USER MOD reduce.3.24.130724 H: found=0, std=0, add=770, rem=0, adj=28 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= -0.0186 K(o=-0.019,f=-1) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 11 CYS SG : rot -167:sc= -0.238 USER MOD Single : A 12 SER OG : rot 180:sc= 0 USER MOD Single : A 16 SER OG : rot 79:sc= 0.0348 USER MOD Single : A 19 HIS : no HE2:sc= -1.23 K(o=-1.2,f=-2.6) USER MOD Single : A 21 MET CE :methyl 172:sc= -0.0184 (180deg=-0.074) USER MOD Single : A 24 THR OG1 : rot -62:sc= 0.975 USER MOD Single : A 27 HIS : no HD1:sc= -0.0117 X(o=-0.012,f=-0.15) USER MOD Single : B 6 GLN : amide:sc= -0.0316 K(o=-0.032,f=-1.1) USER MOD Single : B 9 SER OG : rot 180:sc= 0 USER MOD Single : B 11 CYS SG : rot 180:sc= -0.261 USER MOD Single : B 12 SER OG : rot 180:sc= 0 USER MOD Single : B 16 SER OG : rot 77:sc= 0.0321 USER MOD Single : B 19 HIS : no HE2:sc= -1.3 X(o=-1.3,f=-1.5) USER MOD Single : B 21 MET CE :methyl 171:sc= -0.0186 (180deg=-0.0734) USER MOD Single : B 24 THR OG1 : rot -63:sc= 1.03 USER MOD Single : B 27 HIS : no HD1:sc= -0.0169 X(o=-0.017,f=-0.13) USER MOD Single : C 6 GLN : amide:sc= -0.0259 K(o=-0.026,f=-1) USER MOD Single : C 9 SER OG : rot 180:sc= 0 USER MOD Single : C 11 CYS SG : rot 180:sc= -0.264 USER MOD Single : C 12 SER OG : rot 180:sc= 0 USER MOD Single : C 16 SER OG : rot 78:sc= 0.0402 USER MOD Single : C 19 HIS : no HE2:sc= -1.61 K(o=-1.6,f=-4.8!) USER MOD Single : C 21 MET CE :methyl 170:sc= -0.0223 (180deg=-0.07) USER MOD Single : C 24 THR OG1 : rot -59:sc= 0.947 USER MOD Single : C 27 HIS : no HD1:sc= -0.0121 X(o=-0.012,f=-0.12) USER MOD Single : D 6 GLN : amide:sc= -0.029 K(o=-0.029,f=-1) USER MOD Single : D 9 SER OG : rot 180:sc= 0 USER MOD Single : D 11 CYS SG : rot -154:sc= -0.0318 USER MOD Single : D 12 SER OG : rot 180:sc= 0 USER MOD Single : D 16 SER OG : rot 77:sc= 0.0365 USER MOD Single : D 19 HIS :FLIP no HD1:sc= -1.04 F(o=-2.1,f=-1) USER MOD Single : D 21 MET CE :methyl 170:sc= -0.0246 (180deg=-0.0751) USER MOD Single : D 24 THR OG1 : rot -54:sc= 0.998 USER MOD Single : D 27 HIS : no HD1:sc= -0.0214 X(o=-0.021,f=-0.17) USER MOD ----------------------------------------------------------------- ATOM 69 N PHE A 5 8.969 12.909 6.323 1.00 0.00 N0 ATOM 70 CA PHE A 5 9.972 11.864 6.178 1.00 0.00 C0 ATOM 71 C PHE A 5 10.746 12.012 4.866 1.00 0.00 C0 ATOM 72 O PHE A 5 11.952 11.768 4.818 1.00 0.00 O0 ATOM 73 CB PHE A 5 9.304 10.493 6.215 1.00 0.00 C0 ATOM 74 CG PHE A 5 10.256 9.456 5.664 1.00 0.00 C0 ATOM 75 CD1 PHE A 5 11.264 8.915 6.475 1.00 0.00 C0 ATOM 76 CD2 PHE A 5 10.128 9.034 4.336 1.00 0.00 C0 ATOM 77 CE1 PHE A 5 12.140 7.952 5.955 1.00 0.00 C0 ATOM 78 CE2 PHE A 5 11.003 8.075 3.817 1.00 0.00 C0 ATOM 79 CZ PHE A 5 12.007 7.529 4.622 1.00 0.00 C0 ATOM 0 HA PHE A 5 10.674 11.959 7.007 1.00 0.00 H new ATOM 0 HB2 PHE A 5 9.025 10.240 7.238 1.00 0.00 H new ATOM 0 HB3 PHE A 5 8.385 10.508 5.628 1.00 0.00 H new ATOM 0 HD1 PHE A 5 11.365 9.240 7.500 1.00 0.00 H new ATOM 0 HD2 PHE A 5 9.352 9.450 3.711 1.00 0.00 H new ATOM 0 HE1 PHE A 5 12.917 7.535 6.579 1.00 0.00 H new ATOM 0 HE2 PHE A 5 10.903 7.755 2.790 1.00 0.00 H new ATOM 0 HZ PHE A 5 12.678 6.784 4.220 1.00 0.00 H new ATOM 89 N GLN A 6 10.043 12.387 3.803 1.00 0.00 N0 ATOM 90 CA GLN A 6 10.667 12.537 2.489 1.00 0.00 C0 ATOM 91 C GLN A 6 11.720 13.636 2.486 1.00 0.00 C0 ATOM 92 O GLN A 6 12.771 13.501 1.862 1.00 0.00 O0 ATOM 93 CB GLN A 6 9.604 12.887 1.459 1.00 0.00 C0 ATOM 94 CG GLN A 6 8.714 11.674 1.213 1.00 0.00 C0 ATOM 95 CD GLN A 6 7.524 12.080 0.350 1.00 0.00 C0 ATOM 96 OE1 GLN A 6 6.989 13.177 0.507 1.00 0.00 O0 ATOM 97 NE2 GLN A 6 7.086 11.261 -0.565 1.00 0.00 N0 ATOM 0 H GLN A 6 9.044 12.593 3.823 1.00 0.00 H new ATOM 0 HA GLN A 6 11.150 11.591 2.245 1.00 0.00 H new ATOM 0 HB2 GLN A 6 9.004 13.726 1.811 1.00 0.00 H new ATOM 0 HB3 GLN A 6 10.075 13.201 0.527 1.00 0.00 H new ATOM 0 HG2 GLN A 6 9.283 10.887 0.718 1.00 0.00 H new ATOM 0 HG3 GLN A 6 8.366 11.267 2.162 1.00 0.00 H new ATOM 0 HE21 GLN A 6 7.532 10.353 -0.692 1.00 0.00 H new ATOM 0 HE22 GLN A 6 6.297 11.529 -1.154 1.00 0.00 H new ATOM 106 N ILE A 7 11.405 14.730 3.163 1.00 0.00 N0 ATOM 107 CA ILE A 7 12.314 15.872 3.214 1.00 0.00 C0 ATOM 108 C ILE A 7 13.595 15.483 3.948 1.00 0.00 C0 ATOM 109 O ILE A 7 14.694 15.907 3.576 1.00 0.00 O0 ATOM 110 CB ILE A 7 11.647 17.106 3.889 1.00 0.00 C0 ATOM 111 CG1 ILE A 7 12.012 17.167 5.383 1.00 0.00 C0 ATOM 112 CG2 ILE A 7 10.121 17.040 3.737 1.00 0.00 C0 ATOM 113 CD1 ILE A 7 11.116 18.175 6.113 1.00 0.00 C0 ATOM 0 H ILE A 7 10.535 14.854 3.681 1.00 0.00 H new ATOM 0 HA ILE A 7 12.560 16.156 2.191 1.00 0.00 H new ATOM 0 HB ILE A 7 12.018 18.004 3.395 1.00 0.00 H new ATOM 0 HG12 ILE A 7 11.900 16.180 5.832 1.00 0.00 H new ATOM 0 HG13 ILE A 7 13.058 17.452 5.497 1.00 0.00 H new ATOM 0 HG21 ILE A 7 9.670 17.910 4.214 1.00 0.00 H new ATOM 0 HG22 ILE A 7 9.861 17.031 2.679 1.00 0.00 H new ATOM 0 HG23 ILE A 7 9.747 16.132 4.210 1.00 0.00 H new ATOM 0 HD11 ILE A 7 11.387 18.206 7.168 1.00 0.00 H new ATOM 0 HD12 ILE A 7 11.249 19.164 5.675 1.00 0.00 H new ATOM 0 HD13 ILE A 7 10.073 17.873 6.015 1.00 0.00 H new ATOM 125 N LEU A 8 13.446 14.669 4.989 1.00 0.00 N0 ATOM 126 CA LEU A 8 14.590 14.231 5.770 1.00 0.00 C0 ATOM 127 C LEU A 8 15.420 13.212 5.005 1.00 0.00 C0 ATOM 128 O LEU A 8 16.642 13.169 5.133 1.00 0.00 O0 ATOM 129 CB LEU A 8 14.113 13.630 7.093 1.00 0.00 C0 ATOM 130 CG LEU A 8 15.318 13.190 7.932 1.00 0.00 C0 ATOM 131 CD1 LEU A 8 16.190 14.403 8.269 1.00 0.00 C0 ATOM 132 CD2 LEU A 8 14.825 12.547 9.228 1.00 0.00 C0 ATOM 0 H LEU A 8 12.549 14.303 5.307 1.00 0.00 H new ATOM 0 HA LEU A 8 15.220 15.098 5.970 1.00 0.00 H new ATOM 0 HB2 LEU A 8 13.524 14.363 7.644 1.00 0.00 H new ATOM 0 HB3 LEU A 8 13.462 12.777 6.901 1.00 0.00 H new ATOM 0 HG LEU A 8 15.907 12.471 7.363 1.00 0.00 H new ATOM 0 HD11 LEU A 8 17.044 14.083 8.865 1.00 0.00 H new ATOM 0 HD12 LEU A 8 16.544 14.864 7.347 1.00 0.00 H new ATOM 0 HD13 LEU A 8 15.604 15.127 8.835 1.00 0.00 H new ATOM 0 HD21 LEU A 8 15.680 12.233 9.827 1.00 0.00 H new ATOM 0 HD22 LEU A 8 14.234 13.269 9.791 1.00 0.00 H new ATOM 0 HD23 LEU A 8 14.209 11.679 8.992 1.00 0.00 H new ATOM 144 N SER A 9 14.743 12.405 4.203 1.00 0.00 N0 ATOM 145 CA SER A 9 15.425 11.394 3.410 1.00 0.00 C0 ATOM 146 C SER A 9 16.232 12.047 2.295 1.00 0.00 C0 ATOM 147 O SER A 9 17.384 11.688 2.060 1.00 0.00 O0 ATOM 148 CB SER A 9 14.405 10.428 2.811 1.00 0.00 C0 ATOM 149 OG SER A 9 15.092 9.398 2.114 1.00 0.00 O0 ATOM 0 H SER A 9 13.730 12.429 4.084 1.00 0.00 H new ATOM 0 HA SER A 9 16.106 10.843 4.059 1.00 0.00 H new ATOM 0 HB2 SER A 9 13.785 10.000 3.599 1.00 0.00 H new ATOM 0 HB3 SER A 9 13.737 10.959 2.133 1.00 0.00 H new ATOM 0 HG SER A 9 14.442 8.774 1.728 1.00 0.00 H new ATOM 155 N ILE A 10 15.616 13.007 1.608 1.00 0.00 N0 ATOM 156 CA ILE A 10 16.288 13.695 0.512 1.00 0.00 C0 ATOM 157 C ILE A 10 17.534 14.405 1.023 1.00 0.00 C0 ATOM 158 O ILE A 10 18.612 14.277 0.441 1.00 0.00 O0 ATOM 159 CB ILE A 10 15.343 14.720 -0.130 1.00 0.00 C0 ATOM 160 CG1 ILE A 10 14.167 13.994 -0.801 1.00 0.00 C0 ATOM 161 CG2 ILE A 10 16.107 15.540 -1.177 1.00 0.00 C0 ATOM 162 CD1 ILE A 10 14.596 13.401 -2.147 1.00 0.00 C0 ATOM 0 H ILE A 10 14.663 13.322 1.789 1.00 0.00 H new ATOM 0 HA ILE A 10 16.576 12.955 -0.235 1.00 0.00 H new ATOM 0 HB ILE A 10 14.959 15.387 0.642 1.00 0.00 H new ATOM 0 HG12 ILE A 10 13.802 13.201 -0.148 1.00 0.00 H new ATOM 0 HG13 ILE A 10 13.341 14.689 -0.951 1.00 0.00 H new ATOM 0 HG21 ILE A 10 15.434 16.267 -1.632 1.00 0.00 H new ATOM 0 HG22 ILE A 10 16.935 16.062 -0.697 1.00 0.00 H new ATOM 0 HG23 ILE A 10 16.496 14.874 -1.948 1.00 0.00 H new ATOM 0 HD11 ILE A 10 13.749 12.891 -2.606 1.00 0.00 H new ATOM 0 HD12 ILE A 10 14.938 14.200 -2.804 1.00 0.00 H new ATOM 0 HD13 ILE A 10 15.406 12.689 -1.989 1.00 0.00 H new ATOM 174 N CYS A 11 17.389 15.151 2.114 1.00 0.00 N0 ATOM 175 CA CYS A 11 18.526 15.868 2.675 1.00 0.00 C0 ATOM 176 C CYS A 11 19.613 14.898 3.128 1.00 0.00 C0 ATOM 177 O CYS A 11 20.782 15.057 2.779 1.00 0.00 O0 ATOM 178 CB CYS A 11 18.071 16.714 3.859 1.00 0.00 C0 ATOM 179 SG CYS A 11 19.499 17.576 4.561 1.00 0.00 S0 ATOM 0 H CYS A 11 16.511 15.273 2.619 1.00 0.00 H new ATOM 0 HA CYS A 11 18.939 16.514 1.900 1.00 0.00 H new ATOM 0 HB2 CYS A 11 17.318 17.434 3.538 1.00 0.00 H new ATOM 0 HB3 CYS A 11 17.605 16.082 4.615 1.00 0.00 H new ATOM 0 HG CYS A 11 19.178 18.077 5.717 1.00 0.00 H new ATOM 185 N SER A 12 19.229 13.908 3.929 1.00 0.00 N0 ATOM 186 CA SER A 12 20.194 12.946 4.443 1.00 0.00 C0 ATOM 187 C SER A 12 20.957 12.294 3.297 1.00 0.00 C0 ATOM 188 O SER A 12 22.181 12.164 3.351 1.00 0.00 O0 ATOM 189 CB SER A 12 19.466 11.870 5.251 1.00 0.00 C0 ATOM 190 OG SER A 12 20.419 10.993 5.834 1.00 0.00 O0 ATOM 0 H SER A 12 18.268 13.753 4.232 1.00 0.00 H new ATOM 0 HA SER A 12 20.903 13.469 5.085 1.00 0.00 H new ATOM 0 HB2 SER A 12 18.858 12.332 6.028 1.00 0.00 H new ATOM 0 HB3 SER A 12 18.788 11.311 4.606 1.00 0.00 H new ATOM 0 HG SER A 12 19.955 10.304 6.353 1.00 0.00 H new ATOM 196 N PHE A 13 20.231 11.886 2.263 1.00 0.00 N0 ATOM 197 CA PHE A 13 20.855 11.250 1.111 1.00 0.00 C0 ATOM 198 C PHE A 13 21.885 12.184 0.478 1.00 0.00 C0 ATOM 199 O PHE A 13 22.994 11.766 0.142 1.00 0.00 O0 ATOM 200 CB PHE A 13 19.787 10.889 0.075 1.00 0.00 C0 ATOM 201 CG PHE A 13 19.404 9.438 0.229 1.00 0.00 C0 ATOM 202 CD1 PHE A 13 18.126 9.090 0.687 1.00 0.00 C0 ATOM 203 CD2 PHE A 13 20.329 8.440 -0.092 1.00 0.00 C0 ATOM 204 CE1 PHE A 13 17.777 7.741 0.822 1.00 0.00 C0 ATOM 205 CE2 PHE A 13 19.979 7.091 0.044 1.00 0.00 C0 ATOM 206 CZ PHE A 13 18.703 6.742 0.502 1.00 0.00 C0 ATOM 0 H PHE A 13 19.218 11.983 2.199 1.00 0.00 H new ATOM 0 HA PHE A 13 21.359 10.343 1.446 1.00 0.00 H new ATOM 0 HB2 PHE A 13 18.910 11.523 0.206 1.00 0.00 H new ATOM 0 HB3 PHE A 13 20.165 11.071 -0.931 1.00 0.00 H new ATOM 0 HD1 PHE A 13 17.412 9.861 0.935 1.00 0.00 H new ATOM 0 HD2 PHE A 13 21.314 8.710 -0.445 1.00 0.00 H new ATOM 0 HE1 PHE A 13 16.792 7.471 1.173 1.00 0.00 H new ATOM 0 HE2 PHE A 13 20.693 6.320 -0.204 1.00 0.00 H new ATOM 0 HZ PHE A 13 18.433 5.702 0.608 1.00 0.00 H new ATOM 216 N ILE A 14 21.510 13.450 0.327 1.00 0.00 N0 ATOM 217 CA ILE A 14 22.410 14.435 -0.260 1.00 0.00 C0 ATOM 218 C ILE A 14 23.682 14.544 0.572 1.00 0.00 C0 ATOM 219 O ILE A 14 24.786 14.615 0.030 1.00 0.00 O0 ATOM 220 CB ILE A 14 21.716 15.801 -0.330 1.00 0.00 C0 ATOM 221 CG1 ILE A 14 20.605 15.757 -1.381 1.00 0.00 C0 ATOM 222 CG2 ILE A 14 22.731 16.880 -0.718 1.00 0.00 C0 ATOM 223 CD1 ILE A 14 19.683 16.964 -1.201 1.00 0.00 C0 ATOM 0 H ILE A 14 20.598 13.815 0.600 1.00 0.00 H new ATOM 0 HA ILE A 14 22.673 14.115 -1.268 1.00 0.00 H new ATOM 0 HB ILE A 14 21.291 16.035 0.646 1.00 0.00 H new ATOM 0 HG12 ILE A 14 21.037 15.762 -2.382 1.00 0.00 H new ATOM 0 HG13 ILE A 14 20.035 14.833 -1.284 1.00 0.00 H new ATOM 0 HG21 ILE A 14 22.232 17.848 -0.766 1.00 0.00 H new ATOM 0 HG22 ILE A 14 23.525 16.918 0.028 1.00 0.00 H new ATOM 0 HG23 ILE A 14 23.159 16.643 -1.692 1.00 0.00 H new ATOM 0 HD11 ILE A 14 18.892 16.932 -1.950 1.00 0.00 H new ATOM 0 HD12 ILE A 14 19.241 16.939 -0.205 1.00 0.00 H new ATOM 0 HD13 ILE A 14 20.258 17.882 -1.320 1.00 0.00 H new ATOM 235 N LEU A 15 23.527 14.558 1.890 1.00 0.00 N0 ATOM 236 CA LEU A 15 24.680 14.661 2.774 1.00 0.00 C0 ATOM 237 C LEU A 15 25.604 13.461 2.596 1.00 0.00 C0 ATOM 238 O LEU A 15 26.781 13.623 2.301 1.00 0.00 O0 ATOM 239 CB LEU A 15 24.216 14.742 4.227 1.00 0.00 C0 ATOM 240 CG LEU A 15 24.080 16.209 4.636 1.00 0.00 C0 ATOM 241 CD1 LEU A 15 22.732 16.420 5.324 1.00 0.00 C0 ATOM 242 CD2 LEU A 15 25.209 16.571 5.602 1.00 0.00 C0 ATOM 0 H LEU A 15 22.626 14.500 2.365 1.00 0.00 H new ATOM 0 HA LEU A 15 25.231 15.566 2.518 1.00 0.00 H new ATOM 0 HB2 LEU A 15 23.261 14.230 4.344 1.00 0.00 H new ATOM 0 HB3 LEU A 15 24.930 14.237 4.877 1.00 0.00 H new ATOM 0 HG LEU A 15 24.140 16.844 3.752 1.00 0.00 H new ATOM 0 HD11 LEU A 15 22.633 17.465 5.617 1.00 0.00 H new ATOM 0 HD12 LEU A 15 21.928 16.157 4.637 1.00 0.00 H new ATOM 0 HD13 LEU A 15 22.673 15.788 6.210 1.00 0.00 H new ATOM 0 HD21 LEU A 15 25.115 17.616 5.896 1.00 0.00 H new ATOM 0 HD22 LEU A 15 25.147 15.938 6.487 1.00 0.00 H new ATOM 0 HD23 LEU A 15 26.170 16.417 5.112 1.00 0.00 H new ATOM 254 N SER A 16 25.069 12.262 2.810 1.00 0.00 N0 ATOM 255 CA SER A 16 25.871 11.045 2.692 1.00 0.00 C0 ATOM 256 C SER A 16 26.677 11.058 1.394 1.00 0.00 C0 ATOM 257 O SER A 16 27.852 10.671 1.369 1.00 0.00 O0 ATOM 258 CB SER A 16 24.954 9.821 2.714 1.00 0.00 C0 ATOM 259 OG SER A 16 24.274 9.766 3.961 1.00 0.00 O0 ATOM 0 H SER A 16 24.093 12.106 3.064 1.00 0.00 H new ATOM 0 HA SER A 16 26.563 11.000 3.533 1.00 0.00 H new ATOM 0 HB2 SER A 16 24.235 9.876 1.897 1.00 0.00 H new ATOM 0 HB3 SER A 16 25.537 8.912 2.564 1.00 0.00 H new ATOM 0 HG SER A 16 23.529 10.403 3.956 1.00 0.00 H new ATOM 265 N ALA A 17 26.046 11.517 0.322 1.00 0.00 N0 ATOM 266 CA ALA A 17 26.720 11.592 -0.965 1.00 0.00 C0 ATOM 267 C ALA A 17 27.907 12.551 -0.890 1.00 0.00 C0 ATOM 268 O ALA A 17 29.002 12.245 -1.368 1.00 0.00 O0 ATOM 269 CB ALA A 17 25.736 12.073 -2.033 1.00 0.00 C0 ATOM 0 H ALA A 17 25.078 11.840 0.318 1.00 0.00 H new ATOM 0 HA ALA A 17 27.087 10.600 -1.228 1.00 0.00 H new ATOM 0 HB1 ALA A 17 26.243 12.128 -2.996 1.00 0.00 H new ATOM 0 HB2 ALA A 17 24.903 11.374 -2.101 1.00 0.00 H new ATOM 0 HB3 ALA A 17 25.360 13.060 -1.763 1.00 0.00 H new ATOM 275 N LEU A 18 27.689 13.712 -0.279 1.00 0.00 N0 ATOM 276 CA LEU A 18 28.747 14.706 -0.149 1.00 0.00 C0 ATOM 277 C LEU A 18 29.820 14.245 0.840 1.00 0.00 C0 ATOM 278 O LEU A 18 30.967 14.690 0.776 1.00 0.00 O0 ATOM 279 CB LEU A 18 28.153 16.038 0.319 1.00 0.00 C0 ATOM 280 CG LEU A 18 27.215 16.591 -0.759 1.00 0.00 C0 ATOM 281 CD1 LEU A 18 26.456 17.798 -0.203 1.00 0.00 C0 ATOM 282 CD2 LEU A 18 28.032 17.025 -1.983 1.00 0.00 C0 ATOM 0 H LEU A 18 26.796 13.985 0.131 1.00 0.00 H new ATOM 0 HA LEU A 18 29.214 14.835 -1.125 1.00 0.00 H new ATOM 0 HB2 LEU A 18 27.607 15.896 1.252 1.00 0.00 H new ATOM 0 HB3 LEU A 18 28.951 16.752 0.522 1.00 0.00 H new ATOM 0 HG LEU A 18 26.507 15.816 -1.053 1.00 0.00 H new ATOM 0 HD11 LEU A 18 25.788 18.192 -0.969 1.00 0.00 H new ATOM 0 HD12 LEU A 18 25.872 17.492 0.665 1.00 0.00 H new ATOM 0 HD13 LEU A 18 27.166 18.570 0.092 1.00 0.00 H new ATOM 0 HD21 LEU A 18 27.361 17.418 -2.747 1.00 0.00 H new ATOM 0 HD22 LEU A 18 28.742 17.799 -1.691 1.00 0.00 H new ATOM 0 HD23 LEU A 18 28.574 16.167 -2.382 1.00 0.00 H new ATOM 294 N HIS A 19 29.442 13.344 1.744 1.00 0.00 N0 ATOM 295 CA HIS A 19 30.378 12.822 2.737 1.00 0.00 C0 ATOM 296 C HIS A 19 31.447 11.963 2.074 1.00 0.00 C0 ATOM 297 O HIS A 19 32.651 12.187 2.256 1.00 0.00 O0 ATOM 298 CB HIS A 19 29.620 11.978 3.767 1.00 0.00 C0 ATOM 299 CG HIS A 19 28.958 12.876 4.775 1.00 0.00 C0 ATOM 300 ND1 HIS A 19 29.686 13.655 5.660 1.00 0.00 N0 ATOM 301 CD2 HIS A 19 27.637 13.119 5.063 1.00 0.00 C0 ATOM 302 CE1 HIS A 19 28.810 14.324 6.430 1.00 0.00 C0 ATOM 303 NE2 HIS A 19 27.546 14.035 6.107 1.00 0.00 N0 ATOM 0 H HIS A 19 28.499 12.962 1.810 1.00 0.00 H new ATOM 0 HA HIS A 19 30.861 13.666 3.230 1.00 0.00 H new ATOM 0 HB2 HIS A 19 28.871 11.364 3.267 1.00 0.00 H new ATOM 0 HB3 HIS A 19 30.307 11.297 4.269 1.00 0.00 H new ATOM 0 HD1 HIS A 19 30.703 13.711 5.717 1.00 0.00 H new ATOM 0 HD2 HIS A 19 26.797 12.668 4.556 1.00 0.00 H new ATOM 0 HE1 HIS A 19 29.093 15.011 7.214 1.00 0.00 H new ATOM 311 N PHE A 20 31.009 10.990 1.284 1.00 0.00 N0 ATOM 312 CA PHE A 20 31.960 10.127 0.598 1.00 0.00 C0 ATOM 313 C PHE A 20 32.695 10.916 -0.481 1.00 0.00 C0 ATOM 314 O PHE A 20 33.839 10.609 -0.812 1.00 0.00 O0 ATOM 315 CB PHE A 20 31.250 8.913 -0.011 1.00 0.00 C0 ATOM 316 CG PHE A 20 31.462 7.706 0.885 1.00 0.00 C0 ATOM 317 CD1 PHE A 20 30.443 7.277 1.747 1.00 0.00 C0 ATOM 318 CD2 PHE A 20 32.684 7.019 0.857 1.00 0.00 C0 ATOM 319 CE1 PHE A 20 30.648 6.165 2.580 1.00 0.00 C0 ATOM 320 CE2 PHE A 20 32.887 5.908 1.688 1.00 0.00 C0 ATOM 321 CZ PHE A 20 31.872 5.480 2.550 1.00 0.00 C0 ATOM 0 H PHE A 20 30.026 10.782 1.106 1.00 0.00 H new ATOM 0 HA PHE A 20 32.687 9.763 1.324 1.00 0.00 H new ATOM 0 HB2 PHE A 20 30.185 9.117 -0.120 1.00 0.00 H new ATOM 0 HB3 PHE A 20 31.640 8.712 -1.009 1.00 0.00 H new ATOM 0 HD1 PHE A 20 29.500 7.802 1.771 1.00 0.00 H new ATOM 0 HD2 PHE A 20 33.471 7.346 0.194 1.00 0.00 H new ATOM 0 HE1 PHE A 20 29.862 5.837 3.244 1.00 0.00 H new ATOM 0 HE2 PHE A 20 33.830 5.381 1.662 1.00 0.00 H new ATOM 0 HZ PHE A 20 32.030 4.625 3.190 1.00 0.00 H new ATOM 331 N MET A 21 32.043 11.951 -1.007 1.00 0.00 N0 ATOM 332 CA MET A 21 32.665 12.787 -2.029 1.00 0.00 C0 ATOM 333 C MET A 21 33.921 13.455 -1.479 1.00 0.00 C0 ATOM 334 O MET A 21 34.997 13.387 -2.085 1.00 0.00 O0 ATOM 335 CB MET A 21 31.678 13.857 -2.485 1.00 0.00 C0 ATOM 336 CG MET A 21 30.901 13.362 -3.705 1.00 0.00 C0 ATOM 337 SD MET A 21 29.797 14.673 -4.289 1.00 0.00 S0 ATOM 338 CE MET A 21 28.427 13.608 -4.800 1.00 0.00 C0 ATOM 0 H MET A 21 31.097 12.228 -0.746 1.00 0.00 H new ATOM 0 HA MET A 21 32.942 12.158 -2.875 1.00 0.00 H new ATOM 0 HB2 MET A 21 30.988 14.096 -1.676 1.00 0.00 H new ATOM 0 HB3 MET A 21 32.211 14.775 -2.731 1.00 0.00 H new ATOM 0 HG2 MET A 21 31.592 13.074 -4.497 1.00 0.00 H new ATOM 0 HG3 MET A 21 30.324 12.474 -3.447 1.00 0.00 H new ATOM 0 HE1 MET A 21 27.568 14.223 -5.066 1.00 0.00 H new ATOM 0 HE2 MET A 21 28.730 13.015 -5.663 1.00 0.00 H new ATOM 0 HE3 MET A 21 28.157 12.943 -3.979 1.00 0.00 H new ATOM 348 N ALA A 22 33.792 14.093 -0.325 1.00 0.00 N0 ATOM 349 CA ALA A 22 34.938 14.747 0.277 1.00 0.00 C0 ATOM 350 C ALA A 22 36.004 13.714 0.600 1.00 0.00 C0 ATOM 351 O ALA A 22 37.200 13.968 0.462 1.00 0.00 O0 ATOM 352 CB ALA A 22 34.524 15.488 1.548 1.00 0.00 C0 ATOM 0 H ALA A 22 32.922 14.170 0.203 1.00 0.00 H new ATOM 0 HA ALA A 22 35.341 15.472 -0.429 1.00 0.00 H new ATOM 0 HB1 ALA A 22 35.396 15.973 1.987 1.00 0.00 H new ATOM 0 HB2 ALA A 22 33.775 16.241 1.303 1.00 0.00 H new ATOM 0 HB3 ALA A 22 34.105 14.779 2.262 1.00 0.00 H new ATOM 358 N TRP A 23 35.560 12.541 1.046 1.00 0.00 N0 ATOM 359 CA TRP A 23 36.491 11.473 1.400 1.00 0.00 C0 ATOM 360 C TRP A 23 37.334 11.060 0.196 1.00 0.00 C0 ATOM 361 O TRP A 23 38.550 10.901 0.308 1.00 0.00 O0 ATOM 362 CB TRP A 23 35.716 10.260 1.913 1.00 0.00 C0 ATOM 363 CG TRP A 23 35.090 10.581 3.233 1.00 0.00 C0 ATOM 364 CD1 TRP A 23 35.142 11.784 3.853 1.00 0.00 C0 ATOM 365 CD2 TRP A 23 34.325 9.705 4.108 1.00 0.00 C0 ATOM 366 NE1 TRP A 23 34.453 11.701 5.047 1.00 0.00 N0 ATOM 367 CE2 TRP A 23 33.931 10.439 5.250 1.00 0.00 C0 ATOM 368 CE3 TRP A 23 33.936 8.355 4.018 1.00 0.00 C0 ATOM 369 CZ2 TRP A 23 33.179 9.856 6.270 1.00 0.00 C0 ATOM 370 CZ3 TRP A 23 33.180 7.763 5.042 1.00 0.00 C0 ATOM 371 CH2 TRP A 23 32.800 8.515 6.167 1.00 0.00 C0 ATOM 0 H TRP A 23 34.575 12.308 1.170 1.00 0.00 H new ATOM 0 HA TRP A 23 37.155 11.846 2.179 1.00 0.00 H new ATOM 0 HB2 TRP A 23 34.947 9.978 1.194 1.00 0.00 H new ATOM 0 HB3 TRP A 23 36.385 9.406 2.016 1.00 0.00 H new ATOM 0 HD1 TRP A 23 35.641 12.664 3.475 1.00 0.00 H new ATOM 0 HE1 TRP A 23 34.343 12.477 5.699 1.00 0.00 H new ATOM 0 HE3 TRP A 23 34.221 7.771 3.155 1.00 0.00 H new ATOM 0 HZ2 TRP A 23 32.892 10.437 7.134 1.00 0.00 H new ATOM 0 HZ3 TRP A 23 32.889 6.726 4.965 1.00 0.00 H new ATOM 0 HH2 TRP A 23 32.216 8.057 6.951 1.00 0.00 H new ATOM 382 N THR A 24 36.683 10.872 -0.947 1.00 0.00 N0 ATOM 383 CA THR A 24 37.395 10.463 -2.150 1.00 0.00 C0 ATOM 384 C THR A 24 38.469 11.489 -2.492 1.00 0.00 C0 ATOM 385 O THR A 24 39.589 11.132 -2.855 1.00 0.00 O0 ATOM 386 CB THR A 24 36.409 10.335 -3.325 1.00 0.00 C0 ATOM 387 OG1 THR A 24 35.814 11.598 -3.572 1.00 0.00 O0 ATOM 388 CG2 THR A 24 35.301 9.309 -3.007 1.00 0.00 C0 ATOM 0 H THR A 24 35.677 10.994 -1.065 1.00 0.00 H new ATOM 0 HA THR A 24 37.866 9.497 -1.970 1.00 0.00 H new ATOM 0 HB THR A 24 36.958 9.994 -4.203 1.00 0.00 H new ATOM 0 HG1 THR A 24 35.309 11.882 -2.782 1.00 0.00 H new ATOM 0 HG21 THR A 24 34.618 9.237 -3.853 1.00 0.00 H new ATOM 0 HG22 THR A 24 35.751 8.334 -2.820 1.00 0.00 H new ATOM 0 HG23 THR A 24 34.751 9.630 -2.122 1.00 0.00 H new ATOM 396 N ILE A 25 38.130 12.767 -2.357 1.00 0.00 N0 ATOM 397 CA ILE A 25 39.097 13.821 -2.642 1.00 0.00 C0 ATOM 398 C ILE A 25 40.239 13.784 -1.628 1.00 0.00 C0 ATOM 399 O ILE A 25 41.407 13.967 -1.975 1.00 0.00 O0 ATOM 400 CB ILE A 25 38.416 15.188 -2.607 1.00 0.00 C0 ATOM 401 CG1 ILE A 25 37.426 15.280 -3.770 1.00 0.00 C0 ATOM 402 CG2 ILE A 25 39.464 16.295 -2.739 1.00 0.00 C0 ATOM 403 CD1 ILE A 25 36.593 16.554 -3.637 1.00 0.00 C0 ATOM 0 H ILE A 25 37.211 13.094 -2.058 1.00 0.00 H new ATOM 0 HA ILE A 25 39.505 13.654 -3.639 1.00 0.00 H new ATOM 0 HB ILE A 25 37.889 15.309 -1.660 1.00 0.00 H new ATOM 0 HG12 ILE A 25 37.963 15.283 -4.718 1.00 0.00 H new ATOM 0 HG13 ILE A 25 36.774 14.406 -3.775 1.00 0.00 H new ATOM 0 HG21 ILE A 25 38.972 17.267 -2.713 1.00 0.00 H new ATOM 0 HG22 ILE A 25 40.173 16.225 -1.914 1.00 0.00 H new ATOM 0 HG23 ILE A 25 39.995 16.182 -3.684 1.00 0.00 H new ATOM 0 HD11 ILE A 25 35.889 16.617 -4.467 1.00 0.00 H new ATOM 0 HD12 ILE A 25 36.044 16.533 -2.696 1.00 0.00 H new ATOM 0 HD13 ILE A 25 37.251 17.423 -3.653 1.00 0.00 H new ATOM 415 N GLY A 26 39.885 13.549 -0.371 1.00 0.00 N0 ATOM 416 CA GLY A 26 40.876 13.498 0.693 1.00 0.00 C0 ATOM 417 C GLY A 26 41.932 12.438 0.400 1.00 0.00 C0 ATOM 418 O GLY A 26 43.131 12.696 0.507 1.00 0.00 O0 ATOM 0 H GLY A 26 38.925 13.392 -0.066 1.00 0.00 H new ATOM 0 HA2 GLY A 26 41.352 14.473 0.799 1.00 0.00 H new ATOM 0 HA3 GLY A 26 40.386 13.277 1.642 1.00 0.00 H new ATOM 422 N HIS A 27 41.479 11.248 0.028 1.00 0.00 N0 ATOM 423 CA HIS A 27 42.389 10.155 -0.284 1.00 0.00 C0 ATOM 424 C HIS A 27 43.166 10.454 -1.563 1.00 0.00 C0 ATOM 425 O HIS A 27 44.342 10.109 -1.684 1.00 0.00 O0 ATOM 426 CB HIS A 27 41.609 8.850 -0.449 1.00 0.00 C0 ATOM 427 CG HIS A 27 42.573 7.694 -0.482 1.00 0.00 C0 ATOM 428 ND1 HIS A 27 43.416 7.410 0.581 1.00 0.00 N0 ATOM 429 CD2 HIS A 27 42.833 6.741 -1.434 1.00 0.00 C0 ATOM 430 CE1 HIS A 27 44.139 6.326 0.245 1.00 0.00 C0 ATOM 431 NE2 HIS A 27 43.823 5.878 -0.973 1.00 0.00 N0 ATOM 0 H HIS A 27 40.490 11.016 -0.065 1.00 0.00 H new ATOM 0 HA HIS A 27 43.094 10.050 0.540 1.00 0.00 H new ATOM 0 HB2 HIS A 27 40.905 8.728 0.374 1.00 0.00 H new ATOM 0 HB3 HIS A 27 41.024 8.877 -1.368 1.00 0.00 H new ATOM 0 HD2 HIS A 27 42.344 6.671 -2.394 1.00 0.00 H new ATOM 0 HE1 HIS A 27 44.884 5.873 0.883 1.00 0.00 H new ATOM 0 HE2 HIS A 27 44.222 5.076 -1.461 1.00 0.00 H new ATOM 439 N LEU A 28 42.502 11.112 -2.509 1.00 0.00 N0 ATOM 440 CA LEU A 28 43.137 11.469 -3.774 1.00 0.00 C0 ATOM 441 C LEU A 28 44.138 12.607 -3.583 1.00 0.00 C0 ATOM 442 O LEU A 28 44.919 12.905 -4.489 1.00 0.00 O0 ATOM 443 CB LEU A 28 42.073 11.888 -4.789 1.00 0.00 C0 ATOM 444 CG LEU A 28 41.289 10.656 -5.241 1.00 0.00 C0 ATOM 445 CD1 LEU A 28 40.008 11.099 -5.949 1.00 0.00 C0 ATOM 446 CD2 LEU A 28 42.144 9.840 -6.214 1.00 0.00 C0 ATOM 0 H LEU A 28 41.529 11.408 -2.425 1.00 0.00 H new ATOM 0 HA LEU A 28 43.674 10.595 -4.144 1.00 0.00 H new ATOM 0 HB2 LEU A 28 41.398 12.619 -4.344 1.00 0.00 H new ATOM 0 HB3 LEU A 28 42.543 12.369 -5.647 1.00 0.00 H new ATOM 0 HG LEU A 28 41.036 10.048 -4.373 1.00 0.00 H new ATOM 0 HD11 LEU A 28 39.448 10.221 -6.272 1.00 0.00 H new ATOM 0 HD12 LEU A 28 39.398 11.686 -5.263 1.00 0.00 H new ATOM 0 HD13 LEU A 28 40.264 11.706 -6.818 1.00 0.00 H new ATOM 0 HD21 LEU A 28 41.587 8.961 -6.538 1.00 0.00 H new ATOM 0 HD22 LEU A 28 42.393 10.452 -7.081 1.00 0.00 H new ATOM 0 HD23 LEU A 28 43.062 9.526 -5.717 1.00 0.00 H new ATOM 643 N GLN B 6 11.564 0.935 5.751 1.00 0.00 N0 ATOM 644 CA GLN B 6 12.414 -0.250 5.660 1.00 0.00 C0 ATOM 645 C GLN B 6 13.557 -0.052 4.674 1.00 0.00 C0 ATOM 646 O GLN B 6 14.680 -0.497 4.912 1.00 0.00 O0 ATOM 647 CB GLN B 6 11.582 -1.438 5.197 1.00 0.00 C0 ATOM 648 CG GLN B 6 10.630 -1.858 6.310 1.00 0.00 C0 ATOM 649 CD GLN B 6 9.653 -2.901 5.782 1.00 0.00 C0 ATOM 650 OE1 GLN B 6 9.212 -2.812 4.636 1.00 0.00 O0 ATOM 651 NE2 GLN B 6 9.297 -3.893 6.547 1.00 0.00 N0 ATOM 0 HA GLN B 6 12.834 -0.429 6.650 1.00 0.00 H new ATOM 0 HB2 GLN B 6 11.018 -1.174 4.302 1.00 0.00 H new ATOM 0 HB3 GLN B 6 12.234 -2.269 4.929 1.00 0.00 H new ATOM 0 HG2 GLN B 6 11.193 -2.265 7.150 1.00 0.00 H new ATOM 0 HG3 GLN B 6 10.085 -0.991 6.683 1.00 0.00 H new ATOM 0 HE21 GLN B 6 9.665 -3.963 7.496 1.00 0.00 H new ATOM 0 HE22 GLN B 6 8.650 -4.600 6.197 1.00 0.00 H new ATOM 660 N ILE B 7 13.245 0.591 3.560 1.00 0.00 N0 ATOM 661 CA ILE B 7 14.241 0.820 2.516 1.00 0.00 C0 ATOM 662 C ILE B 7 15.331 1.750 3.040 1.00 0.00 C0 ATOM 663 O ILE B 7 16.514 1.580 2.724 1.00 0.00 O0 ATOM 664 CB ILE B 7 13.596 1.402 1.226 1.00 0.00 C0 ATOM 665 CG1 ILE B 7 13.707 2.936 1.211 1.00 0.00 C0 ATOM 666 CG2 ILE B 7 12.120 0.998 1.137 1.00 0.00 C0 ATOM 667 CD1 ILE B 7 12.802 3.530 0.124 1.00 0.00 C0 ATOM 0 H ILE B 7 12.318 0.963 3.353 1.00 0.00 H new ATOM 0 HA ILE B 7 14.684 -0.140 2.251 1.00 0.00 H new ATOM 0 HB ILE B 7 14.132 0.997 0.368 1.00 0.00 H new ATOM 0 HG12 ILE B 7 13.426 3.336 2.185 1.00 0.00 H new ATOM 0 HG13 ILE B 7 14.741 3.230 1.032 1.00 0.00 H new ATOM 0 HG21 ILE B 7 11.683 1.413 0.229 1.00 0.00 H new ATOM 0 HG22 ILE B 7 12.041 -0.089 1.114 1.00 0.00 H new ATOM 0 HG23 ILE B 7 11.585 1.382 2.005 1.00 0.00 H new ATOM 0 HD11 ILE B 7 12.893 4.616 0.128 1.00 0.00 H new ATOM 0 HD12 ILE B 7 13.102 3.144 -0.850 1.00 0.00 H new ATOM 0 HD13 ILE B 7 11.767 3.252 0.321 1.00 0.00 H new ATOM 679 N LEU B 8 14.929 2.732 3.838 1.00 0.00 N0 ATOM 680 CA LEU B 8 15.872 3.684 4.395 1.00 0.00 C0 ATOM 681 C LEU B 8 16.713 3.046 5.487 1.00 0.00 C0 ATOM 682 O LEU B 8 17.888 3.375 5.655 1.00 0.00 O0 ATOM 683 CB LEU B 8 15.114 4.893 4.950 1.00 0.00 C0 ATOM 684 CG LEU B 8 16.101 5.917 5.519 1.00 0.00 C0 ATOM 685 CD1 LEU B 8 17.023 6.425 4.405 1.00 0.00 C0 ATOM 686 CD2 LEU B 8 15.322 7.092 6.113 1.00 0.00 C0 ATOM 0 H LEU B 8 13.958 2.887 4.111 1.00 0.00 H new ATOM 0 HA LEU B 8 16.544 4.010 3.601 1.00 0.00 H new ATOM 0 HB2 LEU B 8 14.517 5.351 4.161 1.00 0.00 H new ATOM 0 HB3 LEU B 8 14.422 4.572 5.728 1.00 0.00 H new ATOM 0 HG LEU B 8 16.704 5.446 6.295 1.00 0.00 H new ATOM 0 HD11 LEU B 8 17.723 7.153 4.816 1.00 0.00 H new ATOM 0 HD12 LEU B 8 17.577 5.588 3.981 1.00 0.00 H new ATOM 0 HD13 LEU B 8 16.425 6.896 3.625 1.00 0.00 H new ATOM 0 HD21 LEU B 8 16.021 7.823 6.519 1.00 0.00 H new ATOM 0 HD22 LEU B 8 14.719 7.559 5.335 1.00 0.00 H new ATOM 0 HD23 LEU B 8 14.671 6.731 6.909 1.00 0.00 H new ATOM 698 N SER B 9 16.106 2.126 6.218 1.00 0.00 N0 ATOM 699 CA SER B 9 16.808 1.437 7.289 1.00 0.00 C0 ATOM 700 C SER B 9 17.854 0.488 6.715 1.00 0.00 C0 ATOM 701 O SER B 9 18.988 0.444 7.189 1.00 0.00 O0 ATOM 702 CB SER B 9 15.814 0.652 8.142 1.00 0.00 C0 ATOM 703 OG SER B 9 16.502 0.056 9.233 1.00 0.00 O0 ATOM 0 H SER B 9 15.135 1.840 6.091 1.00 0.00 H new ATOM 0 HA SER B 9 17.309 2.179 7.910 1.00 0.00 H new ATOM 0 HB2 SER B 9 15.030 1.314 8.509 1.00 0.00 H new ATOM 0 HB3 SER B 9 15.327 -0.116 7.540 1.00 0.00 H new ATOM 0 HG SER B 9 15.867 -0.448 9.784 1.00 0.00 H new ATOM 709 N ILE B 10 17.464 -0.272 5.695 1.00 0.00 N0 ATOM 710 CA ILE B 10 18.379 -1.222 5.075 1.00 0.00 C0 ATOM 711 C ILE B 10 19.583 -0.492 4.498 1.00 0.00 C0 ATOM 712 O ILE B 10 20.727 -0.887 4.732 1.00 0.00 O0 ATOM 713 CB ILE B 10 17.664 -1.993 3.955 1.00 0.00 C0 ATOM 714 CG1 ILE B 10 16.555 -2.869 4.556 1.00 0.00 C0 ATOM 715 CG2 ILE B 10 18.675 -2.876 3.213 1.00 0.00 C0 ATOM 716 CD1 ILE B 10 17.149 -4.135 5.181 1.00 0.00 C0 ATOM 0 H ILE B 10 16.530 -0.249 5.285 1.00 0.00 H new ATOM 0 HA ILE B 10 18.716 -1.925 5.837 1.00 0.00 H new ATOM 0 HB ILE B 10 17.221 -1.284 3.255 1.00 0.00 H new ATOM 0 HG12 ILE B 10 16.008 -2.305 5.312 1.00 0.00 H new ATOM 0 HG13 ILE B 10 15.838 -3.141 3.781 1.00 0.00 H new ATOM 0 HG21 ILE B 10 18.167 -3.423 2.419 1.00 0.00 H new ATOM 0 HG22 ILE B 10 19.456 -2.251 2.781 1.00 0.00 H new ATOM 0 HG23 ILE B 10 19.122 -3.583 3.912 1.00 0.00 H new ATOM 0 HD11 ILE B 10 16.348 -4.743 5.602 1.00 0.00 H new ATOM 0 HD12 ILE B 10 17.675 -4.706 4.416 1.00 0.00 H new ATOM 0 HD13 ILE B 10 17.847 -3.858 5.971 1.00 0.00 H new ATOM 728 N CYS B 11 19.332 0.576 3.746 1.00 0.00 N0 ATOM 729 CA CYS B 11 20.424 1.335 3.155 1.00 0.00 C0 ATOM 730 C CYS B 11 21.313 1.942 4.236 1.00 0.00 C0 ATOM 731 O CYS B 11 22.535 1.797 4.199 1.00 0.00 O0 ATOM 732 CB CYS B 11 19.862 2.446 2.272 1.00 0.00 C0 ATOM 733 SG CYS B 11 21.228 3.399 1.566 1.00 0.00 S0 ATOM 0 H CYS B 11 18.399 0.929 3.535 1.00 0.00 H new ATOM 0 HA CYS B 11 21.027 0.656 2.552 1.00 0.00 H new ATOM 0 HB2 CYS B 11 19.252 2.020 1.476 1.00 0.00 H new ATOM 0 HB3 CYS B 11 19.213 3.098 2.857 1.00 0.00 H new ATOM 0 HG CYS B 11 20.753 4.345 0.812 1.00 0.00 H new ATOM 739 N SER B 12 20.702 2.649 5.180 1.00 0.00 N0 ATOM 740 CA SER B 12 21.461 3.296 6.241 1.00 0.00 C0 ATOM 741 C SER B 12 22.341 2.279 6.958 1.00 0.00 C0 ATOM 742 O SER B 12 23.520 2.536 7.211 1.00 0.00 O0 ATOM 743 CB SER B 12 20.503 3.944 7.240 1.00 0.00 C0 ATOM 744 OG SER B 12 21.251 4.660 8.213 1.00 0.00 O0 ATOM 0 H SER B 12 19.693 2.787 5.232 1.00 0.00 H new ATOM 0 HA SER B 12 22.098 4.063 5.800 1.00 0.00 H new ATOM 0 HB2 SER B 12 19.820 4.617 6.722 1.00 0.00 H new ATOM 0 HB3 SER B 12 19.893 3.181 7.723 1.00 0.00 H new ATOM 0 HG SER B 12 20.639 5.078 8.854 1.00 0.00 H new ATOM 750 N PHE B 13 21.764 1.129 7.287 1.00 0.00 N0 ATOM 751 CA PHE B 13 22.510 0.084 7.977 1.00 0.00 C0 ATOM 752 C PHE B 13 23.718 -0.343 7.149 1.00 0.00 C0 ATOM 753 O PHE B 13 24.822 -0.497 7.677 1.00 0.00 O0 ATOM 754 CB PHE B 13 21.603 -1.123 8.222 1.00 0.00 C0 ATOM 755 CG PHE B 13 21.055 -1.069 9.627 1.00 0.00 C0 ATOM 756 CD1 PHE B 13 19.690 -0.841 9.844 1.00 0.00 C0 ATOM 757 CD2 PHE B 13 21.917 -1.250 10.714 1.00 0.00 C0 ATOM 758 CE1 PHE B 13 19.189 -0.795 11.152 1.00 0.00 C0 ATOM 759 CE2 PHE B 13 21.417 -1.203 12.019 1.00 0.00 C0 ATOM 760 CZ PHE B 13 20.053 -0.977 12.239 1.00 0.00 C0 ATOM 0 H PHE B 13 20.790 0.898 7.089 1.00 0.00 H new ATOM 0 HA PHE B 13 22.859 0.477 8.932 1.00 0.00 H new ATOM 0 HB2 PHE B 13 20.785 -1.128 7.502 1.00 0.00 H new ATOM 0 HB3 PHE B 13 22.163 -2.047 8.075 1.00 0.00 H new ATOM 0 HD1 PHE B 13 19.025 -0.701 9.005 1.00 0.00 H new ATOM 0 HD2 PHE B 13 22.969 -1.426 10.545 1.00 0.00 H new ATOM 0 HE1 PHE B 13 18.137 -0.619 11.322 1.00 0.00 H new ATOM 0 HE2 PHE B 13 22.083 -1.341 12.858 1.00 0.00 H new ATOM 0 HZ PHE B 13 19.667 -0.943 13.247 1.00 0.00 H new ATOM 770 N ILE B 14 23.504 -0.525 5.852 1.00 0.00 N0 ATOM 771 CA ILE B 14 24.585 -0.930 4.960 1.00 0.00 C0 ATOM 772 C ILE B 14 25.701 0.106 4.987 1.00 0.00 C0 ATOM 773 O ILE B 14 26.881 -0.240 5.030 1.00 0.00 O0 ATOM 774 CB ILE B 14 24.054 -1.086 3.531 1.00 0.00 C0 ATOM 775 CG1 ILE B 14 23.141 -2.312 3.457 1.00 0.00 C0 ATOM 776 CG2 ILE B 14 25.223 -1.274 2.561 1.00 0.00 C0 ATOM 777 CD1 ILE B 14 22.324 -2.262 2.163 1.00 0.00 C0 ATOM 0 H ILE B 14 22.600 -0.400 5.396 1.00 0.00 H new ATOM 0 HA ILE B 14 24.982 -1.887 5.299 1.00 0.00 H new ATOM 0 HB ILE B 14 23.495 -0.191 3.258 1.00 0.00 H new ATOM 0 HG12 ILE B 14 23.736 -3.225 3.489 1.00 0.00 H new ATOM 0 HG13 ILE B 14 22.475 -2.336 4.320 1.00 0.00 H new ATOM 0 HG21 ILE B 14 24.840 -1.384 1.547 1.00 0.00 H new ATOM 0 HG22 ILE B 14 25.879 -0.405 2.609 1.00 0.00 H new ATOM 0 HG23 ILE B 14 25.784 -2.167 2.836 1.00 0.00 H new ATOM 0 HD11 ILE B 14 21.673 -3.135 2.109 1.00 0.00 H new ATOM 0 HD12 ILE B 14 21.718 -1.356 2.150 1.00 0.00 H new ATOM 0 HD13 ILE B 14 22.998 -2.259 1.307 1.00 0.00 H new ATOM 789 N LEU B 15 25.326 1.378 4.964 1.00 0.00 N0 ATOM 790 CA LEU B 15 26.318 2.449 4.984 1.00 0.00 C0 ATOM 791 C LEU B 15 27.131 2.400 6.273 1.00 0.00 C0 ATOM 792 O LEU B 15 28.352 2.306 6.231 1.00 0.00 O0 ATOM 793 CB LEU B 15 25.622 3.804 4.865 1.00 0.00 C0 ATOM 794 CG LEU B 15 25.564 4.217 3.394 1.00 0.00 C0 ATOM 795 CD1 LEU B 15 24.148 4.673 3.050 1.00 0.00 C0 ATOM 796 CD2 LEU B 15 26.543 5.369 3.155 1.00 0.00 C0 ATOM 0 H LEU B 15 24.356 1.693 4.932 1.00 0.00 H new ATOM 0 HA LEU B 15 26.993 2.313 4.139 1.00 0.00 H new ATOM 0 HB2 LEU B 15 24.615 3.746 5.278 1.00 0.00 H new ATOM 0 HB3 LEU B 15 26.161 4.554 5.444 1.00 0.00 H new ATOM 0 HG LEU B 15 25.835 3.370 2.764 1.00 0.00 H new ATOM 0 HD11 LEU B 15 24.105 4.968 2.001 1.00 0.00 H new ATOM 0 HD12 LEU B 15 23.450 3.855 3.226 1.00 0.00 H new ATOM 0 HD13 LEU B 15 23.877 5.522 3.677 1.00 0.00 H new ATOM 0 HD21 LEU B 15 26.505 5.667 2.107 1.00 0.00 H new ATOM 0 HD22 LEU B 15 26.268 6.216 3.783 1.00 0.00 H new ATOM 0 HD23 LEU B 15 27.554 5.045 3.404 1.00 0.00 H new ATOM 808 N SER B 16 26.453 2.498 7.411 1.00 0.00 N0 ATOM 809 CA SER B 16 27.135 2.491 8.705 1.00 0.00 C0 ATOM 810 C SER B 16 28.148 1.348 8.766 1.00 0.00 C0 ATOM 811 O SER B 16 29.266 1.514 9.273 1.00 0.00 O0 ATOM 812 CB SER B 16 26.109 2.329 9.827 1.00 0.00 C0 ATOM 813 OG SER B 16 25.227 3.445 9.819 1.00 0.00 O0 ATOM 0 H SER B 16 25.438 2.583 7.467 1.00 0.00 H new ATOM 0 HA SER B 16 27.663 3.436 8.829 1.00 0.00 H new ATOM 0 HB2 SER B 16 25.547 1.405 9.691 1.00 0.00 H new ATOM 0 HB3 SER B 16 26.614 2.256 10.790 1.00 0.00 H new ATOM 0 HG SER B 16 24.580 3.346 9.090 1.00 0.00 H new ATOM 819 N ALA B 17 27.758 0.195 8.238 1.00 0.00 N0 ATOM 820 CA ALA B 17 28.645 -0.957 8.228 1.00 0.00 C0 ATOM 821 C ALA B 17 29.891 -0.661 7.396 1.00 0.00 C0 ATOM 822 O ALA B 17 31.016 -0.957 7.811 1.00 0.00 O0 ATOM 823 CB ALA B 17 27.910 -2.166 7.645 1.00 0.00 C0 ATOM 0 H ALA B 17 26.843 0.035 7.816 1.00 0.00 H new ATOM 0 HA ALA B 17 28.951 -1.175 9.251 1.00 0.00 H new ATOM 0 HB1 ALA B 17 28.576 -3.028 7.638 1.00 0.00 H new ATOM 0 HB2 ALA B 17 27.035 -2.389 8.255 1.00 0.00 H new ATOM 0 HB3 ALA B 17 27.595 -1.943 6.626 1.00 0.00 H new ATOM 829 N LEU B 18 29.690 -0.070 6.222 1.00 0.00 N0 ATOM 830 CA LEU B 18 30.805 0.259 5.342 1.00 0.00 C0 ATOM 831 C LEU B 18 31.642 1.403 5.916 1.00 0.00 C0 ATOM 832 O LEU B 18 32.822 1.548 5.587 1.00 0.00 O0 ATOM 833 CB LEU B 18 30.278 0.648 3.959 1.00 0.00 C0 ATOM 834 CG LEU B 18 29.599 -0.559 3.307 1.00 0.00 C0 ATOM 835 CD1 LEU B 18 28.880 -0.113 2.033 1.00 0.00 C0 ATOM 836 CD2 LEU B 18 30.651 -1.618 2.953 1.00 0.00 C0 ATOM 0 H LEU B 18 28.772 0.189 5.860 1.00 0.00 H new ATOM 0 HA LEU B 18 31.442 -0.621 5.257 1.00 0.00 H new ATOM 0 HB2 LEU B 18 29.570 1.472 4.048 1.00 0.00 H new ATOM 0 HB3 LEU B 18 31.098 0.999 3.332 1.00 0.00 H new ATOM 0 HG LEU B 18 28.878 -0.985 4.005 1.00 0.00 H new ATOM 0 HD11 LEU B 18 28.396 -0.972 1.568 1.00 0.00 H new ATOM 0 HD12 LEU B 18 28.128 0.636 2.283 1.00 0.00 H new ATOM 0 HD13 LEU B 18 29.602 0.316 1.339 1.00 0.00 H new ATOM 0 HD21 LEU B 18 30.163 -2.475 2.489 1.00 0.00 H new ATOM 0 HD22 LEU B 18 31.375 -1.193 2.258 1.00 0.00 H new ATOM 0 HD23 LEU B 18 31.163 -1.939 3.860 1.00 0.00 H new ATOM 848 N HIS B 19 31.029 2.211 6.779 1.00 0.00 N0 ATOM 849 CA HIS B 19 31.725 3.334 7.398 1.00 0.00 C0 ATOM 850 C HIS B 19 32.801 2.842 8.357 1.00 0.00 C0 ATOM 851 O HIS B 19 33.972 3.227 8.258 1.00 0.00 O0 ATOM 852 CB HIS B 19 30.722 4.203 8.166 1.00 0.00 C0 ATOM 853 CG HIS B 19 29.991 5.107 7.211 1.00 0.00 C0 ATOM 854 ND1 HIS B 19 30.634 6.118 6.516 1.00 0.00 N0 ATOM 855 CD2 HIS B 19 28.671 5.172 6.836 1.00 0.00 C0 ATOM 856 CE1 HIS B 19 29.709 6.744 5.765 1.00 0.00 C0 ATOM 857 NE2 HIS B 19 28.496 6.207 5.923 1.00 0.00 N0 ATOM 0 H HIS B 19 30.055 2.108 7.064 1.00 0.00 H new ATOM 0 HA HIS B 19 32.198 3.920 6.611 1.00 0.00 H new ATOM 0 HB2 HIS B 19 30.011 3.570 8.697 1.00 0.00 H new ATOM 0 HB3 HIS B 19 31.243 4.797 8.917 1.00 0.00 H new ATOM 0 HD1 HIS B 19 31.627 6.346 6.564 1.00 0.00 H new ATOM 0 HD2 HIS B 19 27.889 4.519 7.195 1.00 0.00 H new ATOM 0 HE1 HIS B 19 29.922 7.579 5.114 1.00 0.00 H new ATOM 865 N PHE B 20 32.407 1.970 9.279 1.00 0.00 N0 ATOM 866 CA PHE B 20 33.370 1.436 10.230 1.00 0.00 C0 ATOM 867 C PHE B 20 34.353 0.515 9.515 1.00 0.00 C0 ATOM 868 O PHE B 20 35.499 0.371 9.936 1.00 0.00 O0 ATOM 869 CB PHE B 20 32.658 0.689 11.365 1.00 0.00 C0 ATOM 870 CG PHE B 20 32.592 1.581 12.592 1.00 0.00 C0 ATOM 871 CD1 PHE B 20 31.404 2.252 12.918 1.00 0.00 C0 ATOM 872 CD2 PHE B 20 33.727 1.746 13.399 1.00 0.00 C0 ATOM 873 CE1 PHE B 20 31.353 3.085 14.048 1.00 0.00 C0 ATOM 874 CE2 PHE B 20 33.675 2.577 14.528 1.00 0.00 C0 ATOM 875 CZ PHE B 20 32.490 3.248 14.855 1.00 0.00 C0 ATOM 0 H PHE B 20 31.453 1.626 9.386 1.00 0.00 H new ATOM 0 HA PHE B 20 33.923 2.267 10.669 1.00 0.00 H new ATOM 0 HB2 PHE B 20 31.653 0.405 11.054 1.00 0.00 H new ATOM 0 HB3 PHE B 20 33.191 -0.232 11.600 1.00 0.00 H new ATOM 0 HD1 PHE B 20 30.527 2.128 12.299 1.00 0.00 H new ATOM 0 HD2 PHE B 20 34.644 1.232 13.151 1.00 0.00 H new ATOM 0 HE1 PHE B 20 30.437 3.601 14.296 1.00 0.00 H new ATOM 0 HE2 PHE B 20 34.552 2.700 15.147 1.00 0.00 H new ATOM 0 HZ PHE B 20 32.451 3.888 15.724 1.00 0.00 H new ATOM 885 N MET B 21 33.907 -0.087 8.414 1.00 0.00 N0 ATOM 886 CA MET B 21 34.773 -0.969 7.639 1.00 0.00 C0 ATOM 887 C MET B 21 35.979 -0.204 7.107 1.00 0.00 C0 ATOM 888 O MET B 21 37.130 -0.625 7.281 1.00 0.00 O0 ATOM 889 CB MET B 21 33.988 -1.559 6.470 1.00 0.00 C0 ATOM 890 CG MET B 21 33.388 -2.906 6.877 1.00 0.00 C0 ATOM 891 SD MET B 21 32.537 -3.640 5.457 1.00 0.00 S0 ATOM 892 CE MET B 21 31.175 -4.404 6.375 1.00 0.00 C0 ATOM 0 H MET B 21 32.963 0.019 8.043 1.00 0.00 H new ATOM 0 HA MET B 21 35.125 -1.770 8.288 1.00 0.00 H new ATOM 0 HB2 MET B 21 33.196 -0.874 6.169 1.00 0.00 H new ATOM 0 HB3 MET B 21 34.643 -1.688 5.608 1.00 0.00 H new ATOM 0 HG2 MET B 21 34.173 -3.575 7.230 1.00 0.00 H new ATOM 0 HG3 MET B 21 32.690 -2.771 7.703 1.00 0.00 H new ATOM 0 HE1 MET B 21 30.431 -4.783 5.674 1.00 0.00 H new ATOM 0 HE2 MET B 21 31.559 -5.227 6.977 1.00 0.00 H new ATOM 0 HE3 MET B 21 30.714 -3.662 7.027 1.00 0.00 H new ATOM 902 N ALA B 22 35.722 0.926 6.467 1.00 0.00 N0 ATOM 903 CA ALA B 22 36.810 1.728 5.937 1.00 0.00 C0 ATOM 904 C ALA B 22 37.695 2.203 7.077 1.00 0.00 C0 ATOM 905 O ALA B 22 38.915 2.275 6.945 1.00 0.00 O0 ATOM 906 CB ALA B 22 36.259 2.925 5.163 1.00 0.00 C0 ATOM 0 H ALA B 22 34.788 1.302 6.305 1.00 0.00 H new ATOM 0 HA ALA B 22 37.402 1.118 5.254 1.00 0.00 H new ATOM 0 HB1 ALA B 22 37.086 3.517 4.772 1.00 0.00 H new ATOM 0 HB2 ALA B 22 35.643 2.571 4.336 1.00 0.00 H new ATOM 0 HB3 ALA B 22 35.654 3.541 5.828 1.00 0.00 H new ATOM 912 N TRP B 23 37.065 2.538 8.200 1.00 0.00 N0 ATOM 913 CA TRP B 23 37.808 3.020 9.359 1.00 0.00 C0 ATOM 914 C TRP B 23 38.800 1.967 9.848 1.00 0.00 C0 ATOM 915 O TRP B 23 39.956 2.279 10.133 1.00 0.00 O0 ATOM 916 CB TRP B 23 36.839 3.366 10.490 1.00 0.00 C0 ATOM 917 CG TRP B 23 36.031 4.569 10.110 1.00 0.00 C0 ATOM 918 CD1 TRP B 23 36.097 5.214 8.921 1.00 0.00 C0 ATOM 919 CD2 TRP B 23 35.046 5.286 10.908 1.00 0.00 C0 ATOM 920 NE1 TRP B 23 35.211 6.273 8.936 1.00 0.00 N0 ATOM 921 CE2 TRP B 23 34.540 6.360 10.141 1.00 0.00 C0 ATOM 922 CE3 TRP B 23 34.545 5.107 12.211 1.00 0.00 C0 ATOM 923 CZ2 TRP B 23 33.572 7.227 10.646 1.00 0.00 C0 ATOM 924 CZ3 TRP B 23 33.572 5.979 12.723 1.00 0.00 C0 ATOM 925 CH2 TRP B 23 33.085 7.037 11.942 1.00 0.00 C0 ATOM 0 H TRP B 23 36.055 2.485 8.331 1.00 0.00 H new ATOM 0 HA TRP B 23 38.362 3.910 9.061 1.00 0.00 H new ATOM 0 HB2 TRP B 23 36.180 2.521 10.689 1.00 0.00 H new ATOM 0 HB3 TRP B 23 37.392 3.562 11.409 1.00 0.00 H new ATOM 0 HD1 TRP B 23 36.738 4.944 8.095 1.00 0.00 H new ATOM 0 HE1 TRP B 23 35.069 6.912 8.154 1.00 0.00 H new ATOM 0 HE3 TRP B 23 34.911 4.294 12.820 1.00 0.00 H new ATOM 0 HZ2 TRP B 23 33.201 8.040 10.040 1.00 0.00 H new ATOM 0 HZ3 TRP B 23 33.196 5.834 13.725 1.00 0.00 H new ATOM 0 HH2 TRP B 23 32.335 7.704 12.341 1.00 0.00 H new ATOM 936 N THR B 24 38.337 0.726 9.964 1.00 0.00 N0 ATOM 937 CA THR B 24 39.199 -0.350 10.437 1.00 0.00 C0 ATOM 938 C THR B 24 40.412 -0.481 9.524 1.00 0.00 C0 ATOM 939 O THR B 24 41.537 -0.662 9.993 1.00 0.00 O0 ATOM 940 CB THR B 24 38.419 -1.675 10.459 1.00 0.00 C0 ATOM 941 OG1 THR B 24 38.005 -1.991 9.139 1.00 0.00 O0 ATOM 942 CG2 THR B 24 37.175 -1.571 11.367 1.00 0.00 C0 ATOM 0 H THR B 24 37.383 0.444 9.740 1.00 0.00 H new ATOM 0 HA THR B 24 39.535 -0.117 11.447 1.00 0.00 H new ATOM 0 HB THR B 24 39.071 -2.455 10.852 1.00 0.00 H new ATOM 0 HG1 THR B 24 37.391 -1.300 8.814 1.00 0.00 H new ATOM 0 HG21 THR B 24 36.642 -2.522 11.364 1.00 0.00 H new ATOM 0 HG22 THR B 24 37.486 -1.332 12.384 1.00 0.00 H new ATOM 0 HG23 THR B 24 36.518 -0.785 10.995 1.00 0.00 H new ATOM 950 N ILE B 25 40.186 -0.373 8.220 1.00 0.00 N0 ATOM 951 CA ILE B 25 41.289 -0.467 7.270 1.00 0.00 C0 ATOM 952 C ILE B 25 42.229 0.725 7.431 1.00 0.00 C0 ATOM 953 O ILE B 25 43.452 0.583 7.370 1.00 0.00 O0 ATOM 954 CB ILE B 25 40.749 -0.516 5.841 1.00 0.00 C0 ATOM 955 CG1 ILE B 25 39.988 -1.828 5.642 1.00 0.00 C0 ATOM 956 CG2 ILE B 25 41.913 -0.445 4.846 1.00 0.00 C0 ATOM 957 CD1 ILE B 25 39.276 -1.808 4.290 1.00 0.00 C0 ATOM 0 H ILE B 25 39.268 -0.223 7.802 1.00 0.00 H new ATOM 0 HA ILE B 25 41.845 -1.383 7.471 1.00 0.00 H new ATOM 0 HB ILE B 25 40.082 0.329 5.672 1.00 0.00 H new ATOM 0 HG12 ILE B 25 40.678 -2.671 5.689 1.00 0.00 H new ATOM 0 HG13 ILE B 25 39.263 -1.965 6.444 1.00 0.00 H new ATOM 0 HG21 ILE B 25 41.524 -0.480 3.828 1.00 0.00 H new ATOM 0 HG22 ILE B 25 42.461 0.486 4.993 1.00 0.00 H new ATOM 0 HG23 ILE B 25 42.582 -1.290 5.008 1.00 0.00 H new ATOM 0 HD11 ILE B 25 38.734 -2.744 4.150 1.00 0.00 H new ATOM 0 HD12 ILE B 25 38.574 -0.975 4.261 1.00 0.00 H new ATOM 0 HD13 ILE B 25 40.011 -1.692 3.493 1.00 0.00 H new ATOM 969 N GLY B 26 41.646 1.900 7.632 1.00 0.00 N0 ATOM 970 CA GLY B 26 42.433 3.114 7.792 1.00 0.00 C0 ATOM 971 C GLY B 26 43.412 2.977 8.952 1.00 0.00 C0 ATOM 972 O GLY B 26 44.595 3.288 8.818 1.00 0.00 O0 ATOM 0 H GLY B 26 40.637 2.037 7.688 1.00 0.00 H new ATOM 0 HA2 GLY B 26 42.979 3.322 6.872 1.00 0.00 H new ATOM 0 HA3 GLY B 26 41.770 3.961 7.968 1.00 0.00 H new ATOM 976 N HIS B 27 42.908 2.508 10.089 1.00 0.00 N0 ATOM 977 CA HIS B 27 43.746 2.328 11.268 1.00 0.00 C0 ATOM 978 C HIS B 27 44.756 1.208 11.042 1.00 0.00 C0 ATOM 979 O HIS B 27 45.894 1.279 11.505 1.00 0.00 O0 ATOM 980 CB HIS B 27 42.880 2.007 12.486 1.00 0.00 C0 ATOM 981 CG HIS B 27 43.713 2.110 13.732 1.00 0.00 C0 ATOM 982 ND1 HIS B 27 44.331 3.293 14.108 1.00 0.00 N0 ATOM 983 CD2 HIS B 27 44.037 1.194 14.702 1.00 0.00 C0 ATOM 984 CE1 HIS B 27 44.987 3.060 15.258 1.00 0.00 C0 ATOM 985 NE2 HIS B 27 44.842 1.797 15.666 1.00 0.00 N0 ATOM 0 H HIS B 27 41.930 2.247 10.218 1.00 0.00 H new ATOM 0 HA HIS B 27 44.288 3.256 11.449 1.00 0.00 H new ATOM 0 HB2 HIS B 27 42.039 2.698 12.540 1.00 0.00 H new ATOM 0 HB3 HIS B 27 42.464 1.004 12.396 1.00 0.00 H new ATOM 0 HD2 HIS B 27 43.717 0.163 14.716 1.00 0.00 H new ATOM 0 HE1 HIS B 27 45.562 3.805 15.788 1.00 0.00 H new ATOM 0 HE2 HIS B 27 45.236 1.367 16.503 1.00 0.00 H new ATOM 993 N LEU B 28 44.332 0.179 10.313 1.00 0.00 N0 ATOM 994 CA LEU B 28 45.206 -0.952 10.017 1.00 0.00 C0 ATOM 995 C LEU B 28 46.269 -0.570 8.987 1.00 0.00 C0 ATOM 996 O LEU B 28 47.218 -1.324 8.764 1.00 0.00 O0 ATOM 997 CB LEU B 28 44.379 -2.124 9.488 1.00 0.00 C0 ATOM 998 CG LEU B 28 43.565 -2.730 10.632 1.00 0.00 C0 ATOM 999 CD1 LEU B 28 42.475 -3.632 10.057 1.00 0.00 C0 ATOM 1000 CD2 LEU B 28 44.487 -3.560 11.527 1.00 0.00 C0 ATOM 0 H LEU B 28 43.394 0.105 9.919 1.00 0.00 H new ATOM 0 HA LEU B 28 45.708 -1.244 10.940 1.00 0.00 H new ATOM 0 HB2 LEU B 28 43.714 -1.785 8.694 1.00 0.00 H new ATOM 0 HB3 LEU B 28 45.034 -2.879 9.054 1.00 0.00 H new ATOM 0 HG LEU B 28 43.108 -1.931 11.217 1.00 0.00 H new ATOM 0 HD11 LEU B 28 41.894 -4.065 10.871 1.00 0.00 H new ATOM 0 HD12 LEU B 28 41.818 -3.045 9.415 1.00 0.00 H new ATOM 0 HD13 LEU B 28 42.934 -4.431 9.474 1.00 0.00 H new ATOM 0 HD21 LEU B 28 43.909 -3.993 12.343 1.00 0.00 H new ATOM 0 HD22 LEU B 28 44.941 -4.359 10.940 1.00 0.00 H new ATOM 0 HD23 LEU B 28 45.269 -2.921 11.936 1.00 0.00 H new ATOM 1177 N PHE C 5 10.550 3.021 14.575 1.00 0.00 N0 ATOM 1178 CA PHE C 5 11.288 4.273 14.629 1.00 0.00 C0 ATOM 1179 C PHE C 5 12.142 4.367 15.895 1.00 0.00 C0 ATOM 1180 O PHE C 5 13.256 4.892 15.865 1.00 0.00 O0 ATOM 1181 CB PHE C 5 10.317 5.449 14.592 1.00 0.00 C0 ATOM 1182 CG PHE C 5 11.029 6.696 15.053 1.00 0.00 C0 ATOM 1183 CD1 PHE C 5 11.833 7.415 14.162 1.00 0.00 C0 ATOM 1184 CD2 PHE C 5 10.884 7.131 16.375 1.00 0.00 C0 ATOM 1185 CE1 PHE C 5 12.494 8.571 14.597 1.00 0.00 C0 ATOM 1186 CE2 PHE C 5 11.545 8.286 16.808 1.00 0.00 C0 ATOM 1187 CZ PHE C 5 12.349 9.007 15.919 1.00 0.00 C0 ATOM 0 HA PHE C 5 11.950 4.305 13.764 1.00 0.00 H new ATOM 0 HB2 PHE C 5 9.934 5.588 13.581 1.00 0.00 H new ATOM 0 HB3 PHE C 5 9.459 5.248 15.233 1.00 0.00 H new ATOM 0 HD1 PHE C 5 11.944 7.080 13.141 1.00 0.00 H new ATOM 0 HD2 PHE C 5 10.262 6.575 17.061 1.00 0.00 H new ATOM 0 HE1 PHE C 5 13.116 9.127 13.911 1.00 0.00 H new ATOM 0 HE2 PHE C 5 11.434 8.621 17.829 1.00 0.00 H new ATOM 0 HZ PHE C 5 12.858 9.900 16.253 1.00 0.00 H new ATOM 1197 N GLN C 6 11.605 3.877 17.007 1.00 0.00 N0 ATOM 1198 CA GLN C 6 12.317 3.930 18.283 1.00 0.00 C0 ATOM 1199 C GLN C 6 13.594 3.103 18.252 1.00 0.00 C0 ATOM 1200 O GLN C 6 14.618 3.504 18.806 1.00 0.00 O0 ATOM 1201 CB GLN C 6 11.419 3.387 19.386 1.00 0.00 C0 ATOM 1202 CG GLN C 6 10.285 4.372 19.649 1.00 0.00 C0 ATOM 1203 CD GLN C 6 9.268 3.742 20.594 1.00 0.00 C0 ATOM 1204 OE1 GLN C 6 8.991 2.547 20.500 1.00 0.00 O0 ATOM 1205 NE2 GLN C 6 8.701 4.475 21.511 1.00 0.00 N0 ATOM 0 H GLN C 6 10.684 3.440 17.053 1.00 0.00 H new ATOM 0 HA GLN C 6 12.581 4.971 18.470 1.00 0.00 H new ATOM 0 HB2 GLN C 6 11.013 2.418 19.095 1.00 0.00 H new ATOM 0 HB3 GLN C 6 11.997 3.230 20.296 1.00 0.00 H new ATOM 0 HG2 GLN C 6 10.681 5.290 20.084 1.00 0.00 H new ATOM 0 HG3 GLN C 6 9.803 4.646 18.711 1.00 0.00 H new ATOM 0 HE21 GLN C 6 8.932 5.466 21.587 1.00 0.00 H new ATOM 0 HE22 GLN C 6 8.026 4.058 22.152 1.00 0.00 H new ATOM 1214 N ILE C 7 13.508 1.941 17.627 1.00 0.00 N0 ATOM 1215 CA ILE C 7 14.653 1.035 17.553 1.00 0.00 C0 ATOM 1216 C ILE C 7 15.769 1.679 16.731 1.00 0.00 C0 ATOM 1217 O ILE C 7 16.954 1.535 17.046 1.00 0.00 O0 ATOM 1218 CB ILE C 7 14.253 -0.346 16.953 1.00 0.00 C0 ATOM 1219 CG1 ILE C 7 14.541 -0.382 15.442 1.00 0.00 C0 ATOM 1220 CG2 ILE C 7 12.763 -0.624 17.197 1.00 0.00 C0 ATOM 1221 CD1 ILE C 7 13.865 -1.598 14.795 1.00 0.00 C0 ATOM 0 H ILE C 7 12.665 1.600 17.165 1.00 0.00 H new ATOM 0 HA ILE C 7 15.013 0.855 18.566 1.00 0.00 H new ATOM 0 HB ILE C 7 14.847 -1.115 17.447 1.00 0.00 H new ATOM 0 HG12 ILE C 7 14.179 0.534 14.975 1.00 0.00 H new ATOM 0 HG13 ILE C 7 15.617 -0.423 15.272 1.00 0.00 H new ATOM 0 HG21 ILE C 7 12.499 -1.592 16.772 1.00 0.00 H new ATOM 0 HG22 ILE C 7 12.565 -0.632 18.269 1.00 0.00 H new ATOM 0 HG23 ILE C 7 12.165 0.155 16.724 1.00 0.00 H new ATOM 0 HD11 ILE C 7 14.079 -1.608 13.726 1.00 0.00 H new ATOM 0 HD12 ILE C 7 14.247 -2.512 15.250 1.00 0.00 H new ATOM 0 HD13 ILE C 7 12.787 -1.540 14.948 1.00 0.00 H new ATOM 1233 N LEU C 8 15.378 2.393 15.680 1.00 0.00 N0 ATOM 1234 CA LEU C 8 16.341 3.050 14.815 1.00 0.00 C0 ATOM 1235 C LEU C 8 16.950 4.268 15.495 1.00 0.00 C0 ATOM 1236 O LEU C 8 18.120 4.590 15.284 1.00 0.00 O0 ATOM 1237 CB LEU C 8 15.665 3.468 13.509 1.00 0.00 C0 ATOM 1238 CG LEU C 8 16.684 4.139 12.583 1.00 0.00 C0 ATOM 1239 CD1 LEU C 8 17.797 3.147 12.225 1.00 0.00 C0 ATOM 1240 CD2 LEU C 8 15.979 4.600 11.304 1.00 0.00 C0 ATOM 0 H LEU C 8 14.404 2.529 15.411 1.00 0.00 H new ATOM 0 HA LEU C 8 17.143 2.344 14.601 1.00 0.00 H new ATOM 0 HB2 LEU C 8 15.234 2.596 13.018 1.00 0.00 H new ATOM 0 HB3 LEU C 8 14.844 4.154 13.718 1.00 0.00 H new ATOM 0 HG LEU C 8 17.122 4.998 13.091 1.00 0.00 H new ATOM 0 HD11 LEU C 8 18.518 3.631 11.566 1.00 0.00 H new ATOM 0 HD12 LEU C 8 18.300 2.820 13.135 1.00 0.00 H new ATOM 0 HD13 LEU C 8 17.366 2.283 11.719 1.00 0.00 H new ATOM 0 HD21 LEU C 8 16.701 5.078 10.642 1.00 0.00 H new ATOM 0 HD22 LEU C 8 15.540 3.739 10.800 1.00 0.00 H new ATOM 0 HD23 LEU C 8 15.193 5.311 11.558 1.00 0.00 H new ATOM 1252 N SER C 9 16.153 4.924 16.322 1.00 0.00 N0 ATOM 1253 CA SER C 9 16.621 6.095 17.044 1.00 0.00 C0 ATOM 1254 C SER C 9 17.614 5.693 18.129 1.00 0.00 C0 ATOM 1255 O SER C 9 18.663 6.317 18.283 1.00 0.00 O0 ATOM 1256 CB SER C 9 15.442 6.824 17.676 1.00 0.00 C0 ATOM 1257 OG SER C 9 15.906 8.012 18.304 1.00 0.00 O0 ATOM 0 H SER C 9 15.184 4.667 16.509 1.00 0.00 H new ATOM 0 HA SER C 9 17.120 6.758 16.337 1.00 0.00 H new ATOM 0 HB2 SER C 9 14.700 7.067 16.915 1.00 0.00 H new ATOM 0 HB3 SER C 9 14.951 6.181 18.406 1.00 0.00 H new ATOM 0 HG SER C 9 15.149 8.484 18.710 1.00 0.00 H new ATOM 1263 N ILE C 10 17.278 4.644 18.877 1.00 0.00 N0 ATOM 1264 CA ILE C 10 18.150 4.174 19.947 1.00 0.00 C0 ATOM 1265 C ILE C 10 19.497 3.749 19.382 1.00 0.00 C0 ATOM 1266 O ILE C 10 20.545 4.144 19.893 1.00 0.00 O0 ATOM 1267 CB ILE C 10 17.501 2.987 20.673 1.00 0.00 C0 ATOM 1268 CG1 ILE C 10 16.227 3.450 21.393 1.00 0.00 C0 ATOM 1269 CG2 ILE C 10 18.489 2.406 21.693 1.00 0.00 C0 ATOM 1270 CD1 ILE C 10 16.577 4.181 22.695 1.00 0.00 C0 ATOM 0 H ILE C 10 16.417 4.109 18.763 1.00 0.00 H new ATOM 0 HA ILE C 10 18.301 4.990 20.654 1.00 0.00 H new ATOM 0 HB ILE C 10 17.240 2.220 19.944 1.00 0.00 H new ATOM 0 HG12 ILE C 10 15.655 4.110 20.742 1.00 0.00 H new ATOM 0 HG13 ILE C 10 15.594 2.590 21.611 1.00 0.00 H new ATOM 0 HG21 ILE C 10 18.027 1.563 22.208 1.00 0.00 H new ATOM 0 HG22 ILE C 10 19.388 2.068 21.177 1.00 0.00 H new ATOM 0 HG23 ILE C 10 18.755 3.174 22.420 1.00 0.00 H new ATOM 0 HD11 ILE C 10 15.660 4.501 23.190 1.00 0.00 H new ATOM 0 HD12 ILE C 10 17.129 3.509 23.352 1.00 0.00 H new ATOM 0 HD13 ILE C 10 17.191 5.053 22.469 1.00 0.00 H new ATOM 1282 N CYS C 11 19.471 2.946 18.322 1.00 0.00 N0 ATOM 1283 CA CYS C 11 20.712 2.487 17.713 1.00 0.00 C0 ATOM 1284 C CYS C 11 21.520 3.660 17.167 1.00 0.00 C0 ATOM 1285 O CYS C 11 22.712 3.786 17.447 1.00 0.00 O0 ATOM 1286 CB CYS C 11 20.403 1.511 16.582 1.00 0.00 C0 ATOM 1287 SG CYS C 11 21.953 0.971 15.819 1.00 0.00 S0 ATOM 0 H CYS C 11 18.620 2.606 17.875 1.00 0.00 H new ATOM 0 HA CYS C 11 21.303 1.987 18.480 1.00 0.00 H new ATOM 0 HB2 CYS C 11 19.855 0.651 16.968 1.00 0.00 H new ATOM 0 HB3 CYS C 11 19.765 1.988 15.838 1.00 0.00 H new ATOM 0 HG CYS C 11 21.695 0.137 14.856 1.00 0.00 H new ATOM 1293 N SER C 12 20.877 4.502 16.364 1.00 0.00 N0 ATOM 1294 CA SER C 12 21.563 5.639 15.767 1.00 0.00 C0 ATOM 1295 C SER C 12 22.212 6.500 16.844 1.00 0.00 C0 ATOM 1296 O SER C 12 23.366 6.911 16.709 1.00 0.00 O0 ATOM 1297 CB SER C 12 20.564 6.482 14.974 1.00 0.00 C0 ATOM 1298 OG SER C 12 21.255 7.532 14.309 1.00 0.00 O0 ATOM 0 H SER C 12 19.892 4.419 16.114 1.00 0.00 H new ATOM 0 HA SER C 12 22.341 5.266 15.101 1.00 0.00 H new ATOM 0 HB2 SER C 12 20.041 5.859 14.248 1.00 0.00 H new ATOM 0 HB3 SER C 12 19.809 6.895 15.642 1.00 0.00 H new ATOM 0 HG SER C 12 20.616 8.072 13.799 1.00 0.00 H new ATOM 1304 N PHE C 13 21.469 6.765 17.911 1.00 0.00 N0 ATOM 1305 CA PHE C 13 21.988 7.573 19.006 1.00 0.00 C0 ATOM 1306 C PHE C 13 23.235 6.928 19.604 1.00 0.00 C0 ATOM 1307 O PHE C 13 24.234 7.605 19.862 1.00 0.00 O0 ATOM 1308 CB PHE C 13 20.921 7.722 20.093 1.00 0.00 C0 ATOM 1309 CG PHE C 13 20.205 9.040 19.921 1.00 0.00 C0 ATOM 1310 CD1 PHE C 13 18.860 9.068 19.534 1.00 0.00 C0 ATOM 1311 CD2 PHE C 13 20.892 10.236 20.156 1.00 0.00 C0 ATOM 1312 CE1 PHE C 13 18.203 10.294 19.381 1.00 0.00 C0 ATOM 1313 CE2 PHE C 13 20.234 11.462 20.005 1.00 0.00 C0 ATOM 1314 CZ PHE C 13 18.890 11.491 19.617 1.00 0.00 C0 ATOM 0 H PHE C 13 20.513 6.435 18.041 1.00 0.00 H new ATOM 0 HA PHE C 13 22.252 8.556 18.615 1.00 0.00 H new ATOM 0 HB2 PHE C 13 20.209 6.899 20.033 1.00 0.00 H new ATOM 0 HB3 PHE C 13 21.383 7.673 21.079 1.00 0.00 H new ATOM 0 HD1 PHE C 13 18.330 8.144 19.354 1.00 0.00 H new ATOM 0 HD2 PHE C 13 21.930 10.213 20.454 1.00 0.00 H new ATOM 0 HE1 PHE C 13 17.166 10.317 19.081 1.00 0.00 H new ATOM 0 HE2 PHE C 13 20.763 12.385 20.188 1.00 0.00 H new ATOM 0 HZ PHE C 13 18.382 12.437 19.500 1.00 0.00 H new ATOM 1324 N ILE C 14 23.177 5.617 19.808 1.00 0.00 N0 ATOM 1325 CA ILE C 14 24.309 4.890 20.367 1.00 0.00 C0 ATOM 1326 C ILE C 14 25.526 5.041 19.464 1.00 0.00 C0 ATOM 1327 O ILE C 14 26.644 5.247 19.939 1.00 0.00 O0 ATOM 1328 CB ILE C 14 23.955 3.405 20.517 1.00 0.00 C0 ATOM 1329 CG1 ILE C 14 22.919 3.238 21.630 1.00 0.00 C0 ATOM 1330 CG2 ILE C 14 25.209 2.605 20.874 1.00 0.00 C0 ATOM 1331 CD1 ILE C 14 22.291 1.845 21.541 1.00 0.00 C0 ATOM 0 H ILE C 14 22.363 5.039 19.596 1.00 0.00 H new ATOM 0 HA ILE C 14 24.542 5.303 21.348 1.00 0.00 H new ATOM 0 HB ILE C 14 23.548 3.038 19.575 1.00 0.00 H new ATOM 0 HG12 ILE C 14 23.391 3.374 22.603 1.00 0.00 H new ATOM 0 HG13 ILE C 14 22.147 4.002 21.540 1.00 0.00 H new ATOM 0 HG21 ILE C 14 24.951 1.551 20.979 1.00 0.00 H new ATOM 0 HG22 ILE C 14 25.951 2.720 20.084 1.00 0.00 H new ATOM 0 HG23 ILE C 14 25.620 2.973 21.814 1.00 0.00 H new ATOM 0 HD11 ILE C 14 21.553 1.727 22.335 1.00 0.00 H new ATOM 0 HD12 ILE C 14 21.805 1.726 20.573 1.00 0.00 H new ATOM 0 HD13 ILE C 14 23.067 1.088 21.652 1.00 0.00 H new ATOM 1343 N LEU C 15 25.308 4.939 18.157 1.00 0.00 N0 ATOM 1344 CA LEU C 15 26.405 5.068 17.208 1.00 0.00 C0 ATOM 1345 C LEU C 15 27.033 6.455 17.293 1.00 0.00 C0 ATOM 1346 O LEU C 15 28.229 6.580 17.519 1.00 0.00 O0 ATOM 1347 CB LEU C 15 25.895 4.821 15.787 1.00 0.00 C0 ATOM 1348 CG LEU C 15 26.081 3.348 15.429 1.00 0.00 C0 ATOM 1349 CD1 LEU C 15 24.785 2.803 14.829 1.00 0.00 C0 ATOM 1350 CD2 LEU C 15 27.212 3.215 14.406 1.00 0.00 C0 ATOM 0 H LEU C 15 24.394 4.770 17.736 1.00 0.00 H new ATOM 0 HA LEU C 15 27.164 4.326 17.457 1.00 0.00 H new ATOM 0 HB2 LEU C 15 24.842 5.094 15.714 1.00 0.00 H new ATOM 0 HB3 LEU C 15 26.437 5.449 15.080 1.00 0.00 H new ATOM 0 HG LEU C 15 26.332 2.782 16.326 1.00 0.00 H new ATOM 0 HD11 LEU C 15 24.916 1.752 14.573 1.00 0.00 H new ATOM 0 HD12 LEU C 15 23.978 2.901 15.555 1.00 0.00 H new ATOM 0 HD13 LEU C 15 24.535 3.367 13.930 1.00 0.00 H new ATOM 0 HD21 LEU C 15 27.348 2.165 14.148 1.00 0.00 H new ATOM 0 HD22 LEU C 15 26.959 3.779 13.508 1.00 0.00 H new ATOM 0 HD23 LEU C 15 28.136 3.606 14.832 1.00 0.00 H new ATOM 1362 N SER C 16 26.227 7.489 17.081 1.00 0.00 N0 ATOM 1363 CA SER C 16 26.730 8.860 17.115 1.00 0.00 C0 ATOM 1364 C SER C 16 27.581 9.091 18.363 1.00 0.00 C0 ATOM 1365 O SER C 16 28.631 9.744 18.306 1.00 0.00 O0 ATOM 1366 CB SER C 16 25.554 9.838 17.114 1.00 0.00 C0 ATOM 1367 OG SER C 16 24.819 9.684 15.907 1.00 0.00 O0 ATOM 0 H SER C 16 25.229 7.407 16.885 1.00 0.00 H new ATOM 0 HA SER C 16 27.349 9.025 16.233 1.00 0.00 H new ATOM 0 HB2 SER C 16 24.909 9.651 17.973 1.00 0.00 H new ATOM 0 HB3 SER C 16 25.917 10.862 17.205 1.00 0.00 H new ATOM 0 HG SER C 16 24.252 8.887 15.969 1.00 0.00 H new ATOM 1373 N ALA C 17 27.135 8.535 19.483 1.00 0.00 N0 ATOM 1374 CA ALA C 17 27.873 8.672 20.727 1.00 0.00 C0 ATOM 1375 C ALA C 17 29.244 8.008 20.609 1.00 0.00 C0 ATOM 1376 O ALA C 17 30.263 8.576 21.015 1.00 0.00 O0 ATOM 1377 CB ALA C 17 27.084 8.025 21.867 1.00 0.00 C0 ATOM 0 H ALA C 17 26.275 7.991 19.553 1.00 0.00 H new ATOM 0 HA ALA C 17 28.014 9.732 20.937 1.00 0.00 H new ATOM 0 HB1 ALA C 17 27.640 8.129 22.799 1.00 0.00 H new ATOM 0 HB2 ALA C 17 26.116 8.517 21.965 1.00 0.00 H new ATOM 0 HB3 ALA C 17 26.933 6.967 21.651 1.00 0.00 H new ATOM 1383 N LEU C 18 29.267 6.804 20.045 1.00 0.00 N0 ATOM 1384 CA LEU C 18 30.520 6.075 19.879 1.00 0.00 C0 ATOM 1385 C LEU C 18 31.404 6.735 18.820 1.00 0.00 C0 ATOM 1386 O LEU C 18 32.626 6.573 18.831 1.00 0.00 O0 ATOM 1387 CB LEU C 18 30.227 4.625 19.483 1.00 0.00 C0 ATOM 1388 CG LEU C 18 29.502 3.915 20.632 1.00 0.00 C0 ATOM 1389 CD1 LEU C 18 29.012 2.546 20.157 1.00 0.00 C0 ATOM 1390 CD2 LEU C 18 30.459 3.731 21.816 1.00 0.00 C0 ATOM 0 H LEU C 18 28.441 6.316 19.698 1.00 0.00 H new ATOM 0 HA LEU C 18 31.055 6.093 20.828 1.00 0.00 H new ATOM 0 HB2 LEU C 18 29.614 4.600 18.582 1.00 0.00 H new ATOM 0 HB3 LEU C 18 31.157 4.106 19.250 1.00 0.00 H new ATOM 0 HG LEU C 18 28.651 4.519 20.947 1.00 0.00 H new ATOM 0 HD11 LEU C 18 28.496 2.041 20.974 1.00 0.00 H new ATOM 0 HD12 LEU C 18 28.326 2.675 19.320 1.00 0.00 H new ATOM 0 HD13 LEU C 18 29.864 1.945 19.839 1.00 0.00 H new ATOM 0 HD21 LEU C 18 29.938 3.226 22.630 1.00 0.00 H new ATOM 0 HD22 LEU C 18 31.313 3.130 21.504 1.00 0.00 H new ATOM 0 HD23 LEU C 18 30.807 4.706 22.158 1.00 0.00 H new ATOM 1402 N HIS C 19 30.781 7.480 17.910 1.00 0.00 N0 ATOM 1403 CA HIS C 19 31.516 8.162 16.847 1.00 0.00 C0 ATOM 1404 C HIS C 19 32.391 9.270 17.419 1.00 0.00 C0 ATOM 1405 O HIS C 19 33.602 9.320 17.170 1.00 0.00 O0 ATOM 1406 CB HIS C 19 30.530 8.766 15.843 1.00 0.00 C0 ATOM 1407 CG HIS C 19 30.042 7.702 14.901 1.00 0.00 C0 ATOM 1408 ND1 HIS C 19 30.884 7.072 14.000 1.00 0.00 N0 ATOM 1409 CD2 HIS C 19 28.799 7.153 14.701 1.00 0.00 C0 ATOM 1410 CE1 HIS C 19 30.147 6.190 13.301 1.00 0.00 C0 ATOM 1411 NE2 HIS C 19 28.869 6.198 13.688 1.00 0.00 N0 ATOM 0 H HIS C 19 29.772 7.627 17.887 1.00 0.00 H new ATOM 0 HA HIS C 19 32.154 7.432 16.349 1.00 0.00 H new ATOM 0 HB2 HIS C 19 29.687 9.211 16.371 1.00 0.00 H new ATOM 0 HB3 HIS C 19 31.013 9.566 15.282 1.00 0.00 H new ATOM 0 HD1 HIS C 19 31.883 7.245 13.887 1.00 0.00 H new ATOM 0 HD2 HIS C 19 27.905 7.420 15.245 1.00 0.00 H new ATOM 0 HE1 HIS C 19 30.541 5.554 12.522 1.00 0.00 H new ATOM 1419 N PHE C 20 31.784 10.147 18.209 1.00 0.00 N0 ATOM 1420 CA PHE C 20 32.546 11.230 18.812 1.00 0.00 C0 ATOM 1421 C PHE C 20 33.497 10.679 19.866 1.00 0.00 C0 ATOM 1422 O PHE C 20 34.553 11.258 20.127 1.00 0.00 O0 ATOM 1423 CB PHE C 20 31.609 12.272 19.427 1.00 0.00 C0 ATOM 1424 CG PHE C 20 31.487 13.457 18.491 1.00 0.00 C0 ATOM 1425 CD1 PHE C 20 30.350 13.605 17.684 1.00 0.00 C0 ATOM 1426 CD2 PHE C 20 32.514 14.409 18.431 1.00 0.00 C0 ATOM 1427 CE1 PHE C 20 30.242 14.705 16.820 1.00 0.00 C0 ATOM 1428 CE2 PHE C 20 32.405 15.507 17.567 1.00 0.00 C0 ATOM 1429 CZ PHE C 20 31.270 15.654 16.763 1.00 0.00 C0 ATOM 0 H PHE C 20 30.791 10.131 18.442 1.00 0.00 H new ATOM 0 HA PHE C 20 33.132 11.717 18.033 1.00 0.00 H new ATOM 0 HB2 PHE C 20 30.627 11.833 19.605 1.00 0.00 H new ATOM 0 HB3 PHE C 20 31.994 12.597 20.394 1.00 0.00 H new ATOM 0 HD1 PHE C 20 29.558 12.872 17.728 1.00 0.00 H new ATOM 0 HD2 PHE C 20 33.391 14.296 19.052 1.00 0.00 H new ATOM 0 HE1 PHE C 20 29.366 14.820 16.199 1.00 0.00 H new ATOM 0 HE2 PHE C 20 33.197 16.240 17.522 1.00 0.00 H new ATOM 0 HZ PHE C 20 31.186 16.500 16.097 1.00 0.00 H new ATOM 1439 N MET C 21 33.133 9.542 20.453 1.00 0.00 N0 ATOM 1440 CA MET C 21 33.981 8.913 21.456 1.00 0.00 C0 ATOM 1441 C MET C 21 35.330 8.532 20.854 1.00 0.00 C0 ATOM 1442 O MET C 21 36.390 8.870 21.392 1.00 0.00 O0 ATOM 1443 CB MET C 21 33.293 7.661 21.995 1.00 0.00 C0 ATOM 1444 CG MET C 21 32.490 8.015 23.249 1.00 0.00 C0 ATOM 1445 SD MET C 21 31.748 6.513 23.938 1.00 0.00 S0 ATOM 1446 CE MET C 21 30.199 7.260 24.504 1.00 0.00 C0 ATOM 0 H MET C 21 32.266 9.043 20.253 1.00 0.00 H new ATOM 0 HA MET C 21 34.146 9.622 22.268 1.00 0.00 H new ATOM 0 HB2 MET C 21 32.634 7.241 21.236 1.00 0.00 H new ATOM 0 HB3 MET C 21 34.036 6.898 22.230 1.00 0.00 H new ATOM 0 HG2 MET C 21 33.139 8.485 23.988 1.00 0.00 H new ATOM 0 HG3 MET C 21 31.712 8.738 23.003 1.00 0.00 H new ATOM 0 HE1 MET C 21 29.506 6.475 24.807 1.00 0.00 H new ATOM 0 HE2 MET C 21 30.399 7.915 25.352 1.00 0.00 H new ATOM 0 HE3 MET C 21 29.758 7.841 23.694 1.00 0.00 H new ATOM 1456 N ALA C 22 35.293 7.833 19.730 1.00 0.00 N0 ATOM 1457 CA ALA C 22 36.526 7.435 19.076 1.00 0.00 C0 ATOM 1458 C ALA C 22 37.304 8.673 18.658 1.00 0.00 C0 ATOM 1459 O ALA C 22 38.532 8.703 18.727 1.00 0.00 O0 ATOM 1460 CB ALA C 22 36.224 6.568 17.855 1.00 0.00 C0 ATOM 0 H ALA C 22 34.438 7.535 19.260 1.00 0.00 H new ATOM 0 HA ALA C 22 37.126 6.852 19.774 1.00 0.00 H new ATOM 0 HB1 ALA C 22 37.158 6.277 17.375 1.00 0.00 H new ATOM 0 HB2 ALA C 22 35.684 5.675 18.168 1.00 0.00 H new ATOM 0 HB3 ALA C 22 35.614 7.133 17.150 1.00 0.00 H new ATOM 1466 N TRP C 23 36.577 9.693 18.213 1.00 0.00 N0 ATOM 1467 CA TRP C 23 37.214 10.931 17.773 1.00 0.00 C0 ATOM 1468 C TRP C 23 37.997 11.582 18.908 1.00 0.00 C0 ATOM 1469 O TRP C 23 39.131 12.020 18.717 1.00 0.00 O0 ATOM 1470 CB TRP C 23 36.151 11.907 17.274 1.00 0.00 C0 ATOM 1471 CG TRP C 23 35.547 11.393 16.004 1.00 0.00 C0 ATOM 1472 CD1 TRP C 23 35.844 10.212 15.416 1.00 0.00 C0 ATOM 1473 CD2 TRP C 23 34.558 12.037 15.152 1.00 0.00 C0 ATOM 1474 NE1 TRP C 23 35.093 10.085 14.264 1.00 0.00 N0 ATOM 1475 CE2 TRP C 23 34.285 11.187 14.057 1.00 0.00 C0 ATOM 1476 CE3 TRP C 23 33.874 13.264 15.227 1.00 0.00 C0 ATOM 1477 CZ2 TRP C 23 33.367 11.540 13.068 1.00 0.00 C0 ATOM 1478 CZ3 TRP C 23 32.950 13.627 14.235 1.00 0.00 C0 ATOM 1479 CH2 TRP C 23 32.696 12.764 13.157 1.00 0.00 C0 ATOM 0 H TRP C 23 35.559 9.689 18.147 1.00 0.00 H new ATOM 0 HA TRP C 23 37.907 10.687 16.968 1.00 0.00 H new ATOM 0 HB2 TRP C 23 35.377 12.034 18.031 1.00 0.00 H new ATOM 0 HB3 TRP C 23 36.595 12.888 17.105 1.00 0.00 H new ATOM 0 HD1 TRP C 23 36.553 9.486 15.787 1.00 0.00 H new ATOM 0 HE1 TRP C 23 35.130 9.277 13.642 1.00 0.00 H new ATOM 0 HE3 TRP C 23 34.061 13.932 16.055 1.00 0.00 H new ATOM 0 HZ2 TRP C 23 33.176 10.873 12.240 1.00 0.00 H new ATOM 0 HZ3 TRP C 23 32.433 14.573 14.301 1.00 0.00 H new ATOM 0 HH2 TRP C 23 31.983 13.045 12.397 1.00 0.00 H new ATOM 1490 N THR C 24 37.385 11.652 20.088 1.00 0.00 N0 ATOM 1491 CA THR C 24 38.044 12.264 21.234 1.00 0.00 C0 ATOM 1492 C THR C 24 39.342 11.529 21.541 1.00 0.00 C0 ATOM 1493 O THR C 24 40.366 12.150 21.828 1.00 0.00 O0 ATOM 1494 CB THR C 24 37.119 12.212 22.460 1.00 0.00 C0 ATOM 1495 OG1 THR C 24 36.843 10.858 22.776 1.00 0.00 O0 ATOM 1496 CG2 THR C 24 35.789 12.945 22.181 1.00 0.00 C0 ATOM 0 H THR C 24 36.447 11.297 20.273 1.00 0.00 H new ATOM 0 HA THR C 24 38.268 13.304 20.998 1.00 0.00 H new ATOM 0 HB THR C 24 37.620 12.705 23.293 1.00 0.00 H new ATOM 0 HG1 THR C 24 36.423 10.421 22.006 1.00 0.00 H new ATOM 0 HG21 THR C 24 35.153 12.893 23.065 1.00 0.00 H new ATOM 0 HG22 THR C 24 35.992 13.989 21.941 1.00 0.00 H new ATOM 0 HG23 THR C 24 35.282 12.471 21.340 1.00 0.00 H new ATOM 1504 N ILE C 25 39.304 10.203 21.459 1.00 0.00 N0 ATOM 1505 CA ILE C 25 40.505 9.412 21.715 1.00 0.00 C0 ATOM 1506 C ILE C 25 41.549 9.670 20.633 1.00 0.00 C0 ATOM 1507 O ILE C 25 42.743 9.776 20.913 1.00 0.00 O0 ATOM 1508 CB ILE C 25 40.155 7.926 21.758 1.00 0.00 C0 ATOM 1509 CG1 ILE C 25 39.275 7.655 22.981 1.00 0.00 C0 ATOM 1510 CG2 ILE C 25 41.437 7.093 21.858 1.00 0.00 C0 ATOM 1511 CD1 ILE C 25 38.753 6.221 22.933 1.00 0.00 C0 ATOM 0 H ILE C 25 38.473 9.661 21.222 1.00 0.00 H new ATOM 0 HA ILE C 25 40.918 9.707 22.679 1.00 0.00 H new ATOM 0 HB ILE C 25 39.621 7.652 20.848 1.00 0.00 H new ATOM 0 HG12 ILE C 25 39.847 7.813 23.895 1.00 0.00 H new ATOM 0 HG13 ILE C 25 38.440 8.355 23.003 1.00 0.00 H new ATOM 0 HG21 ILE C 25 41.181 6.034 21.888 1.00 0.00 H new ATOM 0 HG22 ILE C 25 42.067 7.289 20.991 1.00 0.00 H new ATOM 0 HG23 ILE C 25 41.976 7.362 22.766 1.00 0.00 H new ATOM 0 HD11 ILE C 25 38.127 6.032 23.805 1.00 0.00 H new ATOM 0 HD12 ILE C 25 38.165 6.078 22.027 1.00 0.00 H new ATOM 0 HD13 ILE C 25 39.594 5.527 22.933 1.00 0.00 H new ATOM 1523 N GLY C 26 41.083 9.761 19.394 1.00 0.00 N0 ATOM 1524 CA GLY C 26 41.977 9.997 18.267 1.00 0.00 C0 ATOM 1525 C GLY C 26 42.775 11.281 18.466 1.00 0.00 C0 ATOM 1526 O GLY C 26 43.993 11.302 18.288 1.00 0.00 O0 ATOM 0 H GLY C 26 40.098 9.676 19.144 1.00 0.00 H new ATOM 0 HA2 GLY C 26 42.659 9.154 18.156 1.00 0.00 H new ATOM 0 HA3 GLY C 26 41.398 10.063 17.346 1.00 0.00 H new ATOM 1530 N HIS C 27 42.079 12.350 18.835 1.00 0.00 N0 ATOM 1531 CA HIS C 27 42.727 13.636 19.061 1.00 0.00 C0 ATOM 1532 C HIS C 27 43.615 13.581 20.299 1.00 0.00 C0 ATOM 1533 O HIS C 27 44.681 14.197 20.343 1.00 0.00 O0 ATOM 1534 CB HIS C 27 41.677 14.733 19.232 1.00 0.00 C0 ATOM 1535 CG HIS C 27 42.347 16.077 19.177 1.00 0.00 C0 ATOM 1536 ND1 HIS C 27 43.046 16.505 18.059 1.00 0.00 N0 ATOM 1537 CD2 HIS C 27 42.431 17.102 20.086 1.00 0.00 C0 ATOM 1538 CE1 HIS C 27 43.516 17.739 18.320 1.00 0.00 C0 ATOM 1539 NE2 HIS C 27 43.169 18.150 19.542 1.00 0.00 N0 ATOM 0 H HIS C 27 41.070 12.352 18.984 1.00 0.00 H new ATOM 0 HA HIS C 27 43.347 13.862 18.193 1.00 0.00 H new ATOM 0 HB2 HIS C 27 40.924 14.657 18.447 1.00 0.00 H new ATOM 0 HB3 HIS C 27 41.159 14.611 20.183 1.00 0.00 H new ATOM 0 HD2 HIS C 27 41.992 17.097 21.073 1.00 0.00 H new ATOM 0 HE1 HIS C 27 44.102 18.324 17.627 1.00 0.00 H new ATOM 0 HE2 HIS C 27 43.396 19.041 19.983 1.00 0.00 H new ATOM 1547 N LEU C 28 43.178 12.816 21.298 1.00 0.00 N0 ATOM 1548 CA LEU C 28 43.941 12.670 22.531 1.00 0.00 C0 ATOM 1549 C LEU C 28 45.167 11.784 22.314 1.00 0.00 C0 ATOM 1550 O LEU C 28 46.042 11.710 23.178 1.00 0.00 O0 ATOM 1551 CB LEU C 28 43.059 12.060 23.621 1.00 0.00 C0 ATOM 1552 CG LEU C 28 42.036 13.097 24.085 1.00 0.00 C0 ATOM 1553 CD1 LEU C 28 40.931 12.403 24.880 1.00 0.00 C0 ATOM 1554 CD2 LEU C 28 42.730 14.127 24.982 1.00 0.00 C0 ATOM 0 H LEU C 28 42.304 12.291 21.276 1.00 0.00 H new ATOM 0 HA LEU C 28 44.277 13.660 22.841 1.00 0.00 H new ATOM 0 HB2 LEU C 28 42.549 11.175 23.239 1.00 0.00 H new ATOM 0 HB3 LEU C 28 43.672 11.736 24.462 1.00 0.00 H new ATOM 0 HG LEU C 28 41.604 13.595 23.217 1.00 0.00 H new ATOM 0 HD11 LEU C 28 40.202 13.142 25.211 1.00 0.00 H new ATOM 0 HD12 LEU C 28 40.438 11.664 24.249 1.00 0.00 H new ATOM 0 HD13 LEU C 28 41.364 11.907 25.748 1.00 0.00 H new ATOM 0 HD21 LEU C 28 42.003 14.868 25.315 1.00 0.00 H new ATOM 0 HD22 LEU C 28 43.159 13.624 25.849 1.00 0.00 H new ATOM 0 HD23 LEU C 28 43.523 14.622 24.421 1.00 0.00 H new ATOM 1751 N GLN D 6 10.258 14.646 15.076 1.00 0.00 N0 ATOM 1752 CA GLN D 6 10.774 16.014 15.105 1.00 0.00 C0 ATOM 1753 C GLN D 6 11.989 16.141 16.015 1.00 0.00 C0 ATOM 1754 O GLN D 6 12.941 16.854 15.698 1.00 0.00 O0 ATOM 1755 CB GLN D 6 9.692 16.952 15.617 1.00 0.00 C0 ATOM 1756 CG GLN D 6 8.594 17.086 14.567 1.00 0.00 C0 ATOM 1757 CD GLN D 6 7.413 17.847 15.156 1.00 0.00 C0 ATOM 1758 OE1 GLN D 6 7.080 17.670 16.327 1.00 0.00 O0 ATOM 1759 NE2 GLN D 6 6.761 18.698 14.412 1.00 0.00 N0 ATOM 0 HA GLN D 6 11.070 16.275 14.089 1.00 0.00 H new ATOM 0 HB2 GLN D 6 9.274 16.568 16.548 1.00 0.00 H new ATOM 0 HB3 GLN D 6 10.119 17.930 15.838 1.00 0.00 H new ATOM 0 HG2 GLN D 6 8.977 17.610 13.691 1.00 0.00 H new ATOM 0 HG3 GLN D 6 8.274 16.099 14.233 1.00 0.00 H new ATOM 0 HE21 GLN D 6 7.038 18.844 13.441 1.00 0.00 H new ATOM 0 HE22 GLN D 6 5.974 19.217 14.801 1.00 0.00 H new ATOM 1768 N ILE D 7 11.924 15.467 17.152 1.00 0.00 N0 ATOM 1769 CA ILE D 7 13.010 15.529 18.127 1.00 0.00 C0 ATOM 1770 C ILE D 7 14.271 14.905 17.536 1.00 0.00 C0 ATOM 1771 O ILE D 7 15.386 15.385 17.766 1.00 0.00 O0 ATOM 1772 CB ILE D 7 12.622 14.829 19.462 1.00 0.00 C0 ATOM 1773 CG1 ILE D 7 13.129 13.376 19.476 1.00 0.00 C0 ATOM 1774 CG2 ILE D 7 11.099 14.844 19.650 1.00 0.00 C0 ATOM 1775 CD1 ILE D 7 12.483 12.592 20.624 1.00 0.00 C0 ATOM 0 H ILE D 7 11.140 14.875 17.424 1.00 0.00 H new ATOM 0 HA ILE D 7 13.204 16.577 18.356 1.00 0.00 H new ATOM 0 HB ILE D 7 13.089 15.376 20.281 1.00 0.00 H new ATOM 0 HG12 ILE D 7 12.899 12.895 18.525 1.00 0.00 H new ATOM 0 HG13 ILE D 7 14.213 13.364 19.585 1.00 0.00 H new ATOM 0 HG21 ILE D 7 10.843 14.351 20.588 1.00 0.00 H new ATOM 0 HG22 ILE D 7 10.745 15.875 19.674 1.00 0.00 H new ATOM 0 HG23 ILE D 7 10.625 14.317 18.822 1.00 0.00 H new ATOM 0 HD11 ILE D 7 12.853 11.567 20.618 1.00 0.00 H new ATOM 0 HD12 ILE D 7 12.735 13.064 21.574 1.00 0.00 H new ATOM 0 HD13 ILE D 7 11.400 12.587 20.497 1.00 0.00 H new ATOM 1787 N LEU D 8 14.089 13.832 16.771 1.00 0.00 N0 ATOM 1788 CA LEU D 8 15.212 13.147 16.157 1.00 0.00 C0 ATOM 1789 C LEU D 8 15.787 13.959 15.006 1.00 0.00 C0 ATOM 1790 O LEU D 8 16.993 13.941 14.761 1.00 0.00 O0 ATOM 1791 CB LEU D 8 14.768 11.770 15.657 1.00 0.00 C0 ATOM 1792 CG LEU D 8 15.957 11.034 15.031 1.00 0.00 C0 ATOM 1793 CD1 LEU D 8 17.043 10.805 16.087 1.00 0.00 C0 ATOM 1794 CD2 LEU D 8 15.484 9.686 14.484 1.00 0.00 C0 ATOM 0 H LEU D 8 13.178 13.423 16.565 1.00 0.00 H new ATOM 0 HA LEU D 8 15.992 13.026 16.908 1.00 0.00 H new ATOM 0 HB2 LEU D 8 14.362 11.187 16.484 1.00 0.00 H new ATOM 0 HB3 LEU D 8 13.970 11.880 14.923 1.00 0.00 H new ATOM 0 HG LEU D 8 16.369 11.636 14.221 1.00 0.00 H new ATOM 0 HD11 LEU D 8 17.885 10.281 15.635 1.00 0.00 H new ATOM 0 HD12 LEU D 8 17.380 11.766 16.477 1.00 0.00 H new ATOM 0 HD13 LEU D 8 16.638 10.205 16.902 1.00 0.00 H new ATOM 0 HD21 LEU D 8 16.327 9.159 14.037 1.00 0.00 H new ATOM 0 HD22 LEU D 8 15.071 9.088 15.297 1.00 0.00 H new ATOM 0 HD23 LEU D 8 14.716 9.849 13.728 1.00 0.00 H new ATOM 1806 N SER D 9 14.916 14.676 14.315 1.00 0.00 N0 ATOM 1807 CA SER D 9 15.343 15.500 13.197 1.00 0.00 C0 ATOM 1808 C SER D 9 16.141 16.700 13.696 1.00 0.00 C0 ATOM 1809 O SER D 9 17.191 17.029 13.148 1.00 0.00 O0 ATOM 1810 CB SER D 9 14.129 15.981 12.409 1.00 0.00 C0 ATOM 1811 OG SER D 9 14.566 16.711 11.271 1.00 0.00 O0 ATOM 0 H SER D 9 13.915 14.704 14.507 1.00 0.00 H new ATOM 0 HA SER D 9 15.979 14.900 12.546 1.00 0.00 H new ATOM 0 HB2 SER D 9 13.522 15.130 12.098 1.00 0.00 H new ATOM 0 HB3 SER D 9 13.499 16.609 13.038 1.00 0.00 H new ATOM 0 HG SER D 9 13.788 17.020 10.762 1.00 0.00 H new ATOM 1817 N ILE D 10 15.629 17.355 14.737 1.00 0.00 N0 ATOM 1818 CA ILE D 10 16.300 18.525 15.291 1.00 0.00 C0 ATOM 1819 C ILE D 10 17.689 18.149 15.789 1.00 0.00 C0 ATOM 1820 O ILE D 10 18.672 18.821 15.479 1.00 0.00 O0 ATOM 1821 CB ILE D 10 15.479 19.104 16.452 1.00 0.00 C0 ATOM 1822 CG1 ILE D 10 14.143 19.648 15.925 1.00 0.00 C0 ATOM 1823 CG2 ILE D 10 16.267 20.237 17.124 1.00 0.00 C0 ATOM 1824 CD1 ILE D 10 14.342 21.010 15.254 1.00 0.00 C0 ATOM 0 H ILE D 10 14.762 17.098 15.208 1.00 0.00 H new ATOM 0 HA ILE D 10 16.392 19.275 14.506 1.00 0.00 H new ATOM 0 HB ILE D 10 15.283 18.317 17.180 1.00 0.00 H new ATOM 0 HG12 ILE D 10 13.714 18.944 15.212 1.00 0.00 H new ATOM 0 HG13 ILE D 10 13.433 19.742 16.747 1.00 0.00 H new ATOM 0 HG21 ILE D 10 15.683 20.647 17.948 1.00 0.00 H new ATOM 0 HG22 ILE D 10 17.210 19.847 17.506 1.00 0.00 H new ATOM 0 HG23 ILE D 10 16.468 21.022 16.395 1.00 0.00 H new ATOM 0 HD11 ILE D 10 13.384 21.378 14.887 1.00 0.00 H new ATOM 0 HD12 ILE D 10 14.749 21.716 15.978 1.00 0.00 H new ATOM 0 HD13 ILE D 10 15.035 20.906 14.419 1.00 0.00 H new ATOM 1836 N CYS D 11 17.771 17.068 16.560 1.00 0.00 N0 ATOM 1837 CA CYS D 11 19.058 16.630 17.084 1.00 0.00 C0 ATOM 1838 C CYS D 11 20.008 16.252 15.951 1.00 0.00 C0 ATOM 1839 O CYS D 11 21.149 16.709 15.910 1.00 0.00 O0 ATOM 1840 CB CYS D 11 18.862 15.430 18.004 1.00 0.00 C0 ATOM 1841 SG CYS D 11 20.471 14.882 18.623 1.00 0.00 S0 ATOM 0 H CYS D 11 16.976 16.489 16.831 1.00 0.00 H new ATOM 0 HA CYS D 11 19.496 17.456 17.645 1.00 0.00 H new ATOM 0 HB2 CYS D 11 18.211 15.698 18.836 1.00 0.00 H new ATOM 0 HB3 CYS D 11 18.372 14.620 17.464 1.00 0.00 H new ATOM 0 HG CYS D 11 20.416 13.616 18.915 1.00 0.00 H new ATOM 1847 N SER D 12 19.543 15.394 15.047 1.00 0.00 N0 ATOM 1848 CA SER D 12 20.378 14.946 13.941 1.00 0.00 C0 ATOM 1849 C SER D 12 20.913 16.141 13.162 1.00 0.00 C0 ATOM 1850 O SER D 12 22.098 16.195 12.831 1.00 0.00 O0 ATOM 1851 CB SER D 12 19.563 14.048 13.012 1.00 0.00 C0 ATOM 1852 OG SER D 12 20.410 13.532 11.993 1.00 0.00 O0 ATOM 0 H SER D 12 18.602 15.000 15.059 1.00 0.00 H new ATOM 0 HA SER D 12 21.221 14.384 14.343 1.00 0.00 H new ATOM 0 HB2 SER D 12 19.116 13.230 13.578 1.00 0.00 H new ATOM 0 HB3 SER D 12 18.744 14.613 12.568 1.00 0.00 H new ATOM 0 HG SER D 12 19.890 12.954 11.397 1.00 0.00 H new ATOM 1858 N PHE D 13 20.035 17.093 12.868 1.00 0.00 N0 ATOM 1859 CA PHE D 13 20.436 18.282 12.127 1.00 0.00 C0 ATOM 1860 C PHE D 13 21.542 19.026 12.869 1.00 0.00 C0 ATOM 1861 O PHE D 13 22.531 19.451 12.270 1.00 0.00 O0 ATOM 1862 CB PHE D 13 19.231 19.205 11.939 1.00 0.00 C0 ATOM 1863 CG PHE D 13 18.628 18.980 10.573 1.00 0.00 C0 ATOM 1864 CD1 PHE D 13 17.361 18.399 10.448 1.00 0.00 C0 ATOM 1865 CD2 PHE D 13 19.343 19.357 9.431 1.00 0.00 C0 ATOM 1866 CE1 PHE D 13 16.808 18.196 9.177 1.00 0.00 C0 ATOM 1867 CE2 PHE D 13 18.791 19.154 8.162 1.00 0.00 C0 ATOM 1868 CZ PHE D 13 17.524 18.574 8.033 1.00 0.00 C0 ATOM 0 H PHE D 13 19.049 17.066 13.129 1.00 0.00 H new ATOM 0 HA PHE D 13 20.814 17.974 11.152 1.00 0.00 H new ATOM 0 HB2 PHE D 13 18.488 19.011 12.712 1.00 0.00 H new ATOM 0 HB3 PHE D 13 19.537 20.246 12.045 1.00 0.00 H new ATOM 0 HD1 PHE D 13 16.810 18.108 11.330 1.00 0.00 H new ATOM 0 HD2 PHE D 13 20.321 19.805 9.529 1.00 0.00 H new ATOM 0 HE1 PHE D 13 15.830 17.748 9.079 1.00 0.00 H new ATOM 0 HE2 PHE D 13 19.343 19.445 7.281 1.00 0.00 H new ATOM 0 HZ PHE D 13 17.098 18.418 7.053 1.00 0.00 H new ATOM 1878 N ILE D 14 21.368 19.175 14.178 1.00 0.00 N0 ATOM 1879 CA ILE D 14 22.358 19.866 14.993 1.00 0.00 C0 ATOM 1880 C ILE D 14 23.705 19.157 14.900 1.00 0.00 C0 ATOM 1881 O ILE D 14 24.749 19.799 14.787 1.00 0.00 O0 ATOM 1882 CB ILE D 14 21.896 19.910 16.455 1.00 0.00 C0 ATOM 1883 CG1 ILE D 14 20.699 20.855 16.583 1.00 0.00 C0 ATOM 1884 CG2 ILE D 14 23.033 20.418 17.344 1.00 0.00 C0 ATOM 1885 CD1 ILE D 14 20.007 20.623 17.928 1.00 0.00 C0 ATOM 0 H ILE D 14 20.558 18.830 14.693 1.00 0.00 H new ATOM 0 HA ILE D 14 22.467 20.885 14.621 1.00 0.00 H new ATOM 0 HB ILE D 14 21.610 18.906 16.769 1.00 0.00 H new ATOM 0 HG12 ILE D 14 21.030 21.891 16.506 1.00 0.00 H new ATOM 0 HG13 ILE D 14 19.998 20.683 15.767 1.00 0.00 H new ATOM 0 HG21 ILE D 14 22.699 20.447 18.381 1.00 0.00 H new ATOM 0 HG22 ILE D 14 23.889 19.749 17.257 1.00 0.00 H new ATOM 0 HG23 ILE D 14 23.322 21.420 17.028 1.00 0.00 H new ATOM 0 HD11 ILE D 14 19.154 21.296 18.019 1.00 0.00 H new ATOM 0 HD12 ILE D 14 19.662 19.591 17.987 1.00 0.00 H new ATOM 0 HD13 ILE D 14 20.711 20.817 18.737 1.00 0.00 H new ATOM 1897 N LEU D 15 23.675 17.831 14.947 1.00 0.00 N0 ATOM 1898 CA LEU D 15 24.914 17.061 14.872 1.00 0.00 C0 ATOM 1899 C LEU D 15 25.604 17.282 13.530 1.00 0.00 C0 ATOM 1900 O LEU D 15 26.762 17.673 13.486 1.00 0.00 O0 ATOM 1901 CB LEU D 15 24.607 15.575 15.045 1.00 0.00 C0 ATOM 1902 CG LEU D 15 24.750 15.193 16.519 1.00 0.00 C0 ATOM 1903 CD1 LEU D 15 23.526 14.390 16.956 1.00 0.00 C0 ATOM 1904 CD2 LEU D 15 26.010 14.342 16.697 1.00 0.00 C0 ATOM 0 H LEU D 15 22.825 17.274 15.035 1.00 0.00 H new ATOM 0 HA LEU D 15 25.578 17.396 15.668 1.00 0.00 H new ATOM 0 HB2 LEU D 15 23.596 15.359 14.699 1.00 0.00 H new ATOM 0 HB3 LEU D 15 25.287 14.979 14.436 1.00 0.00 H new ATOM 0 HG LEU D 15 24.828 16.094 17.127 1.00 0.00 H new ATOM 0 HD11 LEU D 15 23.626 14.117 18.006 1.00 0.00 H new ATOM 0 HD12 LEU D 15 22.628 14.993 16.822 1.00 0.00 H new ATOM 0 HD13 LEU D 15 23.449 13.486 16.352 1.00 0.00 H new ATOM 0 HD21 LEU D 15 26.118 14.066 17.746 1.00 0.00 H new ATOM 0 HD22 LEU D 15 25.928 13.440 16.091 1.00 0.00 H new ATOM 0 HD23 LEU D 15 26.883 14.913 16.381 1.00 0.00 H new ATOM 1916 N SER D 16 24.893 17.007 12.441 1.00 0.00 N0 ATOM 1917 CA SER D 16 25.470 17.159 11.106 1.00 0.00 C0 ATOM 1918 C SER D 16 26.145 18.522 10.973 1.00 0.00 C0 ATOM 1919 O SER D 16 27.236 18.642 10.396 1.00 0.00 O0 ATOM 1920 CB SER D 16 24.371 17.023 10.051 1.00 0.00 C0 ATOM 1921 OG SER D 16 23.813 15.717 10.124 1.00 0.00 O0 ATOM 0 H SER D 16 23.927 16.681 12.453 1.00 0.00 H new ATOM 0 HA SER D 16 26.217 16.380 10.955 1.00 0.00 H new ATOM 0 HB2 SER D 16 23.597 17.772 10.216 1.00 0.00 H new ATOM 0 HB3 SER D 16 24.780 17.202 9.057 1.00 0.00 H new ATOM 0 HG SER D 16 23.211 15.661 10.895 1.00 0.00 H new ATOM 1927 N ALA D 17 25.502 19.547 11.519 1.00 0.00 N0 ATOM 1928 CA ALA D 17 26.057 20.890 11.468 1.00 0.00 C0 ATOM 1929 C ALA D 17 27.389 20.947 12.217 1.00 0.00 C0 ATOM 1930 O ALA D 17 28.369 21.514 11.727 1.00 0.00 O0 ATOM 1931 CB ALA D 17 25.069 21.876 12.094 1.00 0.00 C0 ATOM 0 H ALA D 17 24.604 19.474 11.998 1.00 0.00 H new ATOM 0 HA ALA D 17 26.232 21.160 10.426 1.00 0.00 H new ATOM 0 HB1 ALA D 17 25.486 22.882 12.055 1.00 0.00 H new ATOM 0 HB2 ALA D 17 24.130 21.851 11.541 1.00 0.00 H new ATOM 0 HB3 ALA D 17 24.886 21.598 13.132 1.00 0.00 H new ATOM 1937 N LEU D 18 27.420 20.347 13.403 1.00 0.00 N0 ATOM 1938 CA LEU D 18 28.636 20.340 14.210 1.00 0.00 C0 ATOM 1939 C LEU D 18 29.707 19.442 13.587 1.00 0.00 C0 ATOM 1940 O LEU D 18 30.901 19.620 13.835 1.00 0.00 O0 ATOM 1941 CB LEU D 18 28.316 19.854 15.626 1.00 0.00 C0 ATOM 1942 CG LEU D 18 27.387 20.857 16.317 1.00 0.00 C0 ATOM 1943 CD1 LEU D 18 26.892 20.264 17.639 1.00 0.00 C0 ATOM 1944 CD2 LEU D 18 28.143 22.161 16.595 1.00 0.00 C0 ATOM 0 H LEU D 18 26.626 19.864 13.824 1.00 0.00 H new ATOM 0 HA LEU D 18 29.023 21.358 14.250 1.00 0.00 H new ATOM 0 HB2 LEU D 18 27.843 18.873 15.586 1.00 0.00 H new ATOM 0 HB3 LEU D 18 29.236 19.741 16.199 1.00 0.00 H new ATOM 0 HG LEU D 18 26.537 21.066 15.667 1.00 0.00 H new ATOM 0 HD11 LEU D 18 26.231 20.976 18.132 1.00 0.00 H new ATOM 0 HD12 LEU D 18 26.348 19.340 17.442 1.00 0.00 H new ATOM 0 HD13 LEU D 18 27.744 20.053 18.285 1.00 0.00 H new ATOM 0 HD21 LEU D 18 27.477 22.870 17.086 1.00 0.00 H new ATOM 0 HD22 LEU D 18 28.996 21.956 17.242 1.00 0.00 H new ATOM 0 HD23 LEU D 18 28.495 22.585 15.655 1.00 0.00 H new ATOM 1956 N HIS D 19 29.274 18.485 12.769 1.00 0.00 N0 ATOM 1957 CA HIS D 19 30.199 17.568 12.109 1.00 0.00 C0 ATOM 1958 C HIS D 19 31.044 18.303 11.078 1.00 0.00 C0 ATOM 1959 O HIS D 19 32.281 18.236 11.099 1.00 0.00 O0 ATOM 1960 CB HIS D 19 29.411 16.452 11.413 1.00 0.00 C0 ATOM 1961 CG HIS D 19 29.004 15.410 12.416 1.00 0.00 C0 ATOM 1962 ND1 HIS D 19 27.772 15.006 12.876 1.00 0.00 N0 flip ATOM 1963 CD2 HIS D 19 29.932 14.619 13.076 1.00 0.00 C0 flip ATOM 1964 CE1 HIS D 19 27.933 13.982 13.805 1.00 0.00 C0 flip ATOM 1965 NE2 HIS D 19 29.253 13.788 13.887 1.00 0.00 N0 flip ATOM 0 H HIS D 19 28.291 18.325 12.548 1.00 0.00 H new ATOM 0 HA HIS D 19 30.858 17.142 12.865 1.00 0.00 H new ATOM 0 HB2 HIS D 19 28.527 16.867 10.928 1.00 0.00 H new ATOM 0 HB3 HIS D 19 30.020 15.998 10.631 1.00 0.00 H new ATOM 0 HD2 HIS D 19 31.005 14.662 12.960 1.00 0.00 H new ATOM 0 HE1 HIS D 19 27.158 13.457 14.344 1.00 0.00 H new ATOM 0 HE2 HIS D 19 29.692 13.094 14.491 1.00 0.00 H new ATOM 1973 N PHE D 20 30.380 19.026 10.184 1.00 0.00 N0 ATOM 1974 CA PHE D 20 31.107 19.772 9.169 1.00 0.00 C0 ATOM 1975 C PHE D 20 31.859 20.932 9.813 1.00 0.00 C0 ATOM 1976 O PHE D 20 32.901 21.358 9.318 1.00 0.00 O0 ATOM 1977 CB PHE D 20 30.153 20.285 8.086 1.00 0.00 C0 ATOM 1978 CG PHE D 20 30.245 19.385 6.870 1.00 0.00 C0 ATOM 1979 CD1 PHE D 20 29.253 18.424 6.628 1.00 0.00 C0 ATOM 1980 CD2 PHE D 20 31.328 19.508 5.989 1.00 0.00 C0 ATOM 1981 CE1 PHE D 20 29.347 17.589 5.503 1.00 0.00 C0 ATOM 1982 CE2 PHE D 20 31.418 18.673 4.867 1.00 0.00 C0 ATOM 1983 CZ PHE D 20 30.429 17.713 4.623 1.00 0.00 C0 ATOM 0 H PHE D 20 29.364 19.110 10.141 1.00 0.00 H new ATOM 0 HA PHE D 20 31.828 19.105 8.696 1.00 0.00 H new ATOM 0 HB2 PHE D 20 29.131 20.302 8.464 1.00 0.00 H new ATOM 0 HB3 PHE D 20 30.409 21.309 7.815 1.00 0.00 H new ATOM 0 HD1 PHE D 20 28.418 18.326 7.306 1.00 0.00 H new ATOM 0 HD2 PHE D 20 32.094 20.247 6.175 1.00 0.00 H new ATOM 0 HE1 PHE D 20 28.583 16.849 5.316 1.00 0.00 H new ATOM 0 HE2 PHE D 20 32.253 18.771 4.189 1.00 0.00 H new ATOM 0 HZ PHE D 20 30.500 17.070 3.758 1.00 0.00 H new ATOM 1993 N MET D 21 31.340 21.422 10.937 1.00 0.00 N0 ATOM 1994 CA MET D 21 31.991 22.518 11.647 1.00 0.00 C0 ATOM 1995 C MET D 21 33.388 22.103 12.101 1.00 0.00 C0 ATOM 1996 O MET D 21 34.375 22.804 11.848 1.00 0.00 O0 ATOM 1997 CB MET D 21 31.155 22.908 12.863 1.00 0.00 C0 ATOM 1998 CG MET D 21 30.198 24.041 12.491 1.00 0.00 C0 ATOM 1999 SD MET D 21 29.273 24.555 13.961 1.00 0.00 S0 ATOM 2000 CE MET D 21 27.704 24.912 13.132 1.00 0.00 C0 ATOM 0 H MET D 21 30.482 21.082 11.370 1.00 0.00 H new ATOM 0 HA MET D 21 32.078 23.370 10.973 1.00 0.00 H new ATOM 0 HB2 MET D 21 30.591 22.046 13.220 1.00 0.00 H new ATOM 0 HB3 MET D 21 31.807 23.223 13.678 1.00 0.00 H new ATOM 0 HG2 MET D 21 30.756 24.885 12.086 1.00 0.00 H new ATOM 0 HG3 MET D 21 29.511 23.710 11.713 1.00 0.00 H new ATOM 0 HE1 MET D 21 26.928 25.079 13.879 1.00 0.00 H new ATOM 0 HE2 MET D 21 27.813 25.804 12.516 1.00 0.00 H new ATOM 0 HE3 MET D 21 27.425 24.068 12.502 1.00 0.00 H new ATOM 2010 N ALA D 22 33.475 20.959 12.763 1.00 0.00 N0 ATOM 2011 CA ALA D 22 34.764 20.480 13.220 1.00 0.00 C0 ATOM 2012 C ALA D 22 35.669 20.229 12.027 1.00 0.00 C0 ATOM 2013 O ALA D 22 36.872 20.480 12.079 1.00 0.00 O0 ATOM 2014 CB ALA D 22 34.600 19.197 14.033 1.00 0.00 C0 ATOM 0 H ALA D 22 32.683 20.357 12.991 1.00 0.00 H new ATOM 0 HA ALA D 22 35.215 21.239 13.860 1.00 0.00 H new ATOM 0 HB1 ALA D 22 35.578 18.851 14.368 1.00 0.00 H new ATOM 0 HB2 ALA D 22 33.968 19.393 14.899 1.00 0.00 H new ATOM 0 HB3 ALA D 22 34.137 18.430 13.412 1.00 0.00 H new ATOM 2020 N TRP D 23 35.082 19.717 10.948 1.00 0.00 N0 ATOM 2021 CA TRP D 23 35.853 19.422 9.744 1.00 0.00 C0 ATOM 2022 C TRP D 23 36.499 20.686 9.187 1.00 0.00 C0 ATOM 2023 O TRP D 23 37.678 20.683 8.829 1.00 0.00 O0 ATOM 2024 CB TRP D 23 34.941 18.810 8.680 1.00 0.00 C0 ATOM 2025 CG TRP D 23 34.505 17.446 9.114 1.00 0.00 C0 ATOM 2026 CD1 TRP D 23 34.811 16.867 10.299 1.00 0.00 C0 ATOM 2027 CD2 TRP D 23 33.691 16.481 8.389 1.00 0.00 C0 ATOM 2028 NE1 TRP D 23 34.234 15.613 10.348 1.00 0.00 N0 ATOM 2029 CE2 TRP D 23 33.534 15.329 9.194 1.00 0.00 C0 ATOM 2030 CE3 TRP D 23 33.078 16.494 7.122 1.00 0.00 C0 ATOM 2031 CZ2 TRP D 23 32.795 14.228 8.759 1.00 0.00 C0 ATOM 2032 CZ3 TRP D 23 32.334 15.387 6.682 1.00 0.00 C0 ATOM 2033 CH2 TRP D 23 32.193 14.256 7.500 1.00 0.00 C0 ATOM 0 H TRP D 23 34.087 19.500 10.882 1.00 0.00 H new ATOM 0 HA TRP D 23 36.639 18.715 10.009 1.00 0.00 H new ATOM 0 HB2 TRP D 23 34.071 19.448 8.522 1.00 0.00 H new ATOM 0 HB3 TRP D 23 35.468 18.748 7.728 1.00 0.00 H new ATOM 0 HD1 TRP D 23 35.409 17.313 11.080 1.00 0.00 H new ATOM 0 HE1 TRP D 23 34.316 14.976 11.140 1.00 0.00 H new ATOM 0 HE3 TRP D 23 33.180 17.360 6.485 1.00 0.00 H new ATOM 0 HZ2 TRP D 23 32.690 13.360 9.393 1.00 0.00 H new ATOM 0 HZ3 TRP D 23 31.868 15.407 5.708 1.00 0.00 H new ATOM 0 HH2 TRP D 23 31.619 13.408 7.156 1.00 0.00 H new ATOM 2044 N THR D 24 35.721 21.761 9.099 1.00 0.00 N0 ATOM 2045 CA THR D 24 36.240 23.014 8.567 1.00 0.00 C0 ATOM 2046 C THR D 24 37.432 23.475 9.396 1.00 0.00 C0 ATOM 2047 O THR D 24 38.438 23.933 8.853 1.00 0.00 O0 ATOM 2048 CB THR D 24 35.140 24.089 8.591 1.00 0.00 C0 ATOM 2049 OG1 THR D 24 34.740 24.314 9.933 1.00 0.00 O0 ATOM 2050 CG2 THR D 24 33.914 23.643 7.767 1.00 0.00 C0 ATOM 0 H THR D 24 34.742 21.790 9.385 1.00 0.00 H new ATOM 0 HA THR D 24 36.562 22.857 7.537 1.00 0.00 H new ATOM 0 HB THR D 24 35.539 25.004 8.153 1.00 0.00 H new ATOM 0 HG1 THR D 24 34.486 23.462 10.346 1.00 0.00 H new ATOM 0 HG21 THR D 24 33.151 24.421 7.800 1.00 0.00 H new ATOM 0 HG22 THR D 24 34.213 23.472 6.733 1.00 0.00 H new ATOM 0 HG23 THR D 24 33.511 22.721 8.185 1.00 0.00 H new ATOM 2058 N ILE D 25 37.322 23.342 10.711 1.00 0.00 N0 ATOM 2059 CA ILE D 25 38.419 23.741 11.589 1.00 0.00 C0 ATOM 2060 C ILE D 25 39.628 22.834 11.373 1.00 0.00 C0 ATOM 2061 O ILE D 25 40.770 23.291 11.359 1.00 0.00 O0 ATOM 2062 CB ILE D 25 37.978 23.680 13.050 1.00 0.00 C0 ATOM 2063 CG1 ILE D 25 36.912 24.751 13.291 1.00 0.00 C0 ATOM 2064 CG2 ILE D 25 39.179 23.937 13.967 1.00 0.00 C0 ATOM 2065 CD1 ILE D 25 36.317 24.576 14.689 1.00 0.00 C0 ATOM 0 H ILE D 25 36.502 22.968 11.189 1.00 0.00 H new ATOM 0 HA ILE D 25 38.699 24.766 11.347 1.00 0.00 H new ATOM 0 HB ILE D 25 37.570 22.693 13.268 1.00 0.00 H new ATOM 0 HG12 ILE D 25 37.351 25.744 13.193 1.00 0.00 H new ATOM 0 HG13 ILE D 25 36.127 24.674 12.538 1.00 0.00 H new ATOM 0 HG21 ILE D 25 38.858 23.892 15.008 1.00 0.00 H new ATOM 0 HG22 ILE D 25 39.941 23.178 13.789 1.00 0.00 H new ATOM 0 HG23 ILE D 25 39.593 24.923 13.757 1.00 0.00 H new ATOM 0 HD11 ILE D 25 35.558 25.339 14.860 1.00 0.00 H new ATOM 0 HD12 ILE D 25 35.863 23.588 14.770 1.00 0.00 H new ATOM 0 HD13 ILE D 25 37.105 24.675 15.435 1.00 0.00 H new ATOM 2077 N GLY D 26 39.358 21.545 11.212 1.00 0.00 N0 ATOM 2078 CA GLY D 26 40.423 20.572 11.006 1.00 0.00 C0 ATOM 2079 C GLY D 26 41.259 20.933 9.784 1.00 0.00 C0 ATOM 2080 O GLY D 26 42.489 20.937 9.838 1.00 0.00 O0 ATOM 0 H GLY D 26 38.417 21.151 11.220 1.00 0.00 H new ATOM 0 HA2 GLY D 26 41.061 20.532 11.889 1.00 0.00 H new ATOM 0 HA3 GLY D 26 39.994 19.578 10.878 1.00 0.00 H new ATOM 2084 N HIS D 27 40.582 21.234 8.682 1.00 0.00 N0 ATOM 2085 CA HIS D 27 41.269 21.600 7.450 1.00 0.00 C0 ATOM 2086 C HIS D 27 41.962 22.949 7.603 1.00 0.00 C0 ATOM 2087 O HIS D 27 43.049 23.168 7.070 1.00 0.00 O0 ATOM 2088 CB HIS D 27 40.273 21.657 6.290 1.00 0.00 C0 ATOM 2089 CG HIS D 27 41.024 21.750 4.991 1.00 0.00 C0 ATOM 2090 ND1 HIS D 27 41.908 20.764 4.581 1.00 0.00 N0 ATOM 2091 CD2 HIS D 27 41.034 22.697 3.999 1.00 0.00 C0 ATOM 2092 CE1 HIS D 27 42.406 21.136 3.390 1.00 0.00 C0 ATOM 2093 NE2 HIS D 27 41.907 22.307 2.988 1.00 0.00 N0 ATOM 0 H HIS D 27 39.564 21.232 8.616 1.00 0.00 H new ATOM 0 HA HIS D 27 42.023 20.842 7.238 1.00 0.00 H new ATOM 0 HB2 HIS D 27 39.641 20.769 6.295 1.00 0.00 H new ATOM 0 HB3 HIS D 27 39.614 22.518 6.404 1.00 0.00 H new ATOM 0 HD2 HIS D 27 40.453 23.607 4.002 1.00 0.00 H new ATOM 0 HE1 HIS D 27 43.123 20.558 2.826 1.00 0.00 H new ATOM 0 HE2 HIS D 27 42.120 22.808 2.125 1.00 0.00 H new ATOM 2101 N LEU D 28 41.328 23.848 8.352 1.00 0.00 N0 ATOM 2102 CA LEU D 28 41.890 25.174 8.587 1.00 0.00 C0 ATOM 2103 C LEU D 28 43.082 25.105 9.541 1.00 0.00 C0 ATOM 2104 O LEU D 28 43.814 26.084 9.693 1.00 0.00 O0 ATOM 2105 CB LEU D 28 40.820 26.097 9.167 1.00 0.00 C0 ATOM 2106 CG LEU D 28 39.806 26.447 8.077 1.00 0.00 C0 ATOM 2107 CD1 LEU D 28 38.554 27.046 8.717 1.00 0.00 C0 ATOM 2108 CD2 LEU D 28 40.422 27.472 7.120 1.00 0.00 C0 ATOM 0 H LEU D 28 40.429 23.683 8.804 1.00 0.00 H new ATOM 0 HA LEU D 28 42.236 25.570 7.632 1.00 0.00 H new ATOM 0 HB2 LEU D 28 40.318 25.610 10.003 1.00 0.00 H new ATOM 0 HB3 LEU D 28 41.280 27.005 9.557 1.00 0.00 H new ATOM 0 HG LEU D 28 39.539 25.544 7.527 1.00 0.00 H new ATOM 0 HD11 LEU D 28 37.832 27.295 7.940 1.00 0.00 H new ATOM 0 HD12 LEU D 28 38.114 26.322 9.403 1.00 0.00 H new ATOM 0 HD13 LEU D 28 38.822 27.949 9.266 1.00 0.00 H new ATOM 0 HD21 LEU D 28 39.701 27.723 6.342 1.00 0.00 H new ATOM 0 HD22 LEU D 28 40.687 28.373 7.673 1.00 0.00 H new ATOM 0 HD23 LEU D 28 41.317 27.051 6.663 1.00 0.00 H new