USER MOD reduce.3.24.130724 H: found=0, std=0, add=770, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 766 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 6 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 9 SER OG : rot -34:sc= 0.731 USER MOD Single : A 11 CYS SG : rot -163:sc= 0.32 USER MOD Single : A 12 SER OG : rot 90:sc= 0.0719 USER MOD Single : A 16 SER OG : rot 81:sc= 0.36 USER MOD Single : A 19 HIS : no HD1:sc=-0.00837 X(o=-0.0084,f=0) USER MOD Single : A 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 24 THR OG1 : rot 65:sc= 1.24 USER MOD Single : A 27 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 6 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 9 SER OG : rot -33:sc= 0.813 USER MOD Single : B 11 CYS SG : rot -170:sc= 0.498 USER MOD Single : B 12 SER OG : rot 88:sc= 0.0825 USER MOD Single : B 16 SER OG : rot 80:sc= 0.375 USER MOD Single : B 19 HIS : no HD1:sc=-0.00579 X(o=-0.0058,f=0) USER MOD Single : B 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 24 THR OG1 : rot 99:sc= 1.32 USER MOD Single : B 27 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : C 6 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : C 9 SER OG : rot -29:sc= 0.735 USER MOD Single : C 11 CYS SG : rot -157:sc= 0.207 USER MOD Single : C 12 SER OG : rot 90:sc= 0.0865 USER MOD Single : C 16 SER OG : rot 80:sc= 0.37 USER MOD Single : C 19 HIS : no HD1:sc=-0.00552 X(o=-0.0055,f=0) USER MOD Single : C 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : C 24 THR OG1 : rot 69:sc= 1.22 USER MOD Single : C 27 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : D 6 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : D 9 SER OG : rot -31:sc= 0.773 USER MOD Single : D 11 CYS SG : rot -172:sc= 1.01 USER MOD Single : D 12 SER OG : rot 91:sc= 0.0844 USER MOD Single : D 16 SER OG : rot 79:sc= 0.366 USER MOD Single : D 19 HIS : no HD1:sc=-0.00734 X(o=-0.0073,f=0) USER MOD Single : D 21 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : D 24 THR OG1 : rot 104:sc= 1.18 USER MOD Single : D 27 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 69 N PHE A 5 9.125 11.802 6.064 1.00 0.00 N0 ATOM 70 CA PHE A 5 10.259 10.922 5.849 1.00 0.00 C0 ATOM 71 C PHE A 5 10.916 11.220 4.503 1.00 0.00 C0 ATOM 72 O PHE A 5 12.119 11.034 4.335 1.00 0.00 O0 ATOM 73 CB PHE A 5 9.804 9.464 5.886 1.00 0.00 C0 ATOM 74 CG PHE A 5 9.877 8.873 4.498 1.00 0.00 C0 ATOM 75 CD1 PHE A 5 11.010 8.150 4.112 1.00 0.00 C0 ATOM 76 CD2 PHE A 5 8.814 9.044 3.601 1.00 0.00 C0 ATOM 77 CE1 PHE A 5 11.083 7.593 2.830 1.00 0.00 C0 ATOM 78 CE2 PHE A 5 8.889 8.487 2.317 1.00 0.00 C0 ATOM 79 CZ PHE A 5 10.022 7.762 1.932 1.00 0.00 C0 ATOM 0 HA PHE A 5 10.986 11.093 6.643 1.00 0.00 H new ATOM 0 HB2 PHE A 5 10.434 8.893 6.568 1.00 0.00 H new ATOM 0 HB3 PHE A 5 8.784 9.401 6.266 1.00 0.00 H new ATOM 0 HD1 PHE A 5 11.829 8.021 4.804 1.00 0.00 H new ATOM 0 HD2 PHE A 5 7.939 9.603 3.898 1.00 0.00 H new ATOM 0 HE1 PHE A 5 11.958 7.033 2.533 1.00 0.00 H new ATOM 0 HE2 PHE A 5 8.071 8.618 1.624 1.00 0.00 H new ATOM 0 HZ PHE A 5 10.078 7.333 0.943 1.00 0.00 H new ATOM 89 N GLN A 6 10.114 11.688 3.550 1.00 0.00 N0 ATOM 90 CA GLN A 6 10.626 12.007 2.222 1.00 0.00 C0 ATOM 91 C GLN A 6 11.616 13.160 2.274 1.00 0.00 C0 ATOM 92 O GLN A 6 12.686 13.098 1.667 1.00 0.00 O0 ATOM 93 CB GLN A 6 9.470 12.373 1.290 1.00 0.00 C0 ATOM 94 CG GLN A 6 10.028 12.765 -0.078 1.00 0.00 C0 ATOM 95 CD GLN A 6 9.043 12.366 -1.172 1.00 0.00 C0 ATOM 96 OE1 GLN A 6 7.878 12.756 -1.130 1.00 0.00 O0 ATOM 97 NE2 GLN A 6 9.446 11.603 -2.150 1.00 0.00 N0 ATOM 0 H GLN A 6 9.115 11.853 3.672 1.00 0.00 H new ATOM 0 HA GLN A 6 11.142 11.125 1.842 1.00 0.00 H new ATOM 0 HB2 GLN A 6 8.788 11.529 1.189 1.00 0.00 H new ATOM 0 HB3 GLN A 6 8.896 13.198 1.711 1.00 0.00 H new ATOM 0 HG2 GLN A 6 10.209 13.839 -0.113 1.00 0.00 H new ATOM 0 HG3 GLN A 6 10.987 12.275 -0.244 1.00 0.00 H new ATOM 0 HE21 GLN A 6 10.414 11.282 -2.181 1.00 0.00 H new ATOM 0 HE22 GLN A 6 8.794 11.328 -2.884 1.00 0.00 H new ATOM 106 N ILE A 7 11.257 14.213 2.996 1.00 0.00 N0 ATOM 107 CA ILE A 7 12.134 15.372 3.098 1.00 0.00 C0 ATOM 108 C ILE A 7 13.379 15.028 3.912 1.00 0.00 C0 ATOM 109 O ILE A 7 14.473 15.526 3.633 1.00 0.00 O0 ATOM 110 CB ILE A 7 11.385 16.548 3.745 1.00 0.00 C0 ATOM 111 CG1 ILE A 7 11.219 16.297 5.245 1.00 0.00 C0 ATOM 112 CG2 ILE A 7 10.002 16.678 3.110 1.00 0.00 C0 ATOM 113 CD1 ILE A 7 10.398 17.422 5.880 1.00 0.00 C0 ATOM 0 H ILE A 7 10.380 14.289 3.512 1.00 0.00 H new ATOM 0 HA ILE A 7 12.445 15.662 2.094 1.00 0.00 H new ATOM 0 HB ILE A 7 11.956 17.463 3.589 1.00 0.00 H new ATOM 0 HG12 ILE A 7 10.725 15.339 5.409 1.00 0.00 H new ATOM 0 HG13 ILE A 7 12.197 16.237 5.722 1.00 0.00 H new ATOM 0 HG21 ILE A 7 9.469 17.511 3.567 1.00 0.00 H new ATOM 0 HG22 ILE A 7 10.108 16.858 2.040 1.00 0.00 H new ATOM 0 HG23 ILE A 7 9.441 15.757 3.269 1.00 0.00 H new ATOM 0 HD11 ILE A 7 10.286 17.233 6.948 1.00 0.00 H new ATOM 0 HD12 ILE A 7 10.909 18.373 5.732 1.00 0.00 H new ATOM 0 HD13 ILE A 7 9.414 17.462 5.414 1.00 0.00 H new ATOM 125 N LEU A 8 13.211 14.175 4.920 1.00 0.00 N0 ATOM 126 CA LEU A 8 14.332 13.781 5.761 1.00 0.00 C0 ATOM 127 C LEU A 8 15.266 12.828 5.020 1.00 0.00 C0 ATOM 128 O LEU A 8 16.481 12.837 5.242 1.00 0.00 O0 ATOM 129 CB LEU A 8 13.801 13.101 7.027 1.00 0.00 C0 ATOM 130 CG LEU A 8 14.029 14.000 8.252 1.00 0.00 C0 ATOM 131 CD1 LEU A 8 15.535 14.175 8.499 1.00 0.00 C0 ATOM 132 CD2 LEU A 8 13.374 15.372 8.024 1.00 0.00 C0 ATOM 0 H LEU A 8 12.319 13.749 5.170 1.00 0.00 H new ATOM 0 HA LEU A 8 14.897 14.674 6.026 1.00 0.00 H new ATOM 0 HB2 LEU A 8 12.737 12.890 6.916 1.00 0.00 H new ATOM 0 HB3 LEU A 8 14.303 12.144 7.171 1.00 0.00 H new ATOM 0 HG LEU A 8 13.577 13.531 9.126 1.00 0.00 H new ATOM 0 HD11 LEU A 8 15.689 14.813 9.369 1.00 0.00 H new ATOM 0 HD12 LEU A 8 15.990 13.201 8.679 1.00 0.00 H new ATOM 0 HD13 LEU A 8 15.996 14.635 7.625 1.00 0.00 H new ATOM 0 HD21 LEU A 8 13.540 16.004 8.897 1.00 0.00 H new ATOM 0 HD22 LEU A 8 13.814 15.844 7.145 1.00 0.00 H new ATOM 0 HD23 LEU A 8 12.303 15.242 7.868 1.00 0.00 H new ATOM 144 N SER A 9 14.700 12.023 4.129 1.00 0.00 N0 ATOM 145 CA SER A 9 15.498 11.088 3.353 1.00 0.00 C0 ATOM 146 C SER A 9 16.266 11.820 2.257 1.00 0.00 C0 ATOM 147 O SER A 9 17.425 11.513 1.989 1.00 0.00 O0 ATOM 148 CB SER A 9 14.591 10.029 2.730 1.00 0.00 C0 ATOM 149 OG SER A 9 13.693 10.658 1.823 1.00 0.00 O0 ATOM 0 H SER A 9 13.700 12.000 3.928 1.00 0.00 H new ATOM 0 HA SER A 9 16.215 10.606 4.018 1.00 0.00 H new ATOM 0 HB2 SER A 9 15.189 9.282 2.209 1.00 0.00 H new ATOM 0 HB3 SER A 9 14.034 9.506 3.508 1.00 0.00 H new ATOM 0 HG SER A 9 13.464 11.551 2.156 1.00 0.00 H new ATOM 155 N ILE A 10 15.616 12.801 1.636 1.00 0.00 N0 ATOM 156 CA ILE A 10 16.252 13.575 0.578 1.00 0.00 C0 ATOM 157 C ILE A 10 17.389 14.422 1.136 1.00 0.00 C0 ATOM 158 O ILE A 10 18.451 14.535 0.520 1.00 0.00 O0 ATOM 159 CB ILE A 10 15.221 14.481 -0.104 1.00 0.00 C0 ATOM 160 CG1 ILE A 10 14.219 13.616 -0.874 1.00 0.00 C0 ATOM 161 CG2 ILE A 10 15.934 15.421 -1.079 1.00 0.00 C0 ATOM 162 CD1 ILE A 10 13.001 14.461 -1.256 1.00 0.00 C0 ATOM 0 H ILE A 10 14.657 13.076 1.846 1.00 0.00 H new ATOM 0 HA ILE A 10 16.662 12.879 -0.154 1.00 0.00 H new ATOM 0 HB ILE A 10 14.696 15.068 0.649 1.00 0.00 H new ATOM 0 HG12 ILE A 10 14.687 13.209 -1.770 1.00 0.00 H new ATOM 0 HG13 ILE A 10 13.909 12.768 -0.263 1.00 0.00 H new ATOM 0 HG21 ILE A 10 15.201 16.066 -1.564 1.00 0.00 H new ATOM 0 HG22 ILE A 10 16.652 16.034 -0.534 1.00 0.00 H new ATOM 0 HG23 ILE A 10 16.457 14.834 -1.834 1.00 0.00 H new ATOM 0 HD11 ILE A 10 12.288 13.845 -1.804 1.00 0.00 H new ATOM 0 HD12 ILE A 10 12.528 14.847 -0.353 1.00 0.00 H new ATOM 0 HD13 ILE A 10 13.318 15.294 -1.883 1.00 0.00 H new ATOM 174 N CYS A 11 17.171 15.013 2.309 1.00 0.00 N0 ATOM 175 CA CYS A 11 18.194 15.846 2.928 1.00 0.00 C0 ATOM 176 C CYS A 11 19.403 15.011 3.335 1.00 0.00 C0 ATOM 177 O CYS A 11 20.539 15.336 2.983 1.00 0.00 O0 ATOM 178 CB CYS A 11 17.614 16.535 4.164 1.00 0.00 C0 ATOM 179 SG CYS A 11 18.786 17.773 4.770 1.00 0.00 S0 ATOM 0 H CYS A 11 16.306 14.931 2.843 1.00 0.00 H new ATOM 0 HA CYS A 11 18.516 16.593 2.202 1.00 0.00 H new ATOM 0 HB2 CYS A 11 16.664 17.008 3.917 1.00 0.00 H new ATOM 0 HB3 CYS A 11 17.411 15.799 4.942 1.00 0.00 H new ATOM 0 HG CYS A 11 18.480 18.099 5.991 1.00 0.00 H new ATOM 185 N SER A 12 19.161 13.937 4.085 1.00 0.00 N0 ATOM 186 CA SER A 12 20.251 13.080 4.533 1.00 0.00 C0 ATOM 187 C SER A 12 20.986 12.479 3.343 1.00 0.00 C0 ATOM 188 O SER A 12 22.211 12.352 3.360 1.00 0.00 O0 ATOM 189 CB SER A 12 19.706 11.960 5.421 1.00 0.00 C0 ATOM 190 OG SER A 12 19.246 12.516 6.645 1.00 0.00 O0 ATOM 0 H SER A 12 18.233 13.644 4.390 1.00 0.00 H new ATOM 0 HA SER A 12 20.951 13.687 5.106 1.00 0.00 H new ATOM 0 HB2 SER A 12 18.892 11.442 4.914 1.00 0.00 H new ATOM 0 HB3 SER A 12 20.484 11.221 5.613 1.00 0.00 H new ATOM 0 HG SER A 12 18.302 12.763 6.558 1.00 0.00 H new ATOM 196 N PHE A 13 20.234 12.108 2.314 1.00 0.00 N0 ATOM 197 CA PHE A 13 20.829 11.520 1.124 1.00 0.00 C0 ATOM 198 C PHE A 13 21.812 12.493 0.483 1.00 0.00 C0 ATOM 199 O PHE A 13 22.925 12.114 0.114 1.00 0.00 O0 ATOM 200 CB PHE A 13 19.731 11.164 0.119 1.00 0.00 C0 ATOM 201 CG PHE A 13 19.273 9.745 0.353 1.00 0.00 C0 ATOM 202 CD1 PHE A 13 19.109 9.266 1.659 1.00 0.00 C0 ATOM 203 CD2 PHE A 13 19.011 8.908 -0.737 1.00 0.00 C0 ATOM 204 CE1 PHE A 13 18.685 7.949 1.873 1.00 0.00 C0 ATOM 205 CE2 PHE A 13 18.586 7.592 -0.524 1.00 0.00 C0 ATOM 206 CZ PHE A 13 18.423 7.111 0.781 1.00 0.00 C0 ATOM 0 H PHE A 13 19.219 12.203 2.280 1.00 0.00 H new ATOM 0 HA PHE A 13 21.366 10.617 1.413 1.00 0.00 H new ATOM 0 HB2 PHE A 13 18.891 11.850 0.224 1.00 0.00 H new ATOM 0 HB3 PHE A 13 20.106 11.273 -0.899 1.00 0.00 H new ATOM 0 HD1 PHE A 13 19.310 9.912 2.501 1.00 0.00 H new ATOM 0 HD2 PHE A 13 19.137 9.278 -1.744 1.00 0.00 H new ATOM 0 HE1 PHE A 13 18.560 7.579 2.880 1.00 0.00 H new ATOM 0 HE2 PHE A 13 18.384 6.947 -1.366 1.00 0.00 H new ATOM 0 HZ PHE A 13 18.096 6.095 0.946 1.00 0.00 H new ATOM 216 N ILE A 14 21.404 13.754 0.368 1.00 0.00 N0 ATOM 217 CA ILE A 14 22.267 14.772 -0.218 1.00 0.00 C0 ATOM 218 C ILE A 14 23.539 14.933 0.605 1.00 0.00 C0 ATOM 219 O ILE A 14 24.637 15.022 0.055 1.00 0.00 O0 ATOM 220 CB ILE A 14 21.528 16.107 -0.289 1.00 0.00 C0 ATOM 221 CG1 ILE A 14 20.440 16.025 -1.363 1.00 0.00 C0 ATOM 222 CG2 ILE A 14 22.515 17.222 -0.639 1.00 0.00 C0 ATOM 223 CD1 ILE A 14 19.453 17.179 -1.182 1.00 0.00 C0 ATOM 0 H ILE A 14 20.490 14.092 0.670 1.00 0.00 H new ATOM 0 HA ILE A 14 22.538 14.456 -1.225 1.00 0.00 H new ATOM 0 HB ILE A 14 21.071 16.324 0.676 1.00 0.00 H new ATOM 0 HG12 ILE A 14 20.890 16.070 -2.355 1.00 0.00 H new ATOM 0 HG13 ILE A 14 19.917 15.071 -1.293 1.00 0.00 H new ATOM 0 HG21 ILE A 14 21.986 18.174 -0.689 1.00 0.00 H new ATOM 0 HG22 ILE A 14 23.289 17.277 0.127 1.00 0.00 H new ATOM 0 HG23 ILE A 14 22.975 17.011 -1.605 1.00 0.00 H new ATOM 0 HD11 ILE A 14 18.679 17.119 -1.947 1.00 0.00 H new ATOM 0 HD12 ILE A 14 18.994 17.114 -0.196 1.00 0.00 H new ATOM 0 HD13 ILE A 14 19.982 18.128 -1.274 1.00 0.00 H new ATOM 235 N LEU A 15 23.389 14.969 1.925 1.00 0.00 N0 ATOM 236 CA LEU A 15 24.545 15.117 2.802 1.00 0.00 C0 ATOM 237 C LEU A 15 25.501 13.941 2.633 1.00 0.00 C0 ATOM 238 O LEU A 15 26.672 14.127 2.323 1.00 0.00 O0 ATOM 239 CB LEU A 15 24.088 15.200 4.258 1.00 0.00 C0 ATOM 240 CG LEU A 15 23.792 16.655 4.616 1.00 0.00 C0 ATOM 241 CD1 LEU A 15 22.933 16.704 5.878 1.00 0.00 C0 ATOM 242 CD2 LEU A 15 25.112 17.388 4.870 1.00 0.00 C0 ATOM 0 H LEU A 15 22.492 14.899 2.406 1.00 0.00 H new ATOM 0 HA LEU A 15 25.066 16.035 2.532 1.00 0.00 H new ATOM 0 HB2 LEU A 15 23.197 14.589 4.406 1.00 0.00 H new ATOM 0 HB3 LEU A 15 24.860 14.802 4.916 1.00 0.00 H new ATOM 0 HG LEU A 15 23.257 17.133 3.795 1.00 0.00 H new ATOM 0 HD11 LEU A 15 22.721 17.742 6.134 1.00 0.00 H new ATOM 0 HD12 LEU A 15 21.996 16.176 5.701 1.00 0.00 H new ATOM 0 HD13 LEU A 15 23.468 16.229 6.701 1.00 0.00 H new ATOM 0 HD21 LEU A 15 24.907 18.428 5.126 1.00 0.00 H new ATOM 0 HD22 LEU A 15 25.642 16.909 5.693 1.00 0.00 H new ATOM 0 HD23 LEU A 15 25.728 17.350 3.972 1.00 0.00 H new ATOM 254 N SER A 16 25.001 12.737 2.870 1.00 0.00 N0 ATOM 255 CA SER A 16 25.832 11.542 2.762 1.00 0.00 C0 ATOM 256 C SER A 16 26.596 11.538 1.441 1.00 0.00 C0 ATOM 257 O SER A 16 27.764 11.142 1.392 1.00 0.00 O0 ATOM 258 CB SER A 16 24.954 10.294 2.847 1.00 0.00 C0 ATOM 259 OG SER A 16 24.273 10.288 4.094 1.00 0.00 O0 ATOM 0 H SER A 16 24.032 12.560 3.136 1.00 0.00 H new ATOM 0 HA SER A 16 26.549 11.543 3.583 1.00 0.00 H new ATOM 0 HB2 SER A 16 24.236 10.283 2.027 1.00 0.00 H new ATOM 0 HB3 SER A 16 25.565 9.397 2.748 1.00 0.00 H new ATOM 0 HG SER A 16 23.492 10.878 4.043 1.00 0.00 H new ATOM 265 N ALA A 17 25.931 11.979 0.377 1.00 0.00 N0 ATOM 266 CA ALA A 17 26.555 12.028 -0.937 1.00 0.00 C0 ATOM 267 C ALA A 17 27.742 12.988 -0.941 1.00 0.00 C0 ATOM 268 O ALA A 17 28.840 12.637 -1.387 1.00 0.00 O0 ATOM 269 CB ALA A 17 25.526 12.484 -1.975 1.00 0.00 C0 ATOM 0 H ALA A 17 24.965 12.306 0.401 1.00 0.00 H new ATOM 0 HA ALA A 17 26.916 11.030 -1.185 1.00 0.00 H new ATOM 0 HB1 ALA A 17 25.993 12.521 -2.959 1.00 0.00 H new ATOM 0 HB2 ALA A 17 24.693 11.781 -1.995 1.00 0.00 H new ATOM 0 HB3 ALA A 17 25.158 13.475 -1.711 1.00 0.00 H new ATOM 275 N LEU A 18 27.522 14.198 -0.430 1.00 0.00 N0 ATOM 276 CA LEU A 18 28.579 15.201 -0.375 1.00 0.00 C0 ATOM 277 C LEU A 18 29.671 14.787 0.605 1.00 0.00 C0 ATOM 278 O LEU A 18 30.820 15.227 0.491 1.00 0.00 O0 ATOM 279 CB LEU A 18 27.999 16.554 0.046 1.00 0.00 C0 ATOM 280 CG LEU A 18 27.717 17.400 -1.199 1.00 0.00 C0 ATOM 281 CD1 LEU A 18 26.520 16.821 -1.955 1.00 0.00 C0 ATOM 282 CD2 LEU A 18 27.405 18.838 -0.777 1.00 0.00 C0 ATOM 0 H LEU A 18 26.626 14.505 -0.051 1.00 0.00 H new ATOM 0 HA LEU A 18 29.017 15.287 -1.370 1.00 0.00 H new ATOM 0 HB2 LEU A 18 27.080 16.407 0.614 1.00 0.00 H new ATOM 0 HB3 LEU A 18 28.699 17.074 0.701 1.00 0.00 H new ATOM 0 HG LEU A 18 28.593 17.391 -1.848 1.00 0.00 H new ATOM 0 HD11 LEU A 18 26.322 17.425 -2.840 1.00 0.00 H new ATOM 0 HD12 LEU A 18 26.741 15.797 -2.256 1.00 0.00 H new ATOM 0 HD13 LEU A 18 25.643 16.828 -1.308 1.00 0.00 H new ATOM 0 HD21 LEU A 18 27.204 19.441 -1.662 1.00 0.00 H new ATOM 0 HD22 LEU A 18 26.530 18.845 -0.127 1.00 0.00 H new ATOM 0 HD23 LEU A 18 28.258 19.253 -0.241 1.00 0.00 H new ATOM 294 N HIS A 19 29.314 13.929 1.554 1.00 0.00 N0 ATOM 295 CA HIS A 19 30.275 13.451 2.539 1.00 0.00 C0 ATOM 296 C HIS A 19 31.300 12.552 1.871 1.00 0.00 C0 ATOM 297 O HIS A 19 32.479 12.890 1.806 1.00 0.00 O0 ATOM 298 CB HIS A 19 29.553 12.681 3.645 1.00 0.00 C0 ATOM 299 CG HIS A 19 30.564 12.016 4.536 1.00 0.00 C0 ATOM 300 ND1 HIS A 19 31.316 12.724 5.461 1.00 0.00 N0 ATOM 301 CD2 HIS A 19 30.960 10.706 4.654 1.00 0.00 C0 ATOM 302 CE1 HIS A 19 32.118 11.843 6.089 1.00 0.00 C0 ATOM 303 NE2 HIS A 19 31.940 10.599 5.635 1.00 0.00 N0 ATOM 0 H HIS A 19 28.372 13.553 1.661 1.00 0.00 H new ATOM 0 HA HIS A 19 30.785 14.308 2.978 1.00 0.00 H new ATOM 0 HB2 HIS A 19 28.930 13.359 4.228 1.00 0.00 H new ATOM 0 HB3 HIS A 19 28.890 11.934 3.209 1.00 0.00 H new ATOM 0 HD2 HIS A 19 30.569 9.884 4.073 1.00 0.00 H new ATOM 0 HE1 HIS A 19 32.820 12.110 6.865 1.00 0.00 H new ATOM 0 HE2 HIS A 19 32.420 9.753 5.942 1.00 0.00 H new ATOM 311 N PHE A 20 30.858 11.395 1.396 1.00 0.00 N0 ATOM 312 CA PHE A 20 31.772 10.463 0.748 1.00 0.00 C0 ATOM 313 C PHE A 20 32.503 11.149 -0.396 1.00 0.00 C0 ATOM 314 O PHE A 20 33.632 10.795 -0.719 1.00 0.00 O0 ATOM 315 CB PHE A 20 31.006 9.249 0.221 1.00 0.00 C0 ATOM 316 CG PHE A 20 31.321 8.040 1.072 1.00 0.00 C0 ATOM 317 CD1 PHE A 20 30.647 7.835 2.283 1.00 0.00 C0 ATOM 318 CD2 PHE A 20 32.287 7.120 0.646 1.00 0.00 C0 ATOM 319 CE1 PHE A 20 30.938 6.709 3.065 1.00 0.00 C0 ATOM 320 CE2 PHE A 20 32.578 5.996 1.429 1.00 0.00 C0 ATOM 321 CZ PHE A 20 31.905 5.790 2.638 1.00 0.00 C0 ATOM 0 H PHE A 20 29.888 11.082 1.445 1.00 0.00 H new ATOM 0 HA PHE A 20 32.503 10.128 1.484 1.00 0.00 H new ATOM 0 HB2 PHE A 20 29.934 9.448 0.237 1.00 0.00 H new ATOM 0 HB3 PHE A 20 31.279 9.057 -0.817 1.00 0.00 H new ATOM 0 HD1 PHE A 20 29.903 8.545 2.614 1.00 0.00 H new ATOM 0 HD2 PHE A 20 32.808 7.277 -0.287 1.00 0.00 H new ATOM 0 HE1 PHE A 20 30.416 6.550 3.997 1.00 0.00 H new ATOM 0 HE2 PHE A 20 33.323 5.287 1.099 1.00 0.00 H new ATOM 0 HZ PHE A 20 32.131 4.923 3.242 1.00 0.00 H new ATOM 331 N MET A 21 31.857 12.135 -1.005 1.00 0.00 N0 ATOM 332 CA MET A 21 32.474 12.859 -2.107 1.00 0.00 C0 ATOM 333 C MET A 21 33.751 13.563 -1.655 1.00 0.00 C0 ATOM 334 O MET A 21 34.850 13.258 -2.137 1.00 0.00 O0 ATOM 335 CB MET A 21 31.488 13.892 -2.653 1.00 0.00 C0 ATOM 336 CG MET A 21 30.831 13.342 -3.921 1.00 0.00 C0 ATOM 337 SD MET A 21 32.037 13.339 -5.271 1.00 0.00 S0 ATOM 338 CE MET A 21 31.552 11.761 -6.013 1.00 0.00 C0 ATOM 0 H MET A 21 30.918 12.448 -0.758 1.00 0.00 H new ATOM 0 HA MET A 21 32.734 12.143 -2.886 1.00 0.00 H new ATOM 0 HB2 MET A 21 30.728 14.118 -1.905 1.00 0.00 H new ATOM 0 HB3 MET A 21 32.006 14.825 -2.873 1.00 0.00 H new ATOM 0 HG2 MET A 21 30.464 12.331 -3.744 1.00 0.00 H new ATOM 0 HG3 MET A 21 29.969 13.952 -4.191 1.00 0.00 H new ATOM 0 HE1 MET A 21 32.180 11.558 -6.880 1.00 0.00 H new ATOM 0 HE2 MET A 21 31.674 10.962 -5.282 1.00 0.00 H new ATOM 0 HE3 MET A 21 30.509 11.811 -6.325 1.00 0.00 H new ATOM 348 N ALA A 22 33.603 14.505 -0.727 1.00 0.00 N0 ATOM 349 CA ALA A 22 34.750 15.248 -0.225 1.00 0.00 C0 ATOM 350 C ALA A 22 35.736 14.323 0.477 1.00 0.00 C0 ATOM 351 O ALA A 22 36.946 14.473 0.335 1.00 0.00 O0 ATOM 352 CB ALA A 22 34.286 16.327 0.751 1.00 0.00 C0 ATOM 0 H ALA A 22 32.709 14.768 -0.312 1.00 0.00 H new ATOM 0 HA ALA A 22 35.251 15.711 -1.075 1.00 0.00 H new ATOM 0 HB1 ALA A 22 35.150 16.878 1.122 1.00 0.00 H new ATOM 0 HB2 ALA A 22 33.610 17.013 0.241 1.00 0.00 H new ATOM 0 HB3 ALA A 22 33.766 15.861 1.588 1.00 0.00 H new ATOM 358 N TRP A 23 35.209 13.374 1.241 1.00 0.00 N0 ATOM 359 CA TRP A 23 36.056 12.437 1.970 1.00 0.00 C0 ATOM 360 C TRP A 23 36.939 11.664 0.999 1.00 0.00 C0 ATOM 361 O TRP A 23 38.145 11.559 1.197 1.00 0.00 O0 ATOM 362 CB TRP A 23 35.189 11.467 2.770 1.00 0.00 C0 ATOM 363 CG TRP A 23 35.845 11.179 4.079 1.00 0.00 C0 ATOM 364 CD1 TRP A 23 35.741 11.951 5.184 1.00 0.00 C0 ATOM 365 CD2 TRP A 23 36.700 10.056 4.444 1.00 0.00 C0 ATOM 366 NE1 TRP A 23 36.479 11.376 6.203 1.00 0.00 N0 ATOM 367 CE2 TRP A 23 37.089 10.207 5.797 1.00 0.00 C0 ATOM 368 CE3 TRP A 23 37.172 8.932 3.741 1.00 0.00 C0 ATOM 369 CZ2 TRP A 23 37.915 9.276 6.429 1.00 0.00 C0 ATOM 370 CZ3 TRP A 23 38.004 7.995 4.373 1.00 0.00 C0 ATOM 371 CH2 TRP A 23 38.374 8.167 5.715 1.00 0.00 C0 ATOM 0 H TRP A 23 34.207 13.233 1.372 1.00 0.00 H new ATOM 0 HA TRP A 23 36.692 12.996 2.656 1.00 0.00 H new ATOM 0 HB2 TRP A 23 34.200 11.896 2.933 1.00 0.00 H new ATOM 0 HB3 TRP A 23 35.047 10.542 2.211 1.00 0.00 H new ATOM 0 HD1 TRP A 23 35.174 12.867 5.259 1.00 0.00 H new ATOM 0 HE1 TRP A 23 36.562 11.769 7.141 1.00 0.00 H new ATOM 0 HE3 TRP A 23 36.892 8.789 2.708 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 38.197 9.412 7.463 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 38.361 7.137 3.823 1.00 0.00 H new ATOM 0 HH2 TRP A 23 39.014 7.442 6.196 1.00 0.00 H new ATOM 382 N THR A 24 36.327 11.116 -0.043 1.00 0.00 N0 ATOM 383 CA THR A 24 37.069 10.348 -1.036 1.00 0.00 C0 ATOM 384 C THR A 24 38.210 11.185 -1.598 1.00 0.00 C0 ATOM 385 O THR A 24 39.342 10.711 -1.709 1.00 0.00 O0 ATOM 386 CB THR A 24 36.132 9.929 -2.172 1.00 0.00 C0 ATOM 387 OG1 THR A 24 35.154 9.028 -1.670 1.00 0.00 O0 ATOM 388 CG2 THR A 24 36.932 9.254 -3.289 1.00 0.00 C0 ATOM 0 H THR A 24 35.325 11.188 -0.222 1.00 0.00 H new ATOM 0 HA THR A 24 37.481 9.458 -0.559 1.00 0.00 H new ATOM 0 HB THR A 24 35.639 10.813 -2.575 1.00 0.00 H new ATOM 0 HG1 THR A 24 34.589 9.490 -1.015 1.00 0.00 H new ATOM 0 HG21 THR A 24 36.257 8.959 -4.093 1.00 0.00 H new ATOM 0 HG22 THR A 24 37.675 9.951 -3.676 1.00 0.00 H new ATOM 0 HG23 THR A 24 37.434 8.371 -2.894 1.00 0.00 H new ATOM 396 N ILE A 25 37.908 12.433 -1.940 1.00 0.00 N0 ATOM 397 CA ILE A 25 38.930 13.324 -2.478 1.00 0.00 C0 ATOM 398 C ILE A 25 40.019 13.568 -1.435 1.00 0.00 C0 ATOM 399 O ILE A 25 41.205 13.601 -1.757 1.00 0.00 O0 ATOM 400 CB ILE A 25 38.296 14.654 -2.890 1.00 0.00 C0 ATOM 401 CG1 ILE A 25 37.377 14.422 -4.088 1.00 0.00 C0 ATOM 402 CG2 ILE A 25 39.390 15.652 -3.279 1.00 0.00 C0 ATOM 403 CD1 ILE A 25 36.515 15.662 -4.318 1.00 0.00 C0 ATOM 0 H ILE A 25 36.979 12.846 -1.856 1.00 0.00 H new ATOM 0 HA ILE A 25 39.380 12.856 -3.354 1.00 0.00 H new ATOM 0 HB ILE A 25 37.723 15.055 -2.054 1.00 0.00 H new ATOM 0 HG12 ILE A 25 37.969 14.208 -4.978 1.00 0.00 H new ATOM 0 HG13 ILE A 25 36.743 13.553 -3.910 1.00 0.00 H new ATOM 0 HG21 ILE A 25 38.933 16.597 -3.572 1.00 0.00 H new ATOM 0 HG22 ILE A 25 40.051 15.817 -2.428 1.00 0.00 H new ATOM 0 HG23 ILE A 25 39.966 15.254 -4.114 1.00 0.00 H new ATOM 0 HD11 ILE A 25 35.859 15.496 -5.173 1.00 0.00 H new ATOM 0 HD12 ILE A 25 35.912 15.856 -3.431 1.00 0.00 H new ATOM 0 HD13 ILE A 25 37.157 16.520 -4.515 1.00 0.00 H new ATOM 415 N GLY A 26 39.597 13.742 -0.187 1.00 0.00 N0 ATOM 416 CA GLY A 26 40.533 13.992 0.901 1.00 0.00 C0 ATOM 417 C GLY A 26 41.514 12.835 1.055 1.00 0.00 C0 ATOM 418 O GLY A 26 42.722 13.042 1.112 1.00 0.00 O0 ATOM 0 H GLY A 26 38.617 13.715 0.095 1.00 0.00 H new ATOM 0 HA2 GLY A 26 41.081 14.915 0.709 1.00 0.00 H new ATOM 0 HA3 GLY A 26 39.984 14.135 1.832 1.00 0.00 H new ATOM 422 N HIS A 27 40.986 11.620 1.111 1.00 0.00 N0 ATOM 423 CA HIS A 27 41.824 10.437 1.249 1.00 0.00 C0 ATOM 424 C HIS A 27 42.774 10.314 0.065 1.00 0.00 C0 ATOM 425 O HIS A 27 43.942 9.963 0.229 1.00 0.00 O0 ATOM 426 CB HIS A 27 40.953 9.186 1.349 1.00 0.00 C0 ATOM 427 CG HIS A 27 41.806 7.963 1.164 1.00 0.00 C0 ATOM 428 ND1 HIS A 27 42.770 7.581 2.084 1.00 0.00 N0 ATOM 429 CD2 HIS A 27 41.848 7.023 0.164 1.00 0.00 C0 ATOM 430 CE1 HIS A 27 43.348 6.456 1.622 1.00 0.00 C0 ATOM 431 NE2 HIS A 27 42.824 6.074 0.456 1.00 0.00 N0 ATOM 0 H HIS A 27 39.985 11.428 1.063 1.00 0.00 H new ATOM 0 HA HIS A 27 42.414 10.536 2.160 1.00 0.00 H new ATOM 0 HB2 HIS A 27 40.457 9.152 2.319 1.00 0.00 H new ATOM 0 HB3 HIS A 27 40.170 9.214 0.591 1.00 0.00 H new ATOM 0 HD2 HIS A 27 41.220 7.020 -0.715 1.00 0.00 H new ATOM 0 HE1 HIS A 27 44.139 5.927 2.133 1.00 0.00 H new ATOM 0 HE2 HIS A 27 43.083 5.261 -0.102 1.00 0.00 H new ATOM 439 N LEU A 28 42.267 10.604 -1.128 1.00 0.00 N0 ATOM 440 CA LEU A 28 43.085 10.521 -2.329 1.00 0.00 C0 ATOM 441 C LEU A 28 44.278 11.466 -2.230 1.00 0.00 C0 ATOM 442 O LEU A 28 45.409 11.084 -2.527 1.00 0.00 O0 ATOM 443 CB LEU A 28 42.241 10.880 -3.558 1.00 0.00 C0 ATOM 444 CG LEU A 28 43.109 10.849 -4.819 1.00 0.00 C0 ATOM 445 CD1 LEU A 28 43.655 9.435 -5.031 1.00 0.00 C0 ATOM 446 CD2 LEU A 28 42.263 11.257 -6.027 1.00 0.00 C0 ATOM 0 H LEU A 28 41.303 10.896 -1.287 1.00 0.00 H new ATOM 0 HA LEU A 28 43.455 9.501 -2.428 1.00 0.00 H new ATOM 0 HB2 LEU A 28 41.414 10.177 -3.659 1.00 0.00 H new ATOM 0 HB3 LEU A 28 41.804 11.871 -3.432 1.00 0.00 H new ATOM 0 HG LEU A 28 43.941 11.544 -4.705 1.00 0.00 H new ATOM 0 HD11 LEU A 28 44.273 9.414 -5.929 1.00 0.00 H new ATOM 0 HD12 LEU A 28 44.257 9.144 -4.170 1.00 0.00 H new ATOM 0 HD13 LEU A 28 42.825 8.738 -5.145 1.00 0.00 H new ATOM 0 HD21 LEU A 28 42.879 11.236 -6.926 1.00 0.00 H new ATOM 0 HD22 LEU A 28 41.431 10.562 -6.140 1.00 0.00 H new ATOM 0 HD23 LEU A 28 41.876 12.265 -5.876 1.00 0.00 H new ATOM 643 N GLN B 6 11.576 1.416 7.115 1.00 0.00 N0 ATOM 644 CA GLN B 6 12.306 0.192 6.806 1.00 0.00 C0 ATOM 645 C GLN B 6 13.356 0.434 5.732 1.00 0.00 C0 ATOM 646 O GLN B 6 14.499 -0.004 5.861 1.00 0.00 O0 ATOM 647 CB GLN B 6 11.337 -0.891 6.333 1.00 0.00 C0 ATOM 648 CG GLN B 6 12.125 -2.146 5.953 1.00 0.00 C0 ATOM 649 CD GLN B 6 11.295 -3.389 6.251 1.00 0.00 C0 ATOM 650 OE1 GLN B 6 10.167 -3.510 5.776 1.00 0.00 O0 ATOM 651 NE2 GLN B 6 11.788 -4.320 7.019 1.00 0.00 N0 ATOM 0 HA GLN B 6 12.809 -0.136 7.716 1.00 0.00 H new ATOM 0 HB2 GLN B 6 10.620 -1.123 7.121 1.00 0.00 H new ATOM 0 HB3 GLN B 6 10.765 -0.534 5.477 1.00 0.00 H new ATOM 0 HG2 GLN B 6 12.385 -2.116 4.895 1.00 0.00 H new ATOM 0 HG3 GLN B 6 13.061 -2.181 6.510 1.00 0.00 H new ATOM 0 HE21 GLN B 6 12.724 -4.215 7.411 1.00 0.00 H new ATOM 0 HE22 GLN B 6 11.238 -5.153 7.228 1.00 0.00 H new ATOM 660 N ILE B 7 12.964 1.126 4.672 1.00 0.00 N0 ATOM 661 CA ILE B 7 13.895 1.402 3.585 1.00 0.00 C0 ATOM 662 C ILE B 7 14.973 2.383 4.041 1.00 0.00 C0 ATOM 663 O ILE B 7 16.128 2.291 3.623 1.00 0.00 O0 ATOM 664 CB ILE B 7 13.140 1.969 2.372 1.00 0.00 C0 ATOM 665 CG1 ILE B 7 12.727 3.415 2.643 1.00 0.00 C0 ATOM 666 CG2 ILE B 7 11.883 1.135 2.123 1.00 0.00 C0 ATOM 667 CD1 ILE B 7 11.899 3.957 1.473 1.00 0.00 C0 ATOM 0 H ILE B 7 12.025 1.501 4.541 1.00 0.00 H new ATOM 0 HA ILE B 7 14.377 0.468 3.295 1.00 0.00 H new ATOM 0 HB ILE B 7 13.793 1.934 1.500 1.00 0.00 H new ATOM 0 HG12 ILE B 7 12.147 3.469 3.564 1.00 0.00 H new ATOM 0 HG13 ILE B 7 13.613 4.033 2.788 1.00 0.00 H new ATOM 0 HG21 ILE B 7 11.345 1.535 1.263 1.00 0.00 H new ATOM 0 HG22 ILE B 7 12.166 0.101 1.925 1.00 0.00 H new ATOM 0 HG23 ILE B 7 11.240 1.174 3.003 1.00 0.00 H new ATOM 0 HD11 ILE B 7 11.611 4.988 1.678 1.00 0.00 H new ATOM 0 HD12 ILE B 7 12.493 3.921 0.560 1.00 0.00 H new ATOM 0 HD13 ILE B 7 11.004 3.348 1.348 1.00 0.00 H new ATOM 679 N LEU B 8 14.589 3.323 4.900 1.00 0.00 N0 ATOM 680 CA LEU B 8 15.535 4.314 5.399 1.00 0.00 C0 ATOM 681 C LEU B 8 16.503 3.693 6.404 1.00 0.00 C0 ATOM 682 O LEU B 8 17.664 4.101 6.494 1.00 0.00 O0 ATOM 683 CB LEU B 8 14.769 5.461 6.064 1.00 0.00 C0 ATOM 684 CG LEU B 8 14.872 6.736 5.213 1.00 0.00 C0 ATOM 685 CD1 LEU B 8 16.329 7.214 5.159 1.00 0.00 C0 ATOM 686 CD2 LEU B 8 14.360 6.458 3.790 1.00 0.00 C0 ATOM 0 H LEU B 8 13.640 3.419 5.261 1.00 0.00 H new ATOM 0 HA LEU B 8 16.114 4.693 4.557 1.00 0.00 H new ATOM 0 HB2 LEU B 8 13.722 5.183 6.190 1.00 0.00 H new ATOM 0 HB3 LEU B 8 15.172 5.647 7.060 1.00 0.00 H new ATOM 0 HG LEU B 8 14.259 7.515 5.666 1.00 0.00 H new ATOM 0 HD11 LEU B 8 16.393 8.118 4.554 1.00 0.00 H new ATOM 0 HD12 LEU B 8 16.680 7.428 6.169 1.00 0.00 H new ATOM 0 HD13 LEU B 8 16.951 6.436 4.716 1.00 0.00 H new ATOM 0 HD21 LEU B 8 14.436 7.366 3.192 1.00 0.00 H new ATOM 0 HD22 LEU B 8 14.962 5.672 3.334 1.00 0.00 H new ATOM 0 HD23 LEU B 8 13.319 6.138 3.834 1.00 0.00 H new ATOM 698 N SER B 9 16.027 2.693 7.137 1.00 0.00 N0 ATOM 699 CA SER B 9 16.866 2.017 8.111 1.00 0.00 C0 ATOM 700 C SER B 9 17.844 1.075 7.417 1.00 0.00 C0 ATOM 701 O SER B 9 19.005 0.975 7.807 1.00 0.00 O0 ATOM 702 CB SER B 9 15.992 1.228 9.082 1.00 0.00 C0 ATOM 703 OG SER B 9 15.296 0.215 8.368 1.00 0.00 O0 ATOM 0 H SER B 9 15.073 2.337 7.074 1.00 0.00 H new ATOM 0 HA SER B 9 17.436 2.767 8.659 1.00 0.00 H new ATOM 0 HB2 SER B 9 16.607 0.781 9.863 1.00 0.00 H new ATOM 0 HB3 SER B 9 15.284 1.894 9.576 1.00 0.00 H new ATOM 0 HG SER B 9 15.092 0.533 7.464 1.00 0.00 H new ATOM 709 N ILE B 10 17.370 0.399 6.375 1.00 0.00 N0 ATOM 710 CA ILE B 10 18.215 -0.522 5.626 1.00 0.00 C0 ATOM 711 C ILE B 10 19.309 0.231 4.881 1.00 0.00 C0 ATOM 712 O ILE B 10 20.459 -0.210 4.837 1.00 0.00 O0 ATOM 713 CB ILE B 10 17.369 -1.322 4.631 1.00 0.00 C0 ATOM 714 CG1 ILE B 10 16.438 -2.266 5.398 1.00 0.00 C0 ATOM 715 CG2 ILE B 10 18.288 -2.146 3.724 1.00 0.00 C0 ATOM 716 CD1 ILE B 10 15.358 -2.799 4.454 1.00 0.00 C0 ATOM 0 H ILE B 10 16.412 0.471 6.033 1.00 0.00 H new ATOM 0 HA ILE B 10 18.684 -1.206 6.333 1.00 0.00 H new ATOM 0 HB ILE B 10 16.778 -0.636 4.025 1.00 0.00 H new ATOM 0 HG12 ILE B 10 17.009 -3.094 5.819 1.00 0.00 H new ATOM 0 HG13 ILE B 10 15.977 -1.739 6.234 1.00 0.00 H new ATOM 0 HG21 ILE B 10 17.685 -2.715 3.016 1.00 0.00 H new ATOM 0 HG22 ILE B 10 18.955 -1.478 3.178 1.00 0.00 H new ATOM 0 HG23 ILE B 10 18.879 -2.832 4.331 1.00 0.00 H new ATOM 0 HD11 ILE B 10 14.696 -3.471 5.001 1.00 0.00 H new ATOM 0 HD12 ILE B 10 14.780 -1.965 4.055 1.00 0.00 H new ATOM 0 HD13 ILE B 10 15.827 -3.341 3.633 1.00 0.00 H new ATOM 728 N CYS B 11 18.955 1.375 4.301 1.00 0.00 N0 ATOM 729 CA CYS B 11 19.927 2.172 3.562 1.00 0.00 C0 ATOM 730 C CYS B 11 20.997 2.732 4.495 1.00 0.00 C0 ATOM 731 O CYS B 11 22.193 2.571 4.245 1.00 0.00 O0 ATOM 732 CB CYS B 11 19.212 3.328 2.860 1.00 0.00 C0 ATOM 733 SG CYS B 11 20.360 4.147 1.728 1.00 0.00 S0 ATOM 0 H CYS B 11 18.014 1.766 4.328 1.00 0.00 H new ATOM 0 HA CYS B 11 20.410 1.529 2.826 1.00 0.00 H new ATOM 0 HB2 CYS B 11 18.347 2.955 2.311 1.00 0.00 H new ATOM 0 HB3 CYS B 11 18.840 4.040 3.596 1.00 0.00 H new ATOM 0 HG CYS B 11 19.822 5.244 1.283 1.00 0.00 H new ATOM 739 N SER B 12 20.566 3.396 5.566 1.00 0.00 N0 ATOM 740 CA SER B 12 21.510 3.976 6.513 1.00 0.00 C0 ATOM 741 C SER B 12 22.375 2.893 7.142 1.00 0.00 C0 ATOM 742 O SER B 12 23.569 3.094 7.366 1.00 0.00 O0 ATOM 743 CB SER B 12 20.755 4.732 7.607 1.00 0.00 C0 ATOM 744 OG SER B 12 20.153 5.890 7.048 1.00 0.00 O0 ATOM 0 H SER B 12 19.583 3.543 5.796 1.00 0.00 H new ATOM 0 HA SER B 12 22.156 4.669 5.973 1.00 0.00 H new ATOM 0 HB2 SER B 12 19.993 4.090 8.049 1.00 0.00 H new ATOM 0 HB3 SER B 12 21.438 5.014 8.408 1.00 0.00 H new ATOM 0 HG SER B 12 19.265 5.662 6.703 1.00 0.00 H new ATOM 750 N PHE B 13 21.768 1.747 7.427 1.00 0.00 N0 ATOM 751 CA PHE B 13 22.496 0.641 8.030 1.00 0.00 C0 ATOM 752 C PHE B 13 23.633 0.189 7.119 1.00 0.00 C0 ATOM 753 O PHE B 13 24.757 -0.019 7.573 1.00 0.00 O0 ATOM 754 CB PHE B 13 21.544 -0.529 8.280 1.00 0.00 C0 ATOM 755 CG PHE B 13 20.956 -0.417 9.666 1.00 0.00 C0 ATOM 756 CD1 PHE B 13 20.559 0.832 10.162 1.00 0.00 C0 ATOM 757 CD2 PHE B 13 20.807 -1.563 10.456 1.00 0.00 C0 ATOM 758 CE1 PHE B 13 20.014 0.933 11.448 1.00 0.00 C0 ATOM 759 CE2 PHE B 13 20.262 -1.460 11.742 1.00 0.00 C0 ATOM 760 CZ PHE B 13 19.866 -0.213 12.237 1.00 0.00 C0 ATOM 0 H PHE B 13 20.781 1.561 7.251 1.00 0.00 H new ATOM 0 HA PHE B 13 22.918 0.978 8.977 1.00 0.00 H new ATOM 0 HB2 PHE B 13 20.748 -0.529 7.535 1.00 0.00 H new ATOM 0 HB3 PHE B 13 22.078 -1.474 8.176 1.00 0.00 H new ATOM 0 HD1 PHE B 13 20.673 1.716 9.553 1.00 0.00 H new ATOM 0 HD2 PHE B 13 21.112 -2.526 10.074 1.00 0.00 H new ATOM 0 HE1 PHE B 13 19.708 1.895 11.831 1.00 0.00 H new ATOM 0 HE2 PHE B 13 20.147 -2.344 12.352 1.00 0.00 H new ATOM 0 HZ PHE B 13 19.446 -0.135 13.229 1.00 0.00 H new ATOM 770 N ILE B 14 23.338 0.058 5.829 1.00 0.00 N0 ATOM 771 CA ILE B 14 24.352 -0.354 4.866 1.00 0.00 C0 ATOM 772 C ILE B 14 25.490 0.658 4.821 1.00 0.00 C0 ATOM 773 O ILE B 14 26.663 0.287 4.806 1.00 0.00 O0 ATOM 774 CB ILE B 14 23.728 -0.491 3.479 1.00 0.00 C0 ATOM 775 CG1 ILE B 14 22.815 -1.719 3.454 1.00 0.00 C0 ATOM 776 CG2 ILE B 14 24.834 -0.648 2.433 1.00 0.00 C0 ATOM 777 CD1 ILE B 14 21.896 -1.652 2.234 1.00 0.00 C0 ATOM 0 H ILE B 14 22.415 0.229 5.430 1.00 0.00 H new ATOM 0 HA ILE B 14 24.754 -1.318 5.178 1.00 0.00 H new ATOM 0 HB ILE B 14 23.143 0.400 3.251 1.00 0.00 H new ATOM 0 HG12 ILE B 14 23.414 -2.629 3.421 1.00 0.00 H new ATOM 0 HG13 ILE B 14 22.221 -1.761 4.367 1.00 0.00 H new ATOM 0 HG21 ILE B 14 24.388 -0.746 1.443 1.00 0.00 H new ATOM 0 HG22 ILE B 14 25.482 0.228 2.454 1.00 0.00 H new ATOM 0 HG23 ILE B 14 25.422 -1.539 2.656 1.00 0.00 H new ATOM 0 HD11 ILE B 14 21.247 -2.528 2.219 1.00 0.00 H new ATOM 0 HD12 ILE B 14 21.287 -0.750 2.287 1.00 0.00 H new ATOM 0 HD13 ILE B 14 22.498 -1.631 1.326 1.00 0.00 H new ATOM 789 N LEU B 15 25.138 1.941 4.803 1.00 0.00 N0 ATOM 790 CA LEU B 15 26.151 2.991 4.762 1.00 0.00 C0 ATOM 791 C LEU B 15 27.037 2.929 6.002 1.00 0.00 C0 ATOM 792 O LEU B 15 28.252 2.804 5.897 1.00 0.00 O0 ATOM 793 CB LEU B 15 25.481 4.360 4.680 1.00 0.00 C0 ATOM 794 CG LEU B 15 25.239 4.720 3.216 1.00 0.00 C0 ATOM 795 CD1 LEU B 15 24.200 5.839 3.132 1.00 0.00 C0 ATOM 796 CD2 LEU B 15 26.551 5.196 2.589 1.00 0.00 C0 ATOM 0 H LEU B 15 24.174 2.275 4.816 1.00 0.00 H new ATOM 0 HA LEU B 15 26.771 2.837 3.878 1.00 0.00 H new ATOM 0 HB2 LEU B 15 24.536 4.348 5.224 1.00 0.00 H new ATOM 0 HB3 LEU B 15 26.111 5.114 5.152 1.00 0.00 H new ATOM 0 HG LEU B 15 24.874 3.844 2.680 1.00 0.00 H new ATOM 0 HD11 LEU B 15 24.027 6.097 2.087 1.00 0.00 H new ATOM 0 HD12 LEU B 15 23.266 5.503 3.583 1.00 0.00 H new ATOM 0 HD13 LEU B 15 24.566 6.716 3.666 1.00 0.00 H new ATOM 0 HD21 LEU B 15 26.382 5.454 1.544 1.00 0.00 H new ATOM 0 HD22 LEU B 15 26.913 6.073 3.125 1.00 0.00 H new ATOM 0 HD23 LEU B 15 27.294 4.400 2.651 1.00 0.00 H new ATOM 808 N SER B 16 26.423 3.046 7.171 1.00 0.00 N0 ATOM 809 CA SER B 16 27.175 3.024 8.420 1.00 0.00 C0 ATOM 810 C SER B 16 28.130 1.834 8.456 1.00 0.00 C0 ATOM 811 O SER B 16 29.259 1.949 8.939 1.00 0.00 O0 ATOM 812 CB SER B 16 26.208 2.933 9.602 1.00 0.00 C0 ATOM 813 OG SER B 16 25.345 4.061 9.586 1.00 0.00 O0 ATOM 0 H SER B 16 25.415 3.156 7.282 1.00 0.00 H new ATOM 0 HA SER B 16 27.757 3.943 8.487 1.00 0.00 H new ATOM 0 HB2 SER B 16 25.626 2.014 9.541 1.00 0.00 H new ATOM 0 HB3 SER B 16 26.763 2.898 10.540 1.00 0.00 H new ATOM 0 HG SER B 16 24.633 3.919 8.928 1.00 0.00 H new ATOM 819 N ALA B 17 27.672 0.699 7.936 1.00 0.00 N0 ATOM 820 CA ALA B 17 28.493 -0.503 7.906 1.00 0.00 C0 ATOM 821 C ALA B 17 29.731 -0.296 7.037 1.00 0.00 C0 ATOM 822 O ALA B 17 30.855 -0.582 7.458 1.00 0.00 O0 ATOM 823 CB ALA B 17 27.671 -1.670 7.352 1.00 0.00 C0 ATOM 0 H ALA B 17 26.742 0.588 7.532 1.00 0.00 H new ATOM 0 HA ALA B 17 28.817 -0.725 8.923 1.00 0.00 H new ATOM 0 HB1 ALA B 17 28.286 -2.570 7.330 1.00 0.00 H new ATOM 0 HB2 ALA B 17 26.803 -1.839 7.990 1.00 0.00 H new ATOM 0 HB3 ALA B 17 27.338 -1.433 6.342 1.00 0.00 H new ATOM 829 N LEU B 18 29.521 0.220 5.827 1.00 0.00 N0 ATOM 830 CA LEU B 18 30.627 0.468 4.907 1.00 0.00 C0 ATOM 831 C LEU B 18 31.523 1.585 5.428 1.00 0.00 C0 ATOM 832 O LEU B 18 32.704 1.660 5.077 1.00 0.00 O0 ATOM 833 CB LEU B 18 30.085 0.843 3.525 1.00 0.00 C0 ATOM 834 CG LEU B 18 30.058 -0.400 2.631 1.00 0.00 C0 ATOM 835 CD1 LEU B 18 28.954 -1.349 3.101 1.00 0.00 C0 ATOM 836 CD2 LEU B 18 29.786 0.018 1.183 1.00 0.00 C0 ATOM 0 H LEU B 18 28.602 0.472 5.464 1.00 0.00 H new ATOM 0 HA LEU B 18 31.218 -0.444 4.829 1.00 0.00 H new ATOM 0 HB2 LEU B 18 29.082 1.259 3.617 1.00 0.00 H new ATOM 0 HB3 LEU B 18 30.710 1.614 3.075 1.00 0.00 H new ATOM 0 HG LEU B 18 31.021 -0.907 2.690 1.00 0.00 H new ATOM 0 HD11 LEU B 18 28.937 -2.232 2.463 1.00 0.00 H new ATOM 0 HD12 LEU B 18 29.146 -1.649 4.131 1.00 0.00 H new ATOM 0 HD13 LEU B 18 27.990 -0.843 3.045 1.00 0.00 H new ATOM 0 HD21 LEU B 18 29.767 -0.867 0.546 1.00 0.00 H new ATOM 0 HD22 LEU B 18 28.824 0.527 1.126 1.00 0.00 H new ATOM 0 HD23 LEU B 18 30.574 0.691 0.845 1.00 0.00 H new ATOM 848 N HIS B 19 30.962 2.441 6.276 1.00 0.00 N0 ATOM 849 CA HIS B 19 31.722 3.545 6.849 1.00 0.00 C0 ATOM 850 C HIS B 19 32.774 3.012 7.806 1.00 0.00 C0 ATOM 851 O HIS B 19 33.968 3.132 7.552 1.00 0.00 O0 ATOM 852 CB HIS B 19 30.785 4.498 7.590 1.00 0.00 C0 ATOM 853 CG HIS B 19 31.598 5.511 8.348 1.00 0.00 C0 ATOM 854 ND1 HIS B 19 32.245 6.563 7.719 1.00 0.00 N0 ATOM 855 CD2 HIS B 19 31.879 5.644 9.684 1.00 0.00 C0 ATOM 856 CE1 HIS B 19 32.877 7.275 8.669 1.00 0.00 C0 ATOM 857 NE2 HIS B 19 32.687 6.757 9.886 1.00 0.00 N0 ATOM 0 H HIS B 19 29.990 2.392 6.580 1.00 0.00 H new ATOM 0 HA HIS B 19 32.216 4.087 6.042 1.00 0.00 H new ATOM 0 HB2 HIS B 19 30.126 5.001 6.882 1.00 0.00 H new ATOM 0 HB3 HIS B 19 30.149 3.939 8.276 1.00 0.00 H new ATOM 0 HD2 HIS B 19 31.526 4.983 10.462 1.00 0.00 H new ATOM 0 HE1 HIS B 19 33.467 8.158 8.472 1.00 0.00 H new ATOM 0 HE2 HIS B 19 33.055 7.103 10.772 1.00 0.00 H new ATOM 865 N PHE B 20 32.329 2.436 8.917 1.00 0.00 N0 ATOM 866 CA PHE B 20 33.263 1.904 9.897 1.00 0.00 C0 ATOM 867 C PHE B 20 34.208 0.905 9.245 1.00 0.00 C0 ATOM 868 O PHE B 20 35.344 0.745 9.676 1.00 0.00 O0 ATOM 869 CB PHE B 20 32.505 1.226 11.038 1.00 0.00 C0 ATOM 870 CG PHE B 20 32.600 2.072 12.289 1.00 0.00 C0 ATOM 871 CD1 PHE B 20 31.732 3.156 12.473 1.00 0.00 C0 ATOM 872 CD2 PHE B 20 33.551 1.762 13.268 1.00 0.00 C0 ATOM 873 CE1 PHE B 20 31.818 3.930 13.639 1.00 0.00 C0 ATOM 874 CE2 PHE B 20 33.636 2.537 14.432 1.00 0.00 C0 ATOM 875 CZ PHE B 20 32.770 3.621 14.619 1.00 0.00 C0 ATOM 0 H PHE B 20 31.344 2.327 9.158 1.00 0.00 H new ATOM 0 HA PHE B 20 33.847 2.733 10.298 1.00 0.00 H new ATOM 0 HB2 PHE B 20 31.460 1.086 10.761 1.00 0.00 H new ATOM 0 HB3 PHE B 20 32.920 0.236 11.225 1.00 0.00 H new ATOM 0 HD1 PHE B 20 30.998 3.395 11.718 1.00 0.00 H new ATOM 0 HD2 PHE B 20 34.219 0.925 13.126 1.00 0.00 H new ATOM 0 HE1 PHE B 20 31.149 4.766 13.782 1.00 0.00 H new ATOM 0 HE2 PHE B 20 34.371 2.298 15.186 1.00 0.00 H new ATOM 0 HZ PHE B 20 32.836 4.218 15.517 1.00 0.00 H new ATOM 885 N MET B 21 33.736 0.240 8.197 1.00 0.00 N0 ATOM 886 CA MET B 21 34.563 -0.730 7.496 1.00 0.00 C0 ATOM 887 C MET B 21 35.801 -0.064 6.901 1.00 0.00 C0 ATOM 888 O MET B 21 36.938 -0.384 7.278 1.00 0.00 O0 ATOM 889 CB MET B 21 33.749 -1.384 6.380 1.00 0.00 C0 ATOM 890 CG MET B 21 33.259 -2.755 6.849 1.00 0.00 C0 ATOM 891 SD MET B 21 34.658 -3.904 6.911 1.00 0.00 S0 ATOM 892 CE MET B 21 34.181 -4.764 8.431 1.00 0.00 C0 ATOM 0 H MET B 21 32.796 0.354 7.819 1.00 0.00 H new ATOM 0 HA MET B 21 34.888 -1.486 8.211 1.00 0.00 H new ATOM 0 HB2 MET B 21 32.901 -0.753 6.115 1.00 0.00 H new ATOM 0 HB3 MET B 21 34.359 -1.490 5.483 1.00 0.00 H new ATOM 0 HG2 MET B 21 32.798 -2.672 7.833 1.00 0.00 H new ATOM 0 HG3 MET B 21 32.494 -3.132 6.170 1.00 0.00 H new ATOM 0 HE1 MET B 21 34.920 -5.532 8.662 1.00 0.00 H new ATOM 0 HE2 MET B 21 34.131 -4.050 9.253 1.00 0.00 H new ATOM 0 HE3 MET B 21 33.205 -5.229 8.295 1.00 0.00 H new ATOM 902 N ALA B 22 35.581 0.861 5.969 1.00 0.00 N0 ATOM 903 CA ALA B 22 36.687 1.557 5.327 1.00 0.00 C0 ATOM 904 C ALA B 22 37.485 2.367 6.340 1.00 0.00 C0 ATOM 905 O ALA B 22 38.710 2.418 6.278 1.00 0.00 O0 ATOM 906 CB ALA B 22 36.153 2.486 4.239 1.00 0.00 C0 ATOM 0 H ALA B 22 34.655 1.142 5.646 1.00 0.00 H new ATOM 0 HA ALA B 22 37.346 0.811 4.883 1.00 0.00 H new ATOM 0 HB1 ALA B 22 36.985 3.004 3.762 1.00 0.00 H new ATOM 0 HB2 ALA B 22 35.614 1.901 3.493 1.00 0.00 H new ATOM 0 HB3 ALA B 22 35.478 3.217 4.684 1.00 0.00 H new ATOM 912 N TRP B 23 36.782 3.010 7.264 1.00 0.00 N0 ATOM 913 CA TRP B 23 37.437 3.826 8.277 1.00 0.00 C0 ATOM 914 C TRP B 23 38.400 2.978 9.096 1.00 0.00 C0 ATOM 915 O TRP B 23 39.550 3.357 9.300 1.00 0.00 O0 ATOM 916 CB TRP B 23 36.389 4.451 9.196 1.00 0.00 C0 ATOM 917 CG TRP B 23 36.813 5.835 9.565 1.00 0.00 C0 ATOM 918 CD1 TRP B 23 36.594 6.938 8.813 1.00 0.00 C0 ATOM 919 CD2 TRP B 23 37.520 6.287 10.757 1.00 0.00 C0 ATOM 920 NE1 TRP B 23 37.123 8.038 9.465 1.00 0.00 N0 ATOM 921 CE2 TRP B 23 37.704 7.687 10.668 1.00 0.00 C0 ATOM 922 CE3 TRP B 23 38.016 5.625 11.894 1.00 0.00 C0 ATOM 923 CZ2 TRP B 23 38.356 8.405 11.670 1.00 0.00 C0 ATOM 924 CZ3 TRP B 23 38.673 6.345 12.906 1.00 0.00 C0 ATOM 925 CH2 TRP B 23 38.842 7.733 12.794 1.00 0.00 C0 ATOM 0 H TRP B 23 35.765 2.983 7.333 1.00 0.00 H new ATOM 0 HA TRP B 23 37.999 4.617 7.781 1.00 0.00 H new ATOM 0 HB2 TRP B 23 35.421 4.477 8.696 1.00 0.00 H new ATOM 0 HB3 TRP B 23 36.269 3.844 10.094 1.00 0.00 H new ATOM 0 HD1 TRP B 23 36.088 6.957 7.859 1.00 0.00 H new ATOM 0 HE1 TRP B 23 37.088 8.991 9.102 1.00 0.00 H new ATOM 0 HE3 TRP B 23 37.891 4.557 11.990 1.00 0.00 H new ATOM 0 HZ2 TRP B 23 38.484 9.473 11.578 1.00 0.00 H new ATOM 0 HZ3 TRP B 23 39.050 5.827 13.775 1.00 0.00 H new ATOM 0 HH2 TRP B 23 39.347 8.281 13.576 1.00 0.00 H new ATOM 936 N THR B 24 37.922 1.834 9.566 1.00 0.00 N0 ATOM 937 CA THR B 24 38.749 0.941 10.365 1.00 0.00 C0 ATOM 938 C THR B 24 40.019 0.584 9.606 1.00 0.00 C0 ATOM 939 O THR B 24 41.118 0.630 10.160 1.00 0.00 O0 ATOM 940 CB THR B 24 37.972 -0.338 10.689 1.00 0.00 C0 ATOM 941 OG1 THR B 24 36.867 -0.021 11.526 1.00 0.00 O0 ATOM 942 CG2 THR B 24 38.886 -1.342 11.395 1.00 0.00 C0 ATOM 0 H THR B 24 36.970 1.504 9.409 1.00 0.00 H new ATOM 0 HA THR B 24 39.016 1.447 11.292 1.00 0.00 H new ATOM 0 HB THR B 24 37.610 -0.783 9.762 1.00 0.00 H new ATOM 0 HG1 THR B 24 36.055 0.051 10.982 1.00 0.00 H new ATOM 0 HG21 THR B 24 38.325 -2.248 11.621 1.00 0.00 H new ATOM 0 HG22 THR B 24 39.726 -1.588 10.746 1.00 0.00 H new ATOM 0 HG23 THR B 24 39.259 -0.905 12.321 1.00 0.00 H new ATOM 950 N ILE B 25 39.867 0.245 8.329 1.00 0.00 N0 ATOM 951 CA ILE B 25 41.019 -0.098 7.508 1.00 0.00 C0 ATOM 952 C ILE B 25 41.947 1.107 7.372 1.00 0.00 C0 ATOM 953 O ILE B 25 43.169 0.971 7.419 1.00 0.00 O0 ATOM 954 CB ILE B 25 40.552 -0.555 6.125 1.00 0.00 C0 ATOM 955 CG1 ILE B 25 39.812 -1.885 6.259 1.00 0.00 C0 ATOM 956 CG2 ILE B 25 41.760 -0.741 5.202 1.00 0.00 C0 ATOM 957 CD1 ILE B 25 39.086 -2.203 4.951 1.00 0.00 C0 ATOM 0 H ILE B 25 38.969 0.201 7.847 1.00 0.00 H new ATOM 0 HA ILE B 25 41.566 -0.910 7.988 1.00 0.00 H new ATOM 0 HB ILE B 25 39.889 0.199 5.702 1.00 0.00 H new ATOM 0 HG12 ILE B 25 40.516 -2.682 6.499 1.00 0.00 H new ATOM 0 HG13 ILE B 25 39.097 -1.834 7.080 1.00 0.00 H new ATOM 0 HG21 ILE B 25 41.420 -1.067 4.219 1.00 0.00 H new ATOM 0 HG22 ILE B 25 42.294 0.204 5.107 1.00 0.00 H new ATOM 0 HG23 ILE B 25 42.427 -1.494 5.623 1.00 0.00 H new ATOM 0 HD11 ILE B 25 38.559 -3.152 5.049 1.00 0.00 H new ATOM 0 HD12 ILE B 25 38.370 -1.411 4.731 1.00 0.00 H new ATOM 0 HD13 ILE B 25 39.811 -2.273 4.140 1.00 0.00 H new ATOM 969 N GLY B 26 41.351 2.281 7.193 1.00 0.00 N0 ATOM 970 CA GLY B 26 42.122 3.507 7.040 1.00 0.00 C0 ATOM 971 C GLY B 26 42.984 3.768 8.269 1.00 0.00 C0 ATOM 972 O GLY B 26 44.180 4.018 8.156 1.00 0.00 O0 ATOM 0 H GLY B 26 40.340 2.408 7.151 1.00 0.00 H new ATOM 0 HA2 GLY B 26 42.756 3.434 6.156 1.00 0.00 H new ATOM 0 HA3 GLY B 26 41.447 4.348 6.880 1.00 0.00 H new ATOM 976 N HIS B 27 42.369 3.700 9.442 1.00 0.00 N0 ATOM 977 CA HIS B 27 43.091 3.923 10.687 1.00 0.00 C0 ATOM 978 C HIS B 27 44.199 2.894 10.859 1.00 0.00 C0 ATOM 979 O HIS B 27 45.299 3.220 11.305 1.00 0.00 O0 ATOM 980 CB HIS B 27 42.126 3.848 11.873 1.00 0.00 C0 ATOM 981 CG HIS B 27 42.910 3.753 13.153 1.00 0.00 C0 ATOM 982 ND1 HIS B 27 43.690 4.797 13.625 1.00 0.00 N0 ATOM 983 CD2 HIS B 27 43.043 2.741 14.070 1.00 0.00 C0 ATOM 984 CE1 HIS B 27 44.254 4.390 14.779 1.00 0.00 C0 ATOM 985 NE2 HIS B 27 43.890 3.145 15.095 1.00 0.00 N0 ATOM 0 H HIS B 27 41.377 3.493 9.557 1.00 0.00 H new ATOM 0 HA HIS B 27 43.541 4.915 10.650 1.00 0.00 H new ATOM 0 HB2 HIS B 27 41.486 4.730 11.891 1.00 0.00 H new ATOM 0 HB3 HIS B 27 41.472 2.982 11.769 1.00 0.00 H new ATOM 0 HD2 HIS B 27 42.562 1.776 14.005 1.00 0.00 H new ATOM 0 HE1 HIS B 27 44.919 4.997 15.375 1.00 0.00 H new ATOM 0 HE2 HIS B 27 44.173 2.606 15.913 1.00 0.00 H new ATOM 993 N LEU B 28 43.905 1.651 10.499 1.00 0.00 N0 ATOM 994 CA LEU B 28 44.891 0.584 10.616 1.00 0.00 C0 ATOM 995 C LEU B 28 46.119 0.897 9.765 1.00 0.00 C0 ATOM 996 O LEU B 28 47.253 0.765 10.223 1.00 0.00 O0 ATOM 997 CB LEU B 28 44.276 -0.743 10.165 1.00 0.00 C0 ATOM 998 CG LEU B 28 45.324 -1.859 10.233 1.00 0.00 C0 ATOM 999 CD1 LEU B 28 45.793 -2.035 11.678 1.00 0.00 C0 ATOM 1000 CD2 LEU B 28 44.704 -3.168 9.735 1.00 0.00 C0 ATOM 0 H LEU B 28 43.001 1.358 10.127 1.00 0.00 H new ATOM 0 HA LEU B 28 45.197 0.506 11.659 1.00 0.00 H new ATOM 0 HB2 LEU B 28 43.426 -0.993 10.799 1.00 0.00 H new ATOM 0 HB3 LEU B 28 43.898 -0.650 9.147 1.00 0.00 H new ATOM 0 HG LEU B 28 46.176 -1.596 9.606 1.00 0.00 H new ATOM 0 HD11 LEU B 28 46.538 -2.829 11.724 1.00 0.00 H new ATOM 0 HD12 LEU B 28 46.233 -1.103 12.034 1.00 0.00 H new ATOM 0 HD13 LEU B 28 44.943 -2.298 12.307 1.00 0.00 H new ATOM 0 HD21 LEU B 28 45.447 -3.964 9.782 1.00 0.00 H new ATOM 0 HD22 LEU B 28 43.852 -3.429 10.363 1.00 0.00 H new ATOM 0 HD23 LEU B 28 44.370 -3.044 8.705 1.00 0.00 H new ATOM 1177 N PHE C 5 10.350 3.866 14.863 1.00 0.00 N0 ATOM 1178 CA PHE C 5 11.254 4.998 14.979 1.00 0.00 C0 ATOM 1179 C PHE C 5 12.036 4.920 16.288 1.00 0.00 C0 ATOM 1180 O PHE C 5 13.167 5.393 16.374 1.00 0.00 O0 ATOM 1181 CB PHE C 5 10.462 6.305 14.929 1.00 0.00 C0 ATOM 1182 CG PHE C 5 10.466 6.951 16.294 1.00 0.00 C0 ATOM 1183 CD1 PHE C 5 11.416 7.935 16.593 1.00 0.00 C0 ATOM 1184 CD2 PHE C 5 9.526 6.569 17.259 1.00 0.00 C0 ATOM 1185 CE1 PHE C 5 11.424 8.538 17.855 1.00 0.00 C0 ATOM 1186 CE2 PHE C 5 9.537 7.172 18.523 1.00 0.00 C0 ATOM 1187 CZ PHE C 5 10.486 8.156 18.820 1.00 0.00 C0 ATOM 0 HA PHE C 5 11.956 4.970 14.146 1.00 0.00 H new ATOM 0 HB2 PHE C 5 10.901 6.980 14.194 1.00 0.00 H new ATOM 0 HB3 PHE C 5 9.438 6.110 14.611 1.00 0.00 H new ATOM 0 HD1 PHE C 5 12.142 8.228 15.850 1.00 0.00 H new ATOM 0 HD2 PHE C 5 8.793 5.810 17.029 1.00 0.00 H new ATOM 0 HE1 PHE C 5 12.155 9.299 18.085 1.00 0.00 H new ATOM 0 HE2 PHE C 5 8.813 6.877 19.268 1.00 0.00 H new ATOM 0 HZ PHE C 5 10.494 8.621 19.795 1.00 0.00 H new ATOM 1197 N GLN C 6 11.422 4.316 17.302 1.00 0.00 N0 ATOM 1198 CA GLN C 6 12.066 4.182 18.603 1.00 0.00 C0 ATOM 1199 C GLN C 6 13.301 3.296 18.519 1.00 0.00 C0 ATOM 1200 O GLN C 6 14.358 3.636 19.050 1.00 0.00 O0 ATOM 1201 CB GLN C 6 11.086 3.592 19.616 1.00 0.00 C0 ATOM 1202 CG GLN C 6 11.794 3.401 20.959 1.00 0.00 C0 ATOM 1203 CD GLN C 6 10.805 3.600 22.100 1.00 0.00 C0 ATOM 1204 OE1 GLN C 6 9.765 2.944 22.142 1.00 0.00 O0 ATOM 1205 NE2 GLN C 6 11.066 4.476 23.030 1.00 0.00 N0 ATOM 0 H GLN C 6 10.486 3.915 17.248 1.00 0.00 H new ATOM 0 HA GLN C 6 12.374 5.176 18.926 1.00 0.00 H new ATOM 0 HB2 GLN C 6 10.228 4.254 19.736 1.00 0.00 H new ATOM 0 HB3 GLN C 6 10.704 2.637 19.255 1.00 0.00 H new ATOM 0 HG2 GLN C 6 12.228 2.402 21.012 1.00 0.00 H new ATOM 0 HG3 GLN C 6 12.616 4.111 21.051 1.00 0.00 H new ATOM 0 HE21 GLN C 6 11.929 5.018 22.992 1.00 0.00 H new ATOM 0 HE22 GLN C 6 10.407 4.619 23.795 1.00 0.00 H new ATOM 1214 N ILE C 7 13.161 2.156 17.857 1.00 0.00 N0 ATOM 1215 CA ILE C 7 14.284 1.234 17.729 1.00 0.00 C0 ATOM 1216 C ILE C 7 15.365 1.830 16.831 1.00 0.00 C0 ATOM 1217 O ILE C 7 16.559 1.619 17.054 1.00 0.00 O0 ATOM 1218 CB ILE C 7 13.802 -0.112 17.163 1.00 0.00 C0 ATOM 1219 CG1 ILE C 7 13.499 0.028 15.671 1.00 0.00 C0 ATOM 1220 CG2 ILE C 7 12.524 -0.538 17.887 1.00 0.00 C0 ATOM 1221 CD1 ILE C 7 12.935 -1.286 15.121 1.00 0.00 C0 ATOM 0 H ILE C 7 12.298 1.850 17.407 1.00 0.00 H new ATOM 0 HA ILE C 7 14.711 1.066 18.718 1.00 0.00 H new ATOM 0 HB ILE C 7 14.583 -0.858 17.309 1.00 0.00 H new ATOM 0 HG12 ILE C 7 12.783 0.835 15.512 1.00 0.00 H new ATOM 0 HG13 ILE C 7 14.407 0.297 15.131 1.00 0.00 H new ATOM 0 HG21 ILE C 7 12.180 -1.492 17.487 1.00 0.00 H new ATOM 0 HG22 ILE C 7 12.727 -0.643 18.953 1.00 0.00 H new ATOM 0 HG23 ILE C 7 11.752 0.217 17.738 1.00 0.00 H new ATOM 0 HD11 ILE C 7 12.723 -1.174 14.058 1.00 0.00 H new ATOM 0 HD12 ILE C 7 13.665 -2.083 15.264 1.00 0.00 H new ATOM 0 HD13 ILE C 7 12.015 -1.537 15.650 1.00 0.00 H new ATOM 1233 N LEU C 8 14.942 2.573 15.812 1.00 0.00 N0 ATOM 1234 CA LEU C 8 15.888 3.188 14.889 1.00 0.00 C0 ATOM 1235 C LEU C 8 16.606 4.364 15.540 1.00 0.00 C0 ATOM 1236 O LEU C 8 17.772 4.638 15.235 1.00 0.00 O0 ATOM 1237 CB LEU C 8 15.145 3.668 13.639 1.00 0.00 C0 ATOM 1238 CG LEU C 8 15.519 2.798 12.432 1.00 0.00 C0 ATOM 1239 CD1 LEU C 8 17.004 2.981 12.092 1.00 0.00 C0 ATOM 1240 CD2 LEU C 8 15.234 1.322 12.746 1.00 0.00 C0 ATOM 0 H LEU C 8 13.961 2.762 15.607 1.00 0.00 H new ATOM 0 HA LEU C 8 16.634 2.442 14.614 1.00 0.00 H new ATOM 0 HB2 LEU C 8 14.069 3.625 13.808 1.00 0.00 H new ATOM 0 HB3 LEU C 8 15.394 4.710 13.437 1.00 0.00 H new ATOM 0 HG LEU C 8 14.919 3.104 11.575 1.00 0.00 H new ATOM 0 HD11 LEU C 8 17.260 2.359 11.234 1.00 0.00 H new ATOM 0 HD12 LEU C 8 17.196 4.027 11.853 1.00 0.00 H new ATOM 0 HD13 LEU C 8 17.612 2.687 12.947 1.00 0.00 H new ATOM 0 HD21 LEU C 8 15.501 0.709 11.885 1.00 0.00 H new ATOM 0 HD22 LEU C 8 15.824 1.013 13.609 1.00 0.00 H new ATOM 0 HD23 LEU C 8 14.174 1.195 12.967 1.00 0.00 H new ATOM 1252 N SER C 9 15.920 5.041 16.449 1.00 0.00 N0 ATOM 1253 CA SER C 9 16.510 6.169 17.146 1.00 0.00 C0 ATOM 1254 C SER C 9 17.491 5.688 18.210 1.00 0.00 C0 ATOM 1255 O SER C 9 18.557 6.271 18.393 1.00 0.00 O0 ATOM 1256 CB SER C 9 15.411 6.998 17.795 1.00 0.00 C0 ATOM 1257 OG SER C 9 14.752 6.216 18.781 1.00 0.00 O0 ATOM 0 H SER C 9 14.959 4.829 16.719 1.00 0.00 H new ATOM 0 HA SER C 9 17.053 6.782 16.426 1.00 0.00 H new ATOM 0 HB2 SER C 9 15.835 7.894 18.249 1.00 0.00 H new ATOM 0 HB3 SER C 9 14.697 7.330 17.041 1.00 0.00 H new ATOM 0 HG SER C 9 14.796 5.269 18.531 1.00 0.00 H new ATOM 1263 N ILE C 10 17.129 4.610 18.897 1.00 0.00 N0 ATOM 1264 CA ILE C 10 17.987 4.054 19.934 1.00 0.00 C0 ATOM 1265 C ILE C 10 19.263 3.480 19.326 1.00 0.00 C0 ATOM 1266 O ILE C 10 20.354 3.649 19.874 1.00 0.00 O0 ATOM 1267 CB ILE C 10 17.243 2.960 20.704 1.00 0.00 C0 ATOM 1268 CG1 ILE C 10 16.105 3.593 21.512 1.00 0.00 C0 ATOM 1269 CG2 ILE C 10 18.210 2.257 21.658 1.00 0.00 C0 ATOM 1270 CD1 ILE C 10 15.148 2.502 21.995 1.00 0.00 C0 ATOM 0 H ILE C 10 16.253 4.107 18.755 1.00 0.00 H new ATOM 0 HA ILE C 10 18.257 4.856 20.621 1.00 0.00 H new ATOM 0 HB ILE C 10 16.835 2.234 20.000 1.00 0.00 H new ATOM 0 HG12 ILE C 10 16.511 4.138 22.364 1.00 0.00 H new ATOM 0 HG13 ILE C 10 15.568 4.316 20.898 1.00 0.00 H new ATOM 0 HG21 ILE C 10 17.679 1.478 22.206 1.00 0.00 H new ATOM 0 HG22 ILE C 10 19.023 1.809 21.087 1.00 0.00 H new ATOM 0 HG23 ILE C 10 18.618 2.982 22.362 1.00 0.00 H new ATOM 0 HD11 ILE C 10 14.340 2.955 22.569 1.00 0.00 H new ATOM 0 HD12 ILE C 10 14.732 1.976 21.136 1.00 0.00 H new ATOM 0 HD13 ILE C 10 15.689 1.796 22.625 1.00 0.00 H new ATOM 1282 N CYS C 11 19.125 2.802 18.190 1.00 0.00 N0 ATOM 1283 CA CYS C 11 20.280 2.209 17.526 1.00 0.00 C0 ATOM 1284 C CYS C 11 21.232 3.287 17.019 1.00 0.00 C0 ATOM 1285 O CYS C 11 22.432 3.249 17.301 1.00 0.00 O0 ATOM 1286 CB CYS C 11 19.812 1.351 16.350 1.00 0.00 C0 ATOM 1287 SG CYS C 11 21.208 0.397 15.707 1.00 0.00 S0 ATOM 0 H CYS C 11 18.235 2.651 17.715 1.00 0.00 H new ATOM 0 HA CYS C 11 20.811 1.590 18.250 1.00 0.00 H new ATOM 0 HB2 CYS C 11 19.015 0.679 16.670 1.00 0.00 H new ATOM 0 HB3 CYS C 11 19.399 1.985 15.565 1.00 0.00 H new ATOM 0 HG CYS C 11 20.970 0.056 14.475 1.00 0.00 H new ATOM 1293 N SER C 12 20.699 4.243 16.262 1.00 0.00 N0 ATOM 1294 CA SER C 12 21.523 5.316 15.719 1.00 0.00 C0 ATOM 1295 C SER C 12 22.161 6.123 16.842 1.00 0.00 C0 ATOM 1296 O SER C 12 23.315 6.538 16.741 1.00 0.00 O0 ATOM 1297 CB SER C 12 20.680 6.235 14.838 1.00 0.00 C0 ATOM 1298 OG SER C 12 20.299 5.535 13.661 1.00 0.00 O0 ATOM 0 H SER C 12 19.711 4.296 16.014 1.00 0.00 H new ATOM 0 HA SER C 12 22.313 4.868 15.116 1.00 0.00 H new ATOM 0 HB2 SER C 12 19.795 6.567 15.381 1.00 0.00 H new ATOM 0 HB3 SER C 12 21.247 7.128 14.577 1.00 0.00 H new ATOM 0 HG SER C 12 19.445 5.079 13.814 1.00 0.00 H new ATOM 1304 N PHE C 13 21.401 6.344 17.910 1.00 0.00 N0 ATOM 1305 CA PHE C 13 21.904 7.107 19.043 1.00 0.00 C0 ATOM 1306 C PHE C 13 23.126 6.422 19.645 1.00 0.00 C0 ATOM 1307 O PHE C 13 24.133 7.069 19.932 1.00 0.00 O0 ATOM 1308 CB PHE C 13 20.810 7.234 20.104 1.00 0.00 C0 ATOM 1309 CG PHE C 13 20.015 8.495 19.861 1.00 0.00 C0 ATOM 1310 CD1 PHE C 13 19.670 8.867 18.556 1.00 0.00 C0 ATOM 1311 CD2 PHE C 13 19.622 9.291 20.943 1.00 0.00 C0 ATOM 1312 CE1 PHE C 13 18.932 10.036 18.333 1.00 0.00 C0 ATOM 1313 CE2 PHE C 13 18.883 10.459 20.721 1.00 0.00 C0 ATOM 1314 CZ PHE C 13 18.539 10.833 19.416 1.00 0.00 C0 ATOM 0 H PHE C 13 20.443 6.008 18.013 1.00 0.00 H new ATOM 0 HA PHE C 13 22.193 8.099 18.697 1.00 0.00 H new ATOM 0 HB2 PHE C 13 20.153 6.365 20.070 1.00 0.00 H new ATOM 0 HB3 PHE C 13 21.255 7.258 21.099 1.00 0.00 H new ATOM 0 HD1 PHE C 13 19.973 8.252 17.721 1.00 0.00 H new ATOM 0 HD2 PHE C 13 19.889 9.004 21.949 1.00 0.00 H new ATOM 0 HE1 PHE C 13 18.666 10.323 17.326 1.00 0.00 H new ATOM 0 HE2 PHE C 13 18.578 11.072 21.556 1.00 0.00 H new ATOM 0 HZ PHE C 13 17.971 11.735 19.245 1.00 0.00 H new ATOM 1324 N ILE C 14 23.036 5.106 19.822 1.00 0.00 N0 ATOM 1325 CA ILE C 14 24.150 4.346 20.379 1.00 0.00 C0 ATOM 1326 C ILE C 14 25.377 4.456 19.481 1.00 0.00 C0 ATOM 1327 O ILE C 14 26.493 4.651 19.962 1.00 0.00 O0 ATOM 1328 CB ILE C 14 23.753 2.879 20.535 1.00 0.00 C0 ATOM 1329 CG1 ILE C 14 22.738 2.746 21.672 1.00 0.00 C0 ATOM 1330 CG2 ILE C 14 24.994 2.044 20.853 1.00 0.00 C0 ATOM 1331 CD1 ILE C 14 22.045 1.386 21.585 1.00 0.00 C0 ATOM 0 H ILE C 14 22.213 4.550 19.591 1.00 0.00 H new ATOM 0 HA ILE C 14 24.396 4.759 21.357 1.00 0.00 H new ATOM 0 HB ILE C 14 23.307 2.521 19.607 1.00 0.00 H new ATOM 0 HG12 ILE C 14 23.239 2.849 22.634 1.00 0.00 H new ATOM 0 HG13 ILE C 14 22.000 3.546 21.610 1.00 0.00 H new ATOM 0 HG21 ILE C 14 24.710 0.998 20.964 1.00 0.00 H new ATOM 0 HG22 ILE C 14 25.715 2.140 20.041 1.00 0.00 H new ATOM 0 HG23 ILE C 14 25.443 2.398 21.781 1.00 0.00 H new ATOM 0 HD11 ILE C 14 21.322 1.293 22.396 1.00 0.00 H new ATOM 0 HD12 ILE C 14 21.530 1.301 20.628 1.00 0.00 H new ATOM 0 HD13 ILE C 14 22.788 0.593 21.669 1.00 0.00 H new ATOM 1343 N LEU C 15 25.164 4.331 18.175 1.00 0.00 N0 ATOM 1344 CA LEU C 15 26.269 4.423 17.228 1.00 0.00 C0 ATOM 1345 C LEU C 15 26.927 5.796 17.301 1.00 0.00 C0 ATOM 1346 O LEU C 15 28.124 5.905 17.537 1.00 0.00 O0 ATOM 1347 CB LEU C 15 25.764 4.172 15.809 1.00 0.00 C0 ATOM 1348 CG LEU C 15 25.806 2.675 15.511 1.00 0.00 C0 ATOM 1349 CD1 LEU C 15 24.916 2.371 14.307 1.00 0.00 C0 ATOM 1350 CD2 LEU C 15 27.247 2.263 15.196 1.00 0.00 C0 ATOM 0 H LEU C 15 24.250 4.168 17.753 1.00 0.00 H new ATOM 0 HA LEU C 15 27.008 3.665 17.489 1.00 0.00 H new ATOM 0 HB2 LEU C 15 24.746 4.546 15.702 1.00 0.00 H new ATOM 0 HB3 LEU C 15 26.380 4.714 15.091 1.00 0.00 H new ATOM 0 HG LEU C 15 25.447 2.119 16.377 1.00 0.00 H new ATOM 0 HD11 LEU C 15 24.945 1.303 14.093 1.00 0.00 H new ATOM 0 HD12 LEU C 15 23.891 2.669 14.528 1.00 0.00 H new ATOM 0 HD13 LEU C 15 25.276 2.924 13.440 1.00 0.00 H new ATOM 0 HD21 LEU C 15 27.282 1.195 14.983 1.00 0.00 H new ATOM 0 HD22 LEU C 15 27.603 2.818 14.328 1.00 0.00 H new ATOM 0 HD23 LEU C 15 27.884 2.483 16.053 1.00 0.00 H new ATOM 1362 N SER C 16 26.141 6.838 17.069 1.00 0.00 N0 ATOM 1363 CA SER C 16 26.668 8.197 17.091 1.00 0.00 C0 ATOM 1364 C SER C 16 27.480 8.439 18.360 1.00 0.00 C0 ATOM 1365 O SER C 16 28.521 9.103 18.323 1.00 0.00 O0 ATOM 1366 CB SER C 16 25.516 9.199 17.025 1.00 0.00 C0 ATOM 1367 OG SER C 16 24.787 8.995 15.823 1.00 0.00 O0 ATOM 0 H SER C 16 25.144 6.771 16.865 1.00 0.00 H new ATOM 0 HA SER C 16 27.319 8.329 16.227 1.00 0.00 H new ATOM 0 HB2 SER C 16 24.861 9.075 17.887 1.00 0.00 H new ATOM 0 HB3 SER C 16 25.902 10.218 17.062 1.00 0.00 H new ATOM 0 HG SER C 16 24.183 8.231 15.932 1.00 0.00 H new ATOM 1373 N ALA C 17 27.000 7.897 19.475 1.00 0.00 N0 ATOM 1374 CA ALA C 17 27.691 8.052 20.748 1.00 0.00 C0 ATOM 1375 C ALA C 17 29.071 7.400 20.704 1.00 0.00 C0 ATOM 1376 O ALA C 17 30.075 8.019 21.068 1.00 0.00 O0 ATOM 1377 CB ALA C 17 26.858 7.412 21.862 1.00 0.00 C0 ATOM 0 H ALA C 17 26.140 7.350 19.522 1.00 0.00 H new ATOM 0 HA ALA C 17 27.819 9.117 20.944 1.00 0.00 H new ATOM 0 HB1 ALA C 17 27.375 7.528 22.815 1.00 0.00 H new ATOM 0 HB2 ALA C 17 25.885 7.900 21.915 1.00 0.00 H new ATOM 0 HB3 ALA C 17 26.721 6.352 21.650 1.00 0.00 H new ATOM 1383 N LEU C 18 29.115 6.152 20.242 1.00 0.00 N0 ATOM 1384 CA LEU C 18 30.377 5.425 20.149 1.00 0.00 C0 ATOM 1385 C LEU C 18 31.284 6.049 19.092 1.00 0.00 C0 ATOM 1386 O LEU C 18 32.508 5.901 19.147 1.00 0.00 O0 ATOM 1387 CB LEU C 18 30.112 3.957 19.801 1.00 0.00 C0 ATOM 1388 CG LEU C 18 30.111 3.121 21.082 1.00 0.00 C0 ATOM 1389 CD1 LEU C 18 28.855 3.432 21.897 1.00 0.00 C0 ATOM 1390 CD2 LEU C 18 30.127 1.634 20.720 1.00 0.00 C0 ATOM 0 H LEU C 18 28.298 5.628 19.929 1.00 0.00 H new ATOM 0 HA LEU C 18 30.878 5.483 21.115 1.00 0.00 H new ATOM 0 HB2 LEU C 18 29.154 3.861 19.290 1.00 0.00 H new ATOM 0 HB3 LEU C 18 30.877 3.591 19.116 1.00 0.00 H new ATOM 0 HG LEU C 18 30.995 3.363 21.672 1.00 0.00 H new ATOM 0 HD11 LEU C 18 28.856 2.835 22.809 1.00 0.00 H new ATOM 0 HD12 LEU C 18 28.842 4.491 22.156 1.00 0.00 H new ATOM 0 HD13 LEU C 18 27.970 3.192 21.308 1.00 0.00 H new ATOM 0 HD21 LEU C 18 30.126 1.037 21.632 1.00 0.00 H new ATOM 0 HD22 LEU C 18 29.243 1.394 20.129 1.00 0.00 H new ATOM 0 HD23 LEU C 18 31.023 1.410 20.141 1.00 0.00 H new ATOM 1402 N HIS C 19 30.680 6.756 18.141 1.00 0.00 N0 ATOM 1403 CA HIS C 19 31.443 7.407 17.086 1.00 0.00 C0 ATOM 1404 C HIS C 19 32.262 8.550 17.659 1.00 0.00 C0 ATOM 1405 O HIS C 19 33.488 8.503 17.655 1.00 0.00 O0 ATOM 1406 CB HIS C 19 30.499 7.936 16.007 1.00 0.00 C0 ATOM 1407 CG HIS C 19 31.273 8.783 15.035 1.00 0.00 C0 ATOM 1408 ND1 HIS C 19 32.121 8.234 14.085 1.00 0.00 N0 ATOM 1409 CD2 HIS C 19 31.338 10.142 14.856 1.00 0.00 C0 ATOM 1410 CE1 HIS C 19 32.654 9.252 13.383 1.00 0.00 C0 ATOM 1411 NE2 HIS C 19 32.210 10.436 13.813 1.00 0.00 N0 ATOM 0 H HIS C 19 29.671 6.891 18.081 1.00 0.00 H new ATOM 0 HA HIS C 19 32.119 6.676 16.642 1.00 0.00 H new ATOM 0 HB2 HIS C 19 30.025 7.105 15.484 1.00 0.00 H new ATOM 0 HB3 HIS C 19 29.701 8.523 16.462 1.00 0.00 H new ATOM 0 HD2 HIS C 19 30.795 10.872 15.437 1.00 0.00 H new ATOM 0 HE1 HIS C 19 33.355 9.126 12.571 1.00 0.00 H new ATOM 0 HE2 HIS C 19 32.457 11.358 13.454 1.00 0.00 H new ATOM 1419 N PHE C 20 31.584 9.587 18.134 1.00 0.00 N0 ATOM 1420 CA PHE C 20 32.284 10.732 18.695 1.00 0.00 C0 ATOM 1421 C PHE C 20 33.220 10.287 19.808 1.00 0.00 C0 ATOM 1422 O PHE C 20 34.248 10.911 20.047 1.00 0.00 O0 ATOM 1423 CB PHE C 20 31.282 11.753 19.235 1.00 0.00 C0 ATOM 1424 CG PHE C 20 31.253 12.966 18.332 1.00 0.00 C0 ATOM 1425 CD1 PHE C 20 30.484 12.955 17.161 1.00 0.00 C0 ATOM 1426 CD2 PHE C 20 31.994 14.106 18.672 1.00 0.00 C0 ATOM 1427 CE1 PHE C 20 30.457 14.085 16.331 1.00 0.00 C0 ATOM 1428 CE2 PHE C 20 31.968 15.232 17.840 1.00 0.00 C0 ATOM 1429 CZ PHE C 20 31.200 15.224 16.671 1.00 0.00 C0 ATOM 0 H PHE C 20 30.567 9.658 18.142 1.00 0.00 H new ATOM 0 HA PHE C 20 32.873 11.198 17.905 1.00 0.00 H new ATOM 0 HB2 PHE C 20 30.289 11.307 19.293 1.00 0.00 H new ATOM 0 HB3 PHE C 20 31.558 12.048 20.247 1.00 0.00 H new ATOM 0 HD1 PHE C 20 29.913 12.077 16.898 1.00 0.00 H new ATOM 0 HD2 PHE C 20 32.585 14.116 19.576 1.00 0.00 H new ATOM 0 HE1 PHE C 20 29.863 14.078 15.429 1.00 0.00 H new ATOM 0 HE2 PHE C 20 32.542 16.109 18.101 1.00 0.00 H new ATOM 0 HZ PHE C 20 31.179 16.094 16.031 1.00 0.00 H new ATOM 1439 N MET C 21 32.861 9.202 20.484 1.00 0.00 N0 ATOM 1440 CA MET C 21 33.691 8.689 21.563 1.00 0.00 C0 ATOM 1441 C MET C 21 35.073 8.289 21.049 1.00 0.00 C0 ATOM 1442 O MET C 21 36.093 8.863 21.452 1.00 0.00 O0 ATOM 1443 CB MET C 21 33.012 7.476 22.193 1.00 0.00 C0 ATOM 1444 CG MET C 21 32.313 7.906 23.485 1.00 0.00 C0 ATOM 1445 SD MET C 21 33.557 8.253 24.756 1.00 0.00 S0 ATOM 1446 CE MET C 21 32.748 9.700 25.486 1.00 0.00 C0 ATOM 0 H MET C 21 32.011 8.667 20.306 1.00 0.00 H new ATOM 0 HA MET C 21 33.815 9.476 22.307 1.00 0.00 H new ATOM 0 HB2 MET C 21 32.289 7.048 21.499 1.00 0.00 H new ATOM 0 HB3 MET C 21 33.749 6.701 22.404 1.00 0.00 H new ATOM 0 HG2 MET C 21 31.705 8.792 23.305 1.00 0.00 H new ATOM 0 HG3 MET C 21 31.639 7.120 23.825 1.00 0.00 H new ATOM 0 HE1 MET C 21 33.357 10.082 26.306 1.00 0.00 H new ATOM 0 HE2 MET C 21 32.633 10.474 24.727 1.00 0.00 H new ATOM 0 HE3 MET C 21 31.766 9.415 25.865 1.00 0.00 H new ATOM 1456 N ALA C 22 35.103 7.301 20.160 1.00 0.00 N0 ATOM 1457 CA ALA C 22 36.365 6.828 19.606 1.00 0.00 C0 ATOM 1458 C ALA C 22 37.063 7.932 18.818 1.00 0.00 C0 ATOM 1459 O ALA C 22 38.280 8.076 18.886 1.00 0.00 O0 ATOM 1460 CB ALA C 22 36.116 5.631 18.692 1.00 0.00 C0 ATOM 0 H ALA C 22 34.276 6.817 19.811 1.00 0.00 H new ATOM 0 HA ALA C 22 37.009 6.531 20.434 1.00 0.00 H new ATOM 0 HB1 ALA C 22 37.064 5.283 18.282 1.00 0.00 H new ATOM 0 HB2 ALA C 22 35.651 4.827 19.263 1.00 0.00 H new ATOM 0 HB3 ALA C 22 35.455 5.927 17.877 1.00 0.00 H new ATOM 1466 N TRP C 23 36.283 8.699 18.065 1.00 0.00 N0 ATOM 1467 CA TRP C 23 36.841 9.777 17.258 1.00 0.00 C0 ATOM 1468 C TRP C 23 37.565 10.779 18.147 1.00 0.00 C0 ATOM 1469 O TRP C 23 38.698 11.162 17.867 1.00 0.00 O0 ATOM 1470 CB TRP C 23 35.725 10.480 16.489 1.00 0.00 C0 ATOM 1471 CG TRP C 23 36.223 10.862 15.132 1.00 0.00 C0 ATOM 1472 CD1 TRP C 23 36.243 10.042 14.057 1.00 0.00 C0 ATOM 1473 CD2 TRP C 23 36.765 12.137 14.684 1.00 0.00 C0 ATOM 1474 NE1 TRP C 23 36.764 10.730 12.978 1.00 0.00 N0 ATOM 1475 CE2 TRP C 23 37.100 12.026 13.314 1.00 0.00 C0 ATOM 1476 CE3 TRP C 23 36.996 13.368 15.325 1.00 0.00 C0 ATOM 1477 CZ2 TRP C 23 37.647 13.098 12.605 1.00 0.00 C0 ATOM 1478 CZ3 TRP C 23 37.546 14.448 14.617 1.00 0.00 C0 ATOM 1479 CH2 TRP C 23 37.871 14.312 13.259 1.00 0.00 C0 ATOM 0 H TRP C 23 35.271 8.596 17.996 1.00 0.00 H new ATOM 0 HA TRP C 23 37.554 9.354 16.550 1.00 0.00 H new ATOM 0 HB2 TRP C 23 34.860 9.823 16.400 1.00 0.00 H new ATOM 0 HB3 TRP C 23 35.397 11.367 17.031 1.00 0.00 H new ATOM 0 HD1 TRP C 23 35.906 9.016 14.044 1.00 0.00 H new ATOM 0 HE1 TRP C 23 36.885 10.330 12.048 1.00 0.00 H new ATOM 0 HE3 TRP C 23 36.748 13.483 16.370 1.00 0.00 H new ATOM 0 HZ2 TRP C 23 37.895 12.989 11.559 1.00 0.00 H new ATOM 0 HZ3 TRP C 23 37.720 15.388 15.120 1.00 0.00 H new ATOM 0 HH2 TRP C 23 38.294 15.146 12.719 1.00 0.00 H new ATOM 1490 N THR C 24 36.901 11.204 19.215 1.00 0.00 N0 ATOM 1491 CA THR C 24 37.490 12.168 20.137 1.00 0.00 C0 ATOM 1492 C THR C 24 38.826 11.648 20.650 1.00 0.00 C0 ATOM 1493 O THR C 24 39.816 12.380 20.676 1.00 0.00 O0 ATOM 1494 CB THR C 24 36.544 12.400 21.317 1.00 0.00 C0 ATOM 1495 OG1 THR C 24 35.354 13.025 20.853 1.00 0.00 O0 ATOM 1496 CG2 THR C 24 37.220 13.292 22.362 1.00 0.00 C0 ATOM 0 H THR C 24 35.960 10.899 19.463 1.00 0.00 H new ATOM 0 HA THR C 24 37.650 13.109 19.611 1.00 0.00 H new ATOM 0 HB THR C 24 36.299 11.441 21.774 1.00 0.00 H new ATOM 0 HG1 THR C 24 34.848 12.395 20.299 1.00 0.00 H new ATOM 0 HG21 THR C 24 36.540 13.452 23.198 1.00 0.00 H new ATOM 0 HG22 THR C 24 38.128 12.808 22.721 1.00 0.00 H new ATOM 0 HG23 THR C 24 37.474 14.252 21.912 1.00 0.00 H new ATOM 1504 N ILE C 25 38.853 10.379 21.044 1.00 0.00 N0 ATOM 1505 CA ILE C 25 40.085 9.779 21.539 1.00 0.00 C0 ATOM 1506 C ILE C 25 41.141 9.755 20.436 1.00 0.00 C0 ATOM 1507 O ILE C 25 42.317 10.016 20.682 1.00 0.00 O0 ATOM 1508 CB ILE C 25 39.809 8.355 22.025 1.00 0.00 C0 ATOM 1509 CG1 ILE C 25 38.927 8.414 23.272 1.00 0.00 C0 ATOM 1510 CG2 ILE C 25 41.127 7.659 22.373 1.00 0.00 C0 ATOM 1511 CD1 ILE C 25 38.398 7.015 23.591 1.00 0.00 C0 ATOM 0 H ILE C 25 38.047 9.754 21.031 1.00 0.00 H new ATOM 0 HA ILE C 25 40.459 10.376 22.371 1.00 0.00 H new ATOM 0 HB ILE C 25 39.304 7.796 21.237 1.00 0.00 H new ATOM 0 HG12 ILE C 25 39.499 8.799 24.116 1.00 0.00 H new ATOM 0 HG13 ILE C 25 38.096 9.100 23.110 1.00 0.00 H new ATOM 0 HG21 ILE C 25 40.923 6.645 22.718 1.00 0.00 H new ATOM 0 HG22 ILE C 25 41.762 7.620 21.488 1.00 0.00 H new ATOM 0 HG23 ILE C 25 41.635 8.215 23.161 1.00 0.00 H new ATOM 0 HD11 ILE C 25 37.769 7.058 24.480 1.00 0.00 H new ATOM 0 HD12 ILE C 25 37.811 6.647 22.749 1.00 0.00 H new ATOM 0 HD13 ILE C 25 39.236 6.342 23.771 1.00 0.00 H new ATOM 1523 N GLY C 26 40.704 9.434 19.223 1.00 0.00 N0 ATOM 1524 CA GLY C 26 41.608 9.366 18.085 1.00 0.00 C0 ATOM 1525 C GLY C 26 42.277 10.715 17.835 1.00 0.00 C0 ATOM 1526 O GLY C 26 43.495 10.797 17.705 1.00 0.00 O0 ATOM 0 H GLY C 26 39.731 9.218 19.005 1.00 0.00 H new ATOM 0 HA2 GLY C 26 42.369 8.607 18.266 1.00 0.00 H new ATOM 0 HA3 GLY C 26 41.057 9.059 17.196 1.00 0.00 H new ATOM 1530 N HIS C 27 41.475 11.767 17.782 1.00 0.00 N0 ATOM 1531 CA HIS C 27 41.997 13.108 17.558 1.00 0.00 C0 ATOM 1532 C HIS C 27 42.953 13.506 18.676 1.00 0.00 C0 ATOM 1533 O HIS C 27 43.990 14.118 18.431 1.00 0.00 O0 ATOM 1534 CB HIS C 27 40.848 14.113 17.478 1.00 0.00 C0 ATOM 1535 CG HIS C 27 41.395 15.511 17.574 1.00 0.00 C0 ATOM 1536 ND1 HIS C 27 42.189 16.069 16.585 1.00 0.00 N0 ATOM 1537 CD2 HIS C 27 41.268 16.475 18.544 1.00 0.00 C0 ATOM 1538 CE1 HIS C 27 42.508 17.316 16.978 1.00 0.00 C0 ATOM 1539 NE2 HIS C 27 41.972 17.615 18.165 1.00 0.00 N0 ATOM 0 H HIS C 27 40.462 11.720 17.891 1.00 0.00 H new ATOM 0 HA HIS C 27 42.543 13.110 16.614 1.00 0.00 H new ATOM 0 HB2 HIS C 27 40.306 13.987 16.541 1.00 0.00 H new ATOM 0 HB3 HIS C 27 40.137 13.933 18.284 1.00 0.00 H new ATOM 0 HD2 HIS C 27 40.708 16.366 19.461 1.00 0.00 H new ATOM 0 HE1 HIS C 27 43.123 17.993 16.404 1.00 0.00 H new ATOM 0 HE2 HIS C 27 42.060 18.490 18.682 1.00 0.00 H new ATOM 1547 N LEU C 28 42.599 13.149 19.906 1.00 0.00 N0 ATOM 1548 CA LEU C 28 43.438 13.474 21.050 1.00 0.00 C0 ATOM 1549 C LEU C 28 44.815 12.833 20.903 1.00 0.00 C0 ATOM 1550 O LEU C 28 45.838 13.483 21.114 1.00 0.00 O0 ATOM 1551 CB LEU C 28 42.773 12.976 22.338 1.00 0.00 C0 ATOM 1552 CG LEU C 28 43.677 13.265 23.541 1.00 0.00 C0 ATOM 1553 CD1 LEU C 28 43.881 14.775 23.681 1.00 0.00 C0 ATOM 1554 CD2 LEU C 28 43.018 12.721 24.813 1.00 0.00 C0 ATOM 0 H LEU C 28 41.745 12.640 20.134 1.00 0.00 H new ATOM 0 HA LEU C 28 43.559 14.556 21.097 1.00 0.00 H new ATOM 0 HB2 LEU C 28 41.808 13.466 22.472 1.00 0.00 H new ATOM 0 HB3 LEU C 28 42.580 11.906 22.267 1.00 0.00 H new ATOM 0 HG LEU C 28 44.643 12.782 23.392 1.00 0.00 H new ATOM 0 HD11 LEU C 28 44.524 14.977 24.537 1.00 0.00 H new ATOM 0 HD12 LEU C 28 44.348 15.164 22.776 1.00 0.00 H new ATOM 0 HD13 LEU C 28 42.916 15.260 23.829 1.00 0.00 H new ATOM 0 HD21 LEU C 28 43.659 12.925 25.671 1.00 0.00 H new ATOM 0 HD22 LEU C 28 42.052 13.205 24.958 1.00 0.00 H new ATOM 0 HD23 LEU C 28 42.873 11.645 24.716 1.00 0.00 H new ATOM 1751 N GLN D 6 10.154 14.491 13.836 1.00 0.00 N0 ATOM 1752 CA GLN D 6 10.583 15.852 14.130 1.00 0.00 C0 ATOM 1753 C GLN D 6 11.744 15.867 15.112 1.00 0.00 C0 ATOM 1754 O GLN D 6 12.730 16.576 14.911 1.00 0.00 O0 ATOM 1755 CB GLN D 6 9.418 16.655 14.709 1.00 0.00 C0 ATOM 1756 CG GLN D 6 9.899 18.062 15.069 1.00 0.00 C0 ATOM 1757 CD GLN D 6 8.767 19.062 14.876 1.00 0.00 C0 ATOM 1758 OE1 GLN D 6 7.685 18.894 15.439 1.00 0.00 O0 ATOM 1759 NE2 GLN D 6 8.951 20.097 14.104 1.00 0.00 N0 ATOM 0 HA GLN D 6 10.916 16.305 13.196 1.00 0.00 H new ATOM 0 HB2 GLN D 6 8.605 16.711 13.985 1.00 0.00 H new ATOM 0 HB3 GLN D 6 9.023 16.156 15.594 1.00 0.00 H new ATOM 0 HG2 GLN D 6 10.243 18.085 16.103 1.00 0.00 H new ATOM 0 HG3 GLN D 6 10.749 18.336 14.444 1.00 0.00 H new ATOM 0 HE21 GLN D 6 9.849 20.233 13.639 1.00 0.00 H new ATOM 0 HE22 GLN D 6 8.197 20.770 13.965 1.00 0.00 H new ATOM 1768 N ILE D 7 11.621 15.089 16.178 1.00 0.00 N0 ATOM 1769 CA ILE D 7 12.676 15.041 17.183 1.00 0.00 C0 ATOM 1770 C ILE D 7 13.923 14.363 16.615 1.00 0.00 C0 ATOM 1771 O ILE D 7 15.049 14.734 16.950 1.00 0.00 O0 ATOM 1772 CB ILE D 7 12.183 14.292 18.432 1.00 0.00 C0 ATOM 1773 CG1 ILE D 7 12.120 12.790 18.147 1.00 0.00 C0 ATOM 1774 CG2 ILE D 7 10.785 14.788 18.798 1.00 0.00 C0 ATOM 1775 CD1 ILE D 7 11.547 12.046 19.356 1.00 0.00 C0 ATOM 0 H ILE D 7 10.817 14.492 16.369 1.00 0.00 H new ATOM 0 HA ILE D 7 12.936 16.061 17.465 1.00 0.00 H new ATOM 0 HB ILE D 7 12.873 14.476 19.256 1.00 0.00 H new ATOM 0 HG12 ILE D 7 11.500 12.605 17.270 1.00 0.00 H new ATOM 0 HG13 ILE D 7 13.117 12.414 17.918 1.00 0.00 H new ATOM 0 HG21 ILE D 7 10.432 14.259 19.683 1.00 0.00 H new ATOM 0 HG22 ILE D 7 10.821 15.858 19.004 1.00 0.00 H new ATOM 0 HG23 ILE D 7 10.104 14.601 17.968 1.00 0.00 H new ATOM 0 HD11 ILE D 7 11.507 10.978 19.141 1.00 0.00 H new ATOM 0 HD12 ILE D 7 12.183 12.218 20.224 1.00 0.00 H new ATOM 0 HD13 ILE D 7 10.542 12.412 19.565 1.00 0.00 H new ATOM 1787 N LEU D 8 13.716 13.368 15.757 1.00 0.00 N0 ATOM 1788 CA LEU D 8 14.833 12.651 15.158 1.00 0.00 C0 ATOM 1789 C LEU D 8 15.533 13.504 14.105 1.00 0.00 C0 ATOM 1790 O LEU D 8 16.749 13.400 13.917 1.00 0.00 O0 ATOM 1791 CB LEU D 8 14.324 11.357 14.515 1.00 0.00 C0 ATOM 1792 CG LEU D 8 14.803 10.141 15.318 1.00 0.00 C0 ATOM 1793 CD1 LEU D 8 16.335 10.036 15.248 1.00 0.00 C0 ATOM 1794 CD2 LEU D 8 14.352 10.276 16.781 1.00 0.00 C0 ATOM 0 H LEU D 8 12.794 13.044 15.464 1.00 0.00 H new ATOM 0 HA LEU D 8 15.552 12.418 15.943 1.00 0.00 H new ATOM 0 HB2 LEU D 8 13.235 11.368 14.473 1.00 0.00 H new ATOM 0 HB3 LEU D 8 14.682 11.288 13.488 1.00 0.00 H new ATOM 0 HG LEU D 8 14.368 9.237 14.892 1.00 0.00 H new ATOM 0 HD11 LEU D 8 16.667 9.170 15.821 1.00 0.00 H new ATOM 0 HD12 LEU D 8 16.645 9.924 14.209 1.00 0.00 H new ATOM 0 HD13 LEU D 8 16.781 10.939 15.665 1.00 0.00 H new ATOM 0 HD21 LEU D 8 14.694 9.410 17.348 1.00 0.00 H new ATOM 0 HD22 LEU D 8 14.778 11.183 17.211 1.00 0.00 H new ATOM 0 HD23 LEU D 8 13.264 10.331 16.823 1.00 0.00 H new ATOM 1806 N SER D 9 14.769 14.362 13.441 1.00 0.00 N0 ATOM 1807 CA SER D 9 15.334 15.238 12.428 1.00 0.00 C0 ATOM 1808 C SER D 9 16.103 16.383 13.079 1.00 0.00 C0 ATOM 1809 O SER D 9 17.170 16.772 12.610 1.00 0.00 O0 ATOM 1810 CB SER D 9 14.218 15.798 11.551 1.00 0.00 C0 ATOM 1811 OG SER D 9 13.352 16.595 12.347 1.00 0.00 O0 ATOM 0 H SER D 9 13.765 14.468 13.585 1.00 0.00 H new ATOM 0 HA SER D 9 16.024 14.661 11.813 1.00 0.00 H new ATOM 0 HB2 SER D 9 14.640 16.395 10.742 1.00 0.00 H new ATOM 0 HB3 SER D 9 13.660 14.984 11.089 1.00 0.00 H new ATOM 0 HG SER D 9 13.332 16.243 13.261 1.00 0.00 H new ATOM 1817 N ILE D 10 15.560 16.909 14.173 1.00 0.00 N0 ATOM 1818 CA ILE D 10 16.208 18.003 14.887 1.00 0.00 C0 ATOM 1819 C ILE D 10 17.511 17.535 15.524 1.00 0.00 C0 ATOM 1820 O ILE D 10 18.515 18.250 15.497 1.00 0.00 O0 ATOM 1821 CB ILE D 10 15.273 18.552 15.970 1.00 0.00 C0 ATOM 1822 CG1 ILE D 10 14.079 19.245 15.305 1.00 0.00 C0 ATOM 1823 CG2 ILE D 10 16.029 19.567 16.831 1.00 0.00 C0 ATOM 1824 CD1 ILE D 10 12.979 19.481 16.342 1.00 0.00 C0 ATOM 0 H ILE D 10 14.679 16.598 14.582 1.00 0.00 H new ATOM 0 HA ILE D 10 16.433 18.792 14.170 1.00 0.00 H new ATOM 0 HB ILE D 10 14.921 17.732 16.596 1.00 0.00 H new ATOM 0 HG12 ILE D 10 14.393 20.194 14.870 1.00 0.00 H new ATOM 0 HG13 ILE D 10 13.698 18.631 14.489 1.00 0.00 H new ATOM 0 HG21 ILE D 10 15.364 19.958 17.601 1.00 0.00 H new ATOM 0 HG22 ILE D 10 16.883 19.080 17.302 1.00 0.00 H new ATOM 0 HG23 ILE D 10 16.379 20.387 16.204 1.00 0.00 H new ATOM 0 HD11 ILE D 10 12.131 19.974 15.867 1.00 0.00 H new ATOM 0 HD12 ILE D 10 12.658 18.525 16.756 1.00 0.00 H new ATOM 0 HD13 ILE D 10 13.364 20.112 17.143 1.00 0.00 H new ATOM 1836 N CYS D 11 17.497 16.331 16.092 1.00 0.00 N0 ATOM 1837 CA CYS D 11 18.691 15.791 16.730 1.00 0.00 C0 ATOM 1838 C CYS D 11 19.787 15.529 15.704 1.00 0.00 C0 ATOM 1839 O CYS D 11 20.923 15.978 15.868 1.00 0.00 O0 ATOM 1840 CB CYS D 11 18.343 14.487 17.446 1.00 0.00 C0 ATOM 1841 SG CYS D 11 19.743 13.966 18.465 1.00 0.00 S0 ATOM 0 H CYS D 11 16.682 15.719 16.123 1.00 0.00 H new ATOM 0 HA CYS D 11 19.058 16.524 17.449 1.00 0.00 H new ATOM 0 HB2 CYS D 11 17.459 14.626 18.068 1.00 0.00 H new ATOM 0 HB3 CYS D 11 18.102 13.713 16.718 1.00 0.00 H new ATOM 0 HG CYS D 11 19.512 12.781 18.947 1.00 0.00 H new ATOM 1847 N SER D 12 19.450 14.792 14.645 1.00 0.00 N0 ATOM 1848 CA SER D 12 20.428 14.476 13.614 1.00 0.00 C0 ATOM 1849 C SER D 12 20.947 15.749 12.958 1.00 0.00 C0 ATOM 1850 O SER D 12 22.131 15.854 12.641 1.00 0.00 O0 ATOM 1851 CB SER D 12 19.800 13.572 12.555 1.00 0.00 C0 ATOM 1852 OG SER D 12 19.547 12.292 13.121 1.00 0.00 O0 ATOM 0 H SER D 12 18.519 14.409 14.483 1.00 0.00 H new ATOM 0 HA SER D 12 21.264 13.957 14.082 1.00 0.00 H new ATOM 0 HB2 SER D 12 18.872 14.011 12.190 1.00 0.00 H new ATOM 0 HB3 SER D 12 20.467 13.478 11.698 1.00 0.00 H new ATOM 0 HG SER D 12 18.642 12.274 13.497 1.00 0.00 H new ATOM 1858 N PHE D 13 20.053 16.711 12.755 1.00 0.00 N0 ATOM 1859 CA PHE D 13 20.436 17.969 12.134 1.00 0.00 C0 ATOM 1860 C PHE D 13 21.496 18.676 12.971 1.00 0.00 C0 ATOM 1861 O PHE D 13 22.495 19.164 12.443 1.00 0.00 O0 ATOM 1862 CB PHE D 13 19.207 18.871 11.995 1.00 0.00 C0 ATOM 1863 CG PHE D 13 18.556 18.633 10.654 1.00 0.00 C0 ATOM 1864 CD1 PHE D 13 18.443 17.331 10.148 1.00 0.00 C0 ATOM 1865 CD2 PHE D 13 18.065 19.714 9.915 1.00 0.00 C0 ATOM 1866 CE1 PHE D 13 17.839 17.114 8.904 1.00 0.00 C0 ATOM 1867 CE2 PHE D 13 17.461 19.497 8.671 1.00 0.00 C0 ATOM 1868 CZ PHE D 13 17.348 18.196 8.166 1.00 0.00 C0 ATOM 0 H PHE D 13 19.068 16.643 13.010 1.00 0.00 H new ATOM 0 HA PHE D 13 20.849 17.760 11.147 1.00 0.00 H new ATOM 0 HB2 PHE D 13 18.498 18.664 12.797 1.00 0.00 H new ATOM 0 HB3 PHE D 13 19.498 19.917 12.089 1.00 0.00 H new ATOM 0 HD1 PHE D 13 18.822 16.495 10.718 1.00 0.00 H new ATOM 0 HD2 PHE D 13 18.152 20.718 10.305 1.00 0.00 H new ATOM 0 HE1 PHE D 13 17.752 16.111 8.514 1.00 0.00 H new ATOM 0 HE2 PHE D 13 17.082 20.333 8.101 1.00 0.00 H new ATOM 0 HZ PHE D 13 16.882 18.028 7.206 1.00 0.00 H new ATOM 1878 N ILE D 14 21.282 18.714 14.283 1.00 0.00 N0 ATOM 1879 CA ILE D 14 22.236 19.352 15.180 1.00 0.00 C0 ATOM 1880 C ILE D 14 23.588 18.655 15.108 1.00 0.00 C0 ATOM 1881 O ILE D 14 24.631 19.309 15.057 1.00 0.00 O0 ATOM 1882 CB ILE D 14 21.710 19.314 16.615 1.00 0.00 C0 ATOM 1883 CG1 ILE D 14 20.527 20.277 16.747 1.00 0.00 C0 ATOM 1884 CG2 ILE D 14 22.823 19.728 17.580 1.00 0.00 C0 ATOM 1885 CD1 ILE D 14 19.755 19.965 18.031 1.00 0.00 C0 ATOM 0 H ILE D 14 20.464 18.314 14.744 1.00 0.00 H new ATOM 0 HA ILE D 14 22.361 20.389 14.870 1.00 0.00 H new ATOM 0 HB ILE D 14 21.383 18.303 16.858 1.00 0.00 H new ATOM 0 HG12 ILE D 14 20.883 21.307 16.766 1.00 0.00 H new ATOM 0 HG13 ILE D 14 19.869 20.183 15.883 1.00 0.00 H new ATOM 0 HG21 ILE D 14 22.447 19.701 18.603 1.00 0.00 H new ATOM 0 HG22 ILE D 14 23.663 19.040 17.484 1.00 0.00 H new ATOM 0 HG23 ILE D 14 23.153 20.739 17.342 1.00 0.00 H new ATOM 0 HD11 ILE D 14 18.913 20.651 18.125 1.00 0.00 H new ATOM 0 HD12 ILE D 14 19.386 18.940 17.994 1.00 0.00 H new ATOM 0 HD13 ILE D 14 20.416 20.082 18.890 1.00 0.00 H new ATOM 1897 N LEU D 15 23.568 17.323 15.107 1.00 0.00 N0 ATOM 1898 CA LEU D 15 24.812 16.565 15.044 1.00 0.00 C0 ATOM 1899 C LEU D 15 25.551 16.850 13.743 1.00 0.00 C0 ATOM 1900 O LEU D 15 26.708 17.254 13.759 1.00 0.00 O0 ATOM 1901 CB LEU D 15 24.510 15.069 15.134 1.00 0.00 C0 ATOM 1902 CG LEU D 15 24.480 14.644 16.600 1.00 0.00 C0 ATOM 1903 CD1 LEU D 15 23.760 13.301 16.723 1.00 0.00 C0 ATOM 1904 CD2 LEU D 15 25.915 14.502 17.112 1.00 0.00 C0 ATOM 0 H LEU D 15 22.720 16.757 15.148 1.00 0.00 H new ATOM 0 HA LEU D 15 25.441 16.867 15.881 1.00 0.00 H new ATOM 0 HB2 LEU D 15 23.552 14.851 14.661 1.00 0.00 H new ATOM 0 HB3 LEU D 15 25.268 14.501 14.595 1.00 0.00 H new ATOM 0 HG LEU D 15 23.953 15.394 17.190 1.00 0.00 H new ATOM 0 HD11 LEU D 15 23.737 12.995 17.769 1.00 0.00 H new ATOM 0 HD12 LEU D 15 22.740 13.400 16.351 1.00 0.00 H new ATOM 0 HD13 LEU D 15 24.289 12.550 16.137 1.00 0.00 H new ATOM 0 HD21 LEU D 15 25.899 14.199 18.159 1.00 0.00 H new ATOM 0 HD22 LEU D 15 26.438 13.748 16.523 1.00 0.00 H new ATOM 0 HD23 LEU D 15 26.431 15.458 17.019 1.00 0.00 H new ATOM 1916 N SER D 16 24.885 16.620 12.622 1.00 0.00 N0 ATOM 1917 CA SER D 16 25.507 16.836 11.321 1.00 0.00 C0 ATOM 1918 C SER D 16 26.135 18.225 11.253 1.00 0.00 C0 ATOM 1919 O SER D 16 27.218 18.397 10.685 1.00 0.00 O0 ATOM 1920 CB SER D 16 24.459 16.697 10.217 1.00 0.00 C0 ATOM 1921 OG SER D 16 23.906 15.389 10.259 1.00 0.00 O0 ATOM 0 H SER D 16 23.922 16.287 12.584 1.00 0.00 H new ATOM 0 HA SER D 16 26.288 16.088 11.181 1.00 0.00 H new ATOM 0 HB2 SER D 16 23.674 17.441 10.349 1.00 0.00 H new ATOM 0 HB3 SER D 16 24.913 16.882 9.243 1.00 0.00 H new ATOM 0 HG SER D 16 23.248 15.335 10.983 1.00 0.00 H new ATOM 1927 N ALA D 17 25.453 19.205 11.836 1.00 0.00 N0 ATOM 1928 CA ALA D 17 25.953 20.573 11.843 1.00 0.00 C0 ATOM 1929 C ALA D 17 27.269 20.666 12.611 1.00 0.00 C0 ATOM 1930 O ALA D 17 28.251 21.226 12.116 1.00 0.00 O0 ATOM 1931 CB ALA D 17 24.916 21.492 12.496 1.00 0.00 C0 ATOM 0 H ALA D 17 24.557 19.078 12.307 1.00 0.00 H new ATOM 0 HA ALA D 17 26.129 20.883 10.813 1.00 0.00 H new ATOM 0 HB1 ALA D 17 25.290 22.516 12.502 1.00 0.00 H new ATOM 0 HB2 ALA D 17 23.985 21.449 11.931 1.00 0.00 H new ATOM 0 HB3 ALA D 17 24.735 21.166 13.520 1.00 0.00 H new ATOM 1937 N LEU D 18 27.287 20.101 13.816 1.00 0.00 N0 ATOM 1938 CA LEU D 18 28.489 20.123 14.640 1.00 0.00 C0 ATOM 1939 C LEU D 18 29.588 19.270 14.018 1.00 0.00 C0 ATOM 1940 O LEU D 18 30.776 19.481 14.286 1.00 0.00 O0 ATOM 1941 CB LEU D 18 28.171 19.608 16.049 1.00 0.00 C0 ATOM 1942 CG LEU D 18 27.912 20.793 16.982 1.00 0.00 C0 ATOM 1943 CD1 LEU D 18 26.574 21.445 16.629 1.00 0.00 C0 ATOM 1944 CD2 LEU D 18 27.871 20.303 18.431 1.00 0.00 C0 ATOM 0 H LEU D 18 26.489 19.627 14.239 1.00 0.00 H new ATOM 0 HA LEU D 18 28.841 21.153 14.702 1.00 0.00 H new ATOM 0 HB2 LEU D 18 27.297 18.957 16.021 1.00 0.00 H new ATOM 0 HB3 LEU D 18 29.002 19.011 16.425 1.00 0.00 H new ATOM 0 HG LEU D 18 28.712 21.524 16.866 1.00 0.00 H new ATOM 0 HD11 LEU D 18 26.393 22.288 17.296 1.00 0.00 H new ATOM 0 HD12 LEU D 18 26.602 21.797 15.598 1.00 0.00 H new ATOM 0 HD13 LEU D 18 25.773 20.715 16.742 1.00 0.00 H new ATOM 0 HD21 LEU D 18 27.687 21.147 19.095 1.00 0.00 H new ATOM 0 HD22 LEU D 18 27.072 19.570 18.545 1.00 0.00 H new ATOM 0 HD23 LEU D 18 28.825 19.842 18.686 1.00 0.00 H new ATOM 1956 N HIS D 19 29.190 18.314 13.181 1.00 0.00 N0 ATOM 1957 CA HIS D 19 30.161 17.442 12.533 1.00 0.00 C0 ATOM 1958 C HIS D 19 30.965 18.212 11.502 1.00 0.00 C0 ATOM 1959 O HIS D 19 32.175 18.354 11.642 1.00 0.00 O0 ATOM 1960 CB HIS D 19 29.433 16.288 11.840 1.00 0.00 C0 ATOM 1961 CG HIS D 19 30.405 15.522 10.988 1.00 0.00 C0 ATOM 1962 ND1 HIS D 19 31.344 14.656 11.527 1.00 0.00 N0 ATOM 1963 CD2 HIS D 19 30.598 15.482 9.629 1.00 0.00 C0 ATOM 1964 CE1 HIS D 19 32.052 14.136 10.507 1.00 0.00 C0 ATOM 1965 NE2 HIS D 19 31.637 14.608 9.327 1.00 0.00 N0 ATOM 0 H HIS D 19 28.217 18.127 12.940 1.00 0.00 H new ATOM 0 HA HIS D 19 30.838 17.053 13.293 1.00 0.00 H new ATOM 0 HB2 HIS D 19 28.985 15.628 12.583 1.00 0.00 H new ATOM 0 HB3 HIS D 19 28.620 16.674 11.225 1.00 0.00 H new ATOM 0 HD2 HIS D 19 30.029 16.045 8.904 1.00 0.00 H new ATOM 0 HE1 HIS D 19 32.856 13.425 10.627 1.00 0.00 H new ATOM 0 HE2 HIS D 19 32.004 14.377 8.404 1.00 0.00 H new ATOM 1973 N PHE D 20 30.296 18.712 10.471 1.00 0.00 N0 ATOM 1974 CA PHE D 20 30.993 19.462 9.435 1.00 0.00 C0 ATOM 1975 C PHE D 20 31.714 20.651 10.047 1.00 0.00 C0 ATOM 1976 O PHE D 20 32.738 21.095 9.535 1.00 0.00 O0 ATOM 1977 CB PHE D 20 30.005 19.942 8.371 1.00 0.00 C0 ATOM 1978 CG PHE D 20 30.203 19.157 7.094 1.00 0.00 C0 ATOM 1979 CD1 PHE D 20 29.620 17.891 6.945 1.00 0.00 C0 ATOM 1980 CD2 PHE D 20 30.968 19.699 6.053 1.00 0.00 C0 ATOM 1981 CE1 PHE D 20 29.802 17.171 5.756 1.00 0.00 C0 ATOM 1982 CE2 PHE D 20 31.150 18.979 4.866 1.00 0.00 C0 ATOM 1983 CZ PHE D 20 30.567 17.715 4.716 1.00 0.00 C0 ATOM 0 H PHE D 20 29.290 18.615 10.331 1.00 0.00 H new ATOM 0 HA PHE D 20 31.725 18.807 8.964 1.00 0.00 H new ATOM 0 HB2 PHE D 20 28.983 19.819 8.729 1.00 0.00 H new ATOM 0 HB3 PHE D 20 30.150 21.005 8.181 1.00 0.00 H new ATOM 0 HD1 PHE D 20 29.031 17.470 7.746 1.00 0.00 H new ATOM 0 HD2 PHE D 20 31.418 20.674 6.166 1.00 0.00 H new ATOM 0 HE1 PHE D 20 29.352 16.196 5.642 1.00 0.00 H new ATOM 0 HE2 PHE D 20 31.741 19.399 4.065 1.00 0.00 H new ATOM 0 HZ PHE D 20 30.707 17.160 3.800 1.00 0.00 H new ATOM 1993 N MET D 21 31.178 21.165 11.147 1.00 0.00 N0 ATOM 1994 CA MET D 21 31.794 22.300 11.812 1.00 0.00 C0 ATOM 1995 C MET D 21 33.201 21.956 12.297 1.00 0.00 C0 ATOM 1996 O MET D 21 34.190 22.555 11.855 1.00 0.00 O0 ATOM 1997 CB MET D 21 30.935 22.714 13.005 1.00 0.00 C0 ATOM 1998 CG MET D 21 30.083 23.924 12.618 1.00 0.00 C0 ATOM 1999 SD MET D 21 31.142 25.388 12.489 1.00 0.00 S0 ATOM 2000 CE MET D 21 30.347 26.118 11.035 1.00 0.00 C0 ATOM 0 H MET D 21 30.328 20.817 11.591 1.00 0.00 H new ATOM 0 HA MET D 21 31.867 23.120 11.098 1.00 0.00 H new ATOM 0 HB2 MET D 21 30.295 21.887 13.311 1.00 0.00 H new ATOM 0 HB3 MET D 21 31.569 22.959 13.857 1.00 0.00 H new ATOM 0 HG2 MET D 21 29.580 23.740 11.668 1.00 0.00 H new ATOM 0 HG3 MET D 21 29.305 24.089 13.364 1.00 0.00 H new ATOM 0 HE1 MET D 21 30.850 27.049 10.774 1.00 0.00 H new ATOM 0 HE2 MET D 21 30.412 25.423 10.198 1.00 0.00 H new ATOM 0 HE3 MET D 21 29.299 26.322 11.257 1.00 0.00 H new ATOM 2010 N ALA D 22 33.288 20.985 13.201 1.00 0.00 N0 ATOM 2011 CA ALA D 22 34.578 20.576 13.739 1.00 0.00 C0 ATOM 2012 C ALA D 22 35.469 20.005 12.642 1.00 0.00 C0 ATOM 2013 O ALA D 22 36.671 20.259 12.614 1.00 0.00 O0 ATOM 2014 CB ALA D 22 34.380 19.529 14.833 1.00 0.00 C0 ATOM 0 H ALA D 22 32.488 20.472 13.573 1.00 0.00 H new ATOM 0 HA ALA D 22 35.065 21.456 14.160 1.00 0.00 H new ATOM 0 HB1 ALA D 22 35.350 19.229 15.229 1.00 0.00 H new ATOM 0 HB2 ALA D 22 33.775 19.951 15.635 1.00 0.00 H new ATOM 0 HB3 ALA D 22 33.874 18.658 14.416 1.00 0.00 H new ATOM 2020 N TRP D 23 34.875 19.221 11.753 1.00 0.00 N0 ATOM 2021 CA TRP D 23 35.630 18.606 10.668 1.00 0.00 C0 ATOM 2022 C TRP D 23 36.287 19.680 9.810 1.00 0.00 C0 ATOM 2023 O TRP D 23 37.475 19.603 9.510 1.00 0.00 O0 ATOM 2024 CB TRP D 23 34.702 17.752 9.808 1.00 0.00 C0 ATOM 2025 CG TRP D 23 35.424 16.523 9.366 1.00 0.00 C0 ATOM 2026 CD1 TRP D 23 35.545 15.391 10.097 1.00 0.00 C0 ATOM 2027 CD2 TRP D 23 36.122 16.276 8.111 1.00 0.00 C0 ATOM 2028 NE1 TRP D 23 36.275 14.467 9.372 1.00 0.00 N0 ATOM 2029 CE2 TRP D 23 36.653 14.965 8.141 1.00 0.00 C0 ATOM 2030 CE3 TRP D 23 36.345 17.056 6.961 1.00 0.00 C0 ATOM 2031 CZ2 TRP D 23 37.379 14.444 7.069 1.00 0.00 C0 ATOM 2032 CZ3 TRP D 23 37.074 16.534 5.880 1.00 0.00 C0 ATOM 2033 CH2 TRP D 23 37.590 15.232 5.934 1.00 0.00 C0 ATOM 0 H TRP D 23 33.880 18.996 11.760 1.00 0.00 H new ATOM 0 HA TRP D 23 36.407 17.972 11.095 1.00 0.00 H new ATOM 0 HB2 TRP D 23 33.812 17.480 10.375 1.00 0.00 H new ATOM 0 HB3 TRP D 23 34.366 18.321 8.941 1.00 0.00 H new ATOM 0 HD1 TRP D 23 35.138 15.235 11.085 1.00 0.00 H new ATOM 0 HE1 TRP D 23 36.506 13.531 9.706 1.00 0.00 H new ATOM 0 HE3 TRP D 23 35.954 18.061 6.909 1.00 0.00 H new ATOM 0 HZ2 TRP D 23 37.775 13.440 7.116 1.00 0.00 H new ATOM 0 HZ3 TRP D 23 37.238 17.140 5.001 1.00 0.00 H new ATOM 0 HH2 TRP D 23 38.150 14.838 5.099 1.00 0.00 H new ATOM 2044 N THR D 24 35.502 20.674 9.411 1.00 0.00 N0 ATOM 2045 CA THR D 24 36.017 21.756 8.582 1.00 0.00 C0 ATOM 2046 C THR D 24 37.216 22.406 9.256 1.00 0.00 C0 ATOM 2047 O THR D 24 38.245 22.640 8.623 1.00 0.00 O0 ATOM 2048 CB THR D 24 34.924 22.805 8.361 1.00 0.00 C0 ATOM 2049 OG1 THR D 24 33.869 22.235 7.598 1.00 0.00 O0 ATOM 2050 CG2 THR D 24 35.502 24.015 7.621 1.00 0.00 C0 ATOM 0 H THR D 24 34.513 20.753 9.646 1.00 0.00 H new ATOM 0 HA THR D 24 36.326 21.346 7.621 1.00 0.00 H new ATOM 0 HB THR D 24 34.539 23.132 9.327 1.00 0.00 H new ATOM 0 HG1 THR D 24 33.113 22.030 8.187 1.00 0.00 H new ATOM 0 HG21 THR D 24 34.718 24.756 7.468 1.00 0.00 H new ATOM 0 HG22 THR D 24 36.306 24.454 8.213 1.00 0.00 H new ATOM 0 HG23 THR D 24 35.895 23.697 6.655 1.00 0.00 H new ATOM 2058 N ILE D 25 37.086 22.684 10.550 1.00 0.00 N0 ATOM 2059 CA ILE D 25 38.180 23.292 11.295 1.00 0.00 C0 ATOM 2060 C ILE D 25 39.385 22.356 11.324 1.00 0.00 C0 ATOM 2061 O ILE D 25 40.526 22.791 11.190 1.00 0.00 O0 ATOM 2062 CB ILE D 25 37.726 23.601 12.724 1.00 0.00 C0 ATOM 2063 CG1 ILE D 25 36.674 24.709 12.687 1.00 0.00 C0 ATOM 2064 CG2 ILE D 25 38.922 24.068 13.559 1.00 0.00 C0 ATOM 2065 CD1 ILE D 25 35.998 24.818 14.054 1.00 0.00 C0 ATOM 0 H ILE D 25 36.245 22.500 11.097 1.00 0.00 H new ATOM 0 HA ILE D 25 38.469 24.220 10.801 1.00 0.00 H new ATOM 0 HB ILE D 25 37.303 22.702 13.172 1.00 0.00 H new ATOM 0 HG12 ILE D 25 37.140 25.658 12.423 1.00 0.00 H new ATOM 0 HG13 ILE D 25 35.931 24.494 11.919 1.00 0.00 H new ATOM 0 HG21 ILE D 25 38.593 24.287 14.575 1.00 0.00 H new ATOM 0 HG22 ILE D 25 39.678 23.283 13.583 1.00 0.00 H new ATOM 0 HG23 ILE D 25 39.347 24.967 13.114 1.00 0.00 H new ATOM 0 HD11 ILE D 25 35.248 25.608 14.027 1.00 0.00 H new ATOM 0 HD12 ILE D 25 35.518 23.871 14.299 1.00 0.00 H new ATOM 0 HD13 ILE D 25 36.745 25.053 14.812 1.00 0.00 H new ATOM 2077 N GLY D 26 39.113 21.067 11.507 1.00 0.00 N0 ATOM 2078 CA GLY D 26 40.173 20.068 11.563 1.00 0.00 C0 ATOM 2079 C GLY D 26 40.972 20.045 10.265 1.00 0.00 C0 ATOM 2080 O GLY D 26 42.197 20.102 10.282 1.00 0.00 O0 ATOM 0 H GLY D 26 38.171 20.692 11.619 1.00 0.00 H new ATOM 0 HA2 GLY D 26 40.838 20.284 12.399 1.00 0.00 H new ATOM 0 HA3 GLY D 26 39.741 19.084 11.746 1.00 0.00 H new ATOM 2084 N HIS D 27 40.267 19.974 9.144 1.00 0.00 N0 ATOM 2085 CA HIS D 27 40.920 19.952 7.841 1.00 0.00 C0 ATOM 2086 C HIS D 27 41.722 21.228 7.622 1.00 0.00 C0 ATOM 2087 O HIS D 27 42.830 21.191 7.088 1.00 0.00 O0 ATOM 2088 CB HIS D 27 39.875 19.801 6.735 1.00 0.00 C0 ATOM 2089 CG HIS D 27 40.505 20.104 5.404 1.00 0.00 C0 ATOM 2090 ND1 HIS D 27 41.480 19.296 4.842 1.00 0.00 N0 ATOM 2091 CD2 HIS D 27 40.308 21.129 4.513 1.00 0.00 C0 ATOM 2092 CE1 HIS D 27 41.830 19.844 3.663 1.00 0.00 C0 ATOM 2093 NE2 HIS D 27 41.145 20.963 3.415 1.00 0.00 N0 ATOM 0 H HIS D 27 39.248 19.931 9.110 1.00 0.00 H new ATOM 0 HA HIS D 27 41.602 19.102 7.811 1.00 0.00 H new ATOM 0 HB2 HIS D 27 39.472 18.788 6.736 1.00 0.00 H new ATOM 0 HB3 HIS D 27 39.039 20.477 6.916 1.00 0.00 H new ATOM 0 HD2 HIS D 27 39.609 21.942 4.645 1.00 0.00 H new ATOM 0 HE1 HIS D 27 42.574 19.429 2.999 1.00 0.00 H new ATOM 0 HE2 HIS D 27 41.220 21.566 2.596 1.00 0.00 H new ATOM 2101 N LEU D 28 41.159 22.355 8.041 1.00 0.00 N0 ATOM 2102 CA LEU D 28 41.839 23.634 7.885 1.00 0.00 C0 ATOM 2103 C LEU D 28 43.169 23.627 8.631 1.00 0.00 C0 ATOM 2104 O LEU D 28 44.195 24.041 8.094 1.00 0.00 O0 ATOM 2105 CB LEU D 28 40.951 24.761 8.423 1.00 0.00 C0 ATOM 2106 CG LEU D 28 41.683 26.103 8.315 1.00 0.00 C0 ATOM 2107 CD1 LEU D 28 41.979 26.409 6.846 1.00 0.00 C0 ATOM 2108 CD2 LEU D 28 40.801 27.211 8.897 1.00 0.00 C0 ATOM 0 H LEU D 28 40.243 22.410 8.487 1.00 0.00 H new ATOM 0 HA LEU D 28 42.034 23.798 6.825 1.00 0.00 H new ATOM 0 HB2 LEU D 28 40.018 24.800 7.860 1.00 0.00 H new ATOM 0 HB3 LEU D 28 40.688 24.563 9.462 1.00 0.00 H new ATOM 0 HG LEU D 28 42.620 26.051 8.870 1.00 0.00 H new ATOM 0 HD11 LEU D 28 42.500 27.364 6.771 1.00 0.00 H new ATOM 0 HD12 LEU D 28 42.605 25.620 6.429 1.00 0.00 H new ATOM 0 HD13 LEU D 28 41.043 26.461 6.290 1.00 0.00 H new ATOM 0 HD21 LEU D 28 41.320 28.167 8.821 1.00 0.00 H new ATOM 0 HD22 LEU D 28 39.865 27.261 8.341 1.00 0.00 H new ATOM 0 HD23 LEU D 28 40.589 26.995 9.944 1.00 0.00 H new