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=-0.00777 K(o=-0.0078,f=-1.6!) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 11 CYS SG : rot 96:sc= 0.0233 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 19 HIS : no HE2:sc= -1.34 K(o=-1.3,f=-3!) USER MOD Single : A 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 68:sc= 0.0549 USER MOD Single : A 27 HIS : no HD1:sc= -0.123 K(o=-0.12,f=-0.79) USER MOD Single : B 6 GLN : amide:sc= 0 K(o=0,f=-1.6!) USER MOD Single : B 9 SER OG : rot 180:sc= 0 USER MOD Single : B 11 CYS SG : rot 97:sc= 0.0235 USER MOD Single : B 12 SER OG : rot 180:sc= 0 USER MOD Single : B 16 SER OG : rot 180:sc= 0 USER MOD Single : B 19 HIS : no HE2:sc= -1.31 K(o=-1.3,f=-2.9!) USER MOD Single : B 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 24 THR OG1 : rot 62:sc= -0.0501 USER MOD Single : B 27 HIS : no HD1:sc= -0.137 K(o=-0.14,f=-0.8) USER MOD Single : C 6 GLN : amide:sc= 0 K(o=0,f=-1.7!) USER MOD Single : C 9 SER OG : rot 180:sc= 0 USER MOD Single : C 11 CYS SG : rot 96:sc= 0.0247 USER MOD Single : C 12 SER OG : rot 180:sc= 0 USER MOD Single : C 16 SER OG : rot 180:sc= 0 USER MOD Single : C 19 HIS : no HE2:sc= -1.3 K(o=-1.3,f=-3!) USER MOD Single : C 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 24 THR OG1 : rot 55:sc= 0.0634 USER MOD Single : C 27 HIS : no HD1:sc= -0.142 K(o=-0.14,f=-0.78) USER MOD Single : D 6 GLN : amide:sc=-0.00097 K(o=-0.00097,f=-1.5!) USER MOD Single : D 9 SER OG : rot 180:sc= 0 USER MOD Single : D 11 CYS SG : rot 96:sc= 0.0242 USER MOD Single : D 12 SER OG : rot 180:sc= 0 USER MOD Single : D 16 SER OG : rot 150:sc= 0 USER MOD Single : D 19 HIS : no HE2:sc= -1.18 K(o=-1.2,f=-2.8!) USER MOD Single : D 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : D 24 THR OG1 : rot 61:sc= 0.1 USER MOD Single : D 27 HIS : no HD1:sc= -0.129 K(o=-0.13,f=-0.77) USER MOD ----------------------------------------------------------------- ATOM 69 N PHE A 5 9.064 12.683 6.367 1.00 0.00 N0 ATOM 70 CA PHE A 5 10.118 11.714 6.106 1.00 0.00 C0 ATOM 71 C PHE A 5 10.825 12.021 4.791 1.00 0.00 C0 ATOM 72 O PHE A 5 12.026 11.792 4.653 1.00 0.00 O0 ATOM 73 CB PHE A 5 9.531 10.305 6.052 1.00 0.00 C0 ATOM 74 CG PHE A 5 10.204 9.525 4.951 1.00 0.00 C0 ATOM 75 CD1 PHE A 5 11.420 8.874 5.191 1.00 0.00 C0 ATOM 76 CD2 PHE A 5 9.613 9.459 3.683 1.00 0.00 C0 ATOM 77 CE1 PHE A 5 12.042 8.155 4.164 1.00 0.00 C0 ATOM 78 CE2 PHE A 5 10.235 8.741 2.658 1.00 0.00 C0 ATOM 79 CZ PHE A 5 11.450 8.089 2.897 1.00 0.00 C0 ATOM 0 HA PHE A 5 10.845 11.776 6.916 1.00 0.00 H new ATOM 0 HB2 PHE A 5 9.674 9.803 7.009 1.00 0.00 H new ATOM 0 HB3 PHE A 5 8.457 10.353 5.875 1.00 0.00 H new ATOM 0 HD1 PHE A 5 11.878 8.927 6.168 1.00 0.00 H new ATOM 0 HD2 PHE A 5 8.676 9.963 3.497 1.00 0.00 H new ATOM 0 HE1 PHE A 5 12.979 7.651 4.349 1.00 0.00 H new ATOM 0 HE2 PHE A 5 9.778 8.689 1.681 1.00 0.00 H new ATOM 0 HZ PHE A 5 11.931 7.535 2.104 1.00 0.00 H new ATOM 89 N GLN A 6 10.072 12.525 3.817 1.00 0.00 N0 ATOM 90 CA GLN A 6 10.644 12.837 2.509 1.00 0.00 C0 ATOM 91 C GLN A 6 11.692 13.936 2.616 1.00 0.00 C0 ATOM 92 O GLN A 6 12.735 13.883 1.962 1.00 0.00 O0 ATOM 93 CB GLN A 6 9.537 13.282 1.556 1.00 0.00 C0 ATOM 94 CG GLN A 6 10.114 13.467 0.154 1.00 0.00 C0 ATOM 95 CD GLN A 6 8.985 13.699 -0.841 1.00 0.00 C0 ATOM 96 OE1 GLN A 6 7.814 13.689 -0.462 1.00 0.00 O0 ATOM 97 NE2 GLN A 6 9.266 13.906 -2.097 1.00 0.00 N0 ATOM 0 H GLN A 6 9.076 12.725 3.906 1.00 0.00 H new ATOM 0 HA GLN A 6 11.125 11.937 2.125 1.00 0.00 H new ATOM 0 HB2 GLN A 6 8.739 12.540 1.537 1.00 0.00 H new ATOM 0 HB3 GLN A 6 9.096 14.216 1.905 1.00 0.00 H new ATOM 0 HG2 GLN A 6 10.801 14.313 0.142 1.00 0.00 H new ATOM 0 HG3 GLN A 6 10.688 12.586 -0.132 1.00 0.00 H new ATOM 0 HE21 GLN A 6 10.237 13.914 -2.408 1.00 0.00 H new ATOM 0 HE22 GLN A 6 8.514 14.060 -2.769 1.00 0.00 H new ATOM 106 N ILE A 7 11.393 14.942 3.426 1.00 0.00 N0 ATOM 107 CA ILE A 7 12.311 16.074 3.591 1.00 0.00 C0 ATOM 108 C ILE A 7 13.560 15.640 4.360 1.00 0.00 C0 ATOM 109 O ILE A 7 14.661 16.143 4.121 1.00 0.00 O0 ATOM 110 CB ILE A 7 11.629 17.258 4.317 1.00 0.00 C0 ATOM 111 CG1 ILE A 7 11.922 17.196 5.823 1.00 0.00 C0 ATOM 112 CG2 ILE A 7 10.114 17.227 4.086 1.00 0.00 C0 ATOM 113 CD1 ILE A 7 10.997 18.152 6.577 1.00 0.00 C0 ATOM 0 H ILE A 7 10.535 15.004 3.975 1.00 0.00 H new ATOM 0 HA ILE A 7 12.601 16.410 2.595 1.00 0.00 H new ATOM 0 HB ILE A 7 12.030 18.187 3.911 1.00 0.00 H new ATOM 0 HG12 ILE A 7 11.781 16.178 6.187 1.00 0.00 H new ATOM 0 HG13 ILE A 7 12.963 17.461 6.010 1.00 0.00 H new ATOM 0 HG21 ILE A 7 9.650 18.067 4.603 1.00 0.00 H new ATOM 0 HG22 ILE A 7 9.907 17.300 3.018 1.00 0.00 H new ATOM 0 HG23 ILE A 7 9.706 16.293 4.472 1.00 0.00 H new ATOM 0 HD11 ILE A 7 11.213 18.101 7.644 1.00 0.00 H new ATOM 0 HD12 ILE A 7 11.159 19.170 6.223 1.00 0.00 H new ATOM 0 HD13 ILE A 7 9.959 17.868 6.402 1.00 0.00 H new ATOM 125 N LEU A 8 13.389 14.695 5.275 1.00 0.00 N0 ATOM 126 CA LEU A 8 14.504 14.195 6.063 1.00 0.00 C0 ATOM 127 C LEU A 8 15.347 13.215 5.257 1.00 0.00 C0 ATOM 128 O LEU A 8 16.569 13.167 5.401 1.00 0.00 O0 ATOM 129 CB LEU A 8 13.971 13.503 7.319 1.00 0.00 C0 ATOM 130 CG LEU A 8 15.134 12.978 8.165 1.00 0.00 C0 ATOM 131 CD1 LEU A 8 16.008 14.148 8.632 1.00 0.00 C0 ATOM 132 CD2 LEU A 8 14.572 12.241 9.382 1.00 0.00 C0 ATOM 0 H LEU A 8 12.491 14.261 5.488 1.00 0.00 H new ATOM 0 HA LEU A 8 15.135 15.039 6.344 1.00 0.00 H new ATOM 0 HB2 LEU A 8 13.373 14.203 7.903 1.00 0.00 H new ATOM 0 HB3 LEU A 8 13.314 12.679 7.039 1.00 0.00 H new ATOM 0 HG LEU A 8 15.741 12.298 7.568 1.00 0.00 H new ATOM 0 HD11 LEU A 8 16.834 13.768 9.233 1.00 0.00 H new ATOM 0 HD12 LEU A 8 16.404 14.675 7.764 1.00 0.00 H new ATOM 0 HD13 LEU A 8 15.408 14.834 9.231 1.00 0.00 H new ATOM 0 HD21 LEU A 8 15.394 11.864 9.990 1.00 0.00 H new ATOM 0 HD22 LEU A 8 13.967 12.927 9.975 1.00 0.00 H new ATOM 0 HD23 LEU A 8 13.954 11.407 9.049 1.00 0.00 H new ATOM 144 N SER A 9 14.684 12.446 4.403 1.00 0.00 N0 ATOM 145 CA SER A 9 15.378 11.475 3.570 1.00 0.00 C0 ATOM 146 C SER A 9 16.209 12.178 2.506 1.00 0.00 C0 ATOM 147 O SER A 9 17.364 11.827 2.282 1.00 0.00 O0 ATOM 148 CB SER A 9 14.372 10.538 2.900 1.00 0.00 C0 ATOM 149 OG SER A 9 15.072 9.570 2.130 1.00 0.00 O0 ATOM 0 H SER A 9 13.673 12.476 4.270 1.00 0.00 H new ATOM 0 HA SER A 9 16.043 10.892 4.208 1.00 0.00 H new ATOM 0 HB2 SER A 9 13.759 10.045 3.654 1.00 0.00 H new ATOM 0 HB3 SER A 9 13.696 11.108 2.262 1.00 0.00 H new ATOM 0 HG SER A 9 14.430 8.967 1.701 1.00 0.00 H new ATOM 155 N ILE A 10 15.614 13.178 1.857 1.00 0.00 N0 ATOM 156 CA ILE A 10 16.318 13.920 0.820 1.00 0.00 C0 ATOM 157 C ILE A 10 17.451 14.745 1.427 1.00 0.00 C0 ATOM 158 O ILE A 10 18.505 14.909 0.811 1.00 0.00 O0 ATOM 159 CB ILE A 10 15.338 14.831 0.063 1.00 0.00 C0 ATOM 160 CG1 ILE A 10 15.925 15.207 -1.301 1.00 0.00 C0 ATOM 161 CG2 ILE A 10 15.077 16.106 0.864 1.00 0.00 C0 ATOM 162 CD1 ILE A 10 15.793 14.021 -2.258 1.00 0.00 C0 ATOM 0 H ILE A 10 14.658 13.488 2.030 1.00 0.00 H new ATOM 0 HA ILE A 10 16.750 13.209 0.116 1.00 0.00 H new ATOM 0 HB ILE A 10 14.400 14.293 -0.076 1.00 0.00 H new ATOM 0 HG12 ILE A 10 15.404 16.075 -1.706 1.00 0.00 H new ATOM 0 HG13 ILE A 10 16.973 15.486 -1.193 1.00 0.00 H new ATOM 0 HG21 ILE A 10 14.382 16.743 0.318 1.00 0.00 H new ATOM 0 HG22 ILE A 10 14.648 15.846 1.832 1.00 0.00 H new ATOM 0 HG23 ILE A 10 16.016 16.639 1.015 1.00 0.00 H new ATOM 0 HD11 ILE A 10 16.211 14.288 -3.229 1.00 0.00 H new ATOM 0 HD12 ILE A 10 16.334 13.165 -1.854 1.00 0.00 H new ATOM 0 HD13 ILE A 10 14.740 13.763 -2.375 1.00 0.00 H new ATOM 174 N CYS A 11 17.242 15.245 2.648 1.00 0.00 N0 ATOM 175 CA CYS A 11 18.267 16.033 3.318 1.00 0.00 C0 ATOM 176 C CYS A 11 19.441 15.156 3.731 1.00 0.00 C0 ATOM 177 O CYS A 11 20.581 15.405 3.337 1.00 0.00 O0 ATOM 178 CB CYS A 11 17.674 16.709 4.553 1.00 0.00 C0 ATOM 179 SG CYS A 11 16.978 18.312 4.087 1.00 0.00 S0 ATOM 0 H CYS A 11 16.383 15.118 3.183 1.00 0.00 H new ATOM 0 HA CYS A 11 18.627 16.791 2.622 1.00 0.00 H new ATOM 0 HB2 CYS A 11 16.900 16.078 4.990 1.00 0.00 H new ATOM 0 HB3 CYS A 11 18.444 16.842 5.313 1.00 0.00 H new ATOM 0 HG CYS A 11 15.701 18.186 3.877 1.00 0.00 H new ATOM 185 N SER A 12 19.164 14.134 4.536 1.00 0.00 N0 ATOM 186 CA SER A 12 20.215 13.239 4.997 1.00 0.00 C0 ATOM 187 C SER A 12 20.907 12.575 3.818 1.00 0.00 C0 ATOM 188 O SER A 12 22.123 12.436 3.808 1.00 0.00 O0 ATOM 189 CB SER A 12 19.631 12.171 5.921 1.00 0.00 C0 ATOM 190 OG SER A 12 20.674 11.309 6.360 1.00 0.00 O0 ATOM 0 H SER A 12 18.230 13.908 4.878 1.00 0.00 H new ATOM 0 HA SER A 12 20.948 13.828 5.548 1.00 0.00 H new ATOM 0 HB2 SER A 12 19.146 12.640 6.777 1.00 0.00 H new ATOM 0 HB3 SER A 12 18.866 11.598 5.396 1.00 0.00 H new ATOM 0 HG SER A 12 20.303 10.623 6.954 1.00 0.00 H new ATOM 196 N PHE A 13 20.128 12.155 2.828 1.00 0.00 N0 ATOM 197 CA PHE A 13 20.693 11.499 1.656 1.00 0.00 C0 ATOM 198 C PHE A 13 21.722 12.400 0.979 1.00 0.00 C0 ATOM 199 O PHE A 13 22.829 11.960 0.664 1.00 0.00 O0 ATOM 200 CB PHE A 13 19.580 11.162 0.667 1.00 0.00 C0 ATOM 201 CG PHE A 13 20.180 10.685 -0.631 1.00 0.00 C0 ATOM 202 CD1 PHE A 13 20.649 9.371 -0.747 1.00 0.00 C0 ATOM 203 CD2 PHE A 13 20.266 11.560 -1.721 1.00 0.00 C0 ATOM 204 CE1 PHE A 13 21.203 8.932 -1.956 1.00 0.00 C0 ATOM 205 CE2 PHE A 13 20.822 11.122 -2.927 1.00 0.00 C0 ATOM 206 CZ PHE A 13 21.290 9.808 -3.045 1.00 0.00 C0 ATOM 0 H PHE A 13 19.113 12.256 2.813 1.00 0.00 H new ATOM 0 HA PHE A 13 21.188 10.582 1.977 1.00 0.00 H new ATOM 0 HB2 PHE A 13 18.931 10.391 1.084 1.00 0.00 H new ATOM 0 HB3 PHE A 13 18.959 12.040 0.491 1.00 0.00 H new ATOM 0 HD1 PHE A 13 20.584 8.697 0.094 1.00 0.00 H new ATOM 0 HD2 PHE A 13 19.903 12.573 -1.630 1.00 0.00 H new ATOM 0 HE1 PHE A 13 21.563 7.918 -2.048 1.00 0.00 H new ATOM 0 HE2 PHE A 13 20.890 11.797 -3.767 1.00 0.00 H new ATOM 0 HZ PHE A 13 21.719 9.470 -3.977 1.00 0.00 H new ATOM 216 N ILE A 14 21.352 13.656 0.753 1.00 0.00 N0 ATOM 217 CA ILE A 14 22.257 14.601 0.106 1.00 0.00 C0 ATOM 218 C ILE A 14 23.540 14.769 0.920 1.00 0.00 C0 ATOM 219 O ILE A 14 24.642 14.746 0.375 1.00 0.00 O0 ATOM 220 CB ILE A 14 21.567 15.956 -0.046 1.00 0.00 C0 ATOM 221 CG1 ILE A 14 20.468 15.852 -1.112 1.00 0.00 C0 ATOM 222 CG2 ILE A 14 22.597 17.015 -0.457 1.00 0.00 C0 ATOM 223 CD1 ILE A 14 21.080 15.933 -2.516 1.00 0.00 C0 ATOM 0 H ILE A 14 20.442 14.041 1.005 1.00 0.00 H new ATOM 0 HA ILE A 14 22.518 14.209 -0.877 1.00 0.00 H new ATOM 0 HB ILE A 14 21.119 16.246 0.904 1.00 0.00 H new ATOM 0 HG12 ILE A 14 19.928 14.912 -0.997 1.00 0.00 H new ATOM 0 HG13 ILE A 14 19.743 16.655 -0.977 1.00 0.00 H new ATOM 0 HG21 ILE A 14 22.103 17.981 -0.565 1.00 0.00 H new ATOM 0 HG22 ILE A 14 23.370 17.087 0.308 1.00 0.00 H new ATOM 0 HG23 ILE A 14 23.051 16.732 -1.407 1.00 0.00 H new ATOM 0 HD11 ILE A 14 20.289 15.858 -3.262 1.00 0.00 H new ATOM 0 HD12 ILE A 14 21.600 16.884 -2.632 1.00 0.00 H new ATOM 0 HD13 ILE A 14 21.787 15.115 -2.653 1.00 0.00 H new ATOM 235 N LEU A 15 23.383 14.935 2.227 1.00 0.00 N0 ATOM 236 CA LEU A 15 24.532 15.107 3.114 1.00 0.00 C0 ATOM 237 C LEU A 15 25.373 13.830 3.172 1.00 0.00 C0 ATOM 238 O LEU A 15 26.587 13.882 3.364 1.00 0.00 O0 ATOM 239 CB LEU A 15 24.049 15.473 4.522 1.00 0.00 C0 ATOM 240 CG LEU A 15 23.464 16.889 4.514 1.00 0.00 C0 ATOM 241 CD1 LEU A 15 22.726 17.146 5.831 1.00 0.00 C0 ATOM 242 CD2 LEU A 15 24.596 17.910 4.365 1.00 0.00 C0 ATOM 0 H LEU A 15 22.478 14.955 2.697 1.00 0.00 H new ATOM 0 HA LEU A 15 25.154 15.911 2.720 1.00 0.00 H new ATOM 0 HB2 LEU A 15 23.296 14.759 4.856 1.00 0.00 H new ATOM 0 HB3 LEU A 15 24.878 15.415 5.228 1.00 0.00 H new ATOM 0 HG LEU A 15 22.770 16.987 3.679 1.00 0.00 H new ATOM 0 HD11 LEU A 15 22.310 18.154 5.824 1.00 0.00 H new ATOM 0 HD12 LEU A 15 21.920 16.421 5.944 1.00 0.00 H new ATOM 0 HD13 LEU A 15 23.422 17.046 6.664 1.00 0.00 H new ATOM 0 HD21 LEU A 15 24.179 18.917 4.359 1.00 0.00 H new ATOM 0 HD22 LEU A 15 25.289 17.809 5.200 1.00 0.00 H new ATOM 0 HD23 LEU A 15 25.126 17.732 3.429 1.00 0.00 H new ATOM 254 N SER A 16 24.714 12.693 2.985 1.00 0.00 N0 ATOM 255 CA SER A 16 25.396 11.403 2.999 1.00 0.00 C0 ATOM 256 C SER A 16 26.283 11.250 1.769 1.00 0.00 C0 ATOM 257 O SER A 16 27.451 10.867 1.872 1.00 0.00 O0 ATOM 258 CB SER A 16 24.369 10.273 3.030 1.00 0.00 C0 ATOM 259 OG SER A 16 25.043 9.024 2.995 1.00 0.00 O0 ATOM 0 H SER A 16 23.709 12.637 2.822 1.00 0.00 H new ATOM 0 HA SER A 16 26.021 11.354 3.891 1.00 0.00 H new ATOM 0 HB2 SER A 16 23.759 10.345 3.931 1.00 0.00 H new ATOM 0 HB3 SER A 16 23.692 10.358 2.180 1.00 0.00 H new ATOM 0 HG SER A 16 24.386 8.297 3.016 1.00 0.00 H new ATOM 265 N ALA A 17 25.721 11.559 0.604 1.00 0.00 N0 ATOM 266 CA ALA A 17 26.469 11.458 -0.638 1.00 0.00 C0 ATOM 267 C ALA A 17 27.660 12.409 -0.608 1.00 0.00 C0 ATOM 268 O ALA A 17 28.759 12.057 -1.037 1.00 0.00 O0 ATOM 269 CB ALA A 17 25.567 11.795 -1.828 1.00 0.00 C0 ATOM 0 H ALA A 17 24.758 11.878 0.497 1.00 0.00 H new ATOM 0 HA ALA A 17 26.830 10.435 -0.746 1.00 0.00 H new ATOM 0 HB1 ALA A 17 26.139 11.716 -2.752 1.00 0.00 H new ATOM 0 HB2 ALA A 17 24.730 11.098 -1.859 1.00 0.00 H new ATOM 0 HB3 ALA A 17 25.189 12.812 -1.722 1.00 0.00 H new ATOM 275 N LEU A 18 27.443 13.612 -0.087 1.00 0.00 N0 ATOM 276 CA LEU A 18 28.514 14.593 -0.003 1.00 0.00 C0 ATOM 277 C LEU A 18 29.613 14.117 0.942 1.00 0.00 C0 ATOM 278 O LEU A 18 30.796 14.220 0.622 1.00 0.00 O0 ATOM 279 CB LEU A 18 27.956 15.926 0.488 1.00 0.00 C0 ATOM 280 CG LEU A 18 27.124 16.569 -0.620 1.00 0.00 C0 ATOM 281 CD1 LEU A 18 26.266 17.688 -0.027 1.00 0.00 C0 ATOM 282 CD2 LEU A 18 28.059 17.158 -1.680 1.00 0.00 C0 ATOM 0 H LEU A 18 26.545 13.927 0.279 1.00 0.00 H new ATOM 0 HA LEU A 18 28.943 14.720 -0.997 1.00 0.00 H new ATOM 0 HB2 LEU A 18 27.342 15.771 1.375 1.00 0.00 H new ATOM 0 HB3 LEU A 18 28.771 16.589 0.777 1.00 0.00 H new ATOM 0 HG LEU A 18 26.481 15.816 -1.076 1.00 0.00 H new ATOM 0 HD11 LEU A 18 25.672 18.148 -0.816 1.00 0.00 H new ATOM 0 HD12 LEU A 18 25.603 17.274 0.732 1.00 0.00 H new ATOM 0 HD13 LEU A 18 26.912 18.440 0.426 1.00 0.00 H new ATOM 0 HD21 LEU A 18 27.468 17.618 -2.472 1.00 0.00 H new ATOM 0 HD22 LEU A 18 28.700 17.911 -1.222 1.00 0.00 H new ATOM 0 HD23 LEU A 18 28.676 16.365 -2.102 1.00 0.00 H new ATOM 294 N HIS A 19 29.221 13.621 2.116 1.00 0.00 N0 ATOM 295 CA HIS A 19 30.194 13.162 3.100 1.00 0.00 C0 ATOM 296 C HIS A 19 31.121 12.129 2.478 1.00 0.00 C0 ATOM 297 O HIS A 19 32.344 12.217 2.607 1.00 0.00 O0 ATOM 298 CB HIS A 19 29.460 12.548 4.294 1.00 0.00 C0 ATOM 299 CG HIS A 19 30.436 12.255 5.397 1.00 0.00 C0 ATOM 300 ND1 HIS A 19 31.119 13.261 6.061 1.00 0.00 N0 ATOM 301 CD2 HIS A 19 30.845 11.080 5.977 1.00 0.00 C0 ATOM 302 CE1 HIS A 19 31.897 12.679 6.993 1.00 0.00 C0 ATOM 303 NE2 HIS A 19 31.767 11.349 6.984 1.00 0.00 N0 ATOM 0 H HIS A 19 28.247 13.528 2.404 1.00 0.00 H new ATOM 0 HA HIS A 19 30.790 14.011 3.436 1.00 0.00 H new ATOM 0 HB2 HIS A 19 28.690 13.232 4.650 1.00 0.00 H new ATOM 0 HB3 HIS A 19 28.955 11.631 3.990 1.00 0.00 H new ATOM 0 HD1 HIS A 19 31.046 14.262 5.877 1.00 0.00 H new ATOM 0 HD2 HIS A 19 30.503 10.095 5.694 1.00 0.00 H new ATOM 0 HE1 HIS A 19 32.546 13.220 7.665 1.00 0.00 H new ATOM 311 N PHE A 20 30.536 11.169 1.779 1.00 0.00 N0 ATOM 312 CA PHE A 20 31.332 10.145 1.123 1.00 0.00 C0 ATOM 313 C PHE A 20 32.170 10.759 0.006 1.00 0.00 C0 ATOM 314 O PHE A 20 33.298 10.337 -0.230 1.00 0.00 O0 ATOM 315 CB PHE A 20 30.429 9.052 0.556 1.00 0.00 C0 ATOM 316 CG PHE A 20 30.658 7.764 1.316 1.00 0.00 C0 ATOM 317 CD1 PHE A 20 29.884 7.461 2.442 1.00 0.00 C0 ATOM 318 CD2 PHE A 20 31.647 6.871 0.887 1.00 0.00 C0 ATOM 319 CE1 PHE A 20 30.099 6.261 3.139 1.00 0.00 C0 ATOM 320 CE2 PHE A 20 31.865 5.675 1.582 1.00 0.00 C0 ATOM 321 CZ PHE A 20 31.092 5.368 2.709 1.00 0.00 C0 ATOM 0 H PHE A 20 29.528 11.078 1.652 1.00 0.00 H new ATOM 0 HA PHE A 20 32.000 9.702 1.862 1.00 0.00 H new ATOM 0 HB2 PHE A 20 29.384 9.352 0.634 1.00 0.00 H new ATOM 0 HB3 PHE A 20 30.640 8.904 -0.503 1.00 0.00 H new ATOM 0 HD1 PHE A 20 29.122 8.150 2.775 1.00 0.00 H new ATOM 0 HD2 PHE A 20 32.244 7.105 0.018 1.00 0.00 H new ATOM 0 HE1 PHE A 20 29.500 6.025 4.006 1.00 0.00 H new ATOM 0 HE2 PHE A 20 32.630 4.989 1.249 1.00 0.00 H new ATOM 0 HZ PHE A 20 31.260 4.446 3.246 1.00 0.00 H new ATOM 331 N MET A 21 31.610 11.749 -0.681 1.00 0.00 N0 ATOM 332 CA MET A 21 32.320 12.408 -1.776 1.00 0.00 C0 ATOM 333 C MET A 21 33.609 13.060 -1.275 1.00 0.00 C0 ATOM 334 O MET A 21 34.679 12.894 -1.872 1.00 0.00 O0 ATOM 335 CB MET A 21 31.420 13.475 -2.408 1.00 0.00 C0 ATOM 336 CG MET A 21 32.136 14.113 -3.604 1.00 0.00 C0 ATOM 337 SD MET A 21 32.386 12.866 -4.895 1.00 0.00 S0 ATOM 338 CE MET A 21 33.545 13.815 -5.911 1.00 0.00 C0 ATOM 0 H MET A 21 30.674 12.112 -0.502 1.00 0.00 H new ATOM 0 HA MET A 21 32.578 11.655 -2.520 1.00 0.00 H new ATOM 0 HB2 MET A 21 30.480 13.027 -2.731 1.00 0.00 H new ATOM 0 HB3 MET A 21 31.172 14.239 -1.671 1.00 0.00 H new ATOM 0 HG2 MET A 21 31.546 14.942 -3.994 1.00 0.00 H new ATOM 0 HG3 MET A 21 33.095 14.524 -3.290 1.00 0.00 H new ATOM 0 HE1 MET A 21 33.836 13.224 -6.779 1.00 0.00 H new ATOM 0 HE2 MET A 21 33.067 14.737 -6.243 1.00 0.00 H new ATOM 0 HE3 MET A 21 34.430 14.057 -5.323 1.00 0.00 H new ATOM 348 N ALA A 22 33.497 13.801 -0.178 1.00 0.00 N0 ATOM 349 CA ALA A 22 34.651 14.477 0.394 1.00 0.00 C0 ATOM 350 C ALA A 22 35.688 13.461 0.852 1.00 0.00 C0 ATOM 351 O ALA A 22 36.884 13.661 0.675 1.00 0.00 O0 ATOM 352 CB ALA A 22 34.215 15.346 1.574 1.00 0.00 C0 ATOM 0 H ALA A 22 32.624 13.947 0.329 1.00 0.00 H new ATOM 0 HA ALA A 22 35.098 15.112 -0.371 1.00 0.00 H new ATOM 0 HB1 ALA A 22 35.085 15.849 1.997 1.00 0.00 H new ATOM 0 HB2 ALA A 22 33.496 16.091 1.232 1.00 0.00 H new ATOM 0 HB3 ALA A 22 33.752 14.719 2.336 1.00 0.00 H new ATOM 358 N TRP A 23 35.224 12.369 1.436 1.00 0.00 N0 ATOM 359 CA TRP A 23 36.127 11.327 1.914 1.00 0.00 C0 ATOM 360 C TRP A 23 36.850 10.652 0.757 1.00 0.00 C0 ATOM 361 O TRP A 23 38.070 10.493 0.794 1.00 0.00 O0 ATOM 362 CB TRP A 23 35.322 10.326 2.725 1.00 0.00 C0 ATOM 363 CG TRP A 23 35.084 10.850 4.122 1.00 0.00 C0 ATOM 364 CD1 TRP A 23 34.449 10.142 5.077 1.00 0.00 C0 ATOM 365 CD2 TRP A 23 35.456 12.136 4.752 1.00 0.00 C0 ATOM 366 NE1 TRP A 23 34.413 10.878 6.242 1.00 0.00 N0 ATOM 367 CE2 TRP A 23 35.017 12.105 6.095 1.00 0.00 C0 ATOM 368 CE3 TRP A 23 36.122 13.313 4.315 1.00 0.00 C0 ATOM 369 CZ2 TRP A 23 35.230 13.172 6.962 1.00 0.00 C0 ATOM 370 CZ3 TRP A 23 36.332 14.385 5.190 1.00 0.00 C0 ATOM 371 CH2 TRP A 23 35.891 14.314 6.511 1.00 0.00 C0 ATOM 0 H TRP A 23 34.234 12.178 1.592 1.00 0.00 H new ATOM 0 HA TRP A 23 36.896 11.770 2.546 1.00 0.00 H new ATOM 0 HB2 TRP A 23 34.368 10.134 2.234 1.00 0.00 H new ATOM 0 HB3 TRP A 23 35.853 9.375 2.772 1.00 0.00 H new ATOM 0 HD1 TRP A 23 34.034 9.153 4.950 1.00 0.00 H new ATOM 0 HE1 TRP A 23 33.989 10.551 7.110 1.00 0.00 H new ATOM 0 HE3 TRP A 23 36.470 13.381 3.295 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 34.884 13.116 7.983 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 36.839 15.272 4.840 1.00 0.00 H new ATOM 0 HH2 TRP A 23 36.061 15.142 7.183 1.00 0.00 H new ATOM 382 N THR A 24 36.113 10.259 -0.269 1.00 0.00 N0 ATOM 383 CA THR A 24 36.722 9.616 -1.422 1.00 0.00 C0 ATOM 384 C THR A 24 37.868 10.468 -1.960 1.00 0.00 C0 ATOM 385 O THR A 24 39.002 9.997 -2.079 1.00 0.00 O0 ATOM 386 CB THR A 24 35.662 9.425 -2.507 1.00 0.00 C0 ATOM 387 OG1 THR A 24 34.684 10.449 -2.384 1.00 0.00 O0 ATOM 388 CG2 THR A 24 34.996 8.060 -2.334 1.00 0.00 C0 ATOM 0 H THR A 24 35.101 10.372 -0.328 1.00 0.00 H new ATOM 0 HA THR A 24 37.122 8.647 -1.124 1.00 0.00 H new ATOM 0 HB THR A 24 36.128 9.476 -3.491 1.00 0.00 H new ATOM 0 HG1 THR A 24 35.086 11.314 -2.609 1.00 0.00 H new ATOM 0 HG21 THR A 24 34.240 7.923 -3.107 1.00 0.00 H new ATOM 0 HG22 THR A 24 35.748 7.275 -2.418 1.00 0.00 H new ATOM 0 HG23 THR A 24 34.525 8.007 -1.353 1.00 0.00 H new ATOM 396 N ILE A 25 37.573 11.725 -2.279 1.00 0.00 N0 ATOM 397 CA ILE A 25 38.601 12.620 -2.803 1.00 0.00 C0 ATOM 398 C ILE A 25 39.694 12.842 -1.752 1.00 0.00 C0 ATOM 399 O ILE A 25 40.862 13.039 -2.088 1.00 0.00 O0 ATOM 400 CB ILE A 25 37.975 13.956 -3.229 1.00 0.00 C0 ATOM 401 CG1 ILE A 25 38.665 14.449 -4.500 1.00 0.00 C0 ATOM 402 CG2 ILE A 25 38.147 15.004 -2.128 1.00 0.00 C0 ATOM 403 CD1 ILE A 25 38.138 13.664 -5.702 1.00 0.00 C0 ATOM 0 H ILE A 25 36.647 12.142 -2.186 1.00 0.00 H new ATOM 0 HA ILE A 25 39.056 12.160 -3.680 1.00 0.00 H new ATOM 0 HB ILE A 25 36.911 13.805 -3.410 1.00 0.00 H new ATOM 0 HG12 ILE A 25 38.479 15.514 -4.638 1.00 0.00 H new ATOM 0 HG13 ILE A 25 39.744 14.322 -4.414 1.00 0.00 H new ATOM 0 HG21 ILE A 25 37.697 15.944 -2.447 1.00 0.00 H new ATOM 0 HG22 ILE A 25 37.658 14.659 -1.217 1.00 0.00 H new ATOM 0 HG23 ILE A 25 39.209 15.157 -1.934 1.00 0.00 H new ATOM 0 HD11 ILE A 25 38.629 14.015 -6.609 1.00 0.00 H new ATOM 0 HD12 ILE A 25 38.346 12.603 -5.563 1.00 0.00 H new ATOM 0 HD13 ILE A 25 37.062 13.814 -5.791 1.00 0.00 H new ATOM 415 N GLY A 26 39.301 12.815 -0.481 1.00 0.00 N0 ATOM 416 CA GLY A 26 40.251 13.015 0.611 1.00 0.00 C0 ATOM 417 C GLY A 26 41.352 11.959 0.565 1.00 0.00 C0 ATOM 418 O GLY A 26 42.539 12.280 0.604 1.00 0.00 O0 ATOM 0 H GLY A 26 38.338 12.658 -0.183 1.00 0.00 H new ATOM 0 HA2 GLY A 26 40.691 14.010 0.540 1.00 0.00 H new ATOM 0 HA3 GLY A 26 39.730 12.964 1.567 1.00 0.00 H new ATOM 422 N HIS A 27 40.945 10.699 0.472 1.00 0.00 N0 ATOM 423 CA HIS A 27 41.897 9.599 0.406 1.00 0.00 C0 ATOM 424 C HIS A 27 42.707 9.662 -0.885 1.00 0.00 C0 ATOM 425 O HIS A 27 43.886 9.312 -0.910 1.00 0.00 O0 ATOM 426 CB HIS A 27 41.164 8.261 0.485 1.00 0.00 C0 ATOM 427 CG HIS A 27 42.161 7.139 0.390 1.00 0.00 C0 ATOM 428 ND1 HIS A 27 42.532 6.585 -0.825 1.00 0.00 N0 ATOM 429 CD2 HIS A 27 42.876 6.458 1.346 1.00 0.00 C0 ATOM 430 CE1 HIS A 27 43.434 5.619 -0.572 1.00 0.00 C0 ATOM 431 NE2 HIS A 27 43.679 5.499 0.736 1.00 0.00 N0 ATOM 0 H HIS A 27 39.966 10.415 0.441 1.00 0.00 H new ATOM 0 HA HIS A 27 42.578 9.688 1.253 1.00 0.00 H new ATOM 0 HB2 HIS A 27 40.610 8.192 1.421 1.00 0.00 H new ATOM 0 HB3 HIS A 27 40.436 8.184 -0.322 1.00 0.00 H new ATOM 0 HD2 HIS A 27 42.823 6.640 2.409 1.00 0.00 H new ATOM 0 HE1 HIS A 27 43.903 5.014 -1.334 1.00 0.00 H new ATOM 0 HE2 HIS A 27 44.317 4.845 1.190 1.00 0.00 H new ATOM 439 N LEU A 28 42.062 10.119 -1.953 1.00 0.00 N0 ATOM 440 CA LEU A 28 42.724 10.235 -3.246 1.00 0.00 C0 ATOM 441 C LEU A 28 43.720 11.393 -3.243 1.00 0.00 C0 ATOM 442 O LEU A 28 44.697 11.384 -3.991 1.00 0.00 O0 ATOM 443 CB LEU A 28 41.681 10.456 -4.342 1.00 0.00 C0 ATOM 444 CG LEU A 28 40.866 9.174 -4.539 1.00 0.00 C0 ATOM 445 CD1 LEU A 28 39.575 9.504 -5.291 1.00 0.00 C0 ATOM 446 CD2 LEU A 28 41.675 8.165 -5.358 1.00 0.00 C0 ATOM 0 H LEU A 28 41.086 10.414 -1.949 1.00 0.00 H new ATOM 0 HA LEU A 28 43.268 9.311 -3.440 1.00 0.00 H new ATOM 0 HB2 LEU A 28 41.022 11.280 -4.070 1.00 0.00 H new ATOM 0 HB3 LEU A 28 42.172 10.734 -5.275 1.00 0.00 H new ATOM 0 HG LEU A 28 40.631 8.747 -3.564 1.00 0.00 H new ATOM 0 HD11 LEU A 28 38.993 8.593 -5.432 1.00 0.00 H new ATOM 0 HD12 LEU A 28 38.991 10.221 -4.714 1.00 0.00 H new ATOM 0 HD13 LEU A 28 39.819 9.933 -6.263 1.00 0.00 H new ATOM 0 HD21 LEU A 28 41.090 7.255 -5.495 1.00 0.00 H new ATOM 0 HD22 LEU A 28 41.912 8.594 -6.332 1.00 0.00 H new ATOM 0 HD23 LEU A 28 42.599 7.927 -4.831 1.00 0.00 H new ATOM 643 N GLN B 6 11.677 1.030 5.632 1.00 0.00 N0 ATOM 644 CA GLN B 6 12.487 -0.156 5.369 1.00 0.00 C0 ATOM 645 C GLN B 6 13.601 0.146 4.376 1.00 0.00 C0 ATOM 646 O GLN B 6 14.728 -0.328 4.527 1.00 0.00 O0 ATOM 647 CB GLN B 6 11.605 -1.272 4.813 1.00 0.00 C0 ATOM 648 CG GLN B 6 12.426 -2.553 4.677 1.00 0.00 C0 ATOM 649 CD GLN B 6 11.509 -3.718 4.331 1.00 0.00 C0 ATOM 650 OE1 GLN B 6 10.296 -3.542 4.229 1.00 0.00 O0 ATOM 651 NE2 GLN B 6 12.018 -4.903 4.147 1.00 0.00 N0 ATOM 0 HA GLN B 6 12.938 -0.471 6.310 1.00 0.00 H new ATOM 0 HB2 GLN B 6 10.755 -1.441 5.474 1.00 0.00 H new ATOM 0 HB3 GLN B 6 11.202 -0.982 3.843 1.00 0.00 H new ATOM 0 HG2 GLN B 6 13.182 -2.431 3.902 1.00 0.00 H new ATOM 0 HG3 GLN B 6 12.954 -2.758 5.608 1.00 0.00 H new ATOM 0 HE21 GLN B 6 13.024 -5.045 4.233 1.00 0.00 H new ATOM 0 HE22 GLN B 6 11.410 -5.689 3.917 1.00 0.00 H new ATOM 660 N ILE B 7 13.269 0.920 3.352 1.00 0.00 N0 ATOM 661 CA ILE B 7 14.250 1.259 2.317 1.00 0.00 C0 ATOM 662 C ILE B 7 15.301 2.219 2.871 1.00 0.00 C0 ATOM 663 O ILE B 7 16.469 2.180 2.476 1.00 0.00 O0 ATOM 664 CB ILE B 7 13.572 1.883 1.075 1.00 0.00 C0 ATOM 665 CG1 ILE B 7 13.598 3.416 1.171 1.00 0.00 C0 ATOM 666 CG2 ILE B 7 12.121 1.399 0.956 1.00 0.00 C0 ATOM 667 CD1 ILE B 7 12.652 4.025 0.135 1.00 0.00 C0 ATOM 0 H ILE B 7 12.343 1.323 3.211 1.00 0.00 H new ATOM 0 HA ILE B 7 14.735 0.333 2.010 1.00 0.00 H new ATOM 0 HB ILE B 7 14.124 1.569 0.189 1.00 0.00 H new ATOM 0 HG12 ILE B 7 13.304 3.730 2.172 1.00 0.00 H new ATOM 0 HG13 ILE B 7 14.612 3.781 1.008 1.00 0.00 H new ATOM 0 HG21 ILE B 7 11.659 1.848 0.077 1.00 0.00 H new ATOM 0 HG22 ILE B 7 12.106 0.313 0.860 1.00 0.00 H new ATOM 0 HG23 ILE B 7 11.566 1.692 1.847 1.00 0.00 H new ATOM 0 HD11 ILE B 7 12.679 5.112 0.212 1.00 0.00 H new ATOM 0 HD12 ILE B 7 12.965 3.725 -0.865 1.00 0.00 H new ATOM 0 HD13 ILE B 7 11.637 3.673 0.318 1.00 0.00 H new ATOM 679 N LEU B 8 14.890 3.069 3.804 1.00 0.00 N0 ATOM 680 CA LEU B 8 15.805 4.023 4.411 1.00 0.00 C0 ATOM 681 C LEU B 8 16.676 3.346 5.464 1.00 0.00 C0 ATOM 682 O LEU B 8 17.847 3.689 5.628 1.00 0.00 O0 ATOM 683 CB LEU B 8 15.004 5.156 5.057 1.00 0.00 C0 ATOM 684 CG LEU B 8 15.951 6.173 5.699 1.00 0.00 C0 ATOM 685 CD1 LEU B 8 16.841 6.805 4.623 1.00 0.00 C0 ATOM 686 CD2 LEU B 8 15.124 7.261 6.384 1.00 0.00 C0 ATOM 0 H LEU B 8 13.933 3.116 4.154 1.00 0.00 H new ATOM 0 HA LEU B 8 16.455 4.425 3.634 1.00 0.00 H new ATOM 0 HB2 LEU B 8 14.385 5.648 4.306 1.00 0.00 H new ATOM 0 HB3 LEU B 8 14.329 4.750 5.811 1.00 0.00 H new ATOM 0 HG LEU B 8 16.582 5.672 6.433 1.00 0.00 H new ATOM 0 HD11 LEU B 8 17.513 7.528 5.085 1.00 0.00 H new ATOM 0 HD12 LEU B 8 17.426 6.027 4.132 1.00 0.00 H new ATOM 0 HD13 LEU B 8 16.217 7.310 3.885 1.00 0.00 H new ATOM 0 HD21 LEU B 8 15.791 7.990 6.844 1.00 0.00 H new ATOM 0 HD22 LEU B 8 14.496 7.760 5.646 1.00 0.00 H new ATOM 0 HD23 LEU B 8 14.494 6.811 7.151 1.00 0.00 H new ATOM 698 N SER B 9 16.095 2.380 6.163 1.00 0.00 N0 ATOM 699 CA SER B 9 16.823 1.655 7.194 1.00 0.00 C0 ATOM 700 C SER B 9 17.885 0.759 6.569 1.00 0.00 C0 ATOM 701 O SER B 9 19.023 0.725 7.030 1.00 0.00 O0 ATOM 702 CB SER B 9 15.861 0.805 8.022 1.00 0.00 C0 ATOM 703 OG SER B 9 16.584 0.141 9.049 1.00 0.00 O0 ATOM 0 H SER B 9 15.128 2.082 6.036 1.00 0.00 H new ATOM 0 HA SER B 9 17.310 2.383 7.843 1.00 0.00 H new ATOM 0 HB2 SER B 9 15.084 1.434 8.457 1.00 0.00 H new ATOM 0 HB3 SER B 9 15.361 0.076 7.384 1.00 0.00 H new ATOM 0 HG SER B 9 15.968 -0.404 9.583 1.00 0.00 H new ATOM 709 N ILE B 10 17.506 0.042 5.511 1.00 0.00 N0 ATOM 710 CA ILE B 10 18.442 -0.848 4.835 1.00 0.00 C0 ATOM 711 C ILE B 10 19.527 -0.042 4.124 1.00 0.00 C0 ATOM 712 O ILE B 10 20.681 -0.472 4.057 1.00 0.00 O0 ATOM 713 CB ILE B 10 17.695 -1.737 3.829 1.00 0.00 C0 ATOM 714 CG1 ILE B 10 18.538 -2.974 3.507 1.00 0.00 C0 ATOM 715 CG2 ILE B 10 17.427 -0.964 2.540 1.00 0.00 C0 ATOM 716 CD1 ILE B 10 18.459 -3.967 4.666 1.00 0.00 C0 ATOM 0 H ILE B 10 16.569 0.061 5.109 1.00 0.00 H new ATOM 0 HA ILE B 10 18.917 -1.484 5.582 1.00 0.00 H new ATOM 0 HB ILE B 10 16.746 -2.042 4.270 1.00 0.00 H new ATOM 0 HG12 ILE B 10 18.180 -3.441 2.590 1.00 0.00 H new ATOM 0 HG13 ILE B 10 19.574 -2.685 3.333 1.00 0.00 H new ATOM 0 HG21 ILE B 10 16.897 -1.605 1.835 1.00 0.00 H new ATOM 0 HG22 ILE B 10 16.819 -0.087 2.761 1.00 0.00 H new ATOM 0 HG23 ILE B 10 18.374 -0.648 2.102 1.00 0.00 H new ATOM 0 HD11 ILE B 10 19.060 -4.846 4.434 1.00 0.00 H new ATOM 0 HD12 ILE B 10 18.838 -3.498 5.574 1.00 0.00 H new ATOM 0 HD13 ILE B 10 17.422 -4.266 4.819 1.00 0.00 H new ATOM 728 N CYS B 11 19.165 1.141 3.618 1.00 0.00 N0 ATOM 729 CA CYS B 11 20.134 1.987 2.937 1.00 0.00 C0 ATOM 730 C CYS B 11 21.132 2.568 3.929 1.00 0.00 C0 ATOM 731 O CYS B 11 22.340 2.374 3.790 1.00 0.00 O0 ATOM 732 CB CYS B 11 19.408 3.122 2.213 1.00 0.00 C0 ATOM 733 SG CYS B 11 18.956 2.582 0.547 1.00 0.00 S0 ATOM 0 H CYS B 11 18.221 1.525 3.668 1.00 0.00 H new ATOM 0 HA CYS B 11 20.677 1.379 2.213 1.00 0.00 H new ATOM 0 HB2 CYS B 11 18.515 3.410 2.768 1.00 0.00 H new ATOM 0 HB3 CYS B 11 20.048 4.003 2.160 1.00 0.00 H new ATOM 0 HG CYS B 11 17.720 2.180 0.542 1.00 0.00 H new ATOM 739 N SER B 12 20.628 3.298 4.921 1.00 0.00 N0 ATOM 740 CA SER B 12 21.497 3.909 5.916 1.00 0.00 C0 ATOM 741 C SER B 12 22.310 2.847 6.637 1.00 0.00 C0 ATOM 742 O SER B 12 23.492 3.036 6.891 1.00 0.00 O0 ATOM 743 CB SER B 12 20.667 4.698 6.927 1.00 0.00 C0 ATOM 744 OG SER B 12 21.533 5.286 7.889 1.00 0.00 O0 ATOM 0 H SER B 12 19.633 3.478 5.055 1.00 0.00 H new ATOM 0 HA SER B 12 22.180 4.588 5.405 1.00 0.00 H new ATOM 0 HB2 SER B 12 20.092 5.471 6.418 1.00 0.00 H new ATOM 0 HB3 SER B 12 19.951 4.040 7.419 1.00 0.00 H new ATOM 0 HG SER B 12 21.004 5.794 8.538 1.00 0.00 H new ATOM 750 N PHE B 13 21.672 1.732 6.977 1.00 0.00 N0 ATOM 751 CA PHE B 13 22.364 0.658 7.677 1.00 0.00 C0 ATOM 752 C PHE B 13 23.572 0.183 6.878 1.00 0.00 C0 ATOM 753 O PHE B 13 24.669 0.050 7.420 1.00 0.00 O0 ATOM 754 CB PHE B 13 21.405 -0.511 7.899 1.00 0.00 C0 ATOM 755 CG PHE B 13 22.168 -1.700 8.425 1.00 0.00 C0 ATOM 756 CD1 PHE B 13 22.522 -1.765 9.777 1.00 0.00 C0 ATOM 757 CD2 PHE B 13 22.522 -2.740 7.556 1.00 0.00 C0 ATOM 758 CE1 PHE B 13 23.230 -2.872 10.261 1.00 0.00 C0 ATOM 759 CE2 PHE B 13 23.228 -3.846 8.040 1.00 0.00 C0 ATOM 760 CZ PHE B 13 23.583 -3.913 9.393 1.00 0.00 C0 ATOM 0 H PHE B 13 20.688 1.550 6.782 1.00 0.00 H new ATOM 0 HA PHE B 13 22.711 1.038 8.638 1.00 0.00 H new ATOM 0 HB2 PHE B 13 20.625 -0.225 8.605 1.00 0.00 H new ATOM 0 HB3 PHE B 13 20.909 -0.770 6.964 1.00 0.00 H new ATOM 0 HD1 PHE B 13 22.250 -0.962 10.446 1.00 0.00 H new ATOM 0 HD2 PHE B 13 22.250 -2.688 6.512 1.00 0.00 H new ATOM 0 HE1 PHE B 13 23.504 -2.923 11.304 1.00 0.00 H new ATOM 0 HE2 PHE B 13 23.499 -4.649 7.370 1.00 0.00 H new ATOM 0 HZ PHE B 13 24.129 -4.767 9.767 1.00 0.00 H new ATOM 770 N ILE B 14 23.365 -0.075 5.589 1.00 0.00 N0 ATOM 771 CA ILE B 14 24.454 -0.539 4.735 1.00 0.00 C0 ATOM 772 C ILE B 14 25.588 0.483 4.698 1.00 0.00 C0 ATOM 773 O ILE B 14 26.760 0.129 4.826 1.00 0.00 O0 ATOM 774 CB ILE B 14 23.931 -0.776 3.318 1.00 0.00 C0 ATOM 775 CG1 ILE B 14 23.024 -2.013 3.308 1.00 0.00 C0 ATOM 776 CG2 ILE B 14 25.114 -0.984 2.362 1.00 0.00 C0 ATOM 777 CD1 ILE B 14 23.873 -3.292 3.278 1.00 0.00 C0 ATOM 0 H ILE B 14 22.466 0.028 5.118 1.00 0.00 H new ATOM 0 HA ILE B 14 24.841 -1.472 5.145 1.00 0.00 H new ATOM 0 HB ILE B 14 23.357 0.091 2.990 1.00 0.00 H new ATOM 0 HG12 ILE B 14 22.386 -2.012 4.191 1.00 0.00 H new ATOM 0 HG13 ILE B 14 22.366 -1.984 2.439 1.00 0.00 H new ATOM 0 HG21 ILE B 14 24.740 -1.153 1.352 1.00 0.00 H new ATOM 0 HG22 ILE B 14 25.749 -0.098 2.371 1.00 0.00 H new ATOM 0 HG23 ILE B 14 25.694 -1.849 2.684 1.00 0.00 H new ATOM 0 HD11 ILE B 14 23.218 -4.163 3.271 1.00 0.00 H new ATOM 0 HD12 ILE B 14 24.492 -3.297 2.381 1.00 0.00 H new ATOM 0 HD13 ILE B 14 24.512 -3.325 4.160 1.00 0.00 H new ATOM 789 N LEU B 15 25.231 1.749 4.523 1.00 0.00 N0 ATOM 790 CA LEU B 15 26.226 2.818 4.470 1.00 0.00 C0 ATOM 791 C LEU B 15 26.922 2.982 5.822 1.00 0.00 C0 ATOM 792 O LEU B 15 28.086 3.370 5.890 1.00 0.00 O0 ATOM 793 CB LEU B 15 25.550 4.134 4.067 1.00 0.00 C0 ATOM 794 CG LEU B 15 25.113 4.059 2.600 1.00 0.00 C0 ATOM 795 CD1 LEU B 15 24.190 5.237 2.278 1.00 0.00 C0 ATOM 796 CD2 LEU B 15 26.347 4.123 1.693 1.00 0.00 C0 ATOM 0 H LEU B 15 24.266 2.062 4.416 1.00 0.00 H new ATOM 0 HA LEU B 15 26.979 2.554 3.727 1.00 0.00 H new ATOM 0 HB2 LEU B 15 24.686 4.321 4.705 1.00 0.00 H new ATOM 0 HB3 LEU B 15 26.238 4.967 4.210 1.00 0.00 H new ATOM 0 HG LEU B 15 24.582 3.122 2.431 1.00 0.00 H new ATOM 0 HD11 LEU B 15 23.880 5.182 1.234 1.00 0.00 H new ATOM 0 HD12 LEU B 15 23.310 5.196 2.920 1.00 0.00 H new ATOM 0 HD13 LEU B 15 24.721 6.173 2.450 1.00 0.00 H new ATOM 0 HD21 LEU B 15 26.035 4.070 0.650 1.00 0.00 H new ATOM 0 HD22 LEU B 15 26.877 5.060 1.866 1.00 0.00 H new ATOM 0 HD23 LEU B 15 27.007 3.285 1.918 1.00 0.00 H new ATOM 808 N SER B 16 26.197 2.669 6.890 1.00 0.00 N0 ATOM 809 CA SER B 16 26.742 2.769 8.239 1.00 0.00 C0 ATOM 810 C SER B 16 27.806 1.702 8.468 1.00 0.00 C0 ATOM 811 O SER B 16 28.899 1.992 8.959 1.00 0.00 O0 ATOM 812 CB SER B 16 25.621 2.601 9.264 1.00 0.00 C0 ATOM 813 OG SER B 16 26.170 2.652 10.575 1.00 0.00 O0 ATOM 0 H SER B 16 25.231 2.344 6.848 1.00 0.00 H new ATOM 0 HA SER B 16 27.200 3.751 8.355 1.00 0.00 H new ATOM 0 HB2 SER B 16 24.877 3.388 9.138 1.00 0.00 H new ATOM 0 HB3 SER B 16 25.110 1.651 9.108 1.00 0.00 H new ATOM 0 HG SER B 16 25.453 2.546 11.234 1.00 0.00 H new ATOM 819 N ALA B 17 27.479 0.466 8.104 1.00 0.00 N0 ATOM 820 CA ALA B 17 28.414 -0.634 8.269 1.00 0.00 C0 ATOM 821 C ALA B 17 29.666 -0.384 7.441 1.00 0.00 C0 ATOM 822 O ALA B 17 30.782 -0.632 7.894 1.00 0.00 O0 ATOM 823 CB ALA B 17 27.762 -1.951 7.840 1.00 0.00 C0 ATOM 0 H ALA B 17 26.581 0.205 7.697 1.00 0.00 H new ATOM 0 HA ALA B 17 28.691 -0.702 9.321 1.00 0.00 H new ATOM 0 HB1 ALA B 17 28.473 -2.768 7.968 1.00 0.00 H new ATOM 0 HB2 ALA B 17 26.880 -2.137 8.453 1.00 0.00 H new ATOM 0 HB3 ALA B 17 27.468 -1.887 6.792 1.00 0.00 H new ATOM 829 N LEU B 18 29.479 0.120 6.223 1.00 0.00 N0 ATOM 830 CA LEU B 18 30.611 0.405 5.353 1.00 0.00 C0 ATOM 831 C LEU B 18 31.483 1.507 5.942 1.00 0.00 C0 ATOM 832 O LEU B 18 32.707 1.390 5.957 1.00 0.00 O0 ATOM 833 CB LEU B 18 30.108 0.825 3.974 1.00 0.00 C0 ATOM 834 CG LEU B 18 29.540 -0.394 3.246 1.00 0.00 C0 ATOM 835 CD1 LEU B 18 28.706 0.070 2.053 1.00 0.00 C0 ATOM 836 CD2 LEU B 18 30.693 -1.268 2.746 1.00 0.00 C0 ATOM 0 H LEU B 18 28.566 0.336 5.823 1.00 0.00 H new ATOM 0 HA LEU B 18 31.213 -0.499 5.262 1.00 0.00 H new ATOM 0 HB2 LEU B 18 29.341 1.593 4.073 1.00 0.00 H new ATOM 0 HB3 LEU B 18 30.922 1.261 3.395 1.00 0.00 H new ATOM 0 HG LEU B 18 28.914 -0.967 3.929 1.00 0.00 H new ATOM 0 HD11 LEU B 18 28.300 -0.798 1.533 1.00 0.00 H new ATOM 0 HD12 LEU B 18 27.887 0.698 2.404 1.00 0.00 H new ATOM 0 HD13 LEU B 18 29.335 0.641 1.370 1.00 0.00 H new ATOM 0 HD21 LEU B 18 30.291 -2.138 2.227 1.00 0.00 H new ATOM 0 HD22 LEU B 18 31.316 -0.692 2.061 1.00 0.00 H new ATOM 0 HD23 LEU B 18 31.294 -1.597 3.594 1.00 0.00 H new ATOM 848 N HIS B 19 30.853 2.589 6.399 1.00 0.00 N0 ATOM 849 CA HIS B 19 31.597 3.710 6.957 1.00 0.00 C0 ATOM 850 C HIS B 19 32.515 3.228 8.069 1.00 0.00 C0 ATOM 851 O HIS B 19 33.703 3.558 8.100 1.00 0.00 O0 ATOM 852 CB HIS B 19 30.617 4.750 7.506 1.00 0.00 C0 ATOM 853 CG HIS B 19 31.360 5.995 7.897 1.00 0.00 C0 ATOM 854 ND1 HIS B 19 32.015 6.787 6.965 1.00 0.00 N0 ATOM 855 CD2 HIS B 19 31.551 6.610 9.109 1.00 0.00 C0 ATOM 856 CE1 HIS B 19 32.563 7.823 7.625 1.00 0.00 C0 ATOM 857 NE2 HIS B 19 32.310 7.763 8.936 1.00 0.00 N0 ATOM 0 H HIS B 19 29.840 2.710 6.393 1.00 0.00 H new ATOM 0 HA HIS B 19 32.204 4.162 6.173 1.00 0.00 H new ATOM 0 HB2 HIS B 19 29.864 4.986 6.754 1.00 0.00 H new ATOM 0 HB3 HIS B 19 30.089 4.345 8.369 1.00 0.00 H new ATOM 0 HD1 HIS B 19 32.071 6.615 5.961 1.00 0.00 H new ATOM 0 HD2 HIS B 19 31.170 6.253 10.054 1.00 0.00 H new ATOM 0 HE1 HIS B 19 33.137 8.607 7.153 1.00 0.00 H new ATOM 865 N PHE B 20 31.967 2.423 8.969 1.00 0.00 N0 ATOM 866 CA PHE B 20 32.762 1.889 10.062 1.00 0.00 C0 ATOM 867 C PHE B 20 33.831 0.942 9.526 1.00 0.00 C0 ATOM 868 O PHE B 20 34.936 0.890 10.053 1.00 0.00 O0 ATOM 869 CB PHE B 20 31.868 1.155 11.063 1.00 0.00 C0 ATOM 870 CG PHE B 20 31.840 1.917 12.371 1.00 0.00 C0 ATOM 871 CD1 PHE B 20 30.860 2.891 12.602 1.00 0.00 C0 ATOM 872 CD2 PHE B 20 32.796 1.643 13.357 1.00 0.00 C0 ATOM 873 CE1 PHE B 20 30.835 3.591 13.819 1.00 0.00 C0 ATOM 874 CE2 PHE B 20 32.774 2.342 14.574 1.00 0.00 C0 ATOM 875 CZ PHE B 20 31.792 3.317 14.808 1.00 0.00 C0 ATOM 0 H PHE B 20 30.990 2.130 8.964 1.00 0.00 H new ATOM 0 HA PHE B 20 33.250 2.720 10.571 1.00 0.00 H new ATOM 0 HB2 PHE B 20 30.858 1.061 10.663 1.00 0.00 H new ATOM 0 HB3 PHE B 20 32.242 0.144 11.227 1.00 0.00 H new ATOM 0 HD1 PHE B 20 30.122 3.104 11.843 1.00 0.00 H new ATOM 0 HD2 PHE B 20 33.552 0.892 13.181 1.00 0.00 H new ATOM 0 HE1 PHE B 20 30.078 4.341 13.994 1.00 0.00 H new ATOM 0 HE2 PHE B 20 33.514 2.129 15.331 1.00 0.00 H new ATOM 0 HZ PHE B 20 31.773 3.854 15.745 1.00 0.00 H new ATOM 885 N MET B 21 33.489 0.191 8.482 1.00 0.00 N0 ATOM 886 CA MET B 21 34.434 -0.755 7.888 1.00 0.00 C0 ATOM 887 C MET B 21 35.676 -0.031 7.369 1.00 0.00 C0 ATOM 888 O MET B 21 36.811 -0.444 7.633 1.00 0.00 O0 ATOM 889 CB MET B 21 33.760 -1.504 6.735 1.00 0.00 C0 ATOM 890 CG MET B 21 34.725 -2.550 6.164 1.00 0.00 C0 ATOM 891 SD MET B 21 35.071 -3.806 7.424 1.00 0.00 S0 ATOM 892 CE MET B 21 36.471 -4.592 6.588 1.00 0.00 C0 ATOM 0 H MET B 21 32.574 0.217 8.032 1.00 0.00 H new ATOM 0 HA MET B 21 34.741 -1.463 8.658 1.00 0.00 H new ATOM 0 HB2 MET B 21 32.849 -1.989 7.087 1.00 0.00 H new ATOM 0 HB3 MET B 21 33.466 -0.802 5.955 1.00 0.00 H new ATOM 0 HG2 MET B 21 34.291 -3.017 5.280 1.00 0.00 H new ATOM 0 HG3 MET B 21 35.652 -2.071 5.849 1.00 0.00 H new ATOM 0 HE1 MET B 21 36.848 -5.411 7.201 1.00 0.00 H new ATOM 0 HE2 MET B 21 36.147 -4.981 5.623 1.00 0.00 H new ATOM 0 HE3 MET B 21 37.263 -3.858 6.436 1.00 0.00 H new ATOM 902 N ALA B 22 35.453 1.047 6.625 1.00 0.00 N0 ATOM 903 CA ALA B 22 36.553 1.818 6.070 1.00 0.00 C0 ATOM 904 C ALA B 22 37.398 2.419 7.186 1.00 0.00 C0 ATOM 905 O ALA B 22 38.618 2.448 7.104 1.00 0.00 O0 ATOM 906 CB ALA B 22 36.011 2.927 5.170 1.00 0.00 C0 ATOM 0 H ALA B 22 34.525 1.403 6.395 1.00 0.00 H new ATOM 0 HA ALA B 22 37.181 1.153 5.478 1.00 0.00 H new ATOM 0 HB1 ALA B 22 36.842 3.500 4.758 1.00 0.00 H new ATOM 0 HB2 ALA B 22 35.435 2.486 4.356 1.00 0.00 H new ATOM 0 HB3 ALA B 22 35.369 3.587 5.753 1.00 0.00 H new ATOM 912 N TRP B 23 36.739 2.897 8.228 1.00 0.00 N0 ATOM 913 CA TRP B 23 37.445 3.497 9.356 1.00 0.00 C0 ATOM 914 C TRP B 23 38.287 2.460 10.090 1.00 0.00 C0 ATOM 915 O TRP B 23 39.462 2.696 10.363 1.00 0.00 O0 ATOM 916 CB TRP B 23 36.421 4.136 10.279 1.00 0.00 C0 ATOM 917 CG TRP B 23 36.000 5.484 9.740 1.00 0.00 C0 ATOM 918 CD1 TRP B 23 35.148 6.304 10.388 1.00 0.00 C0 ATOM 919 CD2 TRP B 23 36.382 6.196 8.500 1.00 0.00 C0 ATOM 920 NE1 TRP B 23 34.987 7.461 9.658 1.00 0.00 N0 ATOM 921 CE2 TRP B 23 35.722 7.446 8.497 1.00 0.00 C0 ATOM 922 CE3 TRP B 23 37.223 5.904 7.393 1.00 0.00 C0 ATOM 923 CZ2 TRP B 23 35.885 8.358 7.462 1.00 0.00 C0 ATOM 924 CZ3 TRP B 23 37.383 6.826 6.351 1.00 0.00 C0 ATOM 925 CH2 TRP B 23 36.720 8.051 6.386 1.00 0.00 C0 ATOM 0 H TRP B 23 35.723 2.883 8.320 1.00 0.00 H new ATOM 0 HA TRP B 23 38.134 4.261 8.996 1.00 0.00 H new ATOM 0 HB2 TRP B 23 35.551 3.486 10.374 1.00 0.00 H new ATOM 0 HB3 TRP B 23 36.843 4.251 11.277 1.00 0.00 H new ATOM 0 HD1 TRP B 23 34.668 6.088 11.331 1.00 0.00 H new ATOM 0 HE1 TRP B 23 34.392 8.238 9.946 1.00 0.00 H new ATOM 0 HE3 TRP B 23 37.745 4.960 7.354 1.00 0.00 H new ATOM 0 HZ2 TRP B 23 35.366 9.305 7.490 1.00 0.00 H new ATOM 0 HZ3 TRP B 23 38.024 6.586 5.516 1.00 0.00 H new ATOM 0 HH2 TRP B 23 36.852 8.761 5.583 1.00 0.00 H new ATOM 936 N THR B 24 37.698 1.321 10.407 1.00 0.00 N0 ATOM 937 CA THR B 24 38.429 0.271 11.099 1.00 0.00 C0 ATOM 938 C THR B 24 39.726 -0.047 10.361 1.00 0.00 C0 ATOM 939 O THR B 24 40.813 0.017 10.937 1.00 0.00 O0 ATOM 940 CB THR B 24 37.554 -0.980 11.180 1.00 0.00 C0 ATOM 941 OG1 THR B 24 36.673 -1.001 10.067 1.00 0.00 O0 ATOM 942 CG2 THR B 24 36.741 -0.952 12.474 1.00 0.00 C0 ATOM 0 H THR B 24 36.724 1.099 10.199 1.00 0.00 H new ATOM 0 HA THR B 24 38.678 0.609 12.105 1.00 0.00 H new ATOM 0 HB THR B 24 38.183 -1.870 11.170 1.00 0.00 H new ATOM 0 HG1 THR B 24 37.194 -1.040 9.238 1.00 0.00 H new ATOM 0 HG21 THR B 24 36.117 -1.844 12.531 1.00 0.00 H new ATOM 0 HG22 THR B 24 37.418 -0.927 13.328 1.00 0.00 H new ATOM 0 HG23 THR B 24 36.108 -0.065 12.487 1.00 0.00 H new ATOM 950 N ILE B 25 39.607 -0.386 9.079 1.00 0.00 N0 ATOM 951 CA ILE B 25 40.789 -0.710 8.287 1.00 0.00 C0 ATOM 952 C ILE B 25 41.706 0.513 8.176 1.00 0.00 C0 ATOM 953 O ILE B 25 42.926 0.381 8.092 1.00 0.00 O0 ATOM 954 CB ILE B 25 40.375 -1.206 6.893 1.00 0.00 C0 ATOM 955 CG1 ILE B 25 41.316 -2.331 6.462 1.00 0.00 C0 ATOM 956 CG2 ILE B 25 40.458 -0.069 5.873 1.00 0.00 C0 ATOM 957 CD1 ILE B 25 40.926 -3.622 7.184 1.00 0.00 C0 ATOM 0 H ILE B 25 38.722 -0.443 8.575 1.00 0.00 H new ATOM 0 HA ILE B 25 41.339 -1.507 8.787 1.00 0.00 H new ATOM 0 HB ILE B 25 39.348 -1.567 6.938 1.00 0.00 H new ATOM 0 HG12 ILE B 25 41.260 -2.474 5.383 1.00 0.00 H new ATOM 0 HG13 ILE B 25 42.347 -2.067 6.696 1.00 0.00 H new ATOM 0 HG21 ILE B 25 40.161 -0.438 4.891 1.00 0.00 H new ATOM 0 HG22 ILE B 25 39.791 0.739 6.174 1.00 0.00 H new ATOM 0 HG23 ILE B 25 41.481 0.304 5.826 1.00 0.00 H new ATOM 0 HD11 ILE B 25 41.595 -4.426 6.879 1.00 0.00 H new ATOM 0 HD12 ILE B 25 41.004 -3.474 8.261 1.00 0.00 H new ATOM 0 HD13 ILE B 25 39.900 -3.887 6.927 1.00 0.00 H new ATOM 969 N GLY B 26 41.103 1.700 8.173 1.00 0.00 N0 ATOM 970 CA GLY B 26 41.873 2.939 8.072 1.00 0.00 C0 ATOM 971 C GLY B 26 42.860 3.054 9.231 1.00 0.00 C0 ATOM 972 O GLY B 26 44.049 3.298 9.028 1.00 0.00 O0 ATOM 0 H GLY B 26 40.094 1.831 8.239 1.00 0.00 H new ATOM 0 HA2 GLY B 26 42.412 2.963 7.125 1.00 0.00 H new ATOM 0 HA3 GLY B 26 41.198 3.795 8.076 1.00 0.00 H new ATOM 976 N HIS B 27 42.354 2.868 10.443 1.00 0.00 N0 ATOM 977 CA HIS B 27 43.195 2.940 11.633 1.00 0.00 C0 ATOM 978 C HIS B 27 44.215 1.806 11.640 1.00 0.00 C0 ATOM 979 O HIS B 27 45.344 1.970 12.100 1.00 0.00 O0 ATOM 980 CB HIS B 27 42.335 2.865 12.893 1.00 0.00 C0 ATOM 981 CG HIS B 27 43.223 2.913 14.106 1.00 0.00 C0 ATOM 982 ND1 HIS B 27 43.739 1.766 14.687 1.00 0.00 N0 ATOM 983 CD2 HIS B 27 43.696 3.960 14.858 1.00 0.00 C0 ATOM 984 CE1 HIS B 27 44.488 2.145 15.739 1.00 0.00 C0 ATOM 985 NE2 HIS B 27 44.496 3.473 15.887 1.00 0.00 N0 ATOM 0 H HIS B 27 41.371 2.667 10.629 1.00 0.00 H new ATOM 0 HA HIS B 27 43.727 3.891 11.617 1.00 0.00 H new ATOM 0 HB2 HIS B 27 41.627 3.694 12.914 1.00 0.00 H new ATOM 0 HB3 HIS B 27 41.750 1.946 12.893 1.00 0.00 H new ATOM 0 HD2 HIS B 27 43.480 5.003 14.678 1.00 0.00 H new ATOM 0 HE1 HIS B 27 45.018 1.460 16.384 1.00 0.00 H new ATOM 0 HE2 HIS B 27 44.984 4.014 16.601 1.00 0.00 H new ATOM 993 N LEU B 28 43.804 0.655 11.119 1.00 0.00 N0 ATOM 994 CA LEU B 28 44.684 -0.507 11.059 1.00 0.00 C0 ATOM 995 C LEU B 28 45.770 -0.313 10.004 1.00 0.00 C0 ATOM 996 O LEU B 28 46.853 -0.889 10.103 1.00 0.00 O0 ATOM 997 CB LEU B 28 43.866 -1.758 10.733 1.00 0.00 C0 ATOM 998 CG LEU B 28 42.976 -2.115 11.927 1.00 0.00 C0 ATOM 999 CD1 LEU B 28 41.870 -3.066 11.469 1.00 0.00 C0 ATOM 1000 CD2 LEU B 28 43.813 -2.809 13.007 1.00 0.00 C0 ATOM 0 H LEU B 28 42.872 0.502 10.734 1.00 0.00 H new ATOM 0 HA LEU B 28 45.164 -0.626 12.030 1.00 0.00 H new ATOM 0 HB2 LEU B 28 43.253 -1.584 9.849 1.00 0.00 H new ATOM 0 HB3 LEU B 28 44.531 -2.590 10.501 1.00 0.00 H new ATOM 0 HG LEU B 28 42.538 -1.203 12.333 1.00 0.00 H new ATOM 0 HD11 LEU B 28 41.235 -3.321 12.318 1.00 0.00 H new ATOM 0 HD12 LEU B 28 41.269 -2.582 10.699 1.00 0.00 H new ATOM 0 HD13 LEU B 28 42.316 -3.974 11.063 1.00 0.00 H new ATOM 0 HD21 LEU B 28 43.176 -3.061 13.855 1.00 0.00 H new ATOM 0 HD22 LEU B 28 44.251 -3.720 12.599 1.00 0.00 H new ATOM 0 HD23 LEU B 28 44.608 -2.140 13.337 1.00 0.00 H new ATOM 1177 N PHE C 5 10.522 2.836 14.831 1.00 0.00 N0 ATOM 1178 CA PHE C 5 11.315 4.042 15.019 1.00 0.00 C0 ATOM 1179 C PHE C 5 12.169 3.938 16.276 1.00 0.00 C0 ATOM 1180 O PHE C 5 13.282 4.463 16.325 1.00 0.00 O0 ATOM 1181 CB PHE C 5 10.398 5.258 15.127 1.00 0.00 C0 ATOM 1182 CG PHE C 5 10.934 6.200 16.179 1.00 0.00 C0 ATOM 1183 CD1 PHE C 5 11.923 7.134 15.852 1.00 0.00 C0 ATOM 1184 CD2 PHE C 5 10.437 6.137 17.487 1.00 0.00 C0 ATOM 1185 CE1 PHE C 5 12.412 8.009 16.830 1.00 0.00 C0 ATOM 1186 CE2 PHE C 5 10.927 7.009 18.467 1.00 0.00 C0 ATOM 1187 CZ PHE C 5 11.914 7.947 18.138 1.00 0.00 C0 ATOM 0 HA PHE C 5 11.972 4.155 14.157 1.00 0.00 H new ATOM 0 HB2 PHE C 5 10.336 5.767 14.165 1.00 0.00 H new ATOM 0 HB3 PHE C 5 9.387 4.943 15.386 1.00 0.00 H new ATOM 0 HD1 PHE C 5 12.310 7.180 14.845 1.00 0.00 H new ATOM 0 HD2 PHE C 5 9.675 5.415 17.740 1.00 0.00 H new ATOM 0 HE1 PHE C 5 13.173 8.732 16.576 1.00 0.00 H new ATOM 0 HE2 PHE C 5 10.544 6.958 19.476 1.00 0.00 H new ATOM 0 HZ PHE C 5 12.291 8.622 18.892 1.00 0.00 H new ATOM 1197 N GLN C 6 11.640 3.277 17.300 1.00 0.00 N0 ATOM 1198 CA GLN C 6 12.366 3.135 18.560 1.00 0.00 C0 ATOM 1199 C GLN C 6 13.645 2.331 18.370 1.00 0.00 C0 ATOM 1200 O GLN C 6 14.685 2.652 18.946 1.00 0.00 O0 ATOM 1201 CB GLN C 6 11.479 2.438 19.589 1.00 0.00 C0 ATOM 1202 CG GLN C 6 12.187 2.423 20.943 1.00 0.00 C0 ATOM 1203 CD GLN C 6 11.227 1.928 22.018 1.00 0.00 C0 ATOM 1204 OE1 GLN C 6 10.066 1.640 21.729 1.00 0.00 O0 ATOM 1205 NE2 GLN C 6 11.643 1.815 23.249 1.00 0.00 N0 ATOM 0 H GLN C 6 10.721 2.835 17.285 1.00 0.00 H new ATOM 0 HA GLN C 6 12.633 4.132 18.912 1.00 0.00 H new ATOM 0 HB2 GLN C 6 10.523 2.956 19.672 1.00 0.00 H new ATOM 0 HB3 GLN C 6 11.263 1.419 19.268 1.00 0.00 H new ATOM 0 HG2 GLN C 6 13.064 1.777 20.899 1.00 0.00 H new ATOM 0 HG3 GLN C 6 12.541 3.424 21.190 1.00 0.00 H new ATOM 0 HE21 GLN C 6 12.606 2.054 23.486 1.00 0.00 H new ATOM 0 HE22 GLN C 6 11.006 1.487 23.975 1.00 0.00 H new ATOM 1214 N ILE C 7 13.551 1.274 17.576 1.00 0.00 N0 ATOM 1215 CA ILE C 7 14.709 0.408 17.337 1.00 0.00 C0 ATOM 1216 C ILE C 7 15.747 1.127 16.478 1.00 0.00 C0 ATOM 1217 O ILE C 7 16.954 0.918 16.632 1.00 0.00 O0 ATOM 1218 CB ILE C 7 14.296 -0.921 16.659 1.00 0.00 C0 ATOM 1219 CG1 ILE C 7 14.453 -0.807 15.135 1.00 0.00 C0 ATOM 1220 CG2 ILE C 7 12.842 -1.268 17.003 1.00 0.00 C0 ATOM 1221 CD1 ILE C 7 13.744 -1.975 14.446 1.00 0.00 C0 ATOM 0 H ILE C 7 12.699 0.993 17.090 1.00 0.00 H new ATOM 0 HA ILE C 7 15.146 0.173 18.307 1.00 0.00 H new ATOM 0 HB ILE C 7 14.946 -1.714 17.029 1.00 0.00 H new ATOM 0 HG12 ILE C 7 14.035 0.138 14.788 1.00 0.00 H new ATOM 0 HG13 ILE C 7 15.510 -0.805 14.869 1.00 0.00 H new ATOM 0 HG21 ILE C 7 12.567 -2.205 16.519 1.00 0.00 H new ATOM 0 HG22 ILE C 7 12.739 -1.374 18.083 1.00 0.00 H new ATOM 0 HG23 ILE C 7 12.185 -0.472 16.652 1.00 0.00 H new ATOM 0 HD11 ILE C 7 13.861 -1.885 13.366 1.00 0.00 H new ATOM 0 HD12 ILE C 7 14.181 -2.915 14.782 1.00 0.00 H new ATOM 0 HD13 ILE C 7 12.684 -1.957 14.699 1.00 0.00 H new ATOM 1233 N LEU C 8 15.279 1.991 15.586 1.00 0.00 N0 ATOM 1234 CA LEU C 8 16.173 2.741 14.720 1.00 0.00 C0 ATOM 1235 C LEU C 8 16.801 3.911 15.469 1.00 0.00 C0 ATOM 1236 O LEU C 8 17.960 4.259 15.239 1.00 0.00 O0 ATOM 1237 CB LEU C 8 15.392 3.263 13.511 1.00 0.00 C0 ATOM 1238 CG LEU C 8 16.320 4.052 12.584 1.00 0.00 C0 ATOM 1239 CD1 LEU C 8 17.423 3.133 12.048 1.00 0.00 C0 ATOM 1240 CD2 LEU C 8 15.502 4.609 11.418 1.00 0.00 C0 ATOM 0 H LEU C 8 14.288 2.188 15.445 1.00 0.00 H new ATOM 0 HA LEU C 8 16.972 2.078 14.387 1.00 0.00 H new ATOM 0 HB2 LEU C 8 14.947 2.429 12.968 1.00 0.00 H new ATOM 0 HB3 LEU C 8 14.573 3.899 13.845 1.00 0.00 H new ATOM 0 HG LEU C 8 16.780 4.871 13.137 1.00 0.00 H new ATOM 0 HD11 LEU C 8 18.080 3.700 11.389 1.00 0.00 H new ATOM 0 HD12 LEU C 8 18.001 2.734 12.881 1.00 0.00 H new ATOM 0 HD13 LEU C 8 16.973 2.311 11.492 1.00 0.00 H new ATOM 0 HD21 LEU C 8 16.155 5.173 10.752 1.00 0.00 H new ATOM 0 HD22 LEU C 8 15.046 3.786 10.868 1.00 0.00 H new ATOM 0 HD23 LEU C 8 14.721 5.266 11.802 1.00 0.00 H new ATOM 1252 N SER C 9 16.028 4.505 16.370 1.00 0.00 N0 ATOM 1253 CA SER C 9 16.514 5.630 17.155 1.00 0.00 C0 ATOM 1254 C SER C 9 17.572 5.169 18.150 1.00 0.00 C0 ATOM 1255 O SER C 9 18.615 5.802 18.289 1.00 0.00 O0 ATOM 1256 CB SER C 9 15.358 6.292 17.903 1.00 0.00 C0 ATOM 1257 OG SER C 9 15.847 7.412 18.628 1.00 0.00 O0 ATOM 0 H SER C 9 15.068 4.228 16.574 1.00 0.00 H new ATOM 0 HA SER C 9 16.961 6.355 16.474 1.00 0.00 H new ATOM 0 HB2 SER C 9 14.588 6.608 17.199 1.00 0.00 H new ATOM 0 HB3 SER C 9 14.894 5.578 18.584 1.00 0.00 H new ATOM 0 HG SER C 9 15.107 7.840 19.108 1.00 0.00 H new ATOM 1263 N ILE C 10 17.297 4.062 18.836 1.00 0.00 N0 ATOM 1264 CA ILE C 10 18.238 3.533 19.815 1.00 0.00 C0 ATOM 1265 C ILE C 10 19.492 3.009 19.121 1.00 0.00 C0 ATOM 1266 O ILE C 10 20.597 3.120 19.659 1.00 0.00 O0 ATOM 1267 CB ILE C 10 17.576 2.416 20.638 1.00 0.00 C0 ATOM 1268 CG1 ILE C 10 18.339 2.219 21.951 1.00 0.00 C0 ATOM 1269 CG2 ILE C 10 17.589 1.106 19.851 1.00 0.00 C0 ATOM 1270 CD1 ILE C 10 17.984 3.342 22.924 1.00 0.00 C0 ATOM 0 H ILE C 10 16.439 3.520 18.733 1.00 0.00 H new ATOM 0 HA ILE C 10 18.528 4.339 20.489 1.00 0.00 H new ATOM 0 HB ILE C 10 16.545 2.701 20.850 1.00 0.00 H new ATOM 0 HG12 ILE C 10 18.087 1.253 22.388 1.00 0.00 H new ATOM 0 HG13 ILE C 10 19.413 2.214 21.762 1.00 0.00 H new ATOM 0 HG21 ILE C 10 17.118 0.321 20.443 1.00 0.00 H new ATOM 0 HG22 ILE C 10 17.040 1.236 18.918 1.00 0.00 H new ATOM 0 HG23 ILE C 10 18.619 0.825 19.630 1.00 0.00 H new ATOM 0 HD11 ILE C 10 18.528 3.200 23.858 1.00 0.00 H new ATOM 0 HD12 ILE C 10 18.258 4.302 22.487 1.00 0.00 H new ATOM 0 HD13 ILE C 10 16.912 3.326 23.122 1.00 0.00 H new ATOM 1282 N CYS C 11 19.330 2.459 17.913 1.00 0.00 N0 ATOM 1283 CA CYS C 11 20.467 1.944 17.168 1.00 0.00 C0 ATOM 1284 C CYS C 11 21.350 3.085 16.675 1.00 0.00 C0 ATOM 1285 O CYS C 11 22.539 3.137 16.985 1.00 0.00 O0 ATOM 1286 CB CYS C 11 19.975 1.126 15.975 1.00 0.00 C0 ATOM 1287 SG CYS C 11 19.740 -0.595 16.481 1.00 0.00 S0 ATOM 0 H CYS C 11 18.431 2.363 17.441 1.00 0.00 H new ATOM 0 HA CYS C 11 21.055 1.309 17.831 1.00 0.00 H new ATOM 0 HB2 CYS C 11 19.038 1.537 15.600 1.00 0.00 H new ATOM 0 HB3 CYS C 11 20.696 1.181 15.160 1.00 0.00 H new ATOM 0 HG CYS C 11 18.491 -0.791 16.784 1.00 0.00 H new ATOM 1293 N SER C 12 20.766 3.992 15.897 1.00 0.00 N0 ATOM 1294 CA SER C 12 21.522 5.116 15.364 1.00 0.00 C0 ATOM 1295 C SER C 12 22.109 5.947 16.493 1.00 0.00 C0 ATOM 1296 O SER C 12 23.249 6.382 16.416 1.00 0.00 O0 ATOM 1297 CB SER C 12 20.623 5.992 14.492 1.00 0.00 C0 ATOM 1298 OG SER C 12 21.381 7.081 13.982 1.00 0.00 O0 ATOM 0 H SER C 12 19.783 3.970 15.625 1.00 0.00 H new ATOM 0 HA SER C 12 22.337 4.723 14.756 1.00 0.00 H new ATOM 0 HB2 SER C 12 20.210 5.406 13.671 1.00 0.00 H new ATOM 0 HB3 SER C 12 19.780 6.362 15.075 1.00 0.00 H new ATOM 0 HG SER C 12 20.808 7.644 13.421 1.00 0.00 H new ATOM 1304 N PHE C 13 21.323 6.174 17.539 1.00 0.00 N0 ATOM 1305 CA PHE C 13 21.791 6.965 18.669 1.00 0.00 C0 ATOM 1306 C PHE C 13 23.059 6.361 19.262 1.00 0.00 C0 ATOM 1307 O PHE C 13 24.042 7.067 19.495 1.00 0.00 O0 ATOM 1308 CB PHE C 13 20.703 7.024 19.742 1.00 0.00 C0 ATOM 1309 CG PHE C 13 21.258 7.653 20.994 1.00 0.00 C0 ATOM 1310 CD1 PHE C 13 21.389 9.044 21.083 1.00 0.00 C0 ATOM 1311 CD2 PHE C 13 21.642 6.844 22.068 1.00 0.00 C0 ATOM 1312 CE1 PHE C 13 21.902 9.623 22.249 1.00 0.00 C0 ATOM 1313 CE2 PHE C 13 22.156 7.422 23.233 1.00 0.00 C0 ATOM 1314 CZ PHE C 13 22.286 8.812 23.324 1.00 0.00 C0 ATOM 0 H PHE C 13 20.369 5.825 17.628 1.00 0.00 H new ATOM 0 HA PHE C 13 22.016 7.972 18.317 1.00 0.00 H new ATOM 0 HB2 PHE C 13 19.852 7.601 19.380 1.00 0.00 H new ATOM 0 HB3 PHE C 13 20.338 6.020 19.959 1.00 0.00 H new ATOM 0 HD1 PHE C 13 21.095 9.669 20.253 1.00 0.00 H new ATOM 0 HD2 PHE C 13 21.541 5.771 21.998 1.00 0.00 H new ATOM 0 HE1 PHE C 13 22.002 10.696 22.320 1.00 0.00 H new ATOM 0 HE2 PHE C 13 22.452 6.796 24.062 1.00 0.00 H new ATOM 0 HZ PHE C 13 22.683 9.260 24.223 1.00 0.00 H new ATOM 1324 N ILE C 14 23.033 5.054 19.510 1.00 0.00 N0 ATOM 1325 CA ILE C 14 24.193 4.377 20.081 1.00 0.00 C0 ATOM 1326 C ILE C 14 25.412 4.524 19.172 1.00 0.00 C0 ATOM 1327 O ILE C 14 26.510 4.831 19.635 1.00 0.00 O0 ATOM 1328 CB ILE C 14 23.879 2.893 20.276 1.00 0.00 C0 ATOM 1329 CG1 ILE C 14 22.871 2.732 21.423 1.00 0.00 C0 ATOM 1330 CG2 ILE C 14 25.171 2.134 20.604 1.00 0.00 C0 ATOM 1331 CD1 ILE C 14 23.587 2.823 22.775 1.00 0.00 C0 ATOM 0 H ILE C 14 22.232 4.449 19.327 1.00 0.00 H new ATOM 0 HA ILE C 14 24.420 4.837 21.043 1.00 0.00 H new ATOM 0 HB ILE C 14 23.449 2.486 19.361 1.00 0.00 H new ATOM 0 HG12 ILE C 14 22.106 3.506 21.356 1.00 0.00 H new ATOM 0 HG13 ILE C 14 22.362 1.772 21.337 1.00 0.00 H new ATOM 0 HG21 ILE C 14 24.946 1.076 20.743 1.00 0.00 H new ATOM 0 HG22 ILE C 14 25.879 2.250 19.784 1.00 0.00 H new ATOM 0 HG23 ILE C 14 25.607 2.536 21.519 1.00 0.00 H new ATOM 0 HD11 ILE C 14 22.861 2.707 23.580 1.00 0.00 H new ATOM 0 HD12 ILE C 14 24.335 2.033 22.845 1.00 0.00 H new ATOM 0 HD13 ILE C 14 24.075 3.794 22.864 1.00 0.00 H new ATOM 1343 N LEU C 15 25.208 4.307 17.879 1.00 0.00 N0 ATOM 1344 CA LEU C 15 26.295 4.418 16.909 1.00 0.00 C0 ATOM 1345 C LEU C 15 26.783 5.864 16.801 1.00 0.00 C0 ATOM 1346 O LEU C 15 27.955 6.117 16.525 1.00 0.00 O0 ATOM 1347 CB LEU C 15 25.819 3.925 15.538 1.00 0.00 C0 ATOM 1348 CG LEU C 15 25.610 2.407 15.581 1.00 0.00 C0 ATOM 1349 CD1 LEU C 15 24.865 1.957 14.322 1.00 0.00 C0 ATOM 1350 CD2 LEU C 15 26.971 1.705 15.640 1.00 0.00 C0 ATOM 0 H LEU C 15 24.305 4.054 17.477 1.00 0.00 H new ATOM 0 HA LEU C 15 27.126 3.800 17.249 1.00 0.00 H new ATOM 0 HB2 LEU C 15 24.889 4.423 15.264 1.00 0.00 H new ATOM 0 HB3 LEU C 15 26.553 4.180 14.774 1.00 0.00 H new ATOM 0 HG LEU C 15 25.026 2.148 16.464 1.00 0.00 H new ATOM 0 HD11 LEU C 15 24.717 0.878 14.353 1.00 0.00 H new ATOM 0 HD12 LEU C 15 23.897 2.455 14.275 1.00 0.00 H new ATOM 0 HD13 LEU C 15 25.450 2.217 13.440 1.00 0.00 H new ATOM 0 HD21 LEU C 15 26.823 0.626 15.671 1.00 0.00 H new ATOM 0 HD22 LEU C 15 27.554 1.966 14.757 1.00 0.00 H new ATOM 0 HD23 LEU C 15 27.506 2.023 16.535 1.00 0.00 H new ATOM 1362 N SER C 16 25.874 6.802 17.037 1.00 0.00 N0 ATOM 1363 CA SER C 16 26.208 8.222 16.981 1.00 0.00 C0 ATOM 1364 C SER C 16 27.117 8.604 18.143 1.00 0.00 C0 ATOM 1365 O SER C 16 28.143 9.265 17.953 1.00 0.00 O0 ATOM 1366 CB SER C 16 24.929 9.057 17.035 1.00 0.00 C0 ATOM 1367 OG SER C 16 25.270 10.436 17.026 1.00 0.00 O0 ATOM 0 H SER C 16 24.900 6.606 17.269 1.00 0.00 H new ATOM 0 HA SER C 16 26.733 8.419 16.046 1.00 0.00 H new ATOM 0 HB2 SER C 16 24.291 8.822 16.183 1.00 0.00 H new ATOM 0 HB3 SER C 16 24.361 8.816 17.934 1.00 0.00 H new ATOM 0 HG SER C 16 24.452 10.975 17.059 1.00 0.00 H new ATOM 1373 N ALA C 17 26.736 8.184 19.344 1.00 0.00 N0 ATOM 1374 CA ALA C 17 27.525 8.486 20.526 1.00 0.00 C0 ATOM 1375 C ALA C 17 28.910 7.864 20.402 1.00 0.00 C0 ATOM 1376 O ALA C 17 29.913 8.485 20.749 1.00 0.00 O0 ATOM 1377 CB ALA C 17 26.826 7.948 21.778 1.00 0.00 C0 ATOM 0 H ALA C 17 25.893 7.638 19.521 1.00 0.00 H new ATOM 0 HA ALA C 17 27.626 9.568 20.613 1.00 0.00 H new ATOM 0 HB1 ALA C 17 27.426 8.180 22.658 1.00 0.00 H new ATOM 0 HB2 ALA C 17 25.845 8.413 21.875 1.00 0.00 H new ATOM 0 HB3 ALA C 17 26.709 6.868 21.693 1.00 0.00 H new ATOM 1383 N LEU C 18 28.964 6.636 19.891 1.00 0.00 N0 ATOM 1384 CA LEU C 18 30.240 5.956 19.722 1.00 0.00 C0 ATOM 1385 C LEU C 18 31.110 6.680 18.702 1.00 0.00 C0 ATOM 1386 O LEU C 18 32.300 6.887 18.934 1.00 0.00 O0 ATOM 1387 CB LEU C 18 30.001 4.518 19.264 1.00 0.00 C0 ATOM 1388 CG LEU C 18 29.440 3.702 20.429 1.00 0.00 C0 ATOM 1389 CD1 LEU C 18 28.851 2.396 19.896 1.00 0.00 C0 ATOM 1390 CD2 LEU C 18 30.568 3.381 21.413 1.00 0.00 C0 ATOM 0 H LEU C 18 28.150 6.100 19.591 1.00 0.00 H new ATOM 0 HA LEU C 18 30.759 5.955 20.680 1.00 0.00 H new ATOM 0 HB2 LEU C 18 29.305 4.502 18.426 1.00 0.00 H new ATOM 0 HB3 LEU C 18 30.933 4.077 18.912 1.00 0.00 H new ATOM 0 HG LEU C 18 28.663 4.275 20.935 1.00 0.00 H new ATOM 0 HD11 LEU C 18 28.450 1.812 20.725 1.00 0.00 H new ATOM 0 HD12 LEU C 18 28.052 2.619 19.189 1.00 0.00 H new ATOM 0 HD13 LEU C 18 29.631 1.824 19.393 1.00 0.00 H new ATOM 0 HD21 LEU C 18 30.171 2.799 22.245 1.00 0.00 H new ATOM 0 HD22 LEU C 18 31.342 2.806 20.905 1.00 0.00 H new ATOM 0 HD23 LEU C 18 30.996 4.309 21.791 1.00 0.00 H new ATOM 1402 N HIS C 19 30.523 7.040 17.562 1.00 0.00 N0 ATOM 1403 CA HIS C 19 31.273 7.715 16.513 1.00 0.00 C0 ATOM 1404 C HIS C 19 31.954 8.956 17.072 1.00 0.00 C0 ATOM 1405 O HIS C 19 33.150 9.174 16.855 1.00 0.00 O0 ATOM 1406 CB HIS C 19 30.321 8.114 15.381 1.00 0.00 C0 ATOM 1407 CG HIS C 19 31.110 8.629 14.209 1.00 0.00 C0 ATOM 1408 ND1 HIS C 19 31.974 7.819 13.490 1.00 0.00 N0 ATOM 1409 CD2 HIS C 19 31.164 9.863 13.609 1.00 0.00 C0 ATOM 1410 CE1 HIS C 19 32.507 8.565 12.508 1.00 0.00 C0 ATOM 1411 NE2 HIS C 19 32.048 9.820 12.534 1.00 0.00 N0 ATOM 0 H HIS C 19 29.540 6.876 17.345 1.00 0.00 H new ATOM 0 HA HIS C 19 32.035 7.038 16.127 1.00 0.00 H new ATOM 0 HB2 HIS C 19 29.721 7.256 15.078 1.00 0.00 H new ATOM 0 HB3 HIS C 19 29.628 8.880 15.729 1.00 0.00 H new ATOM 0 HD1 HIS C 19 32.170 6.835 13.673 1.00 0.00 H new ATOM 0 HD2 HIS C 19 30.606 10.733 13.923 1.00 0.00 H new ATOM 0 HE1 HIS C 19 33.220 8.196 11.785 1.00 0.00 H new ATOM 1419 N PHE C 20 31.197 9.754 17.813 1.00 0.00 N0 ATOM 1420 CA PHE C 20 31.758 10.954 18.413 1.00 0.00 C0 ATOM 1421 C PHE C 20 32.803 10.583 19.461 1.00 0.00 C0 ATOM 1422 O PHE C 20 33.803 11.276 19.615 1.00 0.00 O0 ATOM 1423 CB PHE C 20 30.652 11.796 19.052 1.00 0.00 C0 ATOM 1424 CG PHE C 20 30.493 13.092 18.285 1.00 0.00 C0 ATOM 1425 CD1 PHE C 20 29.585 13.177 17.222 1.00 0.00 C0 ATOM 1426 CD2 PHE C 20 31.252 14.212 18.643 1.00 0.00 C0 ATOM 1427 CE1 PHE C 20 29.437 14.383 16.517 1.00 0.00 C0 ATOM 1428 CE2 PHE C 20 31.108 15.418 17.941 1.00 0.00 C0 ATOM 1429 CZ PHE C 20 30.199 15.506 16.875 1.00 0.00 C0 ATOM 0 H PHE C 20 30.209 9.595 18.010 1.00 0.00 H new ATOM 0 HA PHE C 20 32.238 11.540 17.630 1.00 0.00 H new ATOM 0 HB2 PHE C 20 29.713 11.243 19.050 1.00 0.00 H new ATOM 0 HB3 PHE C 20 30.896 12.006 20.093 1.00 0.00 H new ATOM 0 HD1 PHE C 20 28.998 12.314 16.944 1.00 0.00 H new ATOM 0 HD2 PHE C 20 31.952 14.148 19.463 1.00 0.00 H new ATOM 0 HE1 PHE C 20 28.736 14.446 15.698 1.00 0.00 H new ATOM 0 HE2 PHE C 20 31.697 16.279 18.221 1.00 0.00 H new ATOM 0 HZ PHE C 20 30.087 16.433 16.333 1.00 0.00 H new ATOM 1439 N MET C 21 32.560 9.493 20.183 1.00 0.00 N0 ATOM 1440 CA MET C 21 33.489 9.047 21.218 1.00 0.00 C0 ATOM 1441 C MET C 21 34.862 8.736 20.621 1.00 0.00 C0 ATOM 1442 O MET C 21 35.896 9.173 21.139 1.00 0.00 O0 ATOM 1443 CB MET C 21 32.938 7.794 21.905 1.00 0.00 C0 ATOM 1444 CG MET C 21 33.876 7.375 23.044 1.00 0.00 C0 ATOM 1445 SD MET C 21 33.899 8.663 24.319 1.00 0.00 S0 ATOM 1446 CE MET C 21 35.331 8.052 25.242 1.00 0.00 C0 ATOM 0 H MET C 21 31.734 8.905 20.072 1.00 0.00 H new ATOM 0 HA MET C 21 33.599 9.850 21.947 1.00 0.00 H new ATOM 0 HB2 MET C 21 31.940 7.991 22.297 1.00 0.00 H new ATOM 0 HB3 MET C 21 32.843 6.983 21.183 1.00 0.00 H new ATOM 0 HG2 MET C 21 33.543 6.430 23.474 1.00 0.00 H new ATOM 0 HG3 MET C 21 34.883 7.213 22.659 1.00 0.00 H new ATOM 0 HE1 MET C 21 35.526 8.711 26.088 1.00 0.00 H new ATOM 0 HE2 MET C 21 35.127 7.045 25.605 1.00 0.00 H new ATOM 0 HE3 MET C 21 36.203 8.032 24.589 1.00 0.00 H new ATOM 1456 N ALA C 22 34.861 7.975 19.531 1.00 0.00 N0 ATOM 1457 CA ALA C 22 36.104 7.605 18.872 1.00 0.00 C0 ATOM 1458 C ALA C 22 36.815 8.845 18.348 1.00 0.00 C0 ATOM 1459 O ALA C 22 38.032 8.956 18.435 1.00 0.00 O0 ATOM 1460 CB ALA C 22 35.815 6.641 17.723 1.00 0.00 C0 ATOM 0 H ALA C 22 34.019 7.606 19.090 1.00 0.00 H new ATOM 0 HA ALA C 22 36.753 7.112 19.596 1.00 0.00 H new ATOM 0 HB1 ALA C 22 36.750 6.368 17.234 1.00 0.00 H new ATOM 0 HB2 ALA C 22 35.334 5.744 18.113 1.00 0.00 H new ATOM 0 HB3 ALA C 22 35.155 7.122 17.001 1.00 0.00 H new ATOM 1466 N TRP C 23 36.051 9.774 17.803 1.00 0.00 N0 ATOM 1467 CA TRP C 23 36.624 11.004 17.267 1.00 0.00 C0 ATOM 1468 C TRP C 23 37.238 11.852 18.373 1.00 0.00 C0 ATOM 1469 O TRP C 23 38.374 12.307 18.247 1.00 0.00 O0 ATOM 1470 CB TRP C 23 35.533 11.760 16.526 1.00 0.00 C0 ATOM 1471 CG TRP C 23 35.332 11.172 15.150 1.00 0.00 C0 ATOM 1472 CD1 TRP C 23 34.469 11.683 14.248 1.00 0.00 C0 ATOM 1473 CD2 TRP C 23 35.972 10.014 14.484 1.00 0.00 C0 ATOM 1474 NE1 TRP C 23 34.536 10.946 13.089 1.00 0.00 N0 ATOM 1475 CE2 TRP C 23 35.442 9.918 13.178 1.00 0.00 C0 ATOM 1476 CE3 TRP C 23 36.949 9.052 14.859 1.00 0.00 C0 ATOM 1477 CZ2 TRP C 23 35.853 8.932 12.291 1.00 0.00 C0 ATOM 1478 CZ3 TRP C 23 37.358 8.060 13.964 1.00 0.00 C0 ATOM 1479 CH2 TRP C 23 36.816 8.001 12.681 1.00 0.00 C0 ATOM 0 H TRP C 23 35.037 9.705 17.718 1.00 0.00 H new ATOM 0 HA TRP C 23 37.431 10.763 16.575 1.00 0.00 H new ATOM 0 HB2 TRP C 23 34.601 11.712 17.089 1.00 0.00 H new ATOM 0 HB3 TRP C 23 35.802 12.813 16.443 1.00 0.00 H new ATOM 0 HD1 TRP C 23 33.827 12.536 14.410 1.00 0.00 H new ATOM 0 HE1 TRP C 23 33.977 11.141 12.258 1.00 0.00 H new ATOM 0 HE3 TRP C 23 37.381 9.088 15.848 1.00 0.00 H new ATOM 0 HZ2 TRP C 23 35.427 8.886 11.300 1.00 0.00 H new ATOM 0 HZ3 TRP C 23 38.098 7.335 14.268 1.00 0.00 H new ATOM 0 HH2 TRP C 23 37.141 7.237 11.991 1.00 0.00 H new ATOM 1490 N THR C 24 36.501 12.066 19.450 1.00 0.00 N0 ATOM 1491 CA THR C 24 37.013 12.856 20.557 1.00 0.00 C0 ATOM 1492 C THR C 24 38.373 12.325 21.002 1.00 0.00 C0 ATOM 1493 O THR C 24 39.357 13.064 21.037 1.00 0.00 O0 ATOM 1494 CB THR C 24 36.022 12.787 21.719 1.00 0.00 C0 ATOM 1495 OG1 THR C 24 35.325 11.550 21.663 1.00 0.00 O0 ATOM 1496 CG2 THR C 24 35.024 13.939 21.604 1.00 0.00 C0 ATOM 0 H THR C 24 35.555 11.708 19.581 1.00 0.00 H new ATOM 0 HA THR C 24 37.134 13.891 20.237 1.00 0.00 H new ATOM 0 HB THR C 24 36.558 12.865 22.665 1.00 0.00 H new ATOM 0 HG1 THR C 24 35.969 10.812 21.645 1.00 0.00 H new ATOM 0 HG21 THR C 24 34.316 13.891 22.432 1.00 0.00 H new ATOM 0 HG22 THR C 24 35.559 14.888 21.638 1.00 0.00 H new ATOM 0 HG23 THR C 24 34.484 13.860 20.660 1.00 0.00 H new ATOM 1504 N ILE C 25 38.425 11.038 21.337 1.00 0.00 N0 ATOM 1505 CA ILE C 25 39.680 10.436 21.777 1.00 0.00 C0 ATOM 1506 C ILE C 25 40.715 10.480 20.648 1.00 0.00 C0 ATOM 1507 O ILE C 25 41.915 10.586 20.896 1.00 0.00 O0 ATOM 1508 CB ILE C 25 39.444 8.992 22.241 1.00 0.00 C0 ATOM 1509 CG1 ILE C 25 40.328 8.705 23.454 1.00 0.00 C0 ATOM 1510 CG2 ILE C 25 39.793 8.005 21.124 1.00 0.00 C0 ATOM 1511 CD1 ILE C 25 39.711 9.348 24.696 1.00 0.00 C0 ATOM 0 H ILE C 25 37.628 10.402 21.313 1.00 0.00 H new ATOM 0 HA ILE C 25 40.067 11.008 22.620 1.00 0.00 H new ATOM 0 HB ILE C 25 38.392 8.873 22.502 1.00 0.00 H new ATOM 0 HG12 ILE C 25 40.427 7.629 23.599 1.00 0.00 H new ATOM 0 HG13 ILE C 25 41.331 9.098 23.288 1.00 0.00 H new ATOM 0 HG21 ILE C 25 39.619 6.986 21.471 1.00 0.00 H new ATOM 0 HG22 ILE C 25 39.167 8.204 20.254 1.00 0.00 H new ATOM 0 HG23 ILE C 25 40.842 8.121 20.850 1.00 0.00 H new ATOM 0 HD11 ILE C 25 40.341 9.144 25.562 1.00 0.00 H new ATOM 0 HD12 ILE C 25 39.635 10.425 24.548 1.00 0.00 H new ATOM 0 HD13 ILE C 25 38.717 8.934 24.864 1.00 0.00 H new ATOM 1523 N GLY C 26 40.235 10.394 19.409 1.00 0.00 N0 ATOM 1524 CA GLY C 26 41.125 10.425 18.250 1.00 0.00 C0 ATOM 1525 C GLY C 26 41.924 11.724 18.219 1.00 0.00 C0 ATOM 1526 O GLY C 26 43.148 11.711 18.090 1.00 0.00 O0 ATOM 0 H GLY C 26 39.245 10.303 19.183 1.00 0.00 H new ATOM 0 HA2 GLY C 26 41.806 9.574 18.285 1.00 0.00 H new ATOM 0 HA3 GLY C 26 40.541 10.329 17.334 1.00 0.00 H new ATOM 1530 N HIS C 27 41.222 12.841 18.349 1.00 0.00 N0 ATOM 1531 CA HIS C 27 41.869 14.148 18.350 1.00 0.00 C0 ATOM 1532 C HIS C 27 42.763 14.304 19.575 1.00 0.00 C0 ATOM 1533 O HIS C 27 43.817 14.935 19.515 1.00 0.00 O0 ATOM 1534 CB HIS C 27 40.818 15.257 18.335 1.00 0.00 C0 ATOM 1535 CG HIS C 27 41.506 16.595 18.361 1.00 0.00 C0 ATOM 1536 ND1 HIS C 27 41.815 17.240 19.548 1.00 0.00 N0 ATOM 1537 CD2 HIS C 27 41.954 17.419 17.359 1.00 0.00 C0 ATOM 1538 CE1 HIS C 27 42.422 18.398 19.234 1.00 0.00 C0 ATOM 1539 NE2 HIS C 27 42.533 18.557 17.913 1.00 0.00 N0 ATOM 0 H HIS C 27 40.208 12.870 18.455 1.00 0.00 H new ATOM 0 HA HIS C 27 42.485 14.225 17.454 1.00 0.00 H new ATOM 0 HB2 HIS C 27 40.196 15.172 17.444 1.00 0.00 H new ATOM 0 HB3 HIS C 27 40.157 15.159 19.196 1.00 0.00 H new ATOM 0 HD2 HIS C 27 41.870 17.215 16.302 1.00 0.00 H new ATOM 0 HE1 HIS C 27 42.777 19.113 19.962 1.00 0.00 H new ATOM 0 HE2 HIS C 27 42.952 19.343 17.417 1.00 0.00 H new ATOM 1547 N LEU C 28 42.331 13.718 20.686 1.00 0.00 N0 ATOM 1548 CA LEU C 28 43.095 13.785 21.926 1.00 0.00 C0 ATOM 1549 C LEU C 28 44.347 12.915 21.842 1.00 0.00 C0 ATOM 1550 O LEU C 28 45.342 13.179 22.518 1.00 0.00 O0 ATOM 1551 CB LEU C 28 42.223 13.326 23.095 1.00 0.00 C0 ATOM 1552 CG LEU C 28 41.128 14.363 23.360 1.00 0.00 C0 ATOM 1553 CD1 LEU C 28 40.023 13.730 24.205 1.00 0.00 C0 ATOM 1554 CD2 LEU C 28 41.718 15.554 24.123 1.00 0.00 C0 ATOM 0 H LEU C 28 41.459 13.193 20.754 1.00 0.00 H new ATOM 0 HA LEU C 28 43.404 14.818 22.085 1.00 0.00 H new ATOM 0 HB2 LEU C 28 41.774 12.359 22.869 1.00 0.00 H new ATOM 0 HB3 LEU C 28 42.835 13.193 23.987 1.00 0.00 H new ATOM 0 HG LEU C 28 40.719 14.704 22.409 1.00 0.00 H new ATOM 0 HD11 LEU C 28 39.243 14.467 24.395 1.00 0.00 H new ATOM 0 HD12 LEU C 28 39.598 12.880 23.671 1.00 0.00 H new ATOM 0 HD13 LEU C 28 40.439 13.390 25.153 1.00 0.00 H new ATOM 0 HD21 LEU C 28 40.936 16.290 24.310 1.00 0.00 H new ATOM 0 HD22 LEU C 28 42.128 15.211 25.073 1.00 0.00 H new ATOM 0 HD23 LEU C 28 42.511 16.010 23.530 1.00 0.00 H new ATOM 1751 N GLN D 6 10.089 15.164 15.098 1.00 0.00 N0 ATOM 1752 CA GLN D 6 10.606 16.519 15.283 1.00 0.00 C0 ATOM 1753 C GLN D 6 11.814 16.525 16.209 1.00 0.00 C0 ATOM 1754 O GLN D 6 12.783 17.249 15.977 1.00 0.00 O0 ATOM 1755 CB GLN D 6 9.517 17.411 15.871 1.00 0.00 C0 ATOM 1756 CG GLN D 6 10.015 18.855 15.928 1.00 0.00 C0 ATOM 1757 CD GLN D 6 8.868 19.780 16.310 1.00 0.00 C0 ATOM 1758 OE1 GLN D 6 7.739 19.325 16.494 1.00 0.00 O0 ATOM 1759 NE2 GLN D 6 9.089 21.058 16.437 1.00 0.00 N0 ATOM 0 HA GLN D 6 10.914 16.899 14.309 1.00 0.00 H new ATOM 0 HB2 GLN D 6 8.615 17.350 15.263 1.00 0.00 H new ATOM 0 HB3 GLN D 6 9.251 17.067 16.871 1.00 0.00 H new ATOM 0 HG2 GLN D 6 10.823 18.943 16.655 1.00 0.00 H new ATOM 0 HG3 GLN D 6 10.424 19.147 14.961 1.00 0.00 H new ATOM 0 HE21 GLN D 6 10.026 21.431 16.284 1.00 0.00 H new ATOM 0 HE22 GLN D 6 8.325 21.685 16.690 1.00 0.00 H new ATOM 1768 N ILE D 7 11.737 15.728 17.264 1.00 0.00 N0 ATOM 1769 CA ILE D 7 12.830 15.667 18.240 1.00 0.00 C0 ATOM 1770 C ILE D 7 14.046 14.966 17.639 1.00 0.00 C0 ATOM 1771 O ILE D 7 15.193 15.296 17.956 1.00 0.00 O0 ATOM 1772 CB ILE D 7 12.395 14.938 19.536 1.00 0.00 C0 ATOM 1773 CG1 ILE D 7 12.785 13.455 19.467 1.00 0.00 C0 ATOM 1774 CG2 ILE D 7 10.880 15.059 19.737 1.00 0.00 C0 ATOM 1775 CD1 ILE D 7 12.076 12.676 20.576 1.00 0.00 C0 ATOM 0 H ILE D 7 10.944 15.120 17.470 1.00 0.00 H new ATOM 0 HA ILE D 7 13.095 16.693 18.497 1.00 0.00 H new ATOM 0 HB ILE D 7 12.904 15.406 20.379 1.00 0.00 H new ATOM 0 HG12 ILE D 7 12.516 13.045 18.494 1.00 0.00 H new ATOM 0 HG13 ILE D 7 13.865 13.349 19.570 1.00 0.00 H new ATOM 0 HG21 ILE D 7 10.592 14.541 20.652 1.00 0.00 H new ATOM 0 HG22 ILE D 7 10.606 16.111 19.814 1.00 0.00 H new ATOM 0 HG23 ILE D 7 10.363 14.611 18.888 1.00 0.00 H new ATOM 0 HD11 ILE D 7 12.358 11.625 20.520 1.00 0.00 H new ATOM 0 HD12 ILE D 7 12.367 13.078 21.546 1.00 0.00 H new ATOM 0 HD13 ILE D 7 10.997 12.769 20.453 1.00 0.00 H new ATOM 1787 N LEU D 8 13.797 14.010 16.752 1.00 0.00 N0 ATOM 1788 CA LEU D 8 14.875 13.281 16.105 1.00 0.00 C0 ATOM 1789 C LEU D 8 15.496 14.107 14.987 1.00 0.00 C0 ATOM 1790 O LEU D 8 16.703 14.046 14.752 1.00 0.00 O0 ATOM 1791 CB LEU D 8 14.331 11.969 15.537 1.00 0.00 C0 ATOM 1792 CG LEU D 8 15.454 11.183 14.857 1.00 0.00 C0 ATOM 1793 CD1 LEU D 8 16.532 10.818 15.884 1.00 0.00 C0 ATOM 1794 CD2 LEU D 8 14.873 9.905 14.249 1.00 0.00 C0 ATOM 0 H LEU D 8 12.860 13.724 16.467 1.00 0.00 H new ATOM 0 HA LEU D 8 15.648 13.072 16.845 1.00 0.00 H new ATOM 0 HB2 LEU D 8 13.892 11.372 16.336 1.00 0.00 H new ATOM 0 HB3 LEU D 8 13.536 12.176 14.820 1.00 0.00 H new ATOM 0 HG LEU D 8 15.902 11.794 14.074 1.00 0.00 H new ATOM 0 HD11 LEU D 8 17.328 10.259 15.393 1.00 0.00 H new ATOM 0 HD12 LEU D 8 16.944 11.729 16.319 1.00 0.00 H new ATOM 0 HD13 LEU D 8 16.092 10.207 16.672 1.00 0.00 H new ATOM 0 HD21 LEU D 8 15.668 9.340 13.762 1.00 0.00 H new ATOM 0 HD22 LEU D 8 14.426 9.298 15.036 1.00 0.00 H new ATOM 0 HD23 LEU D 8 14.111 10.165 13.514 1.00 0.00 H new ATOM 1806 N SER D 9 14.661 14.884 14.306 1.00 0.00 N0 ATOM 1807 CA SER D 9 15.134 15.724 13.216 1.00 0.00 C0 ATOM 1808 C SER D 9 15.985 16.868 13.752 1.00 0.00 C0 ATOM 1809 O SER D 9 17.051 17.156 13.215 1.00 0.00 O0 ATOM 1810 CB SER D 9 13.949 16.290 12.434 1.00 0.00 C0 ATOM 1811 OG SER D 9 14.433 17.072 11.350 1.00 0.00 O0 ATOM 0 H SER D 9 13.660 14.949 14.489 1.00 0.00 H new ATOM 0 HA SER D 9 15.744 15.111 12.552 1.00 0.00 H new ATOM 0 HB2 SER D 9 13.323 15.479 12.062 1.00 0.00 H new ATOM 0 HB3 SER D 9 13.325 16.900 13.087 1.00 0.00 H new ATOM 0 HG SER D 9 13.676 17.435 10.845 1.00 0.00 H new ATOM 1817 N ILE D 10 15.511 17.510 14.818 1.00 0.00 N0 ATOM 1818 CA ILE D 10 16.244 18.620 15.413 1.00 0.00 C0 ATOM 1819 C ILE D 10 17.528 18.121 16.071 1.00 0.00 C0 ATOM 1820 O ILE D 10 18.547 18.815 16.055 1.00 0.00 O0 ATOM 1821 CB ILE D 10 15.366 19.343 16.446 1.00 0.00 C0 ATOM 1822 CG1 ILE D 10 15.908 20.754 16.690 1.00 0.00 C0 ATOM 1823 CG2 ILE D 10 15.366 18.573 17.766 1.00 0.00 C0 ATOM 1824 CD1 ILE D 10 15.524 21.659 15.517 1.00 0.00 C0 ATOM 0 H ILE D 10 14.632 17.282 15.282 1.00 0.00 H new ATOM 0 HA ILE D 10 16.509 19.323 14.623 1.00 0.00 H new ATOM 0 HB ILE D 10 14.348 19.401 16.060 1.00 0.00 H new ATOM 0 HG12 ILE D 10 15.504 21.155 17.620 1.00 0.00 H new ATOM 0 HG13 ILE D 10 16.992 20.724 16.801 1.00 0.00 H new ATOM 0 HG21 ILE D 10 14.741 19.094 18.491 1.00 0.00 H new ATOM 0 HG22 ILE D 10 14.973 17.570 17.602 1.00 0.00 H new ATOM 0 HG23 ILE D 10 16.385 18.505 18.148 1.00 0.00 H new ATOM 0 HD11 ILE D 10 15.910 22.663 15.691 1.00 0.00 H new ATOM 0 HD12 ILE D 10 15.950 21.261 14.596 1.00 0.00 H new ATOM 0 HD13 ILE D 10 14.438 21.698 15.428 1.00 0.00 H new ATOM 1836 N CYS D 11 17.492 16.904 16.620 1.00 0.00 N0 ATOM 1837 CA CYS D 11 18.672 16.337 17.254 1.00 0.00 C0 ATOM 1838 C CYS D 11 19.720 15.975 16.210 1.00 0.00 C0 ATOM 1839 O CYS D 11 20.852 16.457 16.264 1.00 0.00 O0 ATOM 1840 CB CYS D 11 18.282 15.088 18.046 1.00 0.00 C0 ATOM 1841 SG CYS D 11 17.811 15.563 19.727 1.00 0.00 S0 ATOM 0 H CYS D 11 16.668 16.304 16.636 1.00 0.00 H new ATOM 0 HA CYS D 11 19.095 17.081 17.929 1.00 0.00 H new ATOM 0 HB2 CYS D 11 17.454 14.577 17.555 1.00 0.00 H new ATOM 0 HB3 CYS D 11 19.116 14.387 18.075 1.00 0.00 H new ATOM 0 HG CYS D 11 16.518 15.681 19.799 1.00 0.00 H new ATOM 1847 N SER D 12 19.348 15.111 15.269 1.00 0.00 N0 ATOM 1848 CA SER D 12 20.277 14.688 14.232 1.00 0.00 C0 ATOM 1849 C SER D 12 20.771 15.886 13.437 1.00 0.00 C0 ATOM 1850 O SER D 12 21.946 15.975 13.110 1.00 0.00 O0 ATOM 1851 CB SER D 12 19.602 13.690 13.294 1.00 0.00 C0 ATOM 1852 OG SER D 12 20.526 13.291 12.289 1.00 0.00 O0 ATOM 0 H SER D 12 18.419 14.695 15.205 1.00 0.00 H new ATOM 0 HA SER D 12 21.130 14.208 14.711 1.00 0.00 H new ATOM 0 HB2 SER D 12 19.259 12.821 13.855 1.00 0.00 H new ATOM 0 HB3 SER D 12 18.722 14.141 12.836 1.00 0.00 H new ATOM 0 HG SER D 12 20.096 12.649 11.686 1.00 0.00 H new ATOM 1858 N PHE D 13 19.865 16.806 13.120 1.00 0.00 N0 ATOM 1859 CA PHE D 13 20.237 17.989 12.354 1.00 0.00 C0 ATOM 1860 C PHE D 13 21.341 18.765 13.063 1.00 0.00 C0 ATOM 1861 O PHE D 13 22.340 19.137 12.446 1.00 0.00 O0 ATOM 1862 CB PHE D 13 19.016 18.888 12.171 1.00 0.00 C0 ATOM 1863 CG PHE D 13 19.443 20.204 11.572 1.00 0.00 C0 ATOM 1864 CD1 PHE D 13 19.692 20.304 10.198 1.00 0.00 C0 ATOM 1865 CD2 PHE D 13 19.588 21.328 12.394 1.00 0.00 C0 ATOM 1866 CE1 PHE D 13 20.084 21.531 9.646 1.00 0.00 C0 ATOM 1867 CE2 PHE D 13 19.982 22.552 11.844 1.00 0.00 C0 ATOM 1868 CZ PHE D 13 20.229 22.653 10.469 1.00 0.00 C0 ATOM 0 H PHE D 13 18.880 16.756 13.378 1.00 0.00 H new ATOM 0 HA PHE D 13 20.607 17.669 11.380 1.00 0.00 H new ATOM 0 HB2 PHE D 13 18.287 18.401 11.523 1.00 0.00 H new ATOM 0 HB3 PHE D 13 18.528 19.055 13.131 1.00 0.00 H new ATOM 0 HD1 PHE D 13 19.582 19.437 9.564 1.00 0.00 H new ATOM 0 HD2 PHE D 13 19.395 21.250 13.454 1.00 0.00 H new ATOM 0 HE1 PHE D 13 20.274 21.610 8.586 1.00 0.00 H new ATOM 0 HE2 PHE D 13 20.096 23.418 12.479 1.00 0.00 H new ATOM 0 HZ PHE D 13 20.532 23.598 10.044 1.00 0.00 H new ATOM 1878 N ILE D 14 21.156 19.011 14.355 1.00 0.00 N0 ATOM 1879 CA ILE D 14 22.150 19.748 15.127 1.00 0.00 C0 ATOM 1880 C ILE D 14 23.495 19.027 15.110 1.00 0.00 C0 ATOM 1881 O ILE D 14 24.538 19.644 14.896 1.00 0.00 O0 ATOM 1882 CB ILE D 14 21.671 19.904 16.571 1.00 0.00 C0 ATOM 1883 CG1 ILE D 14 20.497 20.892 16.615 1.00 0.00 C0 ATOM 1884 CG2 ILE D 14 22.823 20.421 17.442 1.00 0.00 C0 ATOM 1885 CD1 ILE D 14 21.014 22.333 16.564 1.00 0.00 C0 ATOM 0 H ILE D 14 20.337 18.715 14.885 1.00 0.00 H new ATOM 0 HA ILE D 14 22.277 20.731 14.674 1.00 0.00 H new ATOM 0 HB ILE D 14 21.342 18.938 16.953 1.00 0.00 H new ATOM 0 HG12 ILE D 14 19.827 20.709 15.775 1.00 0.00 H new ATOM 0 HG13 ILE D 14 19.917 20.738 17.525 1.00 0.00 H new ATOM 0 HG21 ILE D 14 22.480 20.532 18.471 1.00 0.00 H new ATOM 0 HG22 ILE D 14 23.650 19.712 17.410 1.00 0.00 H new ATOM 0 HG23 ILE D 14 23.158 21.387 17.065 1.00 0.00 H new ATOM 0 HD11 ILE D 14 20.171 23.023 16.596 1.00 0.00 H new ATOM 0 HD12 ILE D 14 21.666 22.516 17.418 1.00 0.00 H new ATOM 0 HD13 ILE D 14 21.574 22.486 15.641 1.00 0.00 H new ATOM 1897 N LEU D 15 23.463 17.719 15.335 1.00 0.00 N0 ATOM 1898 CA LEU D 15 24.685 16.920 15.345 1.00 0.00 C0 ATOM 1899 C LEU D 15 25.320 16.878 13.954 1.00 0.00 C0 ATOM 1900 O LEU D 15 26.538 16.775 13.819 1.00 0.00 O0 ATOM 1901 CB LEU D 15 24.368 15.496 15.818 1.00 0.00 C0 ATOM 1902 CG LEU D 15 24.013 15.517 17.309 1.00 0.00 C0 ATOM 1903 CD1 LEU D 15 23.418 14.165 17.713 1.00 0.00 C0 ATOM 1904 CD2 LEU D 15 25.276 15.779 18.135 1.00 0.00 C0 ATOM 0 H LEU D 15 22.609 17.190 15.512 1.00 0.00 H new ATOM 0 HA LEU D 15 25.395 17.382 16.031 1.00 0.00 H new ATOM 0 HB2 LEU D 15 23.538 15.087 15.242 1.00 0.00 H new ATOM 0 HB3 LEU D 15 25.226 14.846 15.647 1.00 0.00 H new ATOM 0 HG LEU D 15 23.286 16.307 17.494 1.00 0.00 H new ATOM 0 HD11 LEU D 15 23.166 14.181 18.773 1.00 0.00 H new ATOM 0 HD12 LEU D 15 22.518 13.974 17.129 1.00 0.00 H new ATOM 0 HD13 LEU D 15 24.146 13.376 17.525 1.00 0.00 H new ATOM 0 HD21 LEU D 15 25.021 15.794 19.195 1.00 0.00 H new ATOM 0 HD22 LEU D 15 26.004 14.989 17.948 1.00 0.00 H new ATOM 0 HD23 LEU D 15 25.703 16.741 17.851 1.00 0.00 H new ATOM 1916 N SER D 16 24.481 16.971 12.931 1.00 0.00 N0 ATOM 1917 CA SER D 16 24.954 16.956 11.550 1.00 0.00 C0 ATOM 1918 C SER D 16 25.717 18.236 11.229 1.00 0.00 C0 ATOM 1919 O SER D 16 26.816 18.196 10.672 1.00 0.00 O0 ATOM 1920 CB SER D 16 23.768 16.817 10.597 1.00 0.00 C0 ATOM 1921 OG SER D 16 24.236 16.850 9.256 1.00 0.00 O0 ATOM 0 H SER D 16 23.469 17.058 13.030 1.00 0.00 H new ATOM 0 HA SER D 16 25.625 16.106 11.425 1.00 0.00 H new ATOM 0 HB2 SER D 16 23.242 15.882 10.787 1.00 0.00 H new ATOM 0 HB3 SER D 16 23.055 17.624 10.765 1.00 0.00 H new ATOM 0 HG SER D 16 23.643 16.313 8.689 1.00 0.00 H new ATOM 1927 N ALA D 17 25.126 19.370 11.592 1.00 0.00 N0 ATOM 1928 CA ALA D 17 25.759 20.655 11.343 1.00 0.00 C0 ATOM 1929 C ALA D 17 27.081 20.739 12.094 1.00 0.00 C0 ATOM 1930 O ALA D 17 28.077 21.228 11.564 1.00 0.00 O0 ATOM 1931 CB ALA D 17 24.838 21.794 11.786 1.00 0.00 C0 ATOM 0 H ALA D 17 24.219 19.423 12.055 1.00 0.00 H new ATOM 0 HA ALA D 17 25.948 20.750 10.274 1.00 0.00 H new ATOM 0 HB1 ALA D 17 25.324 22.751 11.594 1.00 0.00 H new ATOM 0 HB2 ALA D 17 23.903 21.744 11.228 1.00 0.00 H new ATOM 0 HB3 ALA D 17 24.630 21.700 12.852 1.00 0.00 H new ATOM 1937 N LEU D 18 27.093 20.249 13.330 1.00 0.00 N0 ATOM 1938 CA LEU D 18 28.310 20.272 14.130 1.00 0.00 C0 ATOM 1939 C LEU D 18 29.383 19.387 13.507 1.00 0.00 C0 ATOM 1940 O LEU D 18 30.540 19.790 13.406 1.00 0.00 O0 ATOM 1941 CB LEU D 18 28.003 19.792 15.548 1.00 0.00 C0 ATOM 1942 CG LEU D 18 27.204 20.865 16.286 1.00 0.00 C0 ATOM 1943 CD1 LEU D 18 26.575 20.258 17.539 1.00 0.00 C0 ATOM 1944 CD2 LEU D 18 28.140 22.005 16.693 1.00 0.00 C0 ATOM 0 H LEU D 18 26.284 19.836 13.794 1.00 0.00 H new ATOM 0 HA LEU D 18 28.684 21.295 14.164 1.00 0.00 H new ATOM 0 HB2 LEU D 18 27.437 18.861 15.514 1.00 0.00 H new ATOM 0 HB3 LEU D 18 28.930 19.582 16.081 1.00 0.00 H new ATOM 0 HG LEU D 18 26.421 21.249 15.633 1.00 0.00 H new ATOM 0 HD11 LEU D 18 26.005 21.022 18.067 1.00 0.00 H new ATOM 0 HD12 LEU D 18 25.911 19.442 17.254 1.00 0.00 H new ATOM 0 HD13 LEU D 18 27.360 19.876 18.192 1.00 0.00 H new ATOM 0 HD21 LEU D 18 27.572 22.772 17.220 1.00 0.00 H new ATOM 0 HD22 LEU D 18 28.921 21.618 17.347 1.00 0.00 H new ATOM 0 HD23 LEU D 18 28.595 22.438 15.802 1.00 0.00 H new ATOM 1956 N HIS D 19 29.005 18.170 13.118 1.00 0.00 N0 ATOM 1957 CA HIS D 19 29.961 17.238 12.537 1.00 0.00 C0 ATOM 1958 C HIS D 19 30.669 17.886 11.357 1.00 0.00 C0 ATOM 1959 O HIS D 19 31.899 17.846 11.256 1.00 0.00 O0 ATOM 1960 CB HIS D 19 29.225 15.978 12.072 1.00 0.00 C0 ATOM 1961 CG HIS D 19 30.222 14.930 11.658 1.00 0.00 C0 ATOM 1962 ND1 HIS D 19 31.100 14.352 12.560 1.00 0.00 N0 ATOM 1963 CD2 HIS D 19 30.482 14.338 10.447 1.00 0.00 C0 ATOM 1964 CE1 HIS D 19 31.838 13.452 11.887 1.00 0.00 C0 ATOM 1965 NE2 HIS D 19 31.503 13.403 10.595 1.00 0.00 N0 ATOM 0 H HIS D 19 28.053 17.812 13.195 1.00 0.00 H new ATOM 0 HA HIS D 19 30.703 16.969 13.289 1.00 0.00 H new ATOM 0 HB2 HIS D 19 28.595 15.596 12.875 1.00 0.00 H new ATOM 0 HB3 HIS D 19 28.567 16.217 11.237 1.00 0.00 H new ATOM 0 HD1 HIS D 19 31.173 14.570 13.554 1.00 0.00 H new ATOM 0 HD2 HIS D 19 29.973 14.563 9.522 1.00 0.00 H new ATOM 0 HE1 HIS D 19 32.608 12.843 12.336 1.00 0.00 H new ATOM 1973 N PHE D 20 29.894 18.505 10.479 1.00 0.00 N0 ATOM 1974 CA PHE D 20 30.472 19.174 9.326 1.00 0.00 C0 ATOM 1975 C PHE D 20 31.312 20.366 9.770 1.00 0.00 C0 ATOM 1976 O PHE D 20 32.340 20.663 9.168 1.00 0.00 O0 ATOM 1977 CB PHE D 20 29.371 19.640 8.374 1.00 0.00 C0 ATOM 1978 CG PHE D 20 29.451 18.854 7.087 1.00 0.00 C0 ATOM 1979 CD1 PHE D 20 28.720 17.667 6.939 1.00 0.00 C0 ATOM 1980 CD2 PHE D 20 30.254 19.315 6.039 1.00 0.00 C0 ATOM 1981 CE1 PHE D 20 28.795 16.944 5.738 1.00 0.00 C0 ATOM 1982 CE2 PHE D 20 30.331 18.593 4.842 1.00 0.00 C0 ATOM 1983 CZ PHE D 20 29.601 17.409 4.690 1.00 0.00 C0 ATOM 0 H PHE D 20 28.877 18.558 10.542 1.00 0.00 H new ATOM 0 HA PHE D 20 31.114 18.465 8.803 1.00 0.00 H new ATOM 0 HB2 PHE D 20 28.394 19.502 8.836 1.00 0.00 H new ATOM 0 HB3 PHE D 20 29.479 20.705 8.169 1.00 0.00 H new ATOM 0 HD1 PHE D 20 28.100 17.309 7.748 1.00 0.00 H new ATOM 0 HD2 PHE D 20 30.816 20.230 6.153 1.00 0.00 H new ATOM 0 HE1 PHE D 20 28.232 16.030 5.622 1.00 0.00 H new ATOM 0 HE2 PHE D 20 30.954 18.950 4.035 1.00 0.00 H new ATOM 0 HZ PHE D 20 29.659 16.854 3.765 1.00 0.00 H new ATOM 1993 N MET D 21 30.865 21.048 10.821 1.00 0.00 N0 ATOM 1994 CA MET D 21 31.588 22.209 11.331 1.00 0.00 C0 ATOM 1995 C MET D 21 32.994 21.821 11.782 1.00 0.00 C0 ATOM 1996 O MET D 21 33.980 22.484 11.433 1.00 0.00 O0 ATOM 1997 CB MET D 21 30.824 22.814 12.514 1.00 0.00 C0 ATOM 1998 CG MET D 21 31.543 24.081 12.997 1.00 0.00 C0 ATOM 1999 SD MET D 21 31.504 25.339 11.692 1.00 0.00 S0 ATOM 2000 CE MET D 21 32.722 26.464 12.416 1.00 0.00 C0 ATOM 0 H MET D 21 30.013 20.819 11.333 1.00 0.00 H new ATOM 0 HA MET D 21 31.669 22.941 10.528 1.00 0.00 H new ATOM 0 HB2 MET D 21 29.803 23.054 12.216 1.00 0.00 H new ATOM 0 HB3 MET D 21 30.757 22.090 13.326 1.00 0.00 H new ATOM 0 HG2 MET D 21 31.063 24.463 13.898 1.00 0.00 H new ATOM 0 HG3 MET D 21 32.575 23.848 13.260 1.00 0.00 H new ATOM 0 HE1 MET D 21 32.855 27.326 11.762 1.00 0.00 H new ATOM 0 HE2 MET D 21 32.372 26.799 13.392 1.00 0.00 H new ATOM 0 HE3 MET D 21 33.674 25.945 12.530 1.00 0.00 H new ATOM 2010 N ALA D 22 33.082 20.747 12.560 1.00 0.00 N0 ATOM 2011 CA ALA D 22 34.365 20.282 13.056 1.00 0.00 C0 ATOM 2012 C ALA D 22 35.262 19.859 11.899 1.00 0.00 C0 ATOM 2013 O ALA D 22 36.456 20.125 11.901 1.00 0.00 O0 ATOM 2014 CB ALA D 22 34.157 19.108 14.012 1.00 0.00 C0 ATOM 0 H ALA D 22 32.283 20.187 12.857 1.00 0.00 H new ATOM 0 HA ALA D 22 34.850 21.099 13.591 1.00 0.00 H new ATOM 0 HB1 ALA D 22 35.123 18.763 14.381 1.00 0.00 H new ATOM 0 HB2 ALA D 22 33.541 19.428 14.852 1.00 0.00 H new ATOM 0 HB3 ALA D 22 33.658 18.294 13.486 1.00 0.00 H new ATOM 2020 N TRP D 23 34.675 19.202 10.913 1.00 0.00 N0 ATOM 2021 CA TRP D 23 35.436 18.748 9.753 1.00 0.00 C0 ATOM 2022 C TRP D 23 35.961 19.927 8.945 1.00 0.00 C0 ATOM 2023 O TRP D 23 37.140 19.966 8.598 1.00 0.00 O0 ATOM 2024 CB TRP D 23 34.543 17.851 8.913 1.00 0.00 C0 ATOM 2025 CG TRP D 23 34.490 16.462 9.501 1.00 0.00 C0 ATOM 2026 CD1 TRP D 23 33.822 15.441 8.926 1.00 0.00 C0 ATOM 2027 CD2 TRP D 23 35.105 15.904 10.726 1.00 0.00 C0 ATOM 2028 NE1 TRP D 23 33.990 14.304 9.685 1.00 0.00 N0 ATOM 2029 CE2 TRP D 23 34.766 14.536 10.796 1.00 0.00 C0 ATOM 2030 CE3 TRP D 23 35.915 16.426 11.773 1.00 0.00 C0 ATOM 2031 CZ2 TRP D 23 35.207 13.725 11.833 1.00 0.00 C0 ATOM 2032 CZ3 TRP D 23 36.353 15.606 12.817 1.00 0.00 C0 ATOM 2033 CH2 TRP D 23 36.004 14.258 12.847 1.00 0.00 C0 ATOM 0 H TRP D 23 33.682 18.971 10.888 1.00 0.00 H new ATOM 0 HA TRP D 23 36.308 18.183 10.083 1.00 0.00 H new ATOM 0 HB2 TRP D 23 33.538 18.271 8.864 1.00 0.00 H new ATOM 0 HB3 TRP D 23 34.920 17.806 7.891 1.00 0.00 H new ATOM 0 HD1 TRP D 23 33.246 15.505 8.014 1.00 0.00 H new ATOM 0 HE1 TRP D 23 33.586 13.397 9.451 1.00 0.00 H new ATOM 0 HE3 TRP D 23 36.195 17.469 11.761 1.00 0.00 H new ATOM 0 HZ2 TRP D 23 34.933 12.681 11.855 1.00 0.00 H new ATOM 0 HZ3 TRP D 23 36.965 16.020 13.604 1.00 0.00 H new ATOM 0 HH2 TRP D 23 36.349 13.627 13.653 1.00 0.00 H new ATOM 2044 N THR D 24 35.100 20.884 8.645 1.00 0.00 N0 ATOM 2045 CA THR D 24 35.518 22.050 7.885 1.00 0.00 C0 ATOM 2046 C THR D 24 36.742 22.693 8.532 1.00 0.00 C0 ATOM 2047 O THR D 24 37.777 22.870 7.887 1.00 0.00 O0 ATOM 2048 CB THR D 24 34.367 23.055 7.837 1.00 0.00 C0 ATOM 2049 OG1 THR D 24 33.572 22.905 9.004 1.00 0.00 O0 ATOM 2050 CG2 THR D 24 33.511 22.790 6.598 1.00 0.00 C0 ATOM 0 H THR D 24 34.116 20.878 8.913 1.00 0.00 H new ATOM 0 HA THR D 24 35.782 21.744 6.873 1.00 0.00 H new ATOM 0 HB THR D 24 34.764 24.069 7.791 1.00 0.00 H new ATOM 0 HG1 THR D 24 34.120 23.080 9.798 1.00 0.00 H new ATOM 0 HG21 THR D 24 32.690 23.506 6.563 1.00 0.00 H new ATOM 0 HG22 THR D 24 34.124 22.896 5.703 1.00 0.00 H new ATOM 0 HG23 THR D 24 33.108 21.778 6.644 1.00 0.00 H new ATOM 2058 N ILE D 25 36.621 23.040 9.811 1.00 0.00 N0 ATOM 2059 CA ILE D 25 37.738 23.662 10.519 1.00 0.00 C0 ATOM 2060 C ILE D 25 38.922 22.695 10.594 1.00 0.00 C0 ATOM 2061 O ILE D 25 40.080 23.117 10.596 1.00 0.00 O0 ATOM 2062 CB ILE D 25 37.298 24.094 11.925 1.00 0.00 C0 ATOM 2063 CG1 ILE D 25 37.966 25.425 12.271 1.00 0.00 C0 ATOM 2064 CG2 ILE D 25 37.709 23.046 12.962 1.00 0.00 C0 ATOM 2065 CD1 ILE D 25 37.238 26.560 11.549 1.00 0.00 C0 ATOM 0 H ILE D 25 35.779 22.905 10.370 1.00 0.00 H new ATOM 0 HA ILE D 25 38.055 24.549 9.970 1.00 0.00 H new ATOM 0 HB ILE D 25 36.213 24.198 11.938 1.00 0.00 H new ATOM 0 HG12 ILE D 25 37.940 25.589 13.348 1.00 0.00 H new ATOM 0 HG13 ILE D 25 39.015 25.406 11.977 1.00 0.00 H new ATOM 0 HG21 ILE D 25 37.389 23.369 13.953 1.00 0.00 H new ATOM 0 HG22 ILE D 25 37.239 22.092 12.722 1.00 0.00 H new ATOM 0 HG23 ILE D 25 38.793 22.929 12.951 1.00 0.00 H new ATOM 0 HD11 ILE D 25 37.712 27.510 11.794 1.00 0.00 H new ATOM 0 HD12 ILE D 25 37.287 26.397 10.472 1.00 0.00 H new ATOM 0 HD13 ILE D 25 36.195 26.583 11.865 1.00 0.00 H new ATOM 2077 N GLY D 26 38.623 21.400 10.660 1.00 0.00 N0 ATOM 2078 CA GLY D 26 39.671 20.385 10.735 1.00 0.00 C0 ATOM 2079 C GLY D 26 40.587 20.466 9.518 1.00 0.00 C0 ATOM 2080 O GLY D 26 41.811 20.520 9.647 1.00 0.00 O0 ATOM 0 H GLY D 26 37.672 21.031 10.663 1.00 0.00 H new ATOM 0 HA2 GLY D 26 40.254 20.524 11.645 1.00 0.00 H new ATOM 0 HA3 GLY D 26 39.221 19.394 10.793 1.00 0.00 H new ATOM 2084 N HIS D 27 39.983 20.482 8.336 1.00 0.00 N0 ATOM 2085 CA HIS D 27 40.745 20.572 7.096 1.00 0.00 C0 ATOM 2086 C HIS D 27 41.460 21.914 6.999 1.00 0.00 C0 ATOM 2087 O HIS D 27 42.567 22.006 6.468 1.00 0.00 O0 ATOM 2088 CB HIS D 27 39.819 20.395 5.894 1.00 0.00 C0 ATOM 2089 CG HIS D 27 40.620 20.515 4.627 1.00 0.00 C0 ATOM 2090 ND1 HIS D 27 40.813 21.731 3.990 1.00 0.00 N0 ATOM 2091 CD2 HIS D 27 41.286 19.585 3.867 1.00 0.00 C0 ATOM 2092 CE1 HIS D 27 41.569 21.503 2.902 1.00 0.00 C0 ATOM 2093 NE2 HIS D 27 41.884 20.212 2.778 1.00 0.00 N0 ATOM 0 H HIS D 27 38.972 20.434 8.210 1.00 0.00 H new ATOM 0 HA HIS D 27 41.491 19.777 7.096 1.00 0.00 H new ATOM 0 HB2 HIS D 27 39.330 19.422 5.938 1.00 0.00 H new ATOM 0 HB3 HIS D 27 39.032 21.149 5.913 1.00 0.00 H new ATOM 0 HD2 HIS D 27 41.338 18.528 4.082 1.00 0.00 H new ATOM 0 HE1 HIS D 27 41.883 22.272 2.212 1.00 0.00 H new ATOM 0 HE2 HIS D 27 42.443 19.778 2.043 1.00 0.00 H new ATOM 2101 N LEU D 28 40.819 22.952 7.525 1.00 0.00 N0 ATOM 2102 CA LEU D 28 41.399 24.291 7.504 1.00 0.00 C0 ATOM 2103 C LEU D 28 42.560 24.397 8.489 1.00 0.00 C0 ATOM 2104 O LEU D 28 43.467 25.207 8.307 1.00 0.00 O0 ATOM 2105 CB LEU D 28 40.326 25.323 7.856 1.00 0.00 C0 ATOM 2106 CG LEU D 28 39.309 25.417 6.716 1.00 0.00 C0 ATOM 2107 CD1 LEU D 28 38.036 26.094 7.226 1.00 0.00 C0 ATOM 2108 CD2 LEU D 28 39.892 26.252 5.570 1.00 0.00 C0 ATOM 0 H LEU D 28 39.903 22.894 7.969 1.00 0.00 H new ATOM 0 HA LEU D 28 41.780 24.486 6.502 1.00 0.00 H new ATOM 0 HB2 LEU D 28 39.825 25.040 8.781 1.00 0.00 H new ATOM 0 HB3 LEU D 28 40.786 26.296 8.028 1.00 0.00 H new ATOM 0 HG LEU D 28 39.079 24.414 6.358 1.00 0.00 H new ATOM 0 HD11 LEU D 28 37.310 26.162 6.416 1.00 0.00 H new ATOM 0 HD12 LEU D 28 37.614 25.508 8.042 1.00 0.00 H new ATOM 0 HD13 LEU D 28 38.275 27.095 7.584 1.00 0.00 H new ATOM 0 HD21 LEU D 28 39.165 26.317 4.760 1.00 0.00 H new ATOM 0 HD22 LEU D 28 40.123 27.254 5.931 1.00 0.00 H new ATOM 0 HD23 LEU D 28 40.803 25.780 5.203 1.00 0.00 H new