0 HG13 ILE A 7 9.671 15.616 3.192 1.00 0.00 H new ATOM 0 HG21 ILE A 7 11.816 17.781 5.406 1.00 0.00 H new ATOM 0 HG22 ILE A 7 13.196 16.658 5.361 1.00 0.00 H new ATOM 0 HG23 ILE A 7 12.688 17.503 3.880 1.00 0.00 H new ATOM 0 HD11 ILE A 7 8.415 17.565 4.067 1.00 0.00 H new ATOM 0 HD12 ILE A 7 8.908 16.491 5.398 1.00 0.00 H new ATOM 0 HD13 ILE A 7 9.801 18.001 5.096 1.00 0.00 H new ATOM 125 N LEU A 8 13.273 13.626 5.372 1.00 0.00 N0 ATOM 126 CA LEU A 8 14.436 13.174 6.122 1.00 0.00 C0 ATOM 127 C LEU A 8 15.253 12.183 5.294 1.00 0.00 C0 ATOM 128 O LEU A 8 16.475 12.109 5.425 1.00 0.00 O0 ATOM 129 CB LEU A 8 13.999 12.510 7.428 1.00 0.00 C0 ATOM 130 CG LEU A 8 15.230 12.226 8.295 1.00 0.00 C0 ATOM 131 CD1 LEU A 8 15.782 13.537 8.862 1.00 0.00 C0 ATOM 132 CD2 LEU A 8 14.837 11.299 9.444 1.00 0.00 C0 ATOM 0 H LEU A 8 12.379 13.270 5.711 1.00 0.00 H new ATOM 0 HA LEU A 8 15.054 14.042 6.350 1.00 0.00 H new ATOM 0 HB2 LEU A 8 13.306 13.159 7.964 1.00 0.00 H new ATOM 0 HB3 LEU A 8 13.468 11.582 7.216 1.00 0.00 H new ATOM 0 HG LEU A 8 15.997 11.750 7.685 1.00 0.00 H new ATOM 0 HD11 LEU A 8 16.657 13.327 9.477 1.00 0.00 H new ATOM 0 HD12 LEU A 8 16.065 14.198 8.042 1.00 0.00 H new ATOM 0 HD13 LEU A 8 15.018 14.021 9.471 1.00 0.00 H new ATOM 0 HD21 LEU A 8 15.711 11.095 10.062 1.00 0.00 H new ATOM 0 HD22 LEU A 8 14.067 11.777 10.050 1.00 0.00 H new ATOM 0 HD23 LEU A 8 14.452 10.363 9.041 1.00 0.00 H new ATOM 144 N SER A 9 14.560 11.429 4.443 1.00 0.00 N0 ATOM 145 CA SER A 9 15.214 10.443 3.590 1.00 0.00 C0 ATOM 146 C SER A 9 16.132 11.099 2.566 1.00 0.00 C0 ATOM 147 O SER A 9 17.291 10.710 2.413 1.00 0.00 O0 ATOM 148 CB SER A 9 14.163 9.605 2.861 1.00 0.00 C0 ATOM 149 OG SER A 9 14.814 8.709 1.970 1.00 0.00 O0 ATOM 0 H SER A 9 13.548 11.483 4.327 1.00 0.00 H new ATOM 0 HA SER A 9 15.822 9.806 4.233 1.00 0.00 H new ATOM 0 HB2 SER A 9 13.562 9.049 3.580 1.00 0.00 H new ATOM 0 HB3 SER A 9 13.482 10.254 2.310 1.00 0.00 H new ATOM 0 HG SER A 9 14.144 8.169 1.502 1.00 0.00 H new ATOM 155 N ILE A 10 15.609 12.097 1.862 1.00 0.00 N0 ATOM 156 CA ILE A 10 16.390 12.793 0.847 1.00 0.00 C0 ATOM 157 C ILE A 10 17.411 13.724 1.492 1.00 0.00 C0 ATOM 158 O ILE A 10 18.456 14.007 0.906 1.00 0.00 O0 ATOM 159 CB ILE A 10 15.462 13.598 -0.071 1.00 0.00 C0 ATOM 160 CG1 ILE A 10 14.678 14.620 0.759 1.00 0.00 C0 ATOM 161 CG2 ILE A 10 14.475 12.651 -0.758 1.00 0.00 C0 ATOM 162 CD1 ILE A 10 15.321 16.005 0.630 1.00 0.00 C0 ATOM 0 H ILE A 10 14.655 12.440 1.974 1.00 0.00 H new ATOM 0 HA ILE A 10 16.924 12.048 0.257 1.00 0.00 H new ATOM 0 HB ILE A 10 16.060 14.115 -0.821 1.00 0.00 H new ATOM 0 HG12 ILE A 10 13.643 14.658 0.421 1.00 0.00 H new ATOM 0 HG13 ILE A 10 14.660 14.314 1.805 1.00 0.00 H new ATOM 0 HG21 ILE A 10 13.816 13.223 -1.410 1.00 0.00 H new ATOM 0 HG22 ILE A 10 15.025 11.919 -1.350 1.00 0.00 H new ATOM 0 HG23 ILE A 10 13.881 12.135 -0.004 1.00 0.00 H new ATOM 0 HD11 ILE A 10 14.757 16.725 1.223 1.00 0.00 H new ATOM 0 HD12 ILE A 10 16.349 15.964 0.990 1.00 0.00 H new ATOM 0 HD13 ILE A 10 15.315 16.313 -0.416 1.00 0.00 H new ATOM 174 N CYS A 11 17.115 14.190 2.702 1.00 0.00 N0 ATOM 175 CA CYS A 11 18.030 15.080 3.405 1.00 0.00 C0 ATOM 176 C CYS A 11 19.316 14.343 3.787 1.00 0.00 C0 ATOM 177 O CYS A 11 20.427 14.789 3.473 1.00 0.00 O0 ATOM 178 CB CYS A 11 17.349 15.614 4.666 1.00 0.00 C0 ATOM 179 SG CYS A 11 18.430 16.813 5.482 1.00 0.00 S0 ATOM 0 H CYS A 11 16.259 13.969 3.210 1.00 0.00 H new ATOM 0 HA CYS A 11 18.290 15.908 2.746 1.00 0.00 H new ATOM 0 HB2 CYS A 11 16.400 16.083 4.407 1.00 0.00 H new ATOM 0 HB3 CYS A 11 17.124 14.792 5.345 1.00 0.00 H new ATOM 0 HG CYS A 11 17.846 17.266 6.552 1.00 0.00 H new ATOM 185 N SER A 12 19.156 13.203 4.457 1.00 0.00 N0 ATOM 186 CA SER A 12 20.303 12.405 4.874 1.00 0.00 C0 ATOM 187 C SER A 12 21.006 11.812 3.659 1.00 0.00 C0 ATOM 188 O SER A 12 22.230 11.715 3.626 1.00 0.00 O0 ATOM 189 CB SER A 12 19.860 11.287 5.817 1.00 0.00 C0 ATOM 190 OG SER A 12 19.361 11.861 7.018 1.00 0.00 O0 ATOM 0 H SER A 12 18.250 12.815 4.720 1.00 0.00 H new ATOM 0 HA SER A 12 21.000 13.055 5.403 1.00 0.00 H new ATOM 0 HB2 SER A 12 19.090 10.678 5.343 1.00 0.00 H new ATOM 0 HB3 SER A 12 20.698 10.626 6.036 1.00 0.00 H new ATOM 0 HG SER A 12 19.074 11.148 7.626 1.00 0.00 H new ATOM 196 N PHE A 13 20.224 11.424 2.661 1.00 0.00 N0 ATOM 197 CA PHE A 13 20.784 10.852 1.445 1.00 0.00 C0 ATOM 198 C PHE A 13 21.761 11.822 0.791 1.00 0.00 C0 ATOM 199 O PHE A 13 22.878 11.447 0.427 1.00 0.00 O0 ATOM 200 CB PHE A 13 19.659 10.517 0.467 1.00 0.00 C0 ATOM 201 CG PHE A 13 20.232 10.342 -0.919 1.00 0.00 C0 ATOM 202 CD1 PHE A 13 21.065 9.255 -1.206 1.00 0.00 C0 ATOM 203 CD2 PHE A 13 19.929 11.275 -1.917 1.00 0.00 C0 ATOM 204 CE1 PHE A 13 21.595 9.100 -2.492 1.00 0.00 C0 ATOM 205 CE2 PHE A 13 20.458 11.121 -3.203 1.00 0.00 C0 ATOM 206 CZ PHE A 13 21.291 10.034 -3.491 1.00 0.00 C0 ATOM 0 H PHE A 13 19.206 11.494 2.669 1.00 0.00 H new ATOM 0 HA PHE A 13 21.323 9.942 1.708 1.00 0.00 H new ATOM 0 HB2 PHE A 13 19.151 9.605 0.780 1.00 0.00 H new ATOM 0 HB3 PHE A 13 18.914 11.313 0.466 1.00 0.00 H new ATOM 0 HD1 PHE A 13 21.299 8.536 -0.435 1.00 0.00 H new ATOM 0 HD2 PHE A 13 19.287 12.114 -1.694 1.00 0.00 H new ATOM 0 HE1 PHE A 13 22.238 8.261 -2.714 1.00 0.00 H new ATOM 0 HE2 PHE A 13 20.224 11.841 -3.973 1.00 0.00 H new ATOM 0 HZ PHE A 13 21.700 9.915 -4.484 1.00 0.00 H new ATOM 216 N ILE A 14 21.342 13.075 0.651 1.00 0.00 N0 ATOM 217 CA ILE A 14 22.197 14.086 0.046 1.00 0.00 C0 ATOM 218 C ILE A 14 23.465 14.279 0.870 1.00 0.00 C0 ATOM 219 O ILE A 14 24.569 14.332 0.329 1.00 0.00 O0 ATOM 220 CB ILE A 14 21.443 15.410 -0.047 1.00 0.00 C0 ATOM 221 CG1 ILE A 14 20.316 15.277 -1.075 1.00 0.00 C0 ATOM 222 CG2 ILE A 14 22.405 16.514 -0.488 1.00 0.00 C0 ATOM 223 CD1 ILE A 14 19.316 16.421 -0.897 1.00 0.00 C0 ATOM 0 H ILE A 14 20.425 13.411 0.945 1.00 0.00 H new ATOM 0 HA ILE A 14 22.476 13.752 -0.953 1.00 0.00 H new ATOM 0 HB ILE A 14 21.024 15.662 0.927 1.00 0.00 H new ATOM 0 HG12 ILE A 14 20.728 15.295 -2.084 1.00 0.00 H new ATOM 0 HG13 ILE A 14 19.812 14.318 -0.954 1.00 0.00 H new ATOM 0 HG21 ILE A 14 21.867 17.460 -0.555 1.00 0.00 H new ATOM 0 HG22 ILE A 14 23.212 16.606 0.239 1.00 0.00 H new ATOM 0 HG23 ILE A 14 22.823 16.264 -1.463 1.00 0.00 H new ATOM 0 HD11 ILE A 14 18.516 16.322 -1.631 1.00 0.00 H new ATOM 0 HD12 ILE A 14 18.894 16.383 0.107 1.00 0.00 H new ATOM 0 HD13 ILE A 14 19.824 17.374 -1.041 1.00 0.00 H new ATOM 235 N LEU A 15 23.300 14.385 2.185 1.00 0.00 N0 ATOM 236 CA LEU A 15 24.447 14.573 3.066 1.00 0.00 C0 ATOM 237 C LEU A 15 25.377 13.362 3.025 1.00 0.00 C0 ATOM 238 O LEU A 15 26.575 13.480 3.274 1.00 0.00 O0 ATOM 239 CB LEU A 15 23.965 14.800 4.503 1.00 0.00 C0 ATOM 240 CG LEU A 15 24.090 16.282 4.876 1.00 0.00 C0 ATOM 241 CD1 LEU A 15 22.794 16.751 5.539 1.00 0.00 C0 ATOM 242 CD2 LEU A 15 25.254 16.454 5.854 1.00 0.00 C0 ATOM 0 H LEU A 15 22.397 14.345 2.658 1.00 0.00 H new ATOM 0 HA LEU A 15 25.002 15.445 2.720 1.00 0.00 H new ATOM 0 HB2 LEU A 15 22.928 14.479 4.601 1.00 0.00 H new ATOM 0 HB3 LEU A 15 24.553 14.193 5.192 1.00 0.00 H new ATOM 0 HG LEU A 15 24.272 16.874 3.979 1.00 0.00 H new ATOM 0 HD11 LEU A 15 22.882 17.804 5.805 1.00 0.00 H new ATOM 0 HD12 LEU A 15 21.963 16.619 4.846 1.00 0.00 H new ATOM 0 HD13 LEU A 15 22.613 16.164 6.439 1.00 0.00 H new ATOM 0 HD21 LEU A 15 25.350 17.506 6.124 1.00 0.00 H new ATOM 0 HD22 LEU A 15 25.066 15.864 6.751 1.00 0.00 H new ATOM 0 HD23 LEU A 15 26.177 16.115 5.384 1.00 0.00 H new ATOM 254 N SER A 16 24.822 12.204 2.695 1.00 0.00 N0 ATOM 255 CA SER A 16 25.615 10.983 2.614 1.00 0.00 C0 ATOM 256 C SER A 16 26.511 10.995 1.378 1.00 0.00 C0 ATOM 257 O SER A 16 27.691 10.630 1.445 1.00 0.00 O0 ATOM 258 CB SER A 16 24.686 9.774 2.558 1.00 0.00 C0 ATOM 259 OG SER A 16 23.934 9.703 3.763 1.00 0.00 O0 ATOM 0 H SER A 16 23.832 12.083 2.480 1.00 0.00 H new ATOM 0 HA SER A 16 26.248 10.924 3.499 1.00 0.00 H new ATOM 0 HB2 SER A 16 24.016 9.855 1.702 1.00 0.00 H new ATOM 0 HB3 SER A 16 25.266 8.861 2.423 1.00 0.00 H new ATOM 0 HG SER A 16 23.205 10.357 3.732 1.00 0.00 H new ATOM 265 N ALA A 17 25.950 11.440 0.258 1.00 0.00 N0 ATOM 266 CA ALA A 17 26.701 11.514 -0.989 1.00 0.00 C0 ATOM 267 C ALA A 17 27.772 12.596 -0.912 1.00 0.00 C0 ATOM 268 O ALA A 17 28.869 12.442 -1.453 1.00 0.00 O0 ATOM 269 CB ALA A 17 25.755 11.809 -2.158 1.00 0.00 C0 ATOM 0 H ALA A 17 24.982 11.753 0.189 1.00 0.00 H new ATOM 0 HA ALA A 17 27.187 10.552 -1.151 1.00 0.00 H new ATOM 0 HB1 ALA A 17 26.327 11.862 -3.084 1.00 0.00 H new ATOM 0 HB2 ALA A 17 25.013 11.014 -2.235 1.00 0.00 H new ATOM 0 HB3 ALA A 17 25.252 12.761 -1.987 1.00 0.00 H new ATOM 275 N LEU A 18 27.461 13.685 -0.220 1.00 0.00 N0 ATOM 276 CA LEU A 18 28.408 14.780 -0.067 1.00 0.00 C0 ATOM 277 C LEU A 18 29.520 14.406 0.910 1.00 0.00 C0 ATOM 278 O LEU A 18 30.672 14.812 0.735 1.00 0.00 O0 ATOM 279 CB LEU A 18 27.667 16.020 0.434 1.00 0.00 C0 ATOM 280 CG LEU A 18 26.705 16.505 -0.653 1.00 0.00 C0 ATOM 281 CD1 LEU A 18 25.696 17.482 -0.046 1.00 0.00 C0 ATOM 282 CD2 LEU A 18 27.494 17.218 -1.754 1.00 0.00 C0 ATOM 0 H LEU A 18 26.564 13.832 0.242 1.00 0.00 H new ATOM 0 HA LEU A 18 28.864 14.989 -1.035 1.00 0.00 H new ATOM 0 HB2 LEU A 18 27.117 15.786 1.345 1.00 0.00 H new ATOM 0 HB3 LEU A 18 28.378 16.807 0.684 1.00 0.00 H new ATOM 0 HG LEU A 18 26.178 15.649 -1.075 1.00 0.00 H new ATOM 0 HD11 LEU A 18 25.012 17.827 -0.821 1.00 0.00 H new ATOM 0 HD12 LEU A 18 25.131 16.980 0.740 1.00 0.00 H new ATOM 0 HD13 LEU A 18 26.225 18.336 0.376 1.00 0.00 H new ATOM 0 HD21 LEU A 18 26.808 17.563 -2.528 1.00 0.00 H new ATOM 0 HD22 LEU A 18 28.021 18.072 -1.329 1.00 0.00 H new ATOM 0 HD23 LEU A 18 28.215 16.527 -2.190 1.00 0.00 H new ATOM 294 N HIS A 19 29.173 13.619 1.933 1.00 0.00 N0 ATOM 295 CA HIS A 19 30.151 13.185 2.924 1.00 0.00 C0 ATOM 296 C HIS A 19 31.205 12.297 2.282 1.00 0.00 C0 ATOM 297 O HIS A 19 32.408 12.501 2.473 1.00 0.00 O0 ATOM 298 CB HIS A 19 29.448 12.419 4.048 1.00 0.00 C0 ATOM 299 CG HIS A 19 30.470 11.921 5.034 1.00 0.00 C0 ATOM 300 ND1 HIS A 19 31.085 10.686 4.899 1.00 0.00 N0 ATOM 301 CD2 HIS A 19 30.994 12.477 6.174 1.00 0.00 C0 ATOM 302 CE1 HIS A 19 31.937 10.540 5.930 1.00 0.00 C0 ATOM 303 NE2 HIS A 19 31.920 11.605 6.737 1.00 0.00 N0 ATOM 0 H HIS A 19 28.227 13.273 2.093 1.00 0.00 H new ATOM 0 HA HIS A 19 30.641 14.067 3.336 1.00 0.00 H new ATOM 0 HB2 HIS A 19 28.729 13.067 4.550 1.00 0.00 H new ATOM 0 HB3 HIS A 19 28.887 11.581 3.635 1.00 0.00 H new ATOM 0 HD1 HIS A 19 30.921 10.010 4.153 1.00 0.00 H new ATOM 0 HD2 HIS A 19 30.728 13.445 6.573 1.00 0.00 H new ATOM 0 HE1 HIS A 19 32.558 9.670 6.086 1.00 0.00 H new ATOM 311 N PHE A 20 30.754 11.313 1.506 1.00 0.00 N0 ATOM 312 CA PHE A 20 31.681 10.408 0.839 1.00 0.00 C0 ATOM 313 C PHE A 20 32.430 11.137 -0.271 1.00 0.00 C0 ATOM 314 O PHE A 20 33.571 10.799 -0.582 1.00 0.00 O0 ATOM 315 CB PHE A 20 30.932 9.204 0.261 1.00 0.00 C0 ATOM 316 CG PHE A 20 31.170 7.995 1.140 1.00 0.00 C0 ATOM 317 CD1 PHE A 20 30.614 7.936 2.426 1.00 0.00 C0 ATOM 318 CD2 PHE A 20 31.955 6.936 0.670 1.00 0.00 C0 ATOM 319 CE1 PHE A 20 30.847 6.816 3.239 1.00 0.00 C0 ATOM 320 CE2 PHE A 20 32.186 5.818 1.481 1.00 0.00 C0 ATOM 321 CZ PHE A 20 31.634 5.758 2.766 1.00 0.00 C0 ATOM 0 H PHE A 20 29.768 11.125 1.327 1.00 0.00 H new ATOM 0 HA PHE A 20 32.402 10.052 1.575 1.00 0.00 H new ATOM 0 HB2 PHE A 20 29.865 9.420 0.201 1.00 0.00 H new ATOM 0 HB3 PHE A 20 31.274 9.002 -0.754 1.00 0.00 H new ATOM 0 HD1 PHE A 20 30.007 8.752 2.790 1.00 0.00 H new ATOM 0 HD2 PHE A 20 32.384 6.981 -0.320 1.00 0.00 H new ATOM 0 HE1 PHE A 20 30.419 6.770 4.230 1.00 0.00 H new ATOM 0 HE2 PHE A 20 32.791 5.001 1.115 1.00 0.00 H new ATOM 0 HZ PHE A 20 31.815 4.897 3.392 1.00 0.00 H new ATOM 331 N MET A 21 31.794 12.150 -0.851 1.00 0.00 N0 ATOM 332 CA MET A 21 32.427 12.923 -1.913 1.00 0.00 C0 ATOM 333 C MET A 21 33.701 13.594 -1.402 1.00 0.00 C0 ATOM 334 O MET A 21 34.795 13.392 -1.948 1.00 0.00 O0 ATOM 335 CB MET A 21 31.454 13.989 -2.417 1.00 0.00 C0 ATOM 336 CG MET A 21 30.887 13.563 -3.773 1.00 0.00 C0 ATOM 337 SD MET A 21 32.103 13.916 -5.068 1.00 0.00 S0 ATOM 338 CE MET A 21 31.018 13.631 -6.488 1.00 0.00 C0 ATOM 0 H MET A 21 30.851 12.452 -0.607 1.00 0.00 H new ATOM 0 HA MET A 21 32.690 12.249 -2.728 1.00 0.00 H new ATOM 0 HB2 MET A 21 30.645 14.126 -1.700 1.00 0.00 H new ATOM 0 HB3 MET A 21 31.964 14.948 -2.509 1.00 0.00 H new ATOM 0 HG2 MET A 21 30.648 12.499 -3.762 1.00 0.00 H new ATOM 0 HG3 MET A 21 29.958 14.096 -3.975 1.00 0.00 H new ATOM 0 HE1 MET A 21 31.575 13.796 -7.410 1.00 0.00 H new ATOM 0 HE2 MET A 21 30.651 12.605 -6.465 1.00 0.00 H new ATOM 0 HE3 MET A 21 30.174 14.320 -6.445 1.00 0.00 H new ATOM 348 N ALA A 22 33.561 14.391 -0.346 1.00 0.00 N0 ATOM 349 CA ALA A 22 34.713 15.077 0.222 1.00 0.00 C0 ATOM 350 C ALA A 22 35.727 14.068 0.747 1.00 0.00 C0 ATOM 351 O ALA A 22 36.932 14.245 0.587 1.00 0.00 O0 ATOM 352 CB ALA A 22 34.268 16.001 1.355 1.00 0.00 C0 ATOM 0 H ALA A 22 32.676 14.575 0.126 1.00 0.00 H new ATOM 0 HA ALA A 22 35.182 15.672 -0.561 1.00 0.00 H new ATOM 0 HB1 ALA A 22 35.137 16.509 1.773 1.00 0.00 H new ATOM 0 HB2 ALA A 22 33.567 16.740 0.968 1.00 0.00 H new ATOM 0 HB3 ALA A 22 33.782 15.414 2.134 1.00 0.00 H new ATOM 358 N TRP A 23 35.229 13.009 1.374 1.00 0.00 N0 ATOM 359 CA TRP A 23 36.104 11.977 1.915 1.00 0.00 C0 ATOM 360 C TRP A 23 36.994 11.398 0.821 1.00 0.00 C0 ATOM 361 O TRP A 23 38.206 11.268 0.996 1.00 0.00 O0 ATOM 362 CB TRP A 23 35.262 10.866 2.539 1.00 0.00 C0 ATOM 363 CG TRP A 23 35.518 10.814 4.009 1.00 0.00 C0 ATOM 364 CD1 TRP A 23 35.010 11.664 4.927 1.00 0.00 C0 ATOM 365 CD2 TRP A 23 36.345 9.862 4.744 1.00 0.00 C0 ATOM 366 NE1 TRP A 23 35.473 11.297 6.179 1.00 0.00 N0 ATOM 367 CE2 TRP A 23 36.300 10.191 6.117 1.00 0.00 C0 ATOM 368 CE3 TRP A 23 37.124 8.756 4.353 1.00 0.00 C0 ATOM 369 CZ2 TRP A 23 37.001 9.452 7.070 1.00 0.00 C0 ATOM 370 CZ3 TRP A 23 37.830 8.007 5.308 1.00 0.00 C0 ATOM 371 CH2 TRP A 23 37.770 8.356 6.665 1.00 0.00 C0 ATOM 0 H TRP A 23 34.233 12.843 1.519 1.00 0.00 H new ATOM 0 HA TRP A 23 36.741 12.424 2.678 1.00 0.00 H new ATOM 0 HB2 TRP A 23 34.204 11.047 2.349 1.00 0.00 H new ATOM 0 HB3 TRP A 23 35.509 9.908 2.082 1.00 0.00 H new ATOM 0 HD1 TRP A 23 34.351 12.494 4.719 1.00 0.00 H new ATOM 0 HE1 TRP A 23 35.233 11.784 7.043 1.00 0.00 H new ATOM 0 HE3 TRP A 23 37.179 8.482 3.310 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 36.950 9.724 8.114 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 38.422 7.159 4.996 1.00 0.00 H new ATOM 0 HH2 TRP A 23 38.317 7.779 7.396 1.00 0.00 H new ATOM 382 N THR A 24 36.383 11.039 -0.301 1.00 0.00 N0 ATOM 383 CA THR A 24 37.127 10.462 -1.411 1.00 0.00 C0 ATOM 384 C THR A 24 38.226 11.415 -1.861 1.00 0.00 C0 ATOM 385 O THR A 24 39.360 10.999 -2.113 1.00 0.00 O0 ATOM 386 CB THR A 24 36.181 10.188 -2.582 1.00 0.00 C0 ATOM 387 OG1 THR A 24 35.173 9.274 -2.171 1.00 0.00 O0 ATOM 388 CG2 THR A 24 36.965 9.589 -3.749 1.00 0.00 C0 ATOM 0 H THR A 24 35.381 11.137 -0.465 1.00 0.00 H new ATOM 0 HA THR A 24 37.579 9.527 -1.080 1.00 0.00 H new ATOM 0 HB THR A 24 35.720 11.123 -2.900 1.00 0.00 H new ATOM 0 HG1 THR A 24 34.461 9.760 -1.705 1.00 0.00 H new ATOM 0 HG21 THR A 24 36.288 9.395 -4.581 1.00 0.00 H new ATOM 0 HG22 THR A 24 37.738 10.289 -4.066 1.00 0.00 H new ATOM 0 HG23 THR A 24 37.429 8.655 -3.434 1.00 0.00 H new ATOM 396 N ILE A 25 37.895 12.696 -1.949 1.00 0.00 N0 ATOM 397 CA ILE A 25 38.877 13.694 -2.361 1.00 0.00 C0 ATOM 398 C ILE A 25 40.000 13.797 -1.327 1.00 0.00 C0 ATOM 399 O ILE A 25 41.179 13.932 -1.671 1.00 0.00 O0 ATOM 400 CB ILE A 25 38.187 15.051 -2.516 1.00 0.00 C0 ATOM 401 CG1 ILE A 25 37.133 14.952 -3.623 1.00 0.00 C0 ATOM 402 CG2 ILE A 25 39.225 16.114 -2.896 1.00 0.00 C0 ATOM 403 CD1 ILE A 25 36.224 16.182 -3.578 1.00 0.00 C0 ATOM 0 H ILE A 25 36.967 13.067 -1.744 1.00 0.00 H new ATOM 0 HA ILE A 25 39.311 13.393 -3.315 1.00 0.00 H new ATOM 0 HB ILE A 25 37.711 15.330 -1.576 1.00 0.00 H new ATOM 0 HG12 ILE A 25 37.619 14.882 -4.596 1.00 0.00 H new ATOM 0 HG13 ILE A 25 36.541 14.045 -3.496 1.00 0.00 H new ATOM 0 HG21 ILE A 25 38.733 17.080 -3.006 1.00 0.00 H new ATOM 0 HG22 ILE A 25 39.982 16.179 -2.114 1.00 0.00 H new ATOM 0 HG23 ILE A 25 39.699 15.839 -3.838 1.00 0.00 H new ATOM 0 HD11 ILE A 25 35.475 16.110 -4.366 1.00 0.00 H new ATOM 0 HD12 ILE A 25 35.727 16.232 -2.609 1.00 0.00 H new ATOM 0 HD13 ILE A 25 36.821 17.082 -3.727 1.00 0.00 H new ATOM 415 N GLY A 26 39.618 13.731 -0.060 1.00 0.00 N0 ATOM 416 CA GLY A 26 40.590 13.822 1.025 1.00 0.00 C0 ATOM 417 C GLY A 26 41.665 12.751 0.874 1.00 0.00 C0 ATOM 418 O GLY A 26 42.860 13.048 0.903 1.00 0.00 O0 ATOM 0 H GLY A 26 38.651 13.616 0.243 1.00 0.00 H new ATOM 0 HA2 GLY A 26 41.051 14.810 1.026 1.00 0.00 H new ATOM 0 HA3 GLY A 26 40.085 13.705 1.984 1.00 0.00 H new ATOM 422 N HIS A 27 41.232 11.510 0.689 1.00 0.00 N0 ATOM 423 CA HIS A 27 42.165 10.405 0.517 1.00 0.00 C0 ATOM 424 C HIS A 27 42.975 10.593 -0.758 1.00 0.00 C0 ATOM 425 O HIS A 27 44.145 10.218 -0.822 1.00 0.00 O0 ATOM 426 CB HIS A 27 41.407 9.082 0.455 1.00 0.00 C0 ATOM 427 CG HIS A 27 41.099 8.620 1.850 1.00 0.00 C0 ATOM 428 ND1 HIS A 27 40.790 9.507 2.867 1.00 0.00 N0 ATOM 429 CD2 HIS A 27 41.048 7.369 2.413 1.00 0.00 C0 ATOM 430 CE1 HIS A 27 40.569 8.788 3.980 1.00 0.00 C0 ATOM 431 NE2 HIS A 27 40.714 7.479 3.760 1.00 0.00 N0 ATOM 0 H HIS A 27 40.248 11.245 0.654 1.00 0.00 H new ATOM 0 HA HIS A 27 42.844 10.388 1.370 1.00 0.00 H new ATOM 0 HB2 HIS A 27 40.484 9.205 -0.112 1.00 0.00 H new ATOM 0 HB3 HIS A 27 42.003 8.332 -0.065 1.00 0.00 H new ATOM 0 HD2 HIS A 27 41.238 6.443 1.891 1.00 0.00 H new ATOM 0 HE1 HIS A 27 40.306 9.216 4.936 1.00 0.00 H new ATOM 0 HE2 HIS A 27 40.604 6.722 4.434 1.00 0.00 H new ATOM 439 N LEU A 28 42.347 11.180 -1.770 1.00 0.00 N0 ATOM 440 CA LEU A 28 43.029 11.412 -3.035 1.00 0.00 C0 ATOM 441 C LEU A 28 44.267 12.278 -2.819 1.00 0.00 C0 ATOM 442 O LEU A 28 45.274 12.115 -3.508 1.00 0.00 O0 ATOM 443 CB LEU A 28 42.085 12.102 -4.024 1.00 0.00 C0 ATOM 444 CG LEU A 28 42.021 11.316 -5.342 1.00 0.00 C0 ATOM 445 CD1 LEU A 28 43.432 11.150 -5.930 1.00 0.00 C0 ATOM 446 CD2 LEU A 28 41.392 9.935 -5.094 1.00 0.00 C0 ATOM 0 H LEU A 28 41.379 11.500 -1.740 1.00 0.00 H new ATOM 0 HA LEU A 28 43.336 10.449 -3.444 1.00 0.00 H new ATOM 0 HB2 LEU A 28 41.088 12.179 -3.591 1.00 0.00 H new ATOM 0 HB3 LEU A 28 42.429 13.118 -4.216 1.00 0.00 H new ATOM 0 HG LEU A 28 41.407 11.868 -6.053 1.00 0.00 H new ATOM 0 HD11 LEU A 28 43.374 10.591 -6.864 1.00 0.00 H new ATOM 0 HD12 LEU A 28 43.864 12.132 -6.121 1.00 0.00 H new ATOM 0 HD13 LEU A 28 44.060 10.609 -5.222 1.00 0.00 H new ATOM 0 HD21 LEU A 28 41.349 9.381 -6.032 1.00 0.00 H new ATOM 0 HD22 LEU A 28 41.997 9.383 -4.374 1.00 0.00 H new ATOM 0 HD23 LEU A 28 40.384 10.060 -4.700 1.00 0.00 H new ATOM 643 N GLN B 6 11.398 1.528 7.190 1.00 0.00 N0 ATOM 644 CA GLN B 6 12.196 0.339 6.921 1.00 0.00 C0 ATOM 645 C GLN B 6 13.258 0.635 5.865 1.00 0.00 C0 ATOM 646 O GLN B 6 14.400 0.189 5.978 1.00 0.00 O0 ATOM 647 CB GLN B 6 11.291 -0.796 6.436 1.00 0.00 C0 ATOM 648 CG GLN B 6 12.077 -2.109 6.424 1.00 0.00 C0 ATOM 649 CD GLN B 6 12.250 -2.624 7.851 1.00 0.00 C0 ATOM 650 OE1 GLN B 6 11.440 -2.315 8.725 1.00 0.00 O0 ATOM 651 NE2 GLN B 6 13.259 -3.401 8.138 1.00 0.00 N0 ATOM 0 HA GLN B 6 12.692 0.038 7.844 1.00 0.00 H new ATOM 0 HB2 GLN B 6 10.422 -0.886 7.088 1.00 0.00 H new ATOM 0 HB3 GLN B 6 10.917 -0.575 5.436 1.00 0.00 H new ATOM 0 HG2 GLN B 6 11.553 -2.851 5.821 1.00 0.00 H new ATOM 0 HG3 GLN B 6 13.053 -1.955 5.963 1.00 0.00 H new ATOM 0 HE21 GLN B 6 13.929 -3.656 7.412 1.00 0.00 H new ATOM 0 HE22 GLN B 6 13.377 -3.753 9.088 1.00 0.00 H new ATOM 660 N ILE B 7 12.870 1.392 4.839 1.00 0.00 N0 ATOM 661 CA ILE B 7 13.791 1.746 3.764 1.00 0.00 C0 ATOM 662 C ILE B 7 14.917 2.626 4.290 1.00 0.00 C0 ATOM 663 O ILE B 7 16.089 2.416 3.976 1.00 0.00 O0 ATOM 664 CB ILE B 7 13.036 2.493 2.665 1.00 0.00 C0 ATOM 665 CG1 ILE B 7 12.029 1.549 2.013 1.00 0.00 C0 ATOM 666 CG2 ILE B 7 14.028 2.980 1.605 1.00 0.00 C0 ATOM 667 CD1 ILE B 7 11.033 2.365 1.192 1.00 0.00 C0 ATOM 0 H ILE B 7 11.929 1.769 4.731 1.00 0.00 H new ATOM 0 HA ILE B 7 14.220 0.829 3.360 1.00 0.00 H new ATOM 0 HB ILE B 7 12.514 3.347 3.098 1.00 0.00 H new ATOM 0 HG12 ILE B 7 12.545 0.833 1.373 1.00 0.00 H new ATOM 0 HG13 ILE B 7 11.504 0.974 2.776 1.00 0.00 H new ATOM 0 HG21 ILE B 7 13.490 3.513 0.821 1.00 0.00 H new ATOM 0 HG22 ILE B 7 14.754 3.649 2.066 1.00 0.00 H new ATOM 0 HG23 ILE B 7 14.547 2.125 1.172 1.00 0.00 H new ATOM 0 HD11 ILE B 7 10.312 1.695 0.724 1.00 0.00 H new ATOM 0 HD12 ILE B 7 10.509 3.063 1.845 1.00 0.00 H new ATOM 0 HD13 ILE B 7 11.566 2.920 0.420 1.00 0.00 H new ATOM 679 N LEU B 8 14.559 3.621 5.088 1.00 0.00 N0 ATOM 680 CA LEU B 8 15.557 4.521 5.647 1.00 0.00 C0 ATOM 681 C LEU B 8 16.394 3.805 6.704 1.00 0.00 C0 ATOM 682 O LEU B 8 17.575 4.107 6.886 1.00 0.00 O0 ATOM 683 CB LEU B 8 14.880 5.741 6.274 1.00 0.00 C0 ATOM 684 CG LEU B 8 15.942 6.771 6.669 1.00 0.00 C0 ATOM 685 CD1 LEU B 8 16.519 7.430 5.413 1.00 0.00 C0 ATOM 686 CD2 LEU B 8 15.308 7.837 7.560 1.00 0.00 C0 ATOM 0 H LEU B 8 13.597 3.824 5.361 1.00 0.00 H new ATOM 0 HA LEU B 8 16.210 4.847 4.838 1.00 0.00 H new ATOM 0 HB2 LEU B 8 14.176 6.182 5.568 1.00 0.00 H new ATOM 0 HB3 LEU B 8 14.306 5.441 7.151 1.00 0.00 H new ATOM 0 HG LEU B 8 16.745 6.271 7.212 1.00 0.00 H new ATOM 0 HD11 LEU B 8 17.274 8.162 5.700 1.00 0.00 H new ATOM 0 HD12 LEU B 8 16.974 6.669 4.779 1.00 0.00 H new ATOM 0 HD13 LEU B 8 15.720 7.929 4.864 1.00 0.00 H new ATOM 0 HD21 LEU B 8 16.063 8.571 7.842 1.00 0.00 H new ATOM 0 HD22 LEU B 8 14.504 8.334 7.017 1.00 0.00 H new ATOM 0 HD23 LEU B 8 14.904 7.368 8.457 1.00 0.00 H new ATOM 698 N SER B 9 15.768 2.852 7.391 1.00 0.00 N0 ATOM 699 CA SER B 9 16.449 2.087 8.430 1.00 0.00 C0 ATOM 700 C SER B 9 17.561 1.217 7.853 1.00 0.00 C0 ATOM 701 O SER B 9 18.690 1.230 8.342 1.00 0.00 O0 ATOM 702 CB SER B 9 15.446 1.199 9.166 1.00 0.00 C0 ATOM 703 OG SER B 9 16.137 0.395 10.114 1.00 0.00 O0 ATOM 0 H SER B 9 14.792 2.592 7.247 1.00 0.00 H new ATOM 0 HA SER B 9 16.897 2.800 9.122 1.00 0.00 H new ATOM 0 HB2 SER B 9 14.699 1.814 9.669 1.00 0.00 H new ATOM 0 HB3 SER B 9 14.913 0.567 8.456 1.00 0.00 H new ATOM 0 HG SER B 9 15.496 -0.175 10.589 1.00 0.00 H new ATOM 709 N ILE B 10 17.233 0.459 6.812 1.00 0.00 N0 ATOM 710 CA ILE B 10 18.213 -0.422 6.184 1.00 0.00 C0 ATOM 711 C ILE B 10 19.209 0.380 5.353 1.00 0.00 C0 ATOM 712 O ILE B 10 20.350 -0.044 5.164 1.00 0.00 O0 ATOM 713 CB ILE B 10 17.502 -1.451 5.296 1.00 0.00 C0 ATOM 714 CG1 ILE B 10 16.701 -0.726 4.210 1.00 0.00 C0 ATOM 715 CG2 ILE B 10 16.545 -2.287 6.148 1.00 0.00 C0 ATOM 716 CD1 ILE B 10 17.475 -0.737 2.888 1.00 0.00 C0 ATOM 0 H ILE B 10 16.306 0.436 6.388 1.00 0.00 H new ATOM 0 HA ILE B 10 18.759 -0.942 6.971 1.00 0.00 H new ATOM 0 HB ILE B 10 18.245 -2.100 4.833 1.00 0.00 H new ATOM 0 HG12 ILE B 10 15.733 -1.209 4.078 1.00 0.00 H new ATOM 0 HG13 ILE B 10 16.505 0.301 4.517 1.00 0.00 H new ATOM 0 HG21 ILE B 10 16.040 -3.018 5.517 1.00 0.00 H new ATOM 0 HG22 ILE B 10 17.107 -2.805 6.925 1.00 0.00 H new ATOM 0 HG23 ILE B 10 15.805 -1.634 6.611 1.00 0.00 H new ATOM 0 HD11 ILE B 10 16.896 -0.219 2.123 1.00 0.00 H new ATOM 0 HD12 ILE B 10 18.432 -0.233 3.022 1.00 0.00 H new ATOM 0 HD13 ILE B 10 17.648 -1.767 2.576 1.00 0.00 H new ATOM 728 N CYS B 11 18.783 1.542 4.864 1.00 0.00 N0 ATOM 729 CA CYS B 11 19.662 2.384 4.063 1.00 0.00 C0 ATOM 730 C CYS B 11 20.807 2.935 4.914 1.00 0.00 C0 ATOM 731 O CYS B 11 21.987 2.792 4.567 1.00 0.00 O0 ATOM 732 CB CYS B 11 18.853 3.542 3.475 1.00 0.00 C0 ATOM 733 SG CYS B 11 19.907 4.524 2.381 1.00 0.00 S0 ATOM 0 H CYS B 11 17.845 1.917 5.007 1.00 0.00 H new ATOM 0 HA CYS B 11 20.089 1.784 3.259 1.00 0.00 H new ATOM 0 HB2 CYS B 11 17.996 3.157 2.922 1.00 0.00 H new ATOM 0 HB3 CYS B 11 18.460 4.168 4.276 1.00 0.00 H new ATOM 0 HG CYS B 11 19.218 5.506 1.881 1.00 0.00 H new ATOM 739 N SER B 12 20.452 3.555 6.038 1.00 0.00 N0 ATOM 740 CA SER B 12 21.452 4.120 6.937 1.00 0.00 C0 ATOM 741 C SER B 12 22.269 3.009 7.585 1.00 0.00 C0 ATOM 742 O SER B 12 23.471 3.149 7.788 1.00 0.00 O0 ATOM 743 CB SER B 12 20.781 4.969 8.014 1.00 0.00 C0 ATOM 744 OG SER B 12 20.166 6.097 7.403 1.00 0.00 O0 ATOM 0 H SER B 12 19.487 3.677 6.345 1.00 0.00 H new ATOM 0 HA SER B 12 22.119 4.755 6.354 1.00 0.00 H new ATOM 0 HB2 SER B 12 20.037 4.379 8.548 1.00 0.00 H new ATOM 0 HB3 SER B 12 21.517 5.294 8.749 1.00 0.00 H new ATOM 0 HG SER B 12 19.732 6.645 8.090 1.00 0.00 H new ATOM 750 N PHE B 13 21.609 1.902 7.900 1.00 0.00 N0 ATOM 751 CA PHE B 13 22.286 0.770 8.515 1.00 0.00 C0 ATOM 752 C PHE B 13 23.431 0.281 7.634 1.00 0.00 C0 ATOM 753 O PHE B 13 24.552 0.077 8.106 1.00 0.00 O0 ATOM 754 CB PHE B 13 21.290 -0.364 8.744 1.00 0.00 C0 ATOM 755 CG PHE B 13 22.039 -1.656 8.963 1.00 0.00 C0 ATOM 756 CD1 PHE B 13 22.806 -1.838 10.121 1.00 0.00 C0 ATOM 757 CD2 PHE B 13 21.968 -2.672 8.005 1.00 0.00 C0 ATOM 758 CE1 PHE B 13 23.501 -3.038 10.318 1.00 0.00 C0 ATOM 759 CE2 PHE B 13 22.661 -3.872 8.201 1.00 0.00 C0 ATOM 760 CZ PHE B 13 23.428 -4.055 9.358 1.00 0.00 C0 ATOM 0 H PHE B 13 20.611 1.765 7.741 1.00 0.00 H new ATOM 0 HA PHE B 13 22.699 1.091 9.471 1.00 0.00 H new ATOM 0 HB2 PHE B 13 20.664 -0.143 9.609 1.00 0.00 H new ATOM 0 HB3 PHE B 13 20.626 -0.458 7.885 1.00 0.00 H new ATOM 0 HD1 PHE B 13 22.861 -1.054 10.861 1.00 0.00 H new ATOM 0 HD2 PHE B 13 21.377 -2.530 7.112 1.00 0.00 H new ATOM 0 HE1 PHE B 13 24.093 -3.179 11.210 1.00 0.00 H new ATOM 0 HE2 PHE B 13 22.604 -4.656 7.461 1.00 0.00 H new ATOM 0 HZ PHE B 13 23.963 -4.981 9.510 1.00 0.00 H new ATOM 770 N ILE B 14 23.149 0.101 6.349 1.00 0.00 N0 ATOM 771 CA ILE B 14 24.168 -0.358 5.416 1.00 0.00 C0 ATOM 772 C ILE B 14 25.314 0.643 5.340 1.00 0.00 C0 ATOM 773 O ILE B 14 26.486 0.267 5.385 1.00 0.00 O0 ATOM 774 CB ILE B 14 23.554 -0.537 4.030 1.00 0.00 C0 ATOM 775 CG1 ILE B 14 22.581 -1.718 4.058 1.00 0.00 C0 ATOM 776 CG2 ILE B 14 24.663 -0.815 3.016 1.00 0.00 C0 ATOM 777 CD1 ILE B 14 21.671 -1.669 2.828 1.00 0.00 C0 ATOM 0 H ILE B 14 22.232 0.264 5.933 1.00 0.00 H new ATOM 0 HA ILE B 14 24.559 -1.312 5.770 1.00 0.00 H new ATOM 0 HB ILE B 14 23.020 0.370 3.745 1.00 0.00 H new ATOM 0 HG12 ILE B 14 23.135 -2.657 4.075 1.00 0.00 H new ATOM 0 HG13 ILE B 14 21.981 -1.685 4.967 1.00 0.00 H new ATOM 0 HG21 ILE B 14 24.227 -0.943 2.025 1.00 0.00 H new ATOM 0 HG22 ILE B 14 25.360 0.023 3.000 1.00 0.00 H new ATOM 0 HG23 ILE B 14 25.195 -1.724 3.298 1.00 0.00 H new ATOM 0 HD11 ILE B 14 20.980 -2.512 2.853 1.00 0.00 H new ATOM 0 HD12 ILE B 14 21.106 -0.737 2.830 1.00 0.00 H new ATOM 0 HD13 ILE B 14 22.278 -1.723 1.924 1.00 0.00 H new ATOM 789 N LEU B 15 24.972 1.921 5.224 1.00 0.00 N0 ATOM 790 CA LEU B 15 25.990 2.964 5.143 1.00 0.00 C0 ATOM 791 C LEU B 15 26.803 3.038 6.434 1.00 0.00 C0 ATOM 792 O LEU B 15 27.959 3.457 6.425 1.00 0.00 O0 ATOM 793 CB LEU B 15 25.328 4.318 4.878 1.00 0.00 C0 ATOM 794 CG LEU B 15 25.528 4.730 3.416 1.00 0.00 C0 ATOM 795 CD1 LEU B 15 24.197 5.209 2.833 1.00 0.00 C0 ATOM 796 CD2 LEU B 15 26.550 5.867 3.352 1.00 0.00 C0 ATOM 0 H LEU B 15 24.010 2.258 5.184 1.00 0.00 H new ATOM 0 HA LEU B 15 26.664 2.717 4.323 1.00 0.00 H new ATOM 0 HB2 LEU B 15 24.263 4.261 5.104 1.00 0.00 H new ATOM 0 HB3 LEU B 15 25.754 5.074 5.538 1.00 0.00 H new ATOM 0 HG LEU B 15 25.888 3.877 2.840 1.00 0.00 H new ATOM 0 HD11 LEU B 15 24.340 5.502 1.793 1.00 0.00 H new ATOM 0 HD12 LEU B 15 23.465 4.403 2.886 1.00 0.00 H new ATOM 0 HD13 LEU B 15 23.836 6.064 3.405 1.00 0.00 H new ATOM 0 HD21 LEU B 15 26.698 6.166 2.314 1.00 0.00 H new ATOM 0 HD22 LEU B 15 26.184 6.718 3.926 1.00 0.00 H new ATOM 0 HD23 LEU B 15 27.498 5.528 3.770 1.00 0.00 H new ATOM 808 N SER B 16 26.201 2.610 7.536 1.00 0.00 N0 ATOM 809 CA SER B 16 26.885 2.623 8.825 1.00 0.00 C0 ATOM 810 C SER B 16 27.951 1.530 8.888 1.00 0.00 C0 ATOM 811 O SER B 16 29.071 1.762 9.356 1.00 0.00 O0 ATOM 812 CB SER B 16 25.869 2.414 9.946 1.00 0.00 C0 ATOM 813 OG SER B 16 24.951 3.499 9.954 1.00 0.00 O0 ATOM 0 H SER B 16 25.247 2.251 7.565 1.00 0.00 H new ATOM 0 HA SER B 16 27.375 3.589 8.946 1.00 0.00 H new ATOM 0 HB2 SER B 16 25.337 1.474 9.800 1.00 0.00 H new ATOM 0 HB3 SER B 16 26.379 2.346 10.907 1.00 0.00 H new ATOM 0 HG SER B 16 24.375 3.446 9.163 1.00 0.00 H new ATOM 819 N ALA B 17 27.598 0.348 8.392 1.00 0.00 N0 ATOM 820 CA ALA B 17 28.528 -0.776 8.378 1.00 0.00 C0 ATOM 821 C ALA B 17 29.669 -0.523 7.400 1.00 0.00 C0 ATOM 822 O ALA B 17 30.814 -0.900 7.649 1.00 0.00 O0 ATOM 823 CB ALA B 17 27.791 -2.063 7.995 1.00 0.00 C0 ATOM 0 H ALA B 17 26.680 0.144 7.997 1.00 0.00 H new ATOM 0 HA ALA B 17 28.947 -0.885 9.378 1.00 0.00 H new ATOM 0 HB1 ALA B 17 28.494 -2.896 7.987 1.00 0.00 H new ATOM 0 HB2 ALA B 17 27.002 -2.260 8.721 1.00 0.00 H new ATOM 0 HB3 ALA B 17 27.352 -1.950 7.004 1.00 0.00 H new ATOM 829 N LEU B 18 29.356 0.132 6.287 1.00 0.00 N0 ATOM 830 CA LEU B 18 30.365 0.438 5.284 1.00 0.00 C0 ATOM 831 C LEU B 18 31.285 1.558 5.760 1.00 0.00 C0 ATOM 832 O LEU B 18 32.483 1.559 5.456 1.00 0.00 O0 ATOM 833 CB LEU B 18 29.671 0.846 3.983 1.00 0.00 C0 ATOM 834 CG LEU B 18 28.925 -0.360 3.409 1.00 0.00 C0 ATOM 835 CD1 LEU B 18 27.928 0.110 2.349 1.00 0.00 C0 ATOM 836 CD2 LEU B 18 29.924 -1.323 2.767 1.00 0.00 C0 ATOM 0 H LEU B 18 28.417 0.459 6.059 1.00 0.00 H new ATOM 0 HA LEU B 18 30.975 -0.449 5.115 1.00 0.00 H new ATOM 0 HB2 LEU B 18 28.975 1.664 4.170 1.00 0.00 H new ATOM 0 HB3 LEU B 18 30.405 1.210 3.264 1.00 0.00 H new ATOM 0 HG LEU B 18 28.392 -0.868 4.213 1.00 0.00 H new ATOM 0 HD11 LEU B 18 27.398 -0.751 1.941 1.00 0.00 H new ATOM 0 HD12 LEU B 18 27.212 0.796 2.802 1.00 0.00 H new ATOM 0 HD13 LEU B 18 28.462 0.620 1.547 1.00 0.00 H new ATOM 0 HD21 LEU B 18 29.391 -2.182 2.359 1.00 0.00 H new ATOM 0 HD22 LEU B 18 30.458 -0.813 1.965 1.00 0.00 H new ATOM 0 HD23 LEU B 18 30.637 -1.662 3.519 1.00 0.00 H new ATOM 848 N HIS B 19 30.727 2.505 6.520 1.00 0.00 N0 ATOM 849 CA HIS B 19 31.507 3.619 7.044 1.00 0.00 C0 ATOM 850 C HIS B 19 32.561 3.122 8.021 1.00 0.00 C0 ATOM 851 O HIS B 19 33.735 3.489 7.926 1.00 0.00 O0 ATOM 852 CB HIS B 19 30.586 4.620 7.746 1.00 0.00 C0 ATOM 853 CG HIS B 19 31.405 5.735 8.338 1.00 0.00 C0 ATOM 854 ND1 HIS B 19 31.924 5.669 9.622 1.00 0.00 N0 ATOM 855 CD2 HIS B 19 31.805 6.949 7.836 1.00 0.00 C0 ATOM 856 CE1 HIS B 19 32.600 6.811 9.846 1.00 0.00 C0 ATOM 857 NE2 HIS B 19 32.559 7.626 8.789 1.00 0.00 N0 ATOM 0 H HIS B 19 29.742 2.519 6.783 1.00 0.00 H new ATOM 0 HA HIS B 19 32.006 4.111 6.209 1.00 0.00 H new ATOM 0 HB2 HIS B 19 29.864 5.024 7.036 1.00 0.00 H new ATOM 0 HB3 HIS B 19 30.017 4.118 8.529 1.00 0.00 H new ATOM 0 HD1 HIS B 19 31.814 4.896 10.278 1.00 0.00 H new ATOM 0 HD2 HIS B 19 31.570 7.322 6.850 1.00 0.00 H new ATOM 0 HE1 HIS B 19 33.113 7.040 10.768 1.00 0.00 H new ATOM 865 N PHE B 20 32.143 2.273 8.955 1.00 0.00 N0 ATOM 866 CA PHE B 20 33.073 1.729 9.934 1.00 0.00 C0 ATOM 867 C PHE B 20 34.038 0.756 9.271 1.00 0.00 C0 ATOM 868 O PHE B 20 35.178 0.608 9.708 1.00 0.00 O0 ATOM 869 CB PHE B 20 32.314 1.030 11.062 1.00 0.00 C0 ATOM 870 CG PHE B 20 32.311 1.912 12.290 1.00 0.00 C0 ATOM 871 CD1 PHE B 20 31.573 3.103 12.305 1.00 0.00 C0 ATOM 872 CD2 PHE B 20 33.060 1.540 13.415 1.00 0.00 C0 ATOM 873 CE1 PHE B 20 31.584 3.920 13.446 1.00 0.00 C0 ATOM 874 CE2 PHE B 20 33.069 2.355 14.552 1.00 0.00 C0 ATOM 875 CZ PHE B 20 32.333 3.544 14.569 1.00 0.00 C0 ATOM 0 H PHE B 20 31.180 1.951 9.053 1.00 0.00 H new ATOM 0 HA PHE B 20 33.646 2.554 10.357 1.00 0.00 H new ATOM 0 HB2 PHE B 20 31.291 0.819 10.750 1.00 0.00 H new ATOM 0 HB3 PHE B 20 32.782 0.072 11.290 1.00 0.00 H new ATOM 0 HD1 PHE B 20 30.996 3.392 11.439 1.00 0.00 H new ATOM 0 HD2 PHE B 20 33.631 0.623 13.404 1.00 0.00 H new ATOM 0 HE1 PHE B 20 31.015 4.838 13.459 1.00 0.00 H new ATOM 0 HE2 PHE B 20 33.645 2.065 15.418 1.00 0.00 H new ATOM 0 HZ PHE B 20 32.342 4.172 15.447 1.00 0.00 H new ATOM 885 N MET B 21 33.584 0.103 8.207 1.00 0.00 N0 ATOM 886 CA MET B 21 34.430 -0.842 7.487 1.00 0.00 C0 ATOM 887 C MET B 21 35.670 -0.141 6.935 1.00 0.00 C0 ATOM 888 O MET B 21 36.810 -0.527 7.233 1.00 0.00 O0 ATOM 889 CB MET B 21 33.638 -1.463 6.336 1.00 0.00 C0 ATOM 890 CG MET B 21 33.239 -2.893 6.704 1.00 0.00 C0 ATOM 891 SD MET B 21 34.655 -3.993 6.456 1.00 0.00 S0 ATOM 892 CE MET B 21 33.768 -5.559 6.641 1.00 0.00 C0 ATOM 0 H MET B 21 32.644 0.209 7.826 1.00 0.00 H new ATOM 0 HA MET B 21 34.749 -1.622 8.178 1.00 0.00 H new ATOM 0 HB2 MET B 21 32.749 -0.868 6.130 1.00 0.00 H new ATOM 0 HB3 MET B 21 34.239 -1.464 5.426 1.00 0.00 H new ATOM 0 HG2 MET B 21 32.909 -2.935 7.742 1.00 0.00 H new ATOM 0 HG3 MET B 21 32.400 -3.218 6.089 1.00 0.00 H new ATOM 0 HE1 MET B 21 34.465 -6.388 6.523 1.00 0.00 H new ATOM 0 HE2 MET B 21 33.314 -5.605 7.631 1.00 0.00 H new ATOM 0 HE3 MET B 21 32.990 -5.628 5.881 1.00 0.00 H new ATOM 902 N ALA B 22 35.448 0.896 6.134 1.00 0.00 N0 ATOM 903 CA ALA B 22 36.559 1.637 5.554 1.00 0.00 C0 ATOM 904 C ALA B 22 37.395 2.286 6.652 1.00 0.00 C0 ATOM 905 O ALA B 22 38.622 2.304 6.582 1.00 0.00 O0 ATOM 906 CB ALA B 22 36.039 2.708 4.599 1.00 0.00 C0 ATOM 0 H ALA B 22 34.522 1.238 5.875 1.00 0.00 H new ATOM 0 HA ALA B 22 37.186 0.939 4.998 1.00 0.00 H new ATOM 0 HB1 ALA B 22 36.880 3.255 4.172 1.00 0.00 H new ATOM 0 HB2 ALA B 22 35.469 2.236 3.798 1.00 0.00 H new ATOM 0 HB3 ALA B 22 35.396 3.399 5.143 1.00 0.00 H new ATOM 912 N TRP B 23 36.720 2.816 7.667 1.00 0.00 N0 ATOM 913 CA TRP B 23 37.414 3.461 8.774 1.00 0.00 C0 ATOM 914 C TRP B 23 38.398 2.496 9.428 1.00 0.00 C0 ATOM 915 O TRP B 23 39.556 2.842 9.665 1.00 0.00 O0 ATOM 916 CB TRP B 23 36.398 3.938 9.809 1.00 0.00 C0 ATOM 917 CG TRP B 23 36.434 5.428 9.890 1.00 0.00 C0 ATOM 918 CD1 TRP B 23 35.875 6.276 8.999 1.00 0.00 C0 ATOM 919 CD2 TRP B 23 37.058 6.261 10.914 1.00 0.00 C0 ATOM 920 NE1 TRP B 23 36.116 7.577 9.409 1.00 0.00 N0 ATOM 921 CE2 TRP B 23 36.841 7.617 10.583 1.00 0.00 C0 ATOM 922 CE3 TRP B 23 37.784 5.969 12.083 1.00 0.00 C0 ATOM 923 CZ2 TRP B 23 37.329 8.651 11.386 1.00 0.00 C0 ATOM 924 CZ3 TRP B 23 38.275 7.006 12.893 1.00 0.00 C0 ATOM 925 CH2 TRP B 23 38.048 8.344 12.544 1.00 0.00 C0 ATOM 0 H TRP B 23 35.703 2.812 7.745 1.00 0.00 H new ATOM 0 HA TRP B 23 37.970 4.315 8.386 1.00 0.00 H new ATOM 0 HB2 TRP B 23 35.398 3.602 9.535 1.00 0.00 H new ATOM 0 HB3 TRP B 23 36.624 3.504 10.783 1.00 0.00 H new ATOM 0 HD1 TRP B 23 35.330 5.987 8.113 1.00 0.00 H new ATOM 0 HE1 TRP B 23 35.797 8.404 8.905 1.00 0.00 H new ATOM 0 HE3 TRP B 23 37.965 4.941 12.359 1.00 0.00 H new ATOM 0 HZ2 TRP B 23 37.152 9.681 11.113 1.00 0.00 H new ATOM 0 HZ3 TRP B 23 38.830 6.771 13.789 1.00 0.00 H new ATOM 0 HH2 TRP B 23 38.429 9.138 13.170 1.00 0.00 H new ATOM 936 N THR B 24 37.929 1.292 9.725 1.00 0.00 N0 ATOM 937 CA THR B 24 38.770 0.291 10.363 1.00 0.00 C0 ATOM 938 C THR B 24 40.005 0.021 9.512 1.00 0.00 C0 ATOM 939 O THR B 24 41.121 -0.070 10.026 1.00 0.00 O0 ATOM 940 CB THR B 24 37.984 -1.007 10.546 1.00 0.00 C0 ATOM 941 OG1 THR B 24 36.850 -0.762 11.366 1.00 0.00 O0 ATOM 942 CG2 THR B 24 38.871 -2.061 11.208 1.00 0.00 C0 ATOM 0 H THR B 24 36.975 0.986 9.535 1.00 0.00 H new ATOM 0 HA THR B 24 39.083 0.667 11.337 1.00 0.00 H new ATOM 0 HB THR B 24 37.659 -1.371 9.571 1.00 0.00 H new ATOM 0 HG1 THR B 24 36.198 -0.223 10.871 1.00 0.00 H new ATOM 0 HG21 THR B 24 38.306 -2.984 11.336 1.00 0.00 H new ATOM 0 HG22 THR B 24 39.740 -2.252 10.579 1.00 0.00 H new ATOM 0 HG23 THR B 24 39.201 -1.699 12.182 1.00 0.00 H new ATOM 950 N ILE B 25 39.804 -0.094 8.205 1.00 0.00 N0 ATOM 951 CA ILE B 25 40.918 -0.345 7.298 1.00 0.00 C0 ATOM 952 C ILE B 25 41.886 0.842 7.300 1.00 0.00 C0 ATOM 953 O ILE B 25 43.108 0.673 7.271 1.00 0.00 O0 ATOM 954 CB ILE B 25 40.381 -0.576 5.885 1.00 0.00 C0 ATOM 955 CG1 ILE B 25 39.494 -1.824 5.885 1.00 0.00 C0 ATOM 956 CG2 ILE B 25 41.552 -0.785 4.918 1.00 0.00 C0 ATOM 957 CD1 ILE B 25 38.700 -1.890 4.578 1.00 0.00 C0 ATOM 0 H ILE B 25 38.893 -0.019 7.753 1.00 0.00 H new ATOM 0 HA ILE B 25 41.456 -1.232 7.633 1.00 0.00 H new ATOM 0 HB ILE B 25 39.801 0.291 5.568 1.00 0.00 H new ATOM 0 HG12 ILE B 25 40.107 -2.718 5.995 1.00 0.00 H new ATOM 0 HG13 ILE B 25 38.813 -1.798 6.735 1.00 0.00 H new ATOM 0 HG21 ILE B 25 41.168 -0.950 3.911 1.00 0.00 H new ATOM 0 HG22 ILE B 25 42.190 0.099 4.923 1.00 0.00 H new ATOM 0 HG23 ILE B 25 42.132 -1.653 5.231 1.00 0.00 H new ATOM 0 HD11 ILE B 25 38.069 -2.779 4.580 1.00 0.00 H new ATOM 0 HD12 ILE B 25 38.075 -1.002 4.487 1.00 0.00 H new ATOM 0 HD13 ILE B 25 39.390 -1.936 3.735 1.00 0.00 H new ATOM 969 N GLY B 26 41.318 2.039 7.335 1.00 0.00 N0 ATOM 970 CA GLY B 26 42.125 3.255 7.337 1.00 0.00 C0 ATOM 971 C GLY B 26 43.112 3.243 8.499 1.00 0.00 C0 ATOM 972 O GLY B 26 44.313 3.448 8.309 1.00 0.00 O0 ATOM 0 H GLY B 26 40.311 2.196 7.362 1.00 0.00 H new ATOM 0 HA2 GLY B 26 42.666 3.340 6.394 1.00 0.00 H new ATOM 0 HA3 GLY B 26 41.477 4.128 7.413 1.00 0.00 H new ATOM 976 N HIS B 27 42.603 2.976 9.695 1.00 0.00 N0 ATOM 977 CA HIS B 27 43.451 2.922 10.879 1.00 0.00 C0 ATOM 978 C HIS B 27 44.451 1.782 10.761 1.00 0.00 C0 ATOM 979 O HIS B 27 45.581 1.881 11.236 1.00 0.00 O0 ATOM 980 CB HIS B 27 42.598 2.731 12.129 1.00 0.00 C0 ATOM 981 CG HIS B 27 42.050 4.060 12.564 1.00 0.00 C0 ATOM 982 ND1 HIS B 27 41.677 5.035 11.656 1.00 0.00 N0 ATOM 983 CD2 HIS B 27 41.806 4.590 13.808 1.00 0.00 C0 ATOM 984 CE1 HIS B 27 41.234 6.095 12.356 1.00 0.00 C0 ATOM 985 NE2 HIS B 27 41.290 5.877 13.674 1.00 0.00 N0 ATOM 0 H HIS B 27 41.615 2.795 9.871 1.00 0.00 H new ATOM 0 HA HIS B 27 43.995 3.863 10.958 1.00 0.00 H new ATOM 0 HB2 HIS B 27 41.782 2.038 11.924 1.00 0.00 H new ATOM 0 HB3 HIS B 27 43.196 2.292 12.928 1.00 0.00 H new ATOM 0 HD2 HIS B 27 41.987 4.086 14.746 1.00 0.00 H new ATOM 0 HE1 HIS B 27 40.877 7.010 11.908 1.00 0.00 H new ATOM 0 HE2 HIS B 27 41.014 6.515 14.420 1.00 0.00 H new ATOM 993 N LEU B 28 44.029 0.699 10.117 1.00 0.00 N0 ATOM 994 CA LEU B 28 44.906 -0.451 9.942 1.00 0.00 C0 ATOM 995 C LEU B 28 46.171 -0.044 9.193 1.00 0.00 C0 ATOM 996 O LEU B 28 47.248 -0.583 9.443 1.00 0.00 O0 ATOM 997 CB LEU B 28 44.179 -1.554 9.167 1.00 0.00 C0 ATOM 998 CG LEU B 28 44.238 -2.881 9.940 1.00 0.00 C0 ATOM 999 CD1 LEU B 28 45.699 -3.263 10.229 1.00 0.00 C0 ATOM 1000 CD2 LEU B 28 43.459 -2.748 11.259 1.00 0.00 C0 ATOM 0 H LEU B 28 43.098 0.594 9.713 1.00 0.00 H new ATOM 0 HA LEU B 28 45.184 -0.828 10.926 1.00 0.00 H new ATOM 0 HB2 LEU B 28 43.140 -1.268 9.003 1.00 0.00 H new ATOM 0 HB3 LEU B 28 44.635 -1.678 8.185 1.00 0.00 H new ATOM 0 HG LEU B 28 43.785 -3.665 9.333 1.00 0.00 H new ATOM 0 HD11 LEU B 28 45.727 -4.205 10.777 1.00 0.00 H new ATOM 0 HD12 LEU B 28 46.239 -3.374 9.289 1.00 0.00 H new ATOM 0 HD13 LEU B 28 46.168 -2.481 10.827 1.00 0.00 H new ATOM 0 HD21 LEU B 28 43.503 -3.691 11.804 1.00 0.00 H new ATOM 0 HD22 LEU B 28 43.902 -1.957 11.865 1.00 0.00 H new ATOM 0 HD23 LEU B 28 42.419 -2.501 11.044 1.00 0.00 H new ATOM 1177 N PHE C 5 10.223 4.076 14.735 1.00 0.00 N0 ATOM 1178 CA PHE C 5 11.064 5.262 14.839 1.00 0.00 C0 ATOM 1179 C PHE C 5 11.933 5.183 16.090 1.00 0.00 C0 ATOM 1180 O PHE C 5 13.050 5.695 16.115 1.00 0.00 O0 ATOM 1181 CB PHE C 5 10.197 6.524 14.893 1.00 0.00 C0 ATOM 1182 CG PHE C 5 10.237 7.113 16.284 1.00 0.00 C0 ATOM 1183 CD1 PHE C 5 11.170 8.110 16.592 1.00 0.00 C0 ATOM 1184 CD2 PHE C 5 9.346 6.660 17.268 1.00 0.00 C0 ATOM 1185 CE1 PHE C 5 11.214 8.656 17.880 1.00 0.00 C0 ATOM 1186 CE2 PHE C 5 9.391 7.207 18.557 1.00 0.00 C0 ATOM 1187 CZ PHE C 5 10.325 8.205 18.862 1.00 0.00 C0 ATOM 0 HA PHE C 5 11.707 5.309 13.960 1.00 0.00 H new ATOM 0 HB2 PHE C 5 10.556 7.255 14.168 1.00 0.00 H new ATOM 0 HB3 PHE C 5 9.170 6.283 14.620 1.00 0.00 H new ATOM 0 HD1 PHE C 5 11.857 8.458 15.835 1.00 0.00 H new ATOM 0 HD2 PHE C 5 8.626 5.890 17.032 1.00 0.00 H new ATOM 0 HE1 PHE C 5 11.934 9.425 18.116 1.00 0.00 H new ATOM 0 HE2 PHE C 5 8.705 6.859 19.315 1.00 0.00 H new ATOM 0 HZ PHE C 5 10.359 8.627 19.856 1.00 0.00 H new ATOM 1197 N GLN C 6 11.410 4.537 17.126 1.00 0.00 N0 ATOM 1198 CA GLN C 6 12.145 4.400 18.377 1.00 0.00 C0 ATOM 1199 C GLN C 6 13.384 3.531 18.178 1.00 0.00 C0 ATOM 1200 O GLN C 6 14.453 3.829 18.710 1.00 0.00 O0 ATOM 1201 CB GLN C 6 11.246 3.772 19.443 1.00 0.00 C0 ATOM 1202 CG GLN C 6 11.917 3.888 20.814 1.00 0.00 C0 ATOM 1203 CD GLN C 6 11.815 5.321 21.323 1.00 0.00 C0 ATOM 1204 OE1 GLN C 6 10.897 6.051 20.942 1.00 0.00 O0 ATOM 1205 NE2 GLN C 6 12.697 5.771 22.173 1.00 0.00 N0 ATOM 0 H GLN C 6 10.487 4.103 17.125 1.00 0.00 H new ATOM 0 HA GLN C 6 12.459 5.391 18.703 1.00 0.00 H new ATOM 0 HB2 GLN C 6 10.278 4.272 19.457 1.00 0.00 H new ATOM 0 HB3 GLN C 6 11.060 2.725 19.205 1.00 0.00 H new ATOM 0 HG2 GLN C 6 11.441 3.208 21.520 1.00 0.00 H new ATOM 0 HG3 GLN C 6 12.964 3.592 20.742 1.00 0.00 H new ATOM 0 HE21 GLN C 6 13.456 5.167 22.488 1.00 0.00 H new ATOM 0 HE22 GLN C 6 12.627 6.727 22.522 1.00 0.00 H new ATOM 1214 N ILE C 7 13.230 2.460 17.402 1.00 0.00 N0 ATOM 1215 CA ILE C 7 14.340 1.551 17.132 1.00 0.00 C0 ATOM 1216 C ILE C 7 15.432 2.257 16.337 1.00 0.00 C0 ATOM 1217 O ILE C 7 16.616 2.139 16.644 1.00 0.00 O0 ATOM 1218 CB ILE C 7 13.840 0.344 16.343 1.00 0.00 C0 ATOM 1219 CG1 ILE C 7 12.880 -0.467 17.212 1.00 0.00 C0 ATOM 1220 CG2 ILE C 7 15.026 -0.539 15.946 1.00 0.00 C0 ATOM 1221 CD1 ILE C 7 12.102 -1.442 16.332 1.00 0.00 C0 ATOM 0 H ILE C 7 12.352 2.202 16.952 1.00 0.00 H new ATOM 0 HA ILE C 7 14.755 1.222 18.085 1.00 0.00 H new ATOM 0 HB ILE C 7 13.325 0.688 15.446 1.00 0.00 H new ATOM 0 HG12 ILE C 7 13.435 -1.012 17.975 1.00 0.00 H new ATOM 0 HG13 ILE C 7 12.192 0.199 17.733 1.00 0.00 H new ATOM 0 HG21 ILE C 7 14.666 -1.400 15.383 1.00 0.00 H new ATOM 0 HG22 ILE C 7 15.717 0.035 15.329 1.00 0.00 H new ATOM 0 HG23 ILE C 7 15.541 -0.882 16.843 1.00 0.00 H new ATOM 0 HD11 ILE C 7 11.416 -2.022 16.950 1.00 0.00 H new ATOM 0 HD12 ILE C 7 11.536 -0.886 15.585 1.00 0.00 H new ATOM 0 HD13 ILE C 7 12.798 -2.116 15.832 1.00 0.00 H new ATOM 1233 N LEU C 8 15.028 2.987 15.309 1.00 0.00 N0 ATOM 1234 CA LEU C 8 15.990 3.701 14.483 1.00 0.00 C0 ATOM 1235 C LEU C 8 16.584 4.879 15.254 1.00 0.00 C0 ATOM 1236 O LEU C 8 17.739 5.249 15.046 1.00 0.00 O0 ATOM 1237 CB LEU C 8 15.316 4.213 13.208 1.00 0.00 C0 ATOM 1238 CG LEU C 8 16.376 4.778 12.258 1.00 0.00 C0 ATOM 1239 CD1 LEU C 8 17.201 3.635 11.657 1.00 0.00 C0 ATOM 1240 CD2 LEU C 8 15.688 5.554 11.135 1.00 0.00 C0 ATOM 0 H LEU C 8 14.054 3.100 15.029 1.00 0.00 H new ATOM 0 HA LEU C 8 16.790 3.011 14.215 1.00 0.00 H new ATOM 0 HB2 LEU C 8 14.772 3.403 12.722 1.00 0.00 H new ATOM 0 HB3 LEU C 8 14.586 4.984 13.455 1.00 0.00 H new ATOM 0 HG LEU C 8 17.038 5.443 12.813 1.00 0.00 H new ATOM 0 HD11 LEU C 8 17.953 4.045 10.982 1.00 0.00 H new ATOM 0 HD12 LEU C 8 17.694 3.082 12.457 1.00 0.00 H new ATOM 0 HD13 LEU C 8 16.544 2.964 11.104 1.00 0.00 H new ATOM 0 HD21 LEU C 8 16.441 5.957 10.457 1.00 0.00 H new ATOM 0 HD22 LEU C 8 15.025 4.887 10.585 1.00 0.00 H new ATOM 0 HD23 LEU C 8 15.107 6.372 11.561 1.00 0.00 H new ATOM 1252 N SER C 9 15.777 5.458 16.142 1.00 0.00 N0 ATOM 1253 CA SER C 9 16.218 6.592 16.945 1.00 0.00 C0 ATOM 1254 C SER C 9 17.338 6.203 17.904 1.00 0.00 C0 ATOM 1255 O SER C 9 18.370 6.870 17.974 1.00 0.00 O0 ATOM 1256 CB SER C 9 15.041 7.152 17.745 1.00 0.00 C0 ATOM 1257 OG SER C 9 15.500 8.199 18.589 1.00 0.00 O0 ATOM 0 H SER C 9 14.818 5.160 16.321 1.00 0.00 H new ATOM 0 HA SER C 9 16.602 7.350 16.262 1.00 0.00 H new ATOM 0 HB2 SER C 9 14.272 7.526 17.069 1.00 0.00 H new ATOM 0 HB3 SER C 9 14.584 6.363 18.342 1.00 0.00 H new ATOM 0 HG SER C 9 14.747 8.560 19.101 1.00 0.00 H new ATOM 1263 N ILE C 10 17.126 5.124 18.649 1.00 0.00 N0 ATOM 1264 CA ILE C 10 18.122 4.664 19.608 1.00 0.00 C0 ATOM 1265 C ILE C 10 19.299 4.004 18.901 1.00 0.00 C0 ATOM 1266 O ILE C 10 20.418 4.003 19.416 1.00 0.00 O0 ATOM 1267 CB ILE C 10 17.488 3.670 20.590 1.00 0.00 C0 ATOM 1268 CG1 ILE C 10 16.936 2.468 19.819 1.00 0.00 C0 ATOM 1269 CG2 ILE C 10 16.342 4.350 21.340 1.00 0.00 C0 ATOM 1270 CD1 ILE C 10 17.914 1.291 19.906 1.00 0.00 C0 ATOM 0 H ILE C 10 16.280 4.556 18.608 1.00 0.00 H new ATOM 0 HA ILE C 10 18.490 5.532 20.155 1.00 0.00 H new ATOM 0 HB ILE C 10 18.245 3.336 21.300 1.00 0.00 H new ATOM 0 HG12 ILE C 10 15.968 2.177 20.228 1.00 0.00 H new ATOM 0 HG13 ILE C 10 16.773 2.739 18.776 1.00 0.00 H new ATOM 0 HG21 ILE C 10 15.893 3.642 22.037 1.00 0.00 H new ATOM 0 HG22 ILE C 10 16.726 5.208 21.891 1.00 0.00 H new ATOM 0 HG23 ILE C 10 15.589 4.685 20.627 1.00 0.00 H new ATOM 0 HD11 ILE C 10 17.511 0.442 19.354 1.00 0.00 H new ATOM 0 HD12 ILE C 10 18.872 1.582 19.476 1.00 0.00 H new ATOM 0 HD13 ILE C 10 18.055 1.011 20.950 1.00 0.00 H new ATOM 1282 N CYS C 11 19.053 3.459 17.711 1.00 0.00 N0 ATOM 1283 CA CYS C 11 20.115 2.813 16.951 1.00 0.00 C0 ATOM 1284 C CYS C 11 21.145 3.843 16.484 1.00 0.00 C0 ATOM 1285 O CYS C 11 22.349 3.697 16.725 1.00 0.00 O0 ATOM 1286 CB CYS C 11 19.510 2.101 15.740 1.00 0.00 C0 ATOM 1287 SG CYS C 11 20.805 1.196 14.856 1.00 0.00 S0 ATOM 0 H CYS C 11 18.139 3.452 17.259 1.00 0.00 H new ATOM 0 HA CYS C 11 20.617 2.088 17.592 1.00 0.00 H new ATOM 0 HB2 CYS C 11 18.728 1.414 16.063 1.00 0.00 H new ATOM 0 HB3 CYS C 11 19.042 2.827 15.075 1.00 0.00 H new ATOM 0 HG CYS C 11 20.287 0.590 13.829 1.00 0.00 H new ATOM 1293 N SER C 12 20.662 4.892 15.820 1.00 0.00 N0 ATOM 1294 CA SER C 12 21.543 5.944 15.326 1.00 0.00 C0 ATOM 1295 C SER C 12 22.152 6.714 16.489 1.00 0.00 C0 ATOM 1296 O SER C 12 23.313 7.112 16.440 1.00 0.00 O0 ATOM 1297 CB SER C 12 20.772 6.897 14.412 1.00 0.00 C0 ATOM 1298 OG SER C 12 20.355 6.194 13.249 1.00 0.00 O0 ATOM 0 H SER C 12 19.673 5.034 15.614 1.00 0.00 H new ATOM 0 HA SER C 12 22.346 5.481 14.753 1.00 0.00 H new ATOM 0 HB2 SER C 12 19.907 7.302 14.936 1.00 0.00 H new ATOM 0 HB3 SER C 12 21.401 7.743 14.134 1.00 0.00 H new ATOM 0 HG SER C 12 19.859 6.800 12.661 1.00 0.00 H new ATOM 1304 N PHE C 13 21.362 6.918 17.536 1.00 0.00 N0 ATOM 1305 CA PHE C 13 21.840 7.637 18.708 1.00 0.00 C0 ATOM 1306 C PHE C 13 23.072 6.953 19.294 1.00 0.00 C0 ATOM 1307 O PHE C 13 24.081 7.603 19.578 1.00 0.00 O0 ATOM 1308 CB PHE C 13 20.733 7.696 19.761 1.00 0.00 C0 ATOM 1309 CG PHE C 13 21.332 8.035 21.104 1.00 0.00 C0 ATOM 1310 CD1 PHE C 13 21.879 9.303 21.333 1.00 0.00 C0 ATOM 1311 CD2 PHE C 13 21.341 7.075 22.122 1.00 0.00 C0 ATOM 1312 CE1 PHE C 13 22.435 9.610 22.579 1.00 0.00 C0 ATOM 1313 CE2 PHE C 13 21.895 7.382 23.369 1.00 0.00 C0 ATOM 1314 CZ PHE C 13 22.444 8.650 23.598 1.00 0.00 C0 ATOM 0 H PHE C 13 20.395 6.598 17.597 1.00 0.00 H new ATOM 0 HA PHE C 13 22.114 8.648 18.408 1.00 0.00 H new ATOM 0 HB2 PHE C 13 19.991 8.445 19.482 1.00 0.00 H new ATOM 0 HB3 PHE C 13 20.215 6.738 19.813 1.00 0.00 H new ATOM 0 HD1 PHE C 13 21.872 10.044 20.548 1.00 0.00 H new ATOM 0 HD2 PHE C 13 20.920 6.096 21.945 1.00 0.00 H new ATOM 0 HE1 PHE C 13 22.858 10.588 22.755 1.00 0.00 H new ATOM 0 HE2 PHE C 13 21.899 6.641 24.155 1.00 0.00 H new ATOM 0 HZ PHE C 13 22.874 8.887 24.560 1.00 0.00 H new ATOM 1324 N ILE C 14 22.989 5.640 19.468 1.00 0.00 N0 ATOM 1325 CA ILE C 14 24.109 4.887 20.016 1.00 0.00 C0 ATOM 1326 C ILE C 14 25.325 5.003 19.108 1.00 0.00 C0 ATOM 1327 O ILE C 14 26.442 5.239 19.574 1.00 0.00 O0 ATOM 1328 CB ILE C 14 23.718 3.418 20.164 1.00 0.00 C0 ATOM 1329 CG1 ILE C 14 22.666 3.284 21.265 1.00 0.00 C0 ATOM 1330 CG2 ILE C 14 24.956 2.600 20.540 1.00 0.00 C0 ATOM 1331 CD1 ILE C 14 21.979 1.920 21.158 1.00 0.00 C0 ATOM 0 H ILE C 14 22.167 5.080 19.240 1.00 0.00 H new ATOM 0 HA ILE C 14 24.361 5.298 20.993 1.00 0.00 H new ATOM 0 HB ILE C 14 23.310 3.050 19.223 1.00 0.00 H new ATOM 0 HG12 ILE C 14 23.134 3.391 22.244 1.00 0.00 H new ATOM 0 HG13 ILE C 14 21.928 4.082 21.176 1.00 0.00 H new ATOM 0 HG21 ILE C 14 24.680 1.551 20.646 1.00 0.00 H new ATOM 0 HG22 ILE C 14 25.709 2.700 19.758 1.00 0.00 H new ATOM 0 HG23 ILE C 14 25.361 2.966 21.483 1.00 0.00 H new ATOM 0 HD11 ILE C 14 21.230 1.827 21.944 1.00 0.00 H new ATOM 0 HD12 ILE C 14 21.497 1.831 20.185 1.00 0.00 H new ATOM 0 HD13 ILE C 14 22.721 1.129 21.269 1.00 0.00 H new ATOM 1343 N LEU C 15 25.109 4.834 17.809 1.00 0.00 N0 ATOM 1344 CA LEU C 15 26.206 4.924 16.852 1.00 0.00 C0 ATOM 1345 C LEU C 15 26.801 6.331 16.830 1.00 0.00 C0 ATOM 1346 O LEU C 15 27.973 6.513 16.505 1.00 0.00 O0 ATOM 1347 CB LEU C 15 25.705 4.557 15.451 1.00 0.00 C0 ATOM 1348 CG LEU C 15 26.175 3.146 15.074 1.00 0.00 C0 ATOM 1349 CD1 LEU C 15 24.998 2.354 14.501 1.00 0.00 C0 ATOM 1350 CD2 LEU C 15 27.278 3.252 14.019 1.00 0.00 C0 ATOM 0 H LEU C 15 24.197 4.636 17.397 1.00 0.00 H new ATOM 0 HA LEU C 15 26.984 4.225 17.159 1.00 0.00 H new ATOM 0 HB2 LEU C 15 24.616 4.606 15.422 1.00 0.00 H new ATOM 0 HB3 LEU C 15 26.076 5.279 14.723 1.00 0.00 H new ATOM 0 HG LEU C 15 26.558 2.637 15.958 1.00 0.00 H new ATOM 0 HD11 LEU C 15 25.330 1.351 14.233 1.00 0.00 H new ATOM 0 HD12 LEU C 15 24.207 2.286 15.248 1.00 0.00 H new ATOM 0 HD13 LEU C 15 24.617 2.859 13.614 1.00 0.00 H new ATOM 0 HD21 LEU C 15 27.617 2.253 13.746 1.00 0.00 H new ATOM 0 HD22 LEU C 15 26.889 3.757 13.135 1.00 0.00 H new ATOM 0 HD23 LEU C 15 28.115 3.821 14.423 1.00 0.00 H new ATOM 1362 N SER C 16 25.993 7.319 17.191 1.00 0.00 N0 ATOM 1363 CA SER C 16 26.455 8.703 17.217 1.00 0.00 C0 ATOM 1364 C SER C 16 27.409 8.935 18.386 1.00 0.00 C0 ATOM 1365 O SER C 16 28.454 9.578 18.238 1.00 0.00 O0 ATOM 1366 CB SER C 16 25.257 9.642 17.334 1.00 0.00 C0 ATOM 1367 OG SER C 16 24.436 9.498 16.183 1.00 0.00 O0 ATOM 0 H SER C 16 25.020 7.191 17.469 1.00 0.00 H new ATOM 0 HA SER C 16 26.991 8.907 16.290 1.00 0.00 H new ATOM 0 HB2 SER C 16 24.686 9.412 18.234 1.00 0.00 H new ATOM 0 HB3 SER C 16 25.596 10.674 17.427 1.00 0.00 H new ATOM 0 HG SER C 16 24.177 8.558 16.081 1.00 0.00 H new ATOM 1373 N ALA C 17 27.049 8.390 19.545 1.00 0.00 N0 ATOM 1374 CA ALA C 17 27.876 8.529 20.738 1.00 0.00 C0 ATOM 1375 C ALA C 17 29.179 7.751 20.586 1.00 0.00 C0 ATOM 1376 O ALA C 17 30.234 8.186 21.050 1.00 0.00 O0 ATOM 1377 CB ALA C 17 27.114 8.027 21.968 1.00 0.00 C0 ATOM 0 H ALA C 17 26.194 7.851 19.682 1.00 0.00 H new ATOM 0 HA ALA C 17 28.114 9.585 20.868 1.00 0.00 H new ATOM 0 HB1 ALA C 17 27.741 8.135 22.853 1.00 0.00 H new ATOM 0 HB2 ALA C 17 26.203 8.611 22.095 1.00 0.00 H new ATOM 0 HB3 ALA C 17 26.856 6.977 21.832 1.00 0.00 H new ATOM 1383 N LEU C 18 29.107 6.603 19.922 1.00 0.00 N0 ATOM 1384 CA LEU C 18 30.287 5.780 19.706 1.00 0.00 C0 ATOM 1385 C LEU C 18 31.200 6.399 18.653 1.00 0.00 C0 ATOM 1386 O LEU C 18 32.428 6.293 18.746 1.00 0.00 O0 ATOM 1387 CB LEU C 18 29.852 4.384 19.261 1.00 0.00 C0 ATOM 1388 CG LEU C 18 29.117 3.692 20.413 1.00 0.00 C0 ATOM 1389 CD1 LEU C 18 28.347 2.482 19.879 1.00 0.00 C0 ATOM 1390 CD2 LEU C 18 30.129 3.222 21.459 1.00 0.00 C0 ATOM 0 H LEU C 18 28.247 6.224 19.526 1.00 0.00 H new ATOM 0 HA LEU C 18 30.844 5.715 20.640 1.00 0.00 H new ATOM 0 HB2 LEU C 18 29.202 4.454 18.389 1.00 0.00 H new ATOM 0 HB3 LEU C 18 30.721 3.797 18.964 1.00 0.00 H new ATOM 0 HG LEU C 18 28.421 4.397 20.868 1.00 0.00 H new ATOM 0 HD11 LEU C 18 27.825 1.991 20.701 1.00 0.00 H new ATOM 0 HD12 LEU C 18 27.623 2.811 19.134 1.00 0.00 H new ATOM 0 HD13 LEU C 18 29.044 1.780 19.421 1.00 0.00 H new ATOM 0 HD21 LEU C 18 29.604 2.730 22.278 1.00 0.00 H new ATOM 0 HD22 LEU C 18 30.826 2.520 21.001 1.00 0.00 H new ATOM 0 HD23 LEU C 18 30.679 4.080 21.845 1.00 0.00 H new ATOM 1402 N HIS C 19 30.600 7.064 17.661 1.00 0.00 N0 ATOM 1403 CA HIS C 19 31.371 7.710 16.604 1.00 0.00 C0 ATOM 1404 C HIS C 19 32.210 8.846 17.170 1.00 0.00 C0 ATOM 1405 O HIS C 19 33.408 8.944 16.899 1.00 0.00 O0 ATOM 1406 CB HIS C 19 30.426 8.254 15.527 1.00 0.00 C0 ATOM 1407 CG HIS C 19 31.222 8.972 14.472 1.00 0.00 C0 ATOM 1408 ND1 HIS C 19 31.518 10.324 14.563 1.00 0.00 N0 ATOM 1409 CD2 HIS C 19 31.792 8.545 13.298 1.00 0.00 C0 ATOM 1410 CE1 HIS C 19 32.235 10.658 13.474 1.00 0.00 C0 ATOM 1411 NE2 HIS C 19 32.431 9.610 12.670 1.00 0.00 N0 ATOM 0 H HIS C 19 29.589 7.167 17.571 1.00 0.00 H new ATOM 0 HA HIS C 19 32.038 6.970 16.162 1.00 0.00 H new ATOM 0 HB2 HIS C 19 29.862 7.437 15.078 1.00 0.00 H new ATOM 0 HB3 HIS C 19 29.701 8.933 15.975 1.00 0.00 H new ATOM 0 HD1 HIS C 19 31.242 10.951 15.318 1.00 0.00 H new ATOM 0 HD2 HIS C 19 31.751 7.535 12.919 1.00 0.00 H new ATOM 0 HE1 HIS C 19 32.606 11.652 13.275 1.00 0.00 H new ATOM 1419 N PHE C 20 31.576 9.697 17.971 1.00 0.00 N0 ATOM 1420 CA PHE C 20 32.288 10.814 18.576 1.00 0.00 C0 ATOM 1421 C PHE C 20 33.270 10.317 19.628 1.00 0.00 C0 ATOM 1422 O PHE C 20 34.306 10.934 19.857 1.00 0.00 O0 ATOM 1423 CB PHE C 20 31.300 11.801 19.202 1.00 0.00 C0 ATOM 1424 CG PHE C 20 31.164 13.010 18.305 1.00 0.00 C0 ATOM 1425 CD1 PHE C 20 30.526 12.899 17.062 1.00 0.00 C0 ATOM 1426 CD2 PHE C 20 31.683 14.244 18.716 1.00 0.00 C0 ATOM 1427 CE1 PHE C 20 30.409 14.024 16.234 1.00 0.00 C0 ATOM 1428 CE2 PHE C 20 31.564 15.366 17.888 1.00 0.00 C0 ATOM 1429 CZ PHE C 20 30.928 15.256 16.648 1.00 0.00 C0 ATOM 0 H PHE C 20 30.587 9.636 18.213 1.00 0.00 H new ATOM 0 HA PHE C 20 32.848 11.327 17.794 1.00 0.00 H new ATOM 0 HB2 PHE C 20 30.329 11.324 19.338 1.00 0.00 H new ATOM 0 HB3 PHE C 20 31.648 12.104 20.190 1.00 0.00 H new ATOM 0 HD1 PHE C 20 30.125 11.948 16.743 1.00 0.00 H new ATOM 0 HD2 PHE C 20 32.176 14.330 19.673 1.00 0.00 H new ATOM 0 HE1 PHE C 20 29.918 13.940 15.276 1.00 0.00 H new ATOM 0 HE2 PHE C 20 31.964 16.317 18.207 1.00 0.00 H new ATOM 0 HZ PHE C 20 30.837 16.122 16.009 1.00 0.00 H new ATOM 1439 N MET C 21 32.946 9.191 20.258 1.00 0.00 N0 ATOM 1440 CA MET C 21 33.821 8.623 21.273 1.00 0.00 C0 ATOM 1441 C MET C 21 35.186 8.283 20.676 1.00 0.00 C0 ATOM 1442 O MET C 21 36.227 8.764 21.146 1.00 0.00 O0 ATOM 1443 CB MET C 21 33.184 7.356 21.846 1.00 0.00 C0 ATOM 1444 CG MET C 21 32.618 7.652 23.237 1.00 0.00 C0 ATOM 1445 SD MET C 21 33.965 7.640 24.446 1.00 0.00 S0 ATOM 1446 CE MET C 21 32.937 7.673 25.935 1.00 0.00 C0 ATOM 0 H MET C 21 32.092 8.660 20.084 1.00 0.00 H new ATOM 0 HA MET C 21 33.959 9.358 22.066 1.00 0.00 H new ATOM 0 HB2 MET C 21 32.391 7.005 21.186 1.00 0.00 H new ATOM 0 HB3 MET C 21 33.925 6.559 21.906 1.00 0.00 H new ATOM 0 HG2 MET C 21 32.119 8.621 23.241 1.00 0.00 H new ATOM 0 HG3 MET C 21 31.868 6.907 23.503 1.00 0.00 H new ATOM 0 HE1 MET C 21 33.576 7.670 26.818 1.00 0.00 H new ATOM 0 HE2 MET C 21 32.323 8.574 25.934 1.00 0.00 H new ATOM 0 HE3 MET C 21 32.292 6.795 25.951 1.00 0.00 H new ATOM 1456 N ALA C 22 35.181 7.456 19.634 1.00 0.00 N0 ATOM 1457 CA ALA C 22 36.427 7.070 18.989 1.00 0.00 C0 ATOM 1458 C ALA C 22 37.118 8.292 18.394 1.00 0.00 C0 ATOM 1459 O ALA C 22 38.338 8.425 18.473 1.00 0.00 O0 ATOM 1460 CB ALA C 22 36.157 6.044 17.891 1.00 0.00 C0 ATOM 0 H ALA C 22 34.341 7.047 19.225 1.00 0.00 H new ATOM 0 HA ALA C 22 37.080 6.625 19.740 1.00 0.00 H new ATOM 0 HB1 ALA C 22 37.097 5.763 17.416 1.00 0.00 H new ATOM 0 HB2 ALA C 22 35.692 5.159 18.326 1.00 0.00 H new ATOM 0 HB3 ALA C 22 35.489 6.476 17.146 1.00 0.00 H new ATOM 1466 N TRP C 23 36.332 9.182 17.802 1.00 0.00 N0 ATOM 1467 CA TRP C 23 36.883 10.389 17.200 1.00 0.00 C0 ATOM 1468 C TRP C 23 37.669 11.191 18.232 1.00 0.00 C0 ATOM 1469 O TRP C 23 38.797 11.614 17.975 1.00 0.00 O0 ATOM 1470 CB TRP C 23 35.751 11.245 16.633 1.00 0.00 C0 ATOM 1471 CG TRP C 23 35.890 11.332 15.149 1.00 0.00 C0 ATOM 1472 CD1 TRP C 23 35.555 10.361 14.269 1.00 0.00 C0 ATOM 1473 CD2 TRP C 23 36.401 12.445 14.356 1.00 0.00 C0 ATOM 1474 NE1 TRP C 23 35.827 10.807 12.988 1.00 0.00 N0 ATOM 1475 CE2 TRP C 23 36.350 12.086 12.991 1.00 0.00 C0 ATOM 1476 CE3 TRP C 23 36.896 13.719 14.690 1.00 0.00 C0 ATOM 1477 CZ2 TRP C 23 36.778 12.958 11.988 1.00 0.00 C0 ATOM 1478 CZ3 TRP C 23 37.327 14.601 13.686 1.00 0.00 C0 ATOM 1479 CH2 TRP C 23 37.267 14.222 12.337 1.00 0.00 C0 ATOM 0 H TRP C 23 35.319 9.092 17.726 1.00 0.00 H new ATOM 0 HA TRP C 23 37.559 10.101 16.395 1.00 0.00 H new ATOM 0 HB2 TRP C 23 34.786 10.810 16.894 1.00 0.00 H new ATOM 0 HB3 TRP C 23 35.780 12.243 17.071 1.00 0.00 H new ATOM 0 HD1 TRP C 23 35.143 9.396 14.524 1.00 0.00 H new ATOM 0 HE1 TRP C 23 35.662 10.259 12.144 1.00 0.00 H new ATOM 0 HE3 TRP C 23 36.945 14.021 15.726 1.00 0.00 H new ATOM 0 HZ2 TRP C 23 36.732 12.659 10.951 1.00 0.00 H new ATOM 0 HZ3 TRP C 23 37.707 15.576 13.954 1.00 0.00 H new ATOM 0 HH2 TRP C 23 37.598 14.905 11.568 1.00 0.00 H new ATOM 1490 N THR C 24 37.061 11.410 19.389 1.00 0.00 N0 ATOM 1491 CA THR C 24 37.706 12.176 20.447 1.00 0.00 C0 ATOM 1492 C THR C 24 39.039 11.538 20.819 1.00 0.00 C0 ATOM 1493 O THR C 24 40.046 12.229 20.989 1.00 0.00 O0 ATOM 1494 CB THR C 24 36.800 12.224 21.678 1.00 0.00 C0 ATOM 1495 OG1 THR C 24 35.570 12.848 21.334 1.00 0.00 O0 ATOM 1496 CG2 THR C 24 37.481 13.023 22.789 1.00 0.00 C0 ATOM 0 H THR C 24 36.127 11.070 19.619 1.00 0.00 H new ATOM 0 HA THR C 24 37.884 13.190 20.089 1.00 0.00 H new ATOM 0 HB THR C 24 36.612 11.209 22.027 1.00 0.00 H new ATOM 0 HG1 THR C 24 35.025 12.228 20.805 1.00 0.00 H new ATOM 0 HG21 THR C 24 36.832 13.055 23.664 1.00 0.00 H new ATOM 0 HG22 THR C 24 38.425 12.546 23.054 1.00 0.00 H new ATOM 0 HG23 THR C 24 37.672 14.038 22.442 1.00 0.00 H new ATOM 1504 N ILE C 25 39.044 10.218 20.936 1.00 0.00 N0 ATOM 1505 CA ILE C 25 40.269 9.503 21.282 1.00 0.00 C0 ATOM 1506 C ILE C 25 41.313 9.664 20.174 1.00 0.00 C0 ATOM 1507 O ILE C 25 42.508 9.835 20.438 1.00 0.00 O0 ATOM 1508 CB ILE C 25 39.956 8.021 21.488 1.00 0.00 C0 ATOM 1509 CG1 ILE C 25 38.985 7.874 22.663 1.00 0.00 C0 ATOM 1510 CG2 ILE C 25 41.250 7.260 21.797 1.00 0.00 C0 ATOM 1511 CD1 ILE C 25 38.416 6.454 22.682 1.00 0.00 C0 ATOM 0 H ILE C 25 38.226 9.624 20.799 1.00 0.00 H new ATOM 0 HA ILE C 25 40.673 9.921 22.204 1.00 0.00 H new ATOM 0 HB ILE C 25 39.506 7.612 20.583 1.00 0.00 H new ATOM 0 HG12 ILE C 25 39.499 8.084 23.601 1.00 0.00 H new ATOM 0 HG13 ILE C 25 38.177 8.600 22.573 1.00 0.00 H new ATOM 0 HG21 ILE C 25 41.025 6.204 21.944 1.00 0.00 H new ATOM 0 HG22 ILE C 25 41.945 7.371 20.965 1.00 0.00 H new ATOM 0 HG23 ILE C 25 41.702 7.664 22.703 1.00 0.00 H new ATOM 0 HD11 ILE C 25 37.725 6.350 23.519 1.00 0.00 H new ATOM 0 HD12 ILE C 25 37.887 6.261 21.749 1.00 0.00 H new ATOM 0 HD13 ILE C 25 39.230 5.737 22.793 1.00 0.00 H new ATOM 1523 N GLY C 26 40.846 9.611 18.935 1.00 0.00 N0 ATOM 1524 CA GLY C 26 41.736 9.747 17.787 1.00 0.00 C0 ATOM 1525 C GLY C 26 42.513 11.055 17.863 1.00 0.00 C0 ATOM 1526 O GLY C 26 43.740 11.067 17.752 1.00 0.00 O0 ATOM 0 H GLY C 26 39.863 9.476 18.698 1.00 0.00 H new ATOM 0 HA2 GLY C 26 42.430 8.907 17.756 1.00 0.00 H new ATOM 0 HA3 GLY C 26 41.156 9.715 16.865 1.00 0.00 H new ATOM 1530 N HIS C 27 41.796 12.151 18.075 1.00 0.00 N0 ATOM 1531 CA HIS C 27 42.431 13.457 18.180 1.00 0.00 C0 ATOM 1532 C HIS C 27 43.345 13.501 19.396 1.00 0.00 C0 ATOM 1533 O HIS C 27 44.389 14.154 19.376 1.00 0.00 O0 ATOM 1534 CB HIS C 27 41.369 14.551 18.291 1.00 0.00 C0 ATOM 1535 CG HIS C 27 40.863 14.893 16.919 1.00 0.00 C0 ATOM 1536 ND1 HIS C 27 40.723 13.936 15.929 1.00 0.00 N0 ATOM 1537 CD2 HIS C 27 40.461 16.079 16.357 1.00 0.00 C0 ATOM 1538 CE1 HIS C 27 40.256 14.554 14.830 1.00 0.00 C0 ATOM 1539 NE2 HIS C 27 40.078 15.863 15.036 1.00 0.00 N0 ATOM 0 H HIS C 27 40.781 12.162 18.177 1.00 0.00 H new ATOM 0 HA HIS C 27 43.026 13.628 17.283 1.00 0.00 H new ATOM 0 HB2 HIS C 27 40.546 14.212 18.921 1.00 0.00 H new ATOM 0 HB3 HIS C 27 41.791 15.436 18.767 1.00 0.00 H new ATOM 0 HD2 HIS C 27 40.444 17.033 16.862 1.00 0.00 H new ATOM 0 HE1 HIS C 27 40.050 14.054 13.895 1.00 0.00 H new ATOM 0 HE2 HIS C 27 39.735 16.554 14.369 1.00 0.00 H new ATOM 1547 N LEU C 28 42.949 12.801 20.452 1.00 0.00 N0 ATOM 1548 CA LEU C 28 43.748 12.770 21.667 1.00 0.00 C0 ATOM 1549 C LEU C 28 45.148 12.238 21.368 1.00 0.00 C0 ATOM 1550 O LEU C 28 46.125 12.662 21.988 1.00 0.00 O0 ATOM 1551 CB LEU C 28 43.075 11.883 22.720 1.00 0.00 C0 ATOM 1552 CG LEU C 28 42.902 12.654 24.037 1.00 0.00 C0 ATOM 1553 CD1 LEU C 28 44.261 13.180 24.528 1.00 0.00 C0 ATOM 1554 CD2 LEU C 28 41.930 13.827 23.829 1.00 0.00 C0 ATOM 0 H LEU C 28 42.089 12.254 20.491 1.00 0.00 H new ATOM 0 HA LEU C 28 43.829 13.786 22.053 1.00 0.00 H new ATOM 0 HB2 LEU C 28 42.103 11.549 22.356 1.00 0.00 H new ATOM 0 HB3 LEU C 28 43.676 10.990 22.890 1.00 0.00 H new ATOM 0 HG LEU C 28 42.495 11.980 24.790 1.00 0.00 H new ATOM 0 HD11 LEU C 28 44.124 13.725 25.462 1.00 0.00 H new ATOM 0 HD12 LEU C 28 44.938 12.342 24.692 1.00 0.00 H new ATOM 0 HD13 LEU C 28 44.685 13.847 23.778 1.00 0.00 H new ATOM 0 HD21 LEU C 28 41.810 14.371 24.766 1.00 0.00 H new ATOM 0 HD22 LEU C 28 42.328 14.498 23.068 1.00 0.00 H new ATOM 0 HD23 LEU C 28 40.962 13.444 23.506 1.00 0.00 H new ATOM 1751 N GLN D 6 9.889 14.656 13.622 1.00 0.00 N0 ATOM 1752 CA GLN D 6 10.409 15.990 13.890 1.00 0.00 C0 ATOM 1753 C GLN D 6 11.579 15.923 14.868 1.00 0.00 C0 ATOM 1754 O GLN D 6 12.577 16.624 14.702 1.00 0.00 O0 ATOM 1755 CB GLN D 6 9.305 16.874 14.475 1.00 0.00 C0 ATOM 1756 CG GLN D 6 9.768 18.331 14.492 1.00 0.00 C0 ATOM 1757 CD GLN D 6 9.720 18.908 13.080 1.00 0.00 C0 ATOM 1758 OE1 GLN D 6 8.942 18.444 12.246 1.00 0.00 O0 ATOM 1759 NE2 GLN D 6 10.501 19.905 12.761 1.00 0.00 N0 ATOM 0 HA GLN D 6 10.758 16.418 12.950 1.00 0.00 H new ATOM 0 HB2 GLN D 6 8.396 16.778 13.881 1.00 0.00 H new ATOM 0 HB3 GLN D 6 9.062 16.548 15.486 1.00 0.00 H new ATOM 0 HG2 GLN D 6 9.131 18.916 15.155 1.00 0.00 H new ATOM 0 HG3 GLN D 6 10.782 18.395 14.886 1.00 0.00 H new ATOM 0 HE21 GLN D 6 11.145 20.289 13.452 1.00 0.00 H new ATOM 0 HE22 GLN D 6 10.466 20.299 11.821 1.00 0.00 H new ATOM 1768 N ILE D 7 11.449 15.070 15.882 1.00 0.00 N0 ATOM 1769 CA ILE D 7 12.500 14.910 16.883 1.00 0.00 C0 ATOM 1770 C ILE D 7 13.759 14.329 16.253 1.00 0.00 C0 ATOM 1771 O ILE D 7 14.867 14.797 16.502 1.00 0.00 O0 ATOM 1772 CB ILE D 7 12.015 13.981 17.995 1.00 0.00 C0 ATOM 1773 CG1 ILE D 7 10.864 14.648 18.746 1.00 0.00 C0 ATOM 1774 CG2 ILE D 7 13.162 13.711 18.971 1.00 0.00 C0 ATOM 1775 CD1 ILE D 7 10.143 13.603 19.594 1.00 0.00 C0 ATOM 0 H ILE D 7 10.629 14.481 16.031 1.00 0.00 H new ATOM 0 HA ILE D 7 12.735 15.891 17.297 1.00 0.00 H new ATOM 0 HB ILE D 7 11.675 13.041 17.560 1.00 0.00 H new ATOM 0 HG12 ILE D 7 11.244 15.449 19.380 1.00 0.00 H new ATOM 0 HG13 ILE D 7 10.169 15.103 18.040 1.00 0.00 H new ATOM 0 HG21 ILE D 7 12.816 13.048 19.764 1.00 0.00 H new ATOM 0 HG22 ILE D 7 13.989 13.240 18.439 1.00 0.00 H new ATOM 0 HG23 ILE D 7 13.499 14.652 19.406 1.00 0.00 H new ATOM 0 HD11 ILE D 7 9.321 14.075 20.132 1.00 0.00 H new ATOM 0 HD12 ILE D 7 9.751 12.818 18.948 1.00 0.00 H new ATOM 0 HD13 ILE D 7 10.842 13.169 20.309 1.00 0.00 H new ATOM 1787 N LEU D 8 13.584 13.298 15.438 1.00 0.00 N0 ATOM 1788 CA LEU D 8 14.722 12.667 14.784 1.00 0.00 C0 ATOM 1789 C LEU D 8 15.297 13.586 13.708 1.00 0.00 C0 ATOM 1790 O LEU D 8 16.498 13.570 13.441 1.00 0.00 O0 ATOM 1791 CB LEU D 8 14.301 11.341 14.151 1.00 0.00 C0 ATOM 1792 CG LEU D 8 15.540 10.595 13.651 1.00 0.00 C0 ATOM 1793 CD1 LEU D 8 16.338 10.053 14.839 1.00 0.00 C0 ATOM 1794 CD2 LEU D 8 15.105 9.433 12.757 1.00 0.00 C0 ATOM 0 H LEU D 8 12.678 12.885 15.216 1.00 0.00 H new ATOM 0 HA LEU D 8 15.487 12.479 15.537 1.00 0.00 H new ATOM 0 HB2 LEU D 8 13.767 10.732 14.880 1.00 0.00 H new ATOM 0 HB3 LEU D 8 13.615 11.523 13.324 1.00 0.00 H new ATOM 0 HG LEU D 8 16.168 11.282 13.083 1.00 0.00 H new ATOM 0 HD11 LEU D 8 17.218 9.523 14.475 1.00 0.00 H new ATOM 0 HD12 LEU D 8 16.650 10.881 15.476 1.00 0.00 H new ATOM 0 HD13 LEU D 8 15.715 9.368 15.414 1.00 0.00 H new ATOM 0 HD21 LEU D 8 15.986 8.900 12.399 1.00 0.00 H new ATOM 0 HD22 LEU D 8 14.475 8.751 13.328 1.00 0.00 H new ATOM 0 HD23 LEU D 8 14.544 9.819 11.906 1.00 0.00 H new ATOM 1806 N SER D 9 14.422 14.384 13.099 1.00 0.00 N0 ATOM 1807 CA SER D 9 14.836 15.311 12.052 1.00 0.00 C0 ATOM 1808 C SER D 9 15.756 16.402 12.594 1.00 0.00 C0 ATOM 1809 O SER D 9 16.821 16.664 12.034 1.00 0.00 O0 ATOM 1810 CB SER D 9 13.607 15.962 11.415 1.00 0.00 C0 ATOM 1811 OG SER D 9 14.029 16.928 10.461 1.00 0.00 O0 ATOM 0 H SER D 9 13.425 14.406 13.313 1.00 0.00 H new ATOM 0 HA SER D 9 15.387 14.738 11.306 1.00 0.00 H new ATOM 0 HB2 SER D 9 12.988 15.205 10.934 1.00 0.00 H new ATOM 0 HB3 SER D 9 12.993 16.435 12.182 1.00 0.00 H new ATOM 0 HG SER D 9 13.244 17.346 10.050 1.00 0.00 H new ATOM 1817 N ILE D 10 15.338 17.036 13.683 1.00 0.00 N0 ATOM 1818 CA ILE D 10 16.130 18.101 14.284 1.00 0.00 C0 ATOM 1819 C ILE D 10 17.337 17.534 15.022 1.00 0.00 C0 ATOM 1820 O ILE D 10 18.359 18.205 15.160 1.00 0.00 O0 ATOM 1821 CB ILE D 10 15.265 18.916 15.255 1.00 0.00 C0 ATOM 1822 CG1 ILE D 10 14.729 17.999 16.358 1.00 0.00 C0 ATOM 1823 CG2 ILE D 10 14.085 19.529 14.498 1.00 0.00 C0 ATOM 1824 CD1 ILE D 10 15.568 18.156 17.629 1.00 0.00 C0 ATOM 0 H ILE D 10 14.462 16.833 14.165 1.00 0.00 H new ATOM 0 HA ILE D 10 16.488 18.750 13.485 1.00 0.00 H new ATOM 0 HB ILE D 10 15.870 19.708 15.697 1.00 0.00 H new ATOM 0 HG12 ILE D 10 13.687 18.242 16.569 1.00 0.00 H new ATOM 0 HG13 ILE D 10 14.753 16.962 16.023 1.00 0.00 H new ATOM 0 HG21 ILE D 10 13.471 20.108 15.188 1.00 0.00 H new ATOM 0 HG22 ILE D 10 14.458 20.182 13.709 1.00 0.00 H new ATOM 0 HG23 ILE D 10 13.484 18.734 14.056 1.00 0.00 H new ATOM 0 HD11 ILE D 10 15.177 17.499 18.406 1.00 0.00 H new ATOM 0 HD12 ILE D 10 16.604 17.891 17.416 1.00 0.00 H new ATOM 0 HD13 ILE D 10 15.521 19.190 17.971 1.00 0.00 H new ATOM 1836 N CYS D 11 17.223 16.291 15.486 1.00 0.00 N0 ATOM 1837 CA CYS D 11 18.326 15.656 16.196 1.00 0.00 C0 ATOM 1838 C CYS D 11 19.505 15.407 15.256 1.00 0.00 C0 ATOM 1839 O CYS D 11 20.642 15.812 15.534 1.00 0.00 O0 ATOM 1840 CB CYS D 11 17.848 14.327 16.786 1.00 0.00 C0 ATOM 1841 SG CYS D 11 19.172 13.587 17.774 1.00 0.00 S0 ATOM 0 H CYS D 11 16.389 15.712 15.384 1.00 0.00 H new ATOM 0 HA CYS D 11 18.658 16.320 16.995 1.00 0.00 H new ATOM 0 HB2 CYS D 11 16.966 14.489 17.406 1.00 0.00 H new ATOM 0 HB3 CYS D 11 17.555 13.647 15.986 1.00 0.00 H new ATOM 0 HG CYS D 11 18.762 12.460 18.275 1.00 0.00 H new ATOM 1847 N SER D 12 19.226 14.750 14.131 1.00 0.00 N0 ATOM 1848 CA SER D 12 20.265 14.455 13.150 1.00 0.00 C0 ATOM 1849 C SER D 12 20.757 15.739 12.498 1.00 0.00 C0 ATOM 1850 O SER D 12 21.943 15.886 12.214 1.00 0.00 O0 ATOM 1851 CB SER D 12 19.733 13.497 12.084 1.00 0.00 C0 ATOM 1852 OG SER D 12 19.436 12.244 12.686 1.00 0.00 O0 ATOM 0 H SER D 12 18.296 14.415 13.879 1.00 0.00 H new ATOM 0 HA SER D 12 21.100 13.980 13.664 1.00 0.00 H new ATOM 0 HB2 SER D 12 18.838 13.912 11.620 1.00 0.00 H new ATOM 0 HB3 SER D 12 20.472 13.368 11.293 1.00 0.00 H new ATOM 0 HG SER D 12 19.093 11.627 12.006 1.00 0.00 H new ATOM 1858 N PHE D 13 19.839 16.670 12.270 1.00 0.00 N0 ATOM 1859 CA PHE D 13 20.196 17.943 11.659 1.00 0.00 C0 ATOM 1860 C PHE D 13 21.256 18.661 12.488 1.00 0.00 C0 ATOM 1861 O PHE D 13 22.264 19.131 11.955 1.00 0.00 O0 ATOM 1862 CB PHE D 13 18.952 18.822 11.540 1.00 0.00 C0 ATOM 1863 CG PHE D 13 19.369 20.257 11.325 1.00 0.00 C0 ATOM 1864 CD1 PHE D 13 19.989 20.641 10.131 1.00 0.00 C0 ATOM 1865 CD2 PHE D 13 19.134 21.205 12.328 1.00 0.00 C0 ATOM 1866 CE1 PHE D 13 20.375 21.973 9.940 1.00 0.00 C0 ATOM 1867 CE2 PHE D 13 19.518 22.537 12.138 1.00 0.00 C0 ATOM 1868 CZ PHE D 13 20.139 22.921 10.944 1.00 0.00 C0 ATOM 0 H PHE D 13 18.850 16.569 12.497 1.00 0.00 H new ATOM 0 HA PHE D 13 20.604 17.750 10.667 1.00 0.00 H new ATOM 0 HB2 PHE D 13 18.333 18.484 10.709 1.00 0.00 H new ATOM 0 HB3 PHE D 13 18.347 18.739 12.443 1.00 0.00 H new ATOM 0 HD1 PHE D 13 20.170 19.910 9.357 1.00 0.00 H new ATOM 0 HD2 PHE D 13 18.656 20.908 13.250 1.00 0.00 H new ATOM 0 HE1 PHE D 13 20.855 22.270 9.019 1.00 0.00 H new ATOM 0 HE2 PHE D 13 19.335 23.268 12.912 1.00 0.00 H new ATOM 0 HZ PHE D 13 20.436 23.949 10.797 1.00 0.00 H new ATOM 1878 N ILE D 14 21.029 18.738 13.795 1.00 0.00 N0 ATOM 1879 CA ILE D 14 21.978 19.397 14.681 1.00 0.00 C0 ATOM 1880 C ILE D 14 23.325 18.687 14.643 1.00 0.00 C0 ATOM 1881 O ILE D 14 24.374 19.325 14.541 1.00 0.00 O0 ATOM 1882 CB ILE D 14 21.438 19.395 16.108 1.00 0.00 C0 ATOM 1883 CG1 ILE D 14 20.222 20.319 16.187 1.00 0.00 C0 ATOM 1884 CG2 ILE D 14 22.523 19.897 17.063 1.00 0.00 C0 ATOM 1885 CD1 ILE D 14 19.436 20.029 17.469 1.00 0.00 C0 ATOM 0 H ILE D 14 20.205 18.356 14.259 1.00 0.00 H new ATOM 0 HA ILE D 14 22.114 20.425 14.344 1.00 0.00 H new ATOM 0 HB ILE D 14 21.148 18.383 16.389 1.00 0.00 H new ATOM 0 HG12 ILE D 14 20.543 21.361 16.174 1.00 0.00 H new ATOM 0 HG13 ILE D 14 19.583 20.171 15.316 1.00 0.00 H new ATOM 0 HG21 ILE D 14 22.139 19.896 18.083 1.00 0.00 H new ATOM 0 HG22 ILE D 14 23.392 19.242 17.002 1.00 0.00 H new ATOM 0 HG23 ILE D 14 22.812 20.911 16.785 1.00 0.00 H new ATOM 0 HD11 ILE D 14 18.570 20.689 17.522 1.00 0.00 H new ATOM 0 HD12 ILE D 14 19.102 18.992 17.464 1.00 0.00 H new ATOM 0 HD13 ILE D 14 20.076 20.200 18.335 1.00 0.00 H new ATOM 1897 N LEU D 15 23.295 17.361 14.729 1.00 0.00 N0 ATOM 1898 CA LEU D 15 24.529 16.583 14.705 1.00 0.00 C0 ATOM 1899 C LEU D 15 25.247 16.734 13.365 1.00 0.00 C0 ATOM 1900 O LEU D 15 26.467 16.595 13.286 1.00 0.00 O0 ATOM 1901 CB LEU D 15 24.216 15.105 14.955 1.00 0.00 C0 ATOM 1902 CG LEU D 15 24.605 14.715 16.384 1.00 0.00 C0 ATOM 1903 CD1 LEU D 15 23.461 13.927 17.027 1.00 0.00 C0 ATOM 1904 CD2 LEU D 15 25.860 13.841 16.339 1.00 0.00 C0 ATOM 0 H LEU D 15 22.442 16.808 14.815 1.00 0.00 H new ATOM 0 HA LEU D 15 25.183 16.959 15.492 1.00 0.00 H new ATOM 0 HB2 LEU D 15 23.154 14.919 14.796 1.00 0.00 H new ATOM 0 HB3 LEU D 15 24.758 14.485 14.241 1.00 0.00 H new ATOM 0 HG LEU D 15 24.801 15.613 16.970 1.00 0.00 H new ATOM 0 HD11 LEU D 15 23.737 13.649 18.044 1.00 0.00 H new ATOM 0 HD12 LEU D 15 22.563 14.544 17.051 1.00 0.00 H new ATOM 0 HD13 LEU D 15 23.267 13.026 16.445 1.00 0.00 H new ATOM 0 HD21 LEU D 15 26.144 13.559 17.353 1.00 0.00 H new ATOM 0 HD22 LEU D 15 25.657 12.943 15.756 1.00 0.00 H new ATOM 0 HD23 LEU D 15 26.675 14.398 15.876 1.00 0.00 H new ATOM 1916 N SER D 16 24.488 17.034 12.320 1.00 0.00 N0 ATOM 1917 CA SER D 16 25.066 17.213 10.993 1.00 0.00 C0 ATOM 1918 C SER D 16 25.846 18.522 10.908 1.00 0.00 C0 ATOM 1919 O SER D 16 26.955 18.570 10.363 1.00 0.00 O0 ATOM 1920 CB SER D 16 23.955 17.210 9.945 1.00 0.00 C0 ATOM 1921 OG SER D 16 23.311 15.942 9.950 1.00 0.00 O0 ATOM 0 H SER D 16 23.477 17.158 12.363 1.00 0.00 H new ATOM 0 HA SER D 16 25.754 16.389 10.804 1.00 0.00 H new ATOM 0 HB2 SER D 16 23.234 17.998 10.160 1.00 0.00 H new ATOM 0 HB3 SER D 16 24.369 17.417 8.958 1.00 0.00 H new ATOM 0 HG SER D 16 22.584 15.947 10.607 1.00 0.00 H new ATOM 1927 N ALA D 17 25.266 19.579 11.473 1.00 0.00 N0 ATOM 1928 CA ALA D 17 25.911 20.887 11.473 1.00 0.00 C0 ATOM 1929 C ALA D 17 27.144 20.882 12.370 1.00 0.00 C0 ATOM 1930 O ALA D 17 28.151 21.523 12.066 1.00 0.00 O0 ATOM 1931 CB ALA D 17 24.927 21.958 11.953 1.00 0.00 C0 ATOM 0 H ALA D 17 24.356 19.555 11.934 1.00 0.00 H new ATOM 0 HA ALA D 17 26.223 21.114 10.454 1.00 0.00 H new ATOM 0 HB1 ALA D 17 25.418 22.931 11.949 1.00 0.00 H new ATOM 0 HB2 ALA D 17 24.065 21.984 11.287 1.00 0.00 H new ATOM 0 HB3 ALA D 17 24.597 21.722 12.965 1.00 0.00 H new ATOM 1937 N LEU D 18 27.071 20.144 13.470 1.00 0.00 N0 ATOM 1938 CA LEU D 18 28.190 20.054 14.397 1.00 0.00 C0 ATOM 1939 C LEU D 18 29.306 19.189 13.820 1.00 0.00 C0 ATOM 1940 O LEU D 18 30.489 19.456 14.050 1.00 0.00 O0 ATOM 1941 CB LEU D 18 27.699 19.465 15.719 1.00 0.00 C0 ATOM 1942 CG LEU D 18 26.736 20.451 16.387 1.00 0.00 C0 ATOM 1943 CD1 LEU D 18 25.951 19.737 17.487 1.00 0.00 C0 ATOM 1944 CD2 LEU D 18 27.531 21.604 17.004 1.00 0.00 C0 ATOM 0 H LEU D 18 26.251 19.601 13.741 1.00 0.00 H new ATOM 0 HA LEU D 18 28.592 21.053 14.565 1.00 0.00 H new ATOM 0 HB2 LEU D 18 27.198 18.513 15.542 1.00 0.00 H new ATOM 0 HB3 LEU D 18 28.545 19.263 16.376 1.00 0.00 H new ATOM 0 HG LEU D 18 26.045 20.840 15.639 1.00 0.00 H new ATOM 0 HD11 LEU D 18 25.267 20.441 17.961 1.00 0.00 H new ATOM 0 HD12 LEU D 18 25.383 18.914 17.053 1.00 0.00 H new ATOM 0 HD13 LEU D 18 26.643 19.346 18.233 1.00 0.00 H new ATOM 0 HD21 LEU D 18 26.845 22.305 17.479 1.00 0.00 H new ATOM 0 HD22 LEU D 18 28.223 21.211 17.749 1.00 0.00 H new ATOM 0 HD23 LEU D 18 28.092 22.118 16.223 1.00 0.00 H new ATOM 1956 N HIS D 19 28.926 18.158 13.058 1.00 0.00 N0 ATOM 1957 CA HIS D 19 29.904 17.269 12.441 1.00 0.00 C0 ATOM 1958 C HIS D 19 30.746 18.021 11.422 1.00 0.00 C0 ATOM 1959 O HIS D 19 31.977 17.934 11.431 1.00 0.00 O0 ATOM 1960 CB HIS D 19 29.189 16.100 11.757 1.00 0.00 C0 ATOM 1961 CG HIS D 19 30.199 15.220 11.073 1.00 0.00 C0 ATOM 1962 ND1 HIS D 19 30.598 15.434 9.764 1.00 0.00 N0 ATOM 1963 CD2 HIS D 19 30.900 14.119 11.503 1.00 0.00 C0 ATOM 1964 CE1 HIS D 19 31.501 14.487 9.453 1.00 0.00 C0 ATOM 1965 NE2 HIS D 19 31.722 13.659 10.477 1.00 0.00 N0 ATOM 0 H HIS D 19 27.954 17.923 12.857 1.00 0.00 H new ATOM 0 HA HIS D 19 30.561 16.886 13.222 1.00 0.00 H new ATOM 0 HB2 HIS D 19 28.628 15.523 12.493 1.00 0.00 H new ATOM 0 HB3 HIS D 19 28.469 16.476 11.031 1.00 0.00 H new ATOM 0 HD1 HIS D 19 30.267 16.176 9.147 1.00 0.00 H new ATOM 0 HD2 HIS D 19 30.825 13.678 12.486 1.00 0.00 H new ATOM 0 HE1 HIS D 19 31.988 14.406 8.492 1.00 0.00 H new ATOM 1973 N PHE D 20 30.079 18.772 10.549 1.00 0.00 N0 ATOM 1974 CA PHE D 20 30.788 19.540 9.536 1.00 0.00 C0 ATOM 1975 C PHE D 20 31.548 20.696 10.177 1.00 0.00 C0 ATOM 1976 O PHE D 20 32.589 21.115 9.677 1.00 0.00 O0 ATOM 1977 CB PHE D 20 29.812 20.072 8.483 1.00 0.00 C0 ATOM 1978 CG PHE D 20 29.928 19.236 7.225 1.00 0.00 C0 ATOM 1979 CD1 PHE D 20 29.482 17.908 7.215 1.00 0.00 C0 ATOM 1980 CD2 PHE D 20 30.495 19.789 6.068 1.00 0.00 C0 ATOM 1981 CE1 PHE D 20 29.607 17.132 6.055 1.00 0.00 C0 ATOM 1982 CE2 PHE D 20 30.615 19.015 4.904 1.00 0.00 C0 ATOM 1983 CZ PHE D 20 30.173 17.682 4.897 1.00 0.00 C0 ATOM 0 H PHE D 20 29.063 18.863 10.524 1.00 0.00 H new ATOM 0 HA PHE D 20 31.503 18.879 9.046 1.00 0.00 H new ATOM 0 HB2 PHE D 20 28.792 20.036 8.865 1.00 0.00 H new ATOM 0 HB3 PHE D 20 30.032 21.116 8.261 1.00 0.00 H new ATOM 0 HD1 PHE D 20 29.041 17.481 8.104 1.00 0.00 H new ATOM 0 HD2 PHE D 20 30.840 20.812 6.073 1.00 0.00 H new ATOM 0 HE1 PHE D 20 29.266 16.107 6.053 1.00 0.00 H new ATOM 0 HE2 PHE D 20 31.048 19.445 4.013 1.00 0.00 H new ATOM 0 HZ PHE D 20 30.269 17.083 4.003 1.00 0.00 H new ATOM 1993 N MET D 21 31.031 21.198 11.296 1.00 0.00 N0 ATOM 1994 CA MET D 21 31.687 22.295 11.999 1.00 0.00 C0 ATOM 1995 C MET D 21 33.090 21.886 12.444 1.00 0.00 C0 ATOM 1996 O MET D 21 34.088 22.532 12.092 1.00 0.00 O0 ATOM 1997 CB MET D 21 30.857 22.691 13.220 1.00 0.00 C0 ATOM 1998 CG MET D 21 30.116 23.997 12.936 1.00 0.00 C0 ATOM 1999 SD MET D 21 31.257 25.388 13.140 1.00 0.00 S0 ATOM 2000 CE MET D 21 30.022 26.709 13.078 1.00 0.00 C0 ATOM 0 H MET D 21 30.170 20.867 11.731 1.00 0.00 H new ATOM 0 HA MET D 21 31.770 23.144 11.320 1.00 0.00 H new ATOM 0 HB2 MET D 21 30.144 21.902 13.459 1.00 0.00 H new ATOM 0 HB3 MET D 21 31.504 22.810 14.089 1.00 0.00 H new ATOM 0 HG2 MET D 21 29.713 23.987 11.923 1.00 0.00 H new ATOM 0 HG3 MET D 21 29.270 24.103 13.614 1.00 0.00 H new ATOM 0 HE1 MET D 21 30.516 27.674 13.187 1.00 0.00 H new ATOM 0 HE2 MET D 21 29.500 26.674 12.122 1.00 0.00 H new ATOM 0 HE3 MET D 21 29.305 26.575 13.888 1.00 0.00 H new ATOM 2010 N ALA D 22 33.171 20.806 13.217 1.00 0.00 N0 ATOM 2011 CA ALA D 22 34.462 20.331 13.692 1.00 0.00 C0 ATOM 2012 C ALA D 22 35.342 19.920 12.521 1.00 0.00 C0 ATOM 2013 O ALA D 22 36.542 20.184 12.511 1.00 0.00 O0 ATOM 2014 CB ALA D 22 34.272 19.145 14.635 1.00 0.00 C0 ATOM 0 H ALA D 22 32.370 20.253 13.522 1.00 0.00 H new ATOM 0 HA ALA D 22 34.950 21.143 14.231 1.00 0.00 H new ATOM 0 HB1 ALA D 22 35.245 18.798 14.984 1.00 0.00 H new ATOM 0 HB2 ALA D 22 33.669 19.452 15.489 1.00 0.00 H new ATOM 0 HB3 ALA D 22 33.767 18.337 14.106 1.00 0.00 H new ATOM 2020 N TRP D 23 34.739 19.272 11.531 1.00 0.00 N0 ATOM 2021 CA TRP D 23 35.483 18.833 10.358 1.00 0.00 C0 ATOM 2022 C TRP D 23 36.173 20.015 9.685 1.00 0.00 C0 ATOM 2023 O TRP D 23 37.359 19.952 9.365 1.00 0.00 O0 ATOM 2024 CB TRP D 23 34.534 18.159 9.367 1.00 0.00 C0 ATOM 2025 CG TRP D 23 34.906 16.720 9.224 1.00 0.00 C0 ATOM 2026 CD1 TRP D 23 34.621 15.744 10.115 1.00 0.00 C0 ATOM 2027 CD2 TRP D 23 35.631 16.081 8.134 1.00 0.00 C0 ATOM 2028 NE1 TRP D 23 35.129 14.546 9.642 1.00 0.00 N0 ATOM 2029 CE2 TRP D 23 35.760 14.704 8.423 1.00 0.00 C0 ATOM 2030 CE3 TRP D 23 36.185 16.562 6.932 1.00 0.00 C0 ATOM 2031 CZ2 TRP D 23 36.414 13.833 7.552 1.00 0.00 C0 ATOM 2032 CZ3 TRP D 23 36.844 15.686 6.053 1.00 0.00 C0 ATOM 2033 CH2 TRP D 23 36.958 14.325 6.363 1.00 0.00 C0 ATOM 0 H TRP D 23 33.746 19.041 11.517 1.00 0.00 H new ATOM 0 HA TRP D 23 36.244 18.121 10.677 1.00 0.00 H new ATOM 0 HB2 TRP D 23 33.505 18.247 9.715 1.00 0.00 H new ATOM 0 HB3 TRP D 23 34.587 18.658 8.399 1.00 0.00 H new ATOM 0 HD1 TRP D 23 34.085 15.877 11.043 1.00 0.00 H new ATOM 0 HE1 TRP D 23 35.047 13.656 10.133 1.00 0.00 H new ATOM 0 HE3 TRP D 23 36.103 17.610 6.684 1.00 0.00 H new ATOM 0 HZ2 TRP D 23 36.499 12.784 7.795 1.00 0.00 H new ATOM 0 HZ3 TRP D 23 37.265 16.064 5.133 1.00 0.00 H new ATOM 0 HH2 TRP D 23 37.466 13.657 5.684 1.00 0.00 H new ATOM 2044 N THR D 24 35.419 21.083 9.463 1.00 0.00 N0 ATOM 2045 CA THR D 24 35.963 22.267 8.816 1.00 0.00 C0 ATOM 2046 C THR D 24 37.158 22.794 9.601 1.00 0.00 C0 ATOM 2047 O THR D 24 38.185 23.153 9.024 1.00 0.00 O0 ATOM 2048 CB THR D 24 34.889 23.353 8.736 1.00 0.00 C0 ATOM 2049 OG1 THR D 24 33.788 22.874 7.978 1.00 0.00 O0 ATOM 2050 CG2 THR D 24 35.464 24.600 8.063 1.00 0.00 C0 ATOM 0 H THR D 24 34.434 21.153 9.720 1.00 0.00 H new ATOM 0 HA THR D 24 36.286 21.999 7.810 1.00 0.00 H new ATOM 0 HB THR D 24 34.558 23.606 9.743 1.00 0.00 H new ATOM 0 HG1 THR D 24 33.275 22.234 8.515 1.00 0.00 H new ATOM 0 HG21 THR D 24 34.695 25.371 8.008 1.00 0.00 H new ATOM 0 HG22 THR D 24 36.309 24.970 8.644 1.00 0.00 H new ATOM 0 HG23 THR D 24 35.798 24.349 7.056 1.00 0.00 H new ATOM 2058 N ILE D 25 37.026 22.827 10.922 1.00 0.00 N0 ATOM 2059 CA ILE D 25 38.116 23.306 11.768 1.00 0.00 C0 ATOM 2060 C ILE D 25 39.325 22.375 11.659 1.00 0.00 C0 ATOM 2061 O ILE D 25 40.476 22.822 11.620 1.00 0.00 O0 ATOM 2062 CB ILE D 25 37.639 23.371 13.221 1.00 0.00 C0 ATOM 2063 CG1 ILE D 25 36.491 24.379 13.325 1.00 0.00 C0 ATOM 2064 CG2 ILE D 25 38.796 23.820 14.121 1.00 0.00 C0 ATOM 2065 CD1 ILE D 25 35.796 24.227 14.680 1.00 0.00 C0 ATOM 0 H ILE D 25 36.189 22.533 11.426 1.00 0.00 H new ATOM 0 HA ILE D 25 38.414 24.301 11.436 1.00 0.00 H new ATOM 0 HB ILE D 25 37.296 22.387 13.540 1.00 0.00 H new ATOM 0 HG12 ILE D 25 36.873 25.394 13.213 1.00 0.00 H new ATOM 0 HG13 ILE D 25 35.776 24.216 12.518 1.00 0.00 H new ATOM 0 HG21 ILE D 25 38.456 23.866 15.155 1.00 0.00 H new ATOM 0 HG22 ILE D 25 39.617 23.108 14.041 1.00 0.00 H new ATOM 0 HG23 ILE D 25 39.139 24.806 13.808 1.00 0.00 H new ATOM 0 HD11 ILE D 25 34.979 24.945 14.753 1.00 0.00 H new ATOM 0 HD12 ILE D 25 35.400 23.216 14.774 1.00 0.00 H new ATOM 0 HD13 ILE D 25 36.513 24.412 15.480 1.00 0.00 H new ATOM 2077 N GLY D 26 39.048 21.080 11.610 1.00 0.00 N0 ATOM 2078 CA GLY D 26 40.112 20.085 11.510 1.00 0.00 C0 ATOM 2079 C GLY D 26 40.986 20.355 10.291 1.00 0.00 C0 ATOM 2080 O GLY D 26 42.211 20.428 10.396 1.00 0.00 O0 ATOM 0 H GLY D 26 38.104 20.693 11.637 1.00 0.00 H new ATOM 0 HA2 GLY D 26 40.722 20.105 12.413 1.00 0.00 H new ATOM 0 HA3 GLY D 26 39.679 19.087 11.440 1.00 0.00 H new ATOM 2084 N HIS D 27 40.347 20.525 9.140 1.00 0.00 N0 ATOM 2085 CA HIS D 27 41.076 20.803 7.909 1.00 0.00 C0 ATOM 2086 C HIS D 27 41.792 22.142 8.011 1.00 0.00 C0 ATOM 2087 O HIS D 27 42.880 22.317 7.462 1.00 0.00 O0 ATOM 2088 CB HIS D 27 40.115 20.823 6.723 1.00 0.00 C0 ATOM 2089 CG HIS D 27 39.857 19.416 6.268 1.00 0.00 C0 ATOM 2090 ND1 HIS D 27 39.782 18.358 7.158 1.00 0.00 N0 ATOM 2091 CD2 HIS D 27 39.656 18.875 5.022 1.00 0.00 C0 ATOM 2092 CE1 HIS D 27 39.546 17.243 6.444 1.00 0.00 C0 ATOM 2093 NE2 HIS D 27 39.459 17.501 5.137 1.00 0.00 N0 ATOM 0 H HIS D 27 39.334 20.476 9.033 1.00 0.00 H new ATOM 0 HA HIS D 27 41.815 20.016 7.758 1.00 0.00 H new ATOM 0 HB2 HIS D 27 39.178 21.303 7.007 1.00 0.00 H new ATOM 0 HB3 HIS D 27 40.538 21.409 5.907 1.00 0.00 H new ATOM 0 HD2 HIS D 27 39.651 19.430 4.095 1.00 0.00 H new ATOM 0 HE1 HIS D 27 39.440 16.259 6.875 1.00 0.00 H new ATOM 0 HE2 HIS D 27 39.286 16.835 4.384 1.00 0.00 H new ATOM 2101 N LEU D 28 41.181 23.080 8.721 1.00 0.00 N0 ATOM 2102 CA LEU D 28 41.780 24.397 8.889 1.00 0.00 C0 ATOM 2103 C LEU D 28 43.152 24.277 9.543 1.00 0.00 C0 ATOM 2104 O LEU D 28 44.059 25.056 9.247 1.00 0.00 O0 ATOM 2105 CB LEU D 28 40.875 25.284 9.751 1.00 0.00 C0 ATOM 2106 CG LEU D 28 40.575 26.605 9.030 1.00 0.00 C0 ATOM 2107 CD1 LEU D 28 41.886 27.321 8.667 1.00 0.00 C0 ATOM 2108 CD2 LEU D 28 39.758 26.331 7.758 1.00 0.00 C0 ATOM 0 H LEU D 28 40.281 22.957 9.185 1.00 0.00 H new ATOM 0 HA LEU D 28 41.894 24.851 7.905 1.00 0.00 H new ATOM 0 HB2 LEU D 28 39.943 24.761 9.968 1.00 0.00 H new ATOM 0 HB3 LEU D 28 41.358 25.486 10.707 1.00 0.00 H new ATOM 0 HG LEU D 28 39.997 27.247 9.695 1.00 0.00 H new ATOM 0 HD11 LEU D 28 41.660 28.257 8.156 1.00 0.00 H new ATOM 0 HD12 LEU D 28 42.450 27.531 9.576 1.00 0.00 H new ATOM 0 HD13 LEU D 28 42.479 26.684 8.011 1.00 0.00 H new ATOM 0 HD21 LEU D 28 39.548 27.273 7.251 1.00 0.00 H new ATOM 0 HD22 LEU D 28 40.326 25.680 7.094 1.00 0.00 H new ATOM 0 HD23 LEU D 28 38.819 25.846 8.026 1.00 0.00 H new