USER MOD reduce.3.24.130724 H: found=0, std=0, add=705, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 707 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 11 LYS NZ :NH3+ 140:sc= -1.09 (180deg=-3.49!) USER MOD Single : A 13 THR OG1 : rot -90:sc= 0.54 USER MOD Single : A 14 LYS NZ :NH3+ 138:sc= -3.33! (180deg=-4.29!) USER MOD Single : A 21 TYR OH : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00396) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 35 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 36 THR OG1 : rot 173:sc= -0.49 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 38 MET CE :methyl -158:sc= -0.136 (180deg=-0.769) USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 ASN : amide:sc= -0.0359 K(o=-0.036,f=-0.7) USER MOD Single : A 49 HIS : no HD1:sc= -0.259 X(o=-0.26,f=-0.043) USER MOD Single : B 213 THR OG1 : rot -160:sc= -0.724 USER MOD Single : B 214 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 221 TYR OH : rot 180:sc= 0.653 USER MOD Single : B 229 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 230 SER OG : rot 180:sc= 0 USER MOD Single : B 235 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 236 THR OG1 : rot 180:sc= 0 USER MOD Single : B 237 SER OG : rot 180:sc= 0 USER MOD Single : B 238 MET CE :methyl -162:sc= -0.062 (180deg=-0.483) USER MOD Single : B 239 SER OG : rot 90:sc= 1.44 USER MOD Single : B 241 TYR OH : rot 63:sc= 0.384 USER MOD Single : B 248 ASN : amide:sc= -0.315 K(o=-0.32,f=-3.2!) USER MOD Single : B 249 HIS : no HD1:sc= -2.67! C(o=-2.7!,f=-4.3!) USER MOD ----------------------------------------------------------------- ATOM 145 N LYS A 11 3.655 13.085 -9.084 1.00 30.51 N ATOM 146 CA LYS A 11 4.401 12.403 -10.155 1.00 52.21 C ATOM 147 C LYS A 11 5.697 11.767 -9.624 1.00 45.44 C ATOM 148 O LYS A 11 6.270 10.881 -10.252 1.00 42.05 O ATOM 149 CB LYS A 11 4.727 13.403 -11.275 1.00 73.21 C ATOM 150 CG LYS A 11 5.493 14.634 -10.789 1.00 74.44 C ATOM 151 CD LYS A 11 5.728 15.671 -11.892 1.00 23.44 C ATOM 152 CE LYS A 11 6.782 15.237 -12.910 1.00 1.11 C ATOM 153 NZ LYS A 11 6.295 14.165 -13.818 1.00 12.13 N ATOM 0 HA LYS A 11 3.774 11.602 -10.548 1.00 52.21 H new ATOM 0 HB2 LYS A 11 5.315 12.899 -12.042 1.00 73.21 H new ATOM 0 HB3 LYS A 11 3.798 13.725 -11.746 1.00 73.21 H new ATOM 0 HG2 LYS A 11 4.940 15.100 -9.973 1.00 74.44 H new ATOM 0 HG3 LYS A 11 6.455 14.319 -10.384 1.00 74.44 H new ATOM 0 HD2 LYS A 11 4.788 15.861 -12.410 1.00 23.44 H new ATOM 0 HD3 LYS A 11 6.037 16.612 -11.437 1.00 23.44 H new ATOM 0 HE2 LYS A 11 7.086 16.100 -13.503 1.00 1.11 H new ATOM 0 HE3 LYS A 11 7.668 14.885 -12.382 1.00 1.11 H new ATOM 0 HZ1 LYS A 11 6.636 14.347 -14.784 1.00 12.13 H new ATOM 0 HZ2 LYS A 11 6.653 13.245 -13.492 1.00 12.13 H new ATOM 0 HZ3 LYS A 11 5.255 14.153 -13.815 1.00 12.13 H new ATOM 167 N ASP A 12 6.128 12.206 -8.446 1.00 42.31 N ATOM 168 CA ASP A 12 7.421 11.801 -7.875 1.00 52.14 C ATOM 169 C ASP A 12 7.318 10.532 -7.005 1.00 22.25 C ATOM 170 O ASP A 12 8.054 10.386 -6.029 1.00 12.10 O ATOM 171 CB ASP A 12 7.964 12.949 -7.025 1.00 41.40 C ATOM 172 CG ASP A 12 7.895 14.276 -7.744 1.00 22.10 C ATOM 173 OD1 ASP A 12 6.809 14.890 -7.746 1.00 0.03 O ATOM 174 OD2 ASP A 12 8.918 14.708 -8.306 1.00 14.20 O ATOM 0 H ASP A 12 5.599 12.850 -7.858 1.00 42.31 H new ATOM 0 HA ASP A 12 8.090 11.570 -8.704 1.00 52.14 H new ATOM 0 HB2 ASP A 12 7.396 13.011 -6.097 1.00 41.40 H new ATOM 0 HB3 ASP A 12 8.998 12.739 -6.753 1.00 41.40 H new ATOM 179 N THR A 13 6.428 9.609 -7.360 1.00 70.52 N ATOM 180 CA THR A 13 6.246 8.380 -6.570 1.00 41.21 C ATOM 181 C THR A 13 6.195 7.129 -7.454 1.00 1.24 C ATOM 182 O THR A 13 5.496 7.093 -8.471 1.00 31.34 O ATOM 183 CB THR A 13 4.978 8.446 -5.678 1.00 10.43 C ATOM 184 OG1 THR A 13 3.862 8.976 -6.413 1.00 3.53 O ATOM 185 CG2 THR A 13 5.228 9.303 -4.443 1.00 5.10 C ATOM 0 H THR A 13 5.824 9.681 -8.179 1.00 70.52 H new ATOM 0 HA THR A 13 7.120 8.307 -5.923 1.00 41.21 H new ATOM 0 HB THR A 13 4.744 7.429 -5.363 1.00 10.43 H new ATOM 0 HG1 THR A 13 3.838 9.951 -6.314 1.00 3.53 H new ATOM 0 HG21 THR A 13 4.325 9.334 -3.833 1.00 5.10 H new ATOM 0 HG22 THR A 13 6.044 8.874 -3.861 1.00 5.10 H new ATOM 0 HG23 THR A 13 5.494 10.315 -4.750 1.00 5.10 H new ATOM 193 N LYS A 14 6.941 6.100 -7.042 1.00 52.33 N ATOM 194 CA LYS A 14 7.083 4.858 -7.816 1.00 53.25 C ATOM 195 C LYS A 14 5.892 3.910 -7.595 1.00 12.21 C ATOM 196 O LYS A 14 5.394 3.779 -6.476 1.00 14.21 O ATOM 197 CB LYS A 14 8.384 4.142 -7.416 1.00 55.34 C ATOM 198 CG LYS A 14 9.657 4.935 -7.708 1.00 40.31 C ATOM 199 CD LYS A 14 10.057 4.891 -9.183 1.00 24.40 C ATOM 200 CE LYS A 14 10.652 3.540 -9.587 1.00 2.45 C ATOM 201 NZ LYS A 14 9.633 2.461 -9.695 1.00 71.11 N ATOM 0 H LYS A 14 7.463 6.102 -6.166 1.00 52.33 H new ATOM 0 HA LYS A 14 7.111 5.127 -8.872 1.00 53.25 H new ATOM 0 HB2 LYS A 14 8.347 3.917 -6.350 1.00 55.34 H new ATOM 0 HB3 LYS A 14 8.436 3.189 -7.942 1.00 55.34 H new ATOM 0 HG2 LYS A 14 9.511 5.972 -7.407 1.00 40.31 H new ATOM 0 HG3 LYS A 14 10.473 4.539 -7.103 1.00 40.31 H new ATOM 0 HD2 LYS A 14 9.183 5.099 -9.800 1.00 24.40 H new ATOM 0 HD3 LYS A 14 10.783 5.679 -9.383 1.00 24.40 H new ATOM 0 HE2 LYS A 14 11.162 3.646 -10.544 1.00 2.45 H new ATOM 0 HE3 LYS A 14 11.405 3.248 -8.855 1.00 2.45 H new ATOM 0 HZ1 LYS A 14 9.826 1.885 -10.539 1.00 71.11 H new ATOM 0 HZ2 LYS A 14 9.674 1.859 -8.848 1.00 71.11 H new ATOM 0 HZ3 LYS A 14 8.686 2.884 -9.774 1.00 71.11 H new ATOM 215 N PRO A 15 5.425 3.232 -8.664 1.00 71.54 N ATOM 216 CA PRO A 15 4.297 2.290 -8.576 1.00 52.42 C ATOM 217 C PRO A 15 4.685 0.901 -8.035 1.00 10.32 C ATOM 218 O PRO A 15 5.768 0.385 -8.316 1.00 43.42 O ATOM 219 CB PRO A 15 3.832 2.189 -10.033 1.00 2.34 C ATOM 220 CG PRO A 15 5.076 2.386 -10.834 1.00 34.11 C ATOM 221 CD PRO A 15 5.939 3.344 -10.049 1.00 71.11 C ATOM 0 HA PRO A 15 3.538 2.638 -7.876 1.00 52.42 H new ATOM 0 HB2 PRO A 15 3.376 1.220 -10.238 1.00 2.34 H new ATOM 0 HB3 PRO A 15 3.085 2.948 -10.265 1.00 2.34 H new ATOM 0 HG2 PRO A 15 5.591 1.438 -10.991 1.00 34.11 H new ATOM 0 HG3 PRO A 15 4.844 2.790 -11.819 1.00 34.11 H new ATOM 0 HD2 PRO A 15 6.993 3.072 -10.107 1.00 71.11 H new ATOM 0 HD3 PRO A 15 5.851 4.363 -10.427 1.00 71.11 H new ATOM 229 N VAL A 16 3.788 0.312 -7.250 1.00 72.31 N ATOM 230 CA VAL A 16 3.935 -1.068 -6.782 1.00 60.54 C ATOM 231 C VAL A 16 2.575 -1.787 -6.836 1.00 34.34 C ATOM 232 O VAL A 16 1.571 -1.288 -6.325 1.00 35.40 O ATOM 233 CB VAL A 16 4.527 -1.126 -5.345 1.00 52.21 C ATOM 234 CG1 VAL A 16 3.703 -0.289 -4.369 1.00 41.13 C ATOM 235 CG2 VAL A 16 4.646 -2.573 -4.863 1.00 45.21 C ATOM 0 H VAL A 16 2.940 0.773 -6.920 1.00 72.31 H new ATOM 0 HA VAL A 16 4.636 -1.577 -7.444 1.00 60.54 H new ATOM 0 HB VAL A 16 5.529 -0.697 -5.381 1.00 52.21 H new ATOM 0 HG11 VAL A 16 4.144 -0.351 -3.374 1.00 41.13 H new ATOM 0 HG12 VAL A 16 3.695 0.750 -4.698 1.00 41.13 H new ATOM 0 HG13 VAL A 16 2.681 -0.668 -4.338 1.00 41.13 H new ATOM 0 HG21 VAL A 16 5.062 -2.588 -3.856 1.00 45.21 H new ATOM 0 HG22 VAL A 16 3.659 -3.036 -4.855 1.00 45.21 H new ATOM 0 HG23 VAL A 16 5.301 -3.128 -5.535 1.00 45.21 H new ATOM 245 N VAL A 17 2.539 -2.947 -7.486 1.00 4.50 N ATOM 246 CA VAL A 17 1.284 -3.675 -7.689 1.00 35.20 C ATOM 247 C VAL A 17 0.899 -4.512 -6.458 1.00 3.41 C ATOM 248 O VAL A 17 1.510 -5.550 -6.174 1.00 33.23 O ATOM 249 CB VAL A 17 1.362 -4.597 -8.931 1.00 1.13 C ATOM 250 CG1 VAL A 17 0.033 -5.314 -9.164 1.00 21.41 C ATOM 251 CG2 VAL A 17 1.774 -3.802 -10.170 1.00 34.31 C ATOM 0 H VAL A 17 3.361 -3.404 -7.881 1.00 4.50 H new ATOM 0 HA VAL A 17 0.514 -2.921 -7.850 1.00 35.20 H new ATOM 0 HB VAL A 17 2.124 -5.353 -8.742 1.00 1.13 H new ATOM 0 HG11 VAL A 17 0.114 -5.955 -10.042 1.00 21.41 H new ATOM 0 HG12 VAL A 17 -0.210 -5.922 -8.292 1.00 21.41 H new ATOM 0 HG13 VAL A 17 -0.754 -4.578 -9.324 1.00 21.41 H new ATOM 0 HG21 VAL A 17 1.823 -4.469 -11.031 1.00 34.31 H new ATOM 0 HG22 VAL A 17 1.041 -3.018 -10.360 1.00 34.31 H new ATOM 0 HG23 VAL A 17 2.753 -3.351 -10.004 1.00 34.31 H new ATOM 261 N VAL A 18 -0.108 -4.050 -5.724 1.00 11.51 N ATOM 262 CA VAL A 18 -0.637 -4.790 -4.580 1.00 64.25 C ATOM 263 C VAL A 18 -1.996 -5.424 -4.925 1.00 14.11 C ATOM 264 O VAL A 18 -2.816 -4.828 -5.624 1.00 35.31 O ATOM 265 CB VAL A 18 -0.771 -3.884 -3.329 1.00 35.43 C ATOM 266 CG1 VAL A 18 -1.767 -2.750 -3.562 1.00 72.20 C ATOM 267 CG2 VAL A 18 -1.156 -4.708 -2.099 1.00 15.55 C ATOM 0 H VAL A 18 -0.577 -3.162 -5.901 1.00 11.51 H new ATOM 0 HA VAL A 18 0.073 -5.583 -4.346 1.00 64.25 H new ATOM 0 HB VAL A 18 0.203 -3.431 -3.144 1.00 35.43 H new ATOM 0 HG11 VAL A 18 -1.835 -2.136 -2.664 1.00 72.20 H new ATOM 0 HG12 VAL A 18 -1.430 -2.136 -4.397 1.00 72.20 H new ATOM 0 HG13 VAL A 18 -2.747 -3.168 -3.791 1.00 72.20 H new ATOM 0 HG21 VAL A 18 -1.244 -4.051 -1.234 1.00 15.55 H new ATOM 0 HG22 VAL A 18 -2.110 -5.203 -2.277 1.00 15.55 H new ATOM 0 HG23 VAL A 18 -0.388 -5.458 -1.908 1.00 15.55 H new ATOM 277 N ARG A 19 -2.223 -6.642 -4.445 1.00 54.43 N ATOM 278 CA ARG A 19 -3.437 -7.391 -4.783 1.00 42.13 C ATOM 279 C ARG A 19 -4.237 -7.758 -3.521 1.00 42.55 C ATOM 280 O ARG A 19 -3.802 -8.583 -2.716 1.00 12.23 O ATOM 281 CB ARG A 19 -3.051 -8.650 -5.577 1.00 73.42 C ATOM 282 CG ARG A 19 -2.300 -8.337 -6.871 1.00 42.02 C ATOM 283 CD ARG A 19 -1.806 -9.595 -7.579 1.00 73.14 C ATOM 284 NE ARG A 19 -1.115 -9.279 -8.833 1.00 51.14 N ATOM 285 CZ ARG A 19 -0.104 -9.952 -9.314 1.00 3.01 C ATOM 286 NH1 ARG A 19 0.374 -10.974 -8.682 1.00 2.14 N ATOM 287 NH2 ARG A 19 0.431 -9.597 -10.435 1.00 31.11 N ATOM 0 H ARG A 19 -1.585 -7.135 -3.820 1.00 54.43 H new ATOM 0 HA ARG A 19 -4.081 -6.762 -5.398 1.00 42.13 H new ATOM 0 HB2 ARG A 19 -2.431 -9.291 -4.950 1.00 73.42 H new ATOM 0 HB3 ARG A 19 -3.954 -9.213 -5.815 1.00 73.42 H new ATOM 0 HG2 ARG A 19 -2.954 -7.780 -7.541 1.00 42.02 H new ATOM 0 HG3 ARG A 19 -1.450 -7.692 -6.647 1.00 42.02 H new ATOM 0 HD2 ARG A 19 -1.131 -10.142 -6.920 1.00 73.14 H new ATOM 0 HD3 ARG A 19 -2.651 -10.252 -7.785 1.00 73.14 H new ATOM 0 HE ARG A 19 -1.447 -8.477 -9.368 1.00 51.14 H new ATOM 0 HH11 ARG A 19 -0.039 -11.264 -7.796 1.00 2.14 H new ATOM 0 HH12 ARG A 19 1.164 -11.490 -9.070 1.00 2.14 H new ATOM 0 HH21 ARG A 19 0.064 -8.792 -10.943 1.00 31.11 H new ATOM 0 HH22 ARG A 19 1.220 -10.121 -10.812 1.00 31.11 H new ATOM 301 N LEU A 20 -5.407 -7.135 -3.361 1.00 41.23 N ATOM 302 CA LEU A 20 -6.251 -7.331 -2.170 1.00 11.33 C ATOM 303 C LEU A 20 -7.565 -8.048 -2.535 1.00 34.21 C ATOM 304 O LEU A 20 -7.985 -8.033 -3.691 1.00 71.13 O ATOM 305 CB LEU A 20 -6.552 -5.966 -1.527 1.00 1.41 C ATOM 306 CG LEU A 20 -7.223 -6.012 -0.142 1.00 21.24 C ATOM 307 CD1 LEU A 20 -6.305 -6.670 0.888 1.00 62.11 C ATOM 308 CD2 LEU A 20 -7.628 -4.610 0.310 1.00 53.31 C ATOM 0 H LEU A 20 -5.797 -6.485 -4.044 1.00 41.23 H new ATOM 0 HA LEU A 20 -5.713 -7.959 -1.460 1.00 11.33 H new ATOM 0 HB2 LEU A 20 -5.617 -5.413 -1.439 1.00 1.41 H new ATOM 0 HB3 LEU A 20 -7.194 -5.401 -2.203 1.00 1.41 H new ATOM 0 HG LEU A 20 -8.126 -6.617 -0.224 1.00 21.24 H new ATOM 0 HD11 LEU A 20 -6.802 -6.690 1.858 1.00 62.11 H new ATOM 0 HD12 LEU A 20 -6.078 -7.689 0.575 1.00 62.11 H new ATOM 0 HD13 LEU A 20 -5.379 -6.100 0.967 1.00 62.11 H new ATOM 0 HD21 LEU A 20 -8.100 -4.666 1.291 1.00 53.31 H new ATOM 0 HD22 LEU A 20 -6.743 -3.977 0.369 1.00 53.31 H new ATOM 0 HD23 LEU A 20 -8.331 -4.185 -0.407 1.00 53.31 H new ATOM 320 N TYR A 21 -8.218 -8.668 -1.553 1.00 74.22 N ATOM 321 CA TYR A 21 -9.464 -9.406 -1.802 1.00 12.04 C ATOM 322 C TYR A 21 -10.664 -8.452 -1.997 1.00 23.13 C ATOM 323 O TYR A 21 -10.794 -7.448 -1.295 1.00 55.45 O ATOM 324 CB TYR A 21 -9.741 -10.379 -0.646 1.00 62.23 C ATOM 325 CG TYR A 21 -8.668 -11.444 -0.477 1.00 12.23 C ATOM 326 CD1 TYR A 21 -7.491 -11.173 0.213 1.00 5.03 C ATOM 327 CD2 TYR A 21 -8.833 -12.721 -1.011 1.00 54.32 C ATOM 328 CE1 TYR A 21 -6.512 -12.135 0.364 1.00 73.31 C ATOM 329 CE2 TYR A 21 -7.857 -13.689 -0.863 1.00 52.55 C ATOM 330 CZ TYR A 21 -6.700 -13.390 -0.173 1.00 31.45 C ATOM 331 OH TYR A 21 -5.727 -14.351 -0.020 1.00 11.11 O ATOM 0 H TYR A 21 -7.910 -8.677 -0.581 1.00 74.22 H new ATOM 0 HA TYR A 21 -9.338 -9.970 -2.726 1.00 12.04 H new ATOM 0 HB2 TYR A 21 -9.829 -9.813 0.281 1.00 62.23 H new ATOM 0 HB3 TYR A 21 -10.701 -10.866 -0.814 1.00 62.23 H new ATOM 0 HD1 TYR A 21 -7.340 -10.192 0.639 1.00 5.03 H new ATOM 0 HD2 TYR A 21 -9.739 -12.958 -1.549 1.00 54.32 H new ATOM 0 HE1 TYR A 21 -5.603 -11.905 0.900 1.00 73.31 H new ATOM 0 HE2 TYR A 21 -7.999 -14.673 -1.285 1.00 52.55 H new ATOM 0 HH TYR A 21 -6.015 -15.180 -0.456 1.00 11.11 H new ATOM 341 N PRO A 22 -11.570 -8.765 -2.949 1.00 14.10 N ATOM 342 CA PRO A 22 -12.727 -7.900 -3.271 1.00 2.11 C ATOM 343 C PRO A 22 -13.647 -7.646 -2.066 1.00 1.55 C ATOM 344 O PRO A 22 -14.157 -6.537 -1.880 1.00 50.55 O ATOM 345 CB PRO A 22 -13.472 -8.685 -4.360 1.00 61.30 C ATOM 346 CG PRO A 22 -12.451 -9.608 -4.931 1.00 42.01 C ATOM 347 CD PRO A 22 -11.545 -9.976 -3.788 1.00 61.04 C ATOM 0 HA PRO A 22 -12.405 -6.907 -3.583 1.00 2.11 H new ATOM 0 HB2 PRO A 22 -14.315 -9.237 -3.943 1.00 61.30 H new ATOM 0 HB3 PRO A 22 -13.873 -8.018 -5.123 1.00 61.30 H new ATOM 0 HG2 PRO A 22 -12.921 -10.494 -5.358 1.00 42.01 H new ATOM 0 HG3 PRO A 22 -11.892 -9.125 -5.733 1.00 42.01 H new ATOM 0 HD2 PRO A 22 -11.910 -10.850 -3.248 1.00 61.04 H new ATOM 0 HD3 PRO A 22 -10.537 -10.210 -4.130 1.00 61.04 H new ATOM 355 N ASP A 23 -13.852 -8.681 -1.255 1.00 73.43 N ATOM 356 CA ASP A 23 -14.678 -8.584 -0.046 1.00 51.05 C ATOM 357 C ASP A 23 -14.075 -7.607 0.979 1.00 60.43 C ATOM 358 O ASP A 23 -14.747 -7.181 1.921 1.00 74.52 O ATOM 359 CB ASP A 23 -14.846 -9.976 0.571 1.00 10.44 C ATOM 360 CG ASP A 23 -15.467 -10.955 -0.410 1.00 71.23 C ATOM 361 OD1 ASP A 23 -14.733 -11.497 -1.259 1.00 73.41 O ATOM 362 OD2 ASP A 23 -16.696 -11.164 -0.355 1.00 62.53 O ATOM 0 H ASP A 23 -13.454 -9.607 -1.413 1.00 73.43 H new ATOM 0 HA ASP A 23 -15.655 -8.191 -0.329 1.00 51.05 H new ATOM 0 HB2 ASP A 23 -13.874 -10.351 0.893 1.00 10.44 H new ATOM 0 HB3 ASP A 23 -15.472 -9.906 1.461 1.00 10.44 H new ATOM 367 N GLU A 24 -12.804 -7.260 0.792 1.00 2.22 N ATOM 368 CA GLU A 24 -12.128 -6.279 1.644 1.00 52.02 C ATOM 369 C GLU A 24 -12.102 -4.898 0.972 1.00 71.22 C ATOM 370 O GLU A 24 -12.285 -3.872 1.630 1.00 64.32 O ATOM 371 CB GLU A 24 -10.708 -6.756 1.960 1.00 63.52 C ATOM 372 CG GLU A 24 -10.673 -8.164 2.540 1.00 54.13 C ATOM 373 CD GLU A 24 -9.277 -8.614 2.927 1.00 32.21 C ATOM 374 OE1 GLU A 24 -8.447 -8.827 2.022 1.00 42.55 O ATOM 375 OE2 GLU A 24 -9.017 -8.768 4.138 1.00 22.23 O ATOM 0 H GLU A 24 -12.216 -7.646 0.053 1.00 2.22 H new ATOM 0 HA GLU A 24 -12.683 -6.184 2.578 1.00 52.02 H new ATOM 0 HB2 GLU A 24 -10.109 -6.728 1.050 1.00 63.52 H new ATOM 0 HB3 GLU A 24 -10.247 -6.066 2.666 1.00 63.52 H new ATOM 0 HG2 GLU A 24 -11.318 -8.205 3.418 1.00 54.13 H new ATOM 0 HG3 GLU A 24 -11.084 -8.861 1.810 1.00 54.13 H new ATOM 382 N ILE A 25 -11.886 -4.882 -0.345 1.00 52.14 N ATOM 383 CA ILE A 25 -11.979 -3.645 -1.134 1.00 20.22 C ATOM 384 C ILE A 25 -13.383 -3.026 -1.003 1.00 12.31 C ATOM 385 O ILE A 25 -13.546 -1.803 -1.024 1.00 75.13 O ATOM 386 CB ILE A 25 -11.660 -3.908 -2.629 1.00 64.30 C ATOM 387 CG1 ILE A 25 -10.257 -4.527 -2.775 1.00 34.33 C ATOM 388 CG2 ILE A 25 -11.769 -2.618 -3.447 1.00 74.10 C ATOM 389 CD1 ILE A 25 -9.878 -4.870 -4.203 1.00 20.34 C ATOM 0 H ILE A 25 -11.645 -5.710 -0.890 1.00 52.14 H new ATOM 0 HA ILE A 25 -11.241 -2.946 -0.741 1.00 20.22 H new ATOM 0 HB ILE A 25 -12.394 -4.614 -3.017 1.00 64.30 H new ATOM 0 HG12 ILE A 25 -9.521 -3.831 -2.372 1.00 34.33 H new ATOM 0 HG13 ILE A 25 -10.206 -5.432 -2.169 1.00 34.33 H new ATOM 0 HG21 ILE A 25 -11.541 -2.829 -4.492 1.00 74.10 H new ATOM 0 HG22 ILE A 25 -12.782 -2.223 -3.370 1.00 74.10 H new ATOM 0 HG23 ILE A 25 -11.062 -1.883 -3.063 1.00 74.10 H new ATOM 0 HD11 ILE A 25 -8.877 -5.301 -4.220 1.00 20.34 H new ATOM 0 HD12 ILE A 25 -10.590 -5.591 -4.605 1.00 20.34 H new ATOM 0 HD13 ILE A 25 -9.894 -3.966 -4.811 1.00 20.34 H new ATOM 401 N GLU A 26 -14.389 -3.891 -0.856 1.00 43.11 N ATOM 402 CA GLU A 26 -15.767 -3.469 -0.569 1.00 34.33 C ATOM 403 C GLU A 26 -15.819 -2.525 0.645 1.00 73.34 C ATOM 404 O GLU A 26 -16.446 -1.463 0.599 1.00 11.52 O ATOM 405 CB GLU A 26 -16.639 -4.709 -0.310 1.00 11.33 C ATOM 406 CG GLU A 26 -18.040 -4.400 0.215 1.00 44.22 C ATOM 407 CD GLU A 26 -18.852 -5.660 0.482 1.00 15.03 C ATOM 408 OE1 GLU A 26 -18.457 -6.455 1.356 1.00 61.23 O ATOM 409 OE2 GLU A 26 -19.870 -5.881 -0.207 1.00 70.22 O ATOM 0 H GLU A 26 -14.275 -4.902 -0.932 1.00 43.11 H new ATOM 0 HA GLU A 26 -16.149 -2.925 -1.433 1.00 34.33 H new ATOM 0 HB2 GLU A 26 -16.729 -5.274 -1.238 1.00 11.33 H new ATOM 0 HB3 GLU A 26 -16.130 -5.352 0.407 1.00 11.33 H new ATOM 0 HG2 GLU A 26 -17.961 -3.821 1.135 1.00 44.22 H new ATOM 0 HG3 GLU A 26 -18.567 -3.778 -0.509 1.00 44.22 H new ATOM 416 N ALA A 27 -15.151 -2.924 1.727 1.00 61.20 N ATOM 417 CA ALA A 27 -15.057 -2.094 2.930 1.00 54.23 C ATOM 418 C ALA A 27 -14.223 -0.830 2.670 1.00 10.44 C ATOM 419 O ALA A 27 -14.572 0.260 3.126 1.00 32.50 O ATOM 420 CB ALA A 27 -14.456 -2.902 4.072 1.00 53.03 C ATOM 0 H ALA A 27 -14.666 -3.818 1.796 1.00 61.20 H new ATOM 0 HA ALA A 27 -16.063 -1.778 3.207 1.00 54.23 H new ATOM 0 HB1 ALA A 27 -14.389 -2.278 4.963 1.00 53.03 H new ATOM 0 HB2 ALA A 27 -15.089 -3.765 4.280 1.00 53.03 H new ATOM 0 HB3 ALA A 27 -13.459 -3.242 3.792 1.00 53.03 H new ATOM 426 N LEU A 28 -13.126 -0.989 1.928 1.00 32.54 N ATOM 427 CA LEU A 28 -12.251 0.134 1.563 1.00 31.13 C ATOM 428 C LEU A 28 -13.052 1.300 0.958 1.00 10.21 C ATOM 429 O LEU A 28 -13.095 2.395 1.517 1.00 24.40 O ATOM 430 CB LEU A 28 -11.179 -0.338 0.565 1.00 32.13 C ATOM 431 CG LEU A 28 -10.226 0.756 0.046 1.00 64.44 C ATOM 432 CD1 LEU A 28 -9.380 1.326 1.180 1.00 74.21 C ATOM 433 CD2 LEU A 28 -9.340 0.214 -1.076 1.00 50.25 C ATOM 0 H LEU A 28 -12.818 -1.891 1.564 1.00 32.54 H new ATOM 0 HA LEU A 28 -11.770 0.493 2.473 1.00 31.13 H new ATOM 0 HB2 LEU A 28 -10.584 -1.118 1.040 1.00 32.13 H new ATOM 0 HB3 LEU A 28 -11.679 -0.795 -0.289 1.00 32.13 H new ATOM 0 HG LEU A 28 -10.831 1.566 -0.360 1.00 64.44 H new ATOM 0 HD11 LEU A 28 -8.716 2.096 0.787 1.00 74.21 H new ATOM 0 HD12 LEU A 28 -10.032 1.761 1.937 1.00 74.21 H new ATOM 0 HD13 LEU A 28 -8.786 0.529 1.627 1.00 74.21 H new ATOM 0 HD21 LEU A 28 -8.675 1.003 -1.428 1.00 50.25 H new ATOM 0 HD22 LEU A 28 -8.747 -0.620 -0.701 1.00 50.25 H new ATOM 0 HD23 LEU A 28 -9.966 -0.128 -1.901 1.00 50.25 H new ATOM 445 N LYS A 29 -13.720 1.041 -0.164 1.00 50.42 N ATOM 446 CA LYS A 29 -14.498 2.073 -0.867 1.00 65.03 C ATOM 447 C LYS A 29 -15.840 2.369 -0.162 1.00 75.54 C ATOM 448 O LYS A 29 -16.722 3.019 -0.727 1.00 71.41 O ATOM 449 CB LYS A 29 -14.723 1.644 -2.328 1.00 30.42 C ATOM 450 CG LYS A 29 -15.485 0.330 -2.492 1.00 43.22 C ATOM 451 CD LYS A 29 -15.342 -0.241 -3.906 1.00 53.24 C ATOM 452 CE LYS A 29 -15.884 0.707 -4.976 1.00 4.14 C ATOM 453 NZ LYS A 29 -17.361 0.865 -4.894 1.00 0.11 N ATOM 0 H LYS A 29 -13.741 0.125 -0.611 1.00 50.42 H new ATOM 0 HA LYS A 29 -13.926 3.001 -0.849 1.00 65.03 H new ATOM 0 HB2 LYS A 29 -15.269 2.433 -2.845 1.00 30.42 H new ATOM 0 HB3 LYS A 29 -13.755 1.552 -2.820 1.00 30.42 H new ATOM 0 HG2 LYS A 29 -15.116 -0.396 -1.768 1.00 43.22 H new ATOM 0 HG3 LYS A 29 -16.540 0.492 -2.271 1.00 43.22 H new ATOM 0 HD2 LYS A 29 -14.291 -0.448 -4.107 1.00 53.24 H new ATOM 0 HD3 LYS A 29 -15.871 -1.192 -3.966 1.00 53.24 H new ATOM 0 HE2 LYS A 29 -15.410 1.683 -4.868 1.00 4.14 H new ATOM 0 HE3 LYS A 29 -15.615 0.330 -5.963 1.00 4.14 H new ATOM 0 HZ1 LYS A 29 -17.686 1.489 -5.659 1.00 0.11 H new ATOM 0 HZ2 LYS A 29 -17.816 -0.066 -4.989 1.00 0.11 H new ATOM 0 HZ3 LYS A 29 -17.615 1.282 -3.976 1.00 0.11 H new ATOM 467 N SER A 30 -15.982 1.899 1.078 1.00 63.51 N ATOM 468 CA SER A 30 -17.168 2.191 1.899 1.00 30.21 C ATOM 469 C SER A 30 -16.816 3.113 3.078 1.00 1.45 C ATOM 470 O SER A 30 -17.571 4.025 3.421 1.00 11.12 O ATOM 471 CB SER A 30 -17.776 0.888 2.436 1.00 34.13 C ATOM 472 OG SER A 30 -18.893 1.142 3.277 1.00 23.31 O ATOM 0 H SER A 30 -15.289 1.311 1.542 1.00 63.51 H new ATOM 0 HA SER A 30 -17.894 2.700 1.264 1.00 30.21 H new ATOM 0 HB2 SER A 30 -18.083 0.258 1.601 1.00 34.13 H new ATOM 0 HB3 SER A 30 -17.019 0.334 2.992 1.00 34.13 H new ATOM 0 HG SER A 30 -19.258 0.292 3.601 1.00 23.31 H new ATOM 478 N ARG A 31 -15.654 2.871 3.690 1.00 3.23 N ATOM 479 CA ARG A 31 -15.207 3.637 4.863 1.00 32.04 C ATOM 480 C ARG A 31 -14.495 4.947 4.477 1.00 54.31 C ATOM 481 O ARG A 31 -14.205 5.780 5.337 1.00 14.13 O ATOM 482 CB ARG A 31 -14.270 2.776 5.725 1.00 72.42 C ATOM 483 CG ARG A 31 -13.024 2.285 4.987 1.00 42.51 C ATOM 484 CD ARG A 31 -12.116 1.463 5.896 1.00 13.31 C ATOM 485 NE ARG A 31 -11.599 2.259 7.004 1.00 45.13 N ATOM 486 CZ ARG A 31 -10.955 1.764 8.027 1.00 54.20 C ATOM 487 NH1 ARG A 31 -10.774 0.487 8.155 1.00 53.42 N ATOM 488 NH2 ARG A 31 -10.510 2.551 8.943 1.00 42.32 N ATOM 0 H ARG A 31 -15.000 2.147 3.393 1.00 3.23 H new ATOM 0 HA ARG A 31 -16.099 3.905 5.429 1.00 32.04 H new ATOM 0 HB2 ARG A 31 -13.960 3.354 6.596 1.00 72.42 H new ATOM 0 HB3 ARG A 31 -14.824 1.914 6.096 1.00 72.42 H new ATOM 0 HG2 ARG A 31 -13.323 1.682 4.130 1.00 42.51 H new ATOM 0 HG3 ARG A 31 -12.471 3.140 4.598 1.00 42.51 H new ATOM 0 HD2 ARG A 31 -12.669 0.610 6.288 1.00 13.31 H new ATOM 0 HD3 ARG A 31 -11.284 1.064 5.315 1.00 13.31 H new ATOM 0 HE ARG A 31 -11.750 3.267 6.978 1.00 45.13 H new ATOM 0 HH11 ARG A 31 -11.137 -0.153 7.449 1.00 53.42 H new ATOM 0 HH12 ARG A 31 -10.268 0.122 8.962 1.00 53.42 H new ATOM 0 HH21 ARG A 31 -10.661 3.557 8.868 1.00 42.32 H new ATOM 0 HH22 ARG A 31 -10.007 2.169 9.744 1.00 42.32 H new ATOM 502 N VAL A 32 -14.208 5.121 3.190 1.00 74.14 N ATOM 503 CA VAL A 32 -13.522 6.327 2.709 1.00 24.42 C ATOM 504 C VAL A 32 -14.510 7.452 2.348 1.00 23.33 C ATOM 505 O VAL A 32 -15.633 7.188 1.911 1.00 62.31 O ATOM 506 CB VAL A 32 -12.638 6.023 1.472 1.00 54.33 C ATOM 507 CG1 VAL A 32 -11.538 5.028 1.827 1.00 22.35 C ATOM 508 CG2 VAL A 32 -13.482 5.505 0.309 1.00 12.12 C ATOM 0 H VAL A 32 -14.437 4.447 2.459 1.00 74.14 H new ATOM 0 HA VAL A 32 -12.892 6.662 3.533 1.00 24.42 H new ATOM 0 HB VAL A 32 -12.168 6.955 1.157 1.00 54.33 H new ATOM 0 HG11 VAL A 32 -10.929 4.829 0.945 1.00 22.35 H new ATOM 0 HG12 VAL A 32 -10.910 5.445 2.614 1.00 22.35 H new ATOM 0 HG13 VAL A 32 -11.987 4.098 2.176 1.00 22.35 H new ATOM 0 HG21 VAL A 32 -12.837 5.300 -0.545 1.00 12.12 H new ATOM 0 HG22 VAL A 32 -13.990 4.588 0.608 1.00 12.12 H new ATOM 0 HG23 VAL A 32 -14.222 6.257 0.033 1.00 12.12 H new ATOM 518 N PRO A 33 -14.111 8.723 2.545 1.00 74.13 N ATOM 519 CA PRO A 33 -14.904 9.876 2.089 1.00 73.34 C ATOM 520 C PRO A 33 -14.854 10.045 0.558 1.00 31.02 C ATOM 521 O PRO A 33 -13.878 9.662 -0.088 1.00 3.44 O ATOM 522 CB PRO A 33 -14.244 11.062 2.807 1.00 24.24 C ATOM 523 CG PRO A 33 -12.835 10.631 3.043 1.00 61.05 C ATOM 524 CD PRO A 33 -12.877 9.137 3.241 1.00 24.12 C ATOM 0 HA PRO A 33 -15.965 9.771 2.318 1.00 73.34 H new ATOM 0 HB2 PRO A 33 -14.284 11.965 2.198 1.00 24.24 H new ATOM 0 HB3 PRO A 33 -14.751 11.288 3.745 1.00 24.24 H new ATOM 0 HG2 PRO A 33 -12.201 10.893 2.196 1.00 61.05 H new ATOM 0 HG3 PRO A 33 -12.418 11.128 3.919 1.00 61.05 H new ATOM 0 HD2 PRO A 33 -11.997 8.653 2.817 1.00 24.12 H new ATOM 0 HD3 PRO A 33 -12.907 8.874 4.298 1.00 24.12 H new ATOM 532 N ALA A 34 -15.905 10.640 -0.010 1.00 0.13 N ATOM 533 CA ALA A 34 -16.063 10.739 -1.470 1.00 1.30 C ATOM 534 C ALA A 34 -14.894 11.469 -2.157 1.00 40.22 C ATOM 535 O ALA A 34 -14.557 11.174 -3.305 1.00 5.51 O ATOM 536 CB ALA A 34 -17.382 11.430 -1.802 1.00 43.32 C ATOM 0 H ALA A 34 -16.666 11.064 0.520 1.00 0.13 H new ATOM 0 HA ALA A 34 -16.065 9.721 -1.859 1.00 1.30 H new ATOM 0 HB1 ALA A 34 -17.494 11.501 -2.884 1.00 43.32 H new ATOM 0 HB2 ALA A 34 -18.209 10.853 -1.389 1.00 43.32 H new ATOM 0 HB3 ALA A 34 -17.387 12.431 -1.371 1.00 43.32 H new ATOM 542 N ASN A 35 -14.277 12.419 -1.455 1.00 3.21 N ATOM 543 CA ASN A 35 -13.187 13.222 -2.036 1.00 3.30 C ATOM 544 C ASN A 35 -11.817 12.524 -1.934 1.00 14.01 C ATOM 545 O ASN A 35 -10.821 13.025 -2.459 1.00 51.05 O ATOM 546 CB ASN A 35 -13.124 14.597 -1.368 1.00 52.31 C ATOM 547 CG ASN A 35 -14.410 15.382 -1.549 1.00 53.22 C ATOM 548 OD1 ASN A 35 -14.589 16.084 -2.538 1.00 12.12 O ATOM 549 ND2 ASN A 35 -15.314 15.276 -0.598 1.00 42.35 N ATOM 0 H ASN A 35 -14.507 12.655 -0.490 1.00 3.21 H new ATOM 0 HA ASN A 35 -13.412 13.339 -3.096 1.00 3.30 H new ATOM 0 HB2 ASN A 35 -12.923 14.473 -0.304 1.00 52.31 H new ATOM 0 HB3 ASN A 35 -12.292 15.164 -1.786 1.00 52.31 H new ATOM 0 HD21 ASN A 35 -16.194 15.787 -0.672 1.00 42.35 H new ATOM 0 HD22 ASN A 35 -15.135 14.683 0.213 1.00 42.35 H new ATOM 556 N THR A 36 -11.772 11.373 -1.265 1.00 20.31 N ATOM 557 CA THR A 36 -10.523 10.607 -1.121 1.00 25.41 C ATOM 558 C THR A 36 -10.527 9.362 -2.015 1.00 33.14 C ATOM 559 O THR A 36 -11.409 8.509 -1.910 1.00 53.05 O ATOM 560 CB THR A 36 -10.274 10.174 0.348 1.00 2.45 C ATOM 561 OG1 THR A 36 -10.147 11.332 1.188 1.00 44.22 O ATOM 562 CG2 THR A 36 -9.009 9.323 0.476 1.00 3.00 C ATOM 0 H THR A 36 -12.581 10.946 -0.813 1.00 20.31 H new ATOM 0 HA THR A 36 -9.718 11.273 -1.431 1.00 25.41 H new ATOM 0 HB THR A 36 -11.128 9.575 0.663 1.00 2.45 H new ATOM 0 HG1 THR A 36 -10.104 11.052 2.126 1.00 44.22 H new ATOM 0 HG21 THR A 36 -8.866 9.038 1.518 1.00 3.00 H new ATOM 0 HG22 THR A 36 -9.111 8.426 -0.135 1.00 3.00 H new ATOM 0 HG23 THR A 36 -8.148 9.898 0.136 1.00 3.00 H new ATOM 570 N SER A 37 -9.529 9.261 -2.888 1.00 3.02 N ATOM 571 CA SER A 37 -9.416 8.132 -3.821 1.00 64.03 C ATOM 572 C SER A 37 -9.025 6.838 -3.090 1.00 10.34 C ATOM 573 O SER A 37 -8.231 6.864 -2.149 1.00 52.25 O ATOM 574 CB SER A 37 -8.374 8.438 -4.910 1.00 40.15 C ATOM 575 OG SER A 37 -8.700 9.625 -5.621 1.00 64.11 O ATOM 0 H SER A 37 -8.781 9.949 -2.973 1.00 3.02 H new ATOM 0 HA SER A 37 -10.394 7.989 -4.281 1.00 64.03 H new ATOM 0 HB2 SER A 37 -7.390 8.544 -4.454 1.00 40.15 H new ATOM 0 HB3 SER A 37 -8.315 7.600 -5.605 1.00 40.15 H new ATOM 0 HG SER A 37 -8.019 9.794 -6.305 1.00 64.11 H new ATOM 581 N MET A 38 -9.568 5.708 -3.544 1.00 33.53 N ATOM 582 CA MET A 38 -9.272 4.397 -2.943 1.00 22.35 C ATOM 583 C MET A 38 -7.759 4.113 -2.936 1.00 32.33 C ATOM 584 O MET A 38 -7.192 3.714 -1.917 1.00 54.32 O ATOM 585 CB MET A 38 -10.010 3.290 -3.708 1.00 51.20 C ATOM 586 CG MET A 38 -11.528 3.439 -3.692 1.00 34.30 C ATOM 587 SD MET A 38 -12.360 2.205 -4.717 1.00 64.33 S ATOM 588 CE MET A 38 -11.731 2.620 -6.342 1.00 31.05 C ATOM 0 H MET A 38 -10.218 5.669 -4.329 1.00 33.53 H new ATOM 0 HA MET A 38 -9.617 4.415 -1.909 1.00 22.35 H new ATOM 0 HB2 MET A 38 -9.666 3.284 -4.742 1.00 51.20 H new ATOM 0 HB3 MET A 38 -9.744 2.324 -3.278 1.00 51.20 H new ATOM 0 HG2 MET A 38 -11.887 3.355 -2.666 1.00 34.30 H new ATOM 0 HG3 MET A 38 -11.795 4.436 -4.042 1.00 34.30 H new ATOM 0 HE1 MET A 38 -12.412 2.239 -7.104 1.00 31.05 H new ATOM 0 HE2 MET A 38 -11.651 3.703 -6.435 1.00 31.05 H new ATOM 0 HE3 MET A 38 -10.747 2.170 -6.477 1.00 31.05 H new ATOM 598 N SER A 39 -7.116 4.333 -4.080 1.00 21.20 N ATOM 599 CA SER A 39 -5.662 4.156 -4.211 1.00 0.02 C ATOM 600 C SER A 39 -4.896 5.133 -3.309 1.00 21.01 C ATOM 601 O SER A 39 -3.925 4.759 -2.652 1.00 15.13 O ATOM 602 CB SER A 39 -5.236 4.365 -5.667 1.00 72.32 C ATOM 603 OG SER A 39 -5.624 5.649 -6.126 1.00 22.21 O ATOM 0 H SER A 39 -7.577 4.636 -4.938 1.00 21.20 H new ATOM 0 HA SER A 39 -5.422 3.140 -3.899 1.00 0.02 H new ATOM 0 HB2 SER A 39 -4.155 4.254 -5.754 1.00 72.32 H new ATOM 0 HB3 SER A 39 -5.687 3.597 -6.296 1.00 72.32 H new ATOM 0 HG SER A 39 -5.341 5.763 -7.057 1.00 22.21 H new ATOM 609 N ALA A 40 -5.339 6.391 -3.285 1.00 35.03 N ATOM 610 CA ALA A 40 -4.737 7.409 -2.415 1.00 0.14 C ATOM 611 C ALA A 40 -4.877 7.027 -0.932 1.00 75.23 C ATOM 612 O ALA A 40 -3.993 7.306 -0.118 1.00 75.42 O ATOM 613 CB ALA A 40 -5.368 8.772 -2.677 1.00 11.53 C ATOM 0 H ALA A 40 -6.112 6.732 -3.857 1.00 35.03 H new ATOM 0 HA ALA A 40 -3.674 7.465 -2.647 1.00 0.14 H new ATOM 0 HB1 ALA A 40 -4.911 9.516 -2.024 1.00 11.53 H new ATOM 0 HB2 ALA A 40 -5.206 9.054 -3.717 1.00 11.53 H new ATOM 0 HB3 ALA A 40 -6.438 8.722 -2.477 1.00 11.53 H new ATOM 619 N TYR A 41 -5.989 6.379 -0.590 1.00 34.24 N ATOM 620 CA TYR A 41 -6.218 5.918 0.780 1.00 13.20 C ATOM 621 C TYR A 41 -5.230 4.797 1.141 1.00 54.35 C ATOM 622 O TYR A 41 -4.623 4.813 2.208 1.00 74.23 O ATOM 623 CB TYR A 41 -7.666 5.442 0.949 1.00 31.03 C ATOM 624 CG TYR A 41 -8.106 5.322 2.399 1.00 55.32 C ATOM 625 CD1 TYR A 41 -8.437 6.455 3.139 1.00 44.14 C ATOM 626 CD2 TYR A 41 -8.197 4.084 3.027 1.00 13.15 C ATOM 627 CE1 TYR A 41 -8.845 6.355 4.457 1.00 23.32 C ATOM 628 CE2 TYR A 41 -8.607 3.978 4.344 1.00 31.14 C ATOM 629 CZ TYR A 41 -8.930 5.116 5.052 1.00 1.03 C ATOM 630 OH TYR A 41 -9.342 5.013 6.363 1.00 63.14 O ATOM 0 H TYR A 41 -6.744 6.161 -1.240 1.00 34.24 H new ATOM 0 HA TYR A 41 -6.051 6.753 1.461 1.00 13.20 H new ATOM 0 HB2 TYR A 41 -8.330 6.136 0.434 1.00 31.03 H new ATOM 0 HB3 TYR A 41 -7.779 4.473 0.463 1.00 31.03 H new ATOM 0 HD1 TYR A 41 -8.374 7.428 2.676 1.00 44.14 H new ATOM 0 HD2 TYR A 41 -7.943 3.190 2.477 1.00 13.15 H new ATOM 0 HE1 TYR A 41 -9.096 7.244 5.017 1.00 23.32 H new ATOM 0 HE2 TYR A 41 -8.674 3.009 4.815 1.00 31.14 H new ATOM 0 HH TYR A 41 -9.349 4.070 6.631 1.00 63.14 H new ATOM 640 N ILE A 42 -5.058 3.835 0.232 1.00 11.34 N ATOM 641 CA ILE A 42 -4.049 2.782 0.401 1.00 61.04 C ATOM 642 C ILE A 42 -2.636 3.390 0.499 1.00 11.32 C ATOM 643 O ILE A 42 -1.804 2.951 1.295 1.00 41.24 O ATOM 644 CB ILE A 42 -4.098 1.767 -0.773 1.00 42.25 C ATOM 645 CG1 ILE A 42 -5.473 1.075 -0.835 1.00 21.10 C ATOM 646 CG2 ILE A 42 -2.983 0.730 -0.649 1.00 2.31 C ATOM 647 CD1 ILE A 42 -5.797 0.229 0.384 1.00 14.44 C ATOM 0 H ILE A 42 -5.602 3.762 -0.628 1.00 11.34 H new ATOM 0 HA ILE A 42 -4.276 2.256 1.328 1.00 61.04 H new ATOM 0 HB ILE A 42 -3.945 2.319 -1.700 1.00 42.25 H new ATOM 0 HG12 ILE A 42 -6.245 1.835 -0.952 1.00 21.10 H new ATOM 0 HG13 ILE A 42 -5.510 0.443 -1.723 1.00 21.10 H new ATOM 0 HG21 ILE A 42 -3.041 0.032 -1.484 1.00 2.31 H new ATOM 0 HG22 ILE A 42 -2.016 1.232 -0.662 1.00 2.31 H new ATOM 0 HG23 ILE A 42 -3.096 0.185 0.288 1.00 2.31 H new ATOM 0 HD11 ILE A 42 -6.781 -0.223 0.262 1.00 14.44 H new ATOM 0 HD12 ILE A 42 -5.048 -0.556 0.492 1.00 14.44 H new ATOM 0 HD13 ILE A 42 -5.795 0.858 1.274 1.00 14.44 H new ATOM 659 N ARG A 43 -2.388 4.418 -0.312 1.00 64.12 N ATOM 660 CA ARG A 43 -1.109 5.138 -0.309 1.00 21.00 C ATOM 661 C ARG A 43 -0.792 5.736 1.073 1.00 62.11 C ATOM 662 O ARG A 43 0.315 5.575 1.589 1.00 54.22 O ATOM 663 CB ARG A 43 -1.140 6.233 -1.385 1.00 71.11 C ATOM 664 CG ARG A 43 0.071 7.167 -1.391 1.00 62.21 C ATOM 665 CD ARG A 43 0.046 8.092 -2.609 1.00 33.41 C ATOM 666 NE ARG A 43 0.997 9.201 -2.501 1.00 0.33 N ATOM 667 CZ ARG A 43 1.762 9.615 -3.475 1.00 11.24 C ATOM 668 NH1 ARG A 43 1.834 8.947 -4.587 1.00 51.24 N ATOM 669 NH2 ARG A 43 2.478 10.684 -3.325 1.00 70.44 N ATOM 0 H ARG A 43 -3.063 4.776 -0.988 1.00 64.12 H new ATOM 0 HA ARG A 43 -0.313 4.429 -0.536 1.00 21.00 H new ATOM 0 HB2 ARG A 43 -1.219 5.758 -2.363 1.00 71.11 H new ATOM 0 HB3 ARG A 43 -2.041 6.831 -1.248 1.00 71.11 H new ATOM 0 HG2 ARG A 43 0.080 7.763 -0.478 1.00 62.21 H new ATOM 0 HG3 ARG A 43 0.988 6.578 -1.396 1.00 62.21 H new ATOM 0 HD2 ARG A 43 0.271 7.512 -3.504 1.00 33.41 H new ATOM 0 HD3 ARG A 43 -0.960 8.493 -2.734 1.00 33.41 H new ATOM 0 HE ARG A 43 1.066 9.682 -1.604 1.00 0.33 H new ATOM 0 HH11 ARG A 43 1.290 8.092 -4.704 1.00 51.24 H new ATOM 0 HH12 ARG A 43 2.434 9.278 -5.343 1.00 51.24 H new ATOM 0 HH21 ARG A 43 2.444 11.202 -2.447 1.00 70.44 H new ATOM 0 HH22 ARG A 43 3.076 11.008 -4.085 1.00 70.44 H new ATOM 683 N ARG A 44 -1.766 6.421 1.673 1.00 14.22 N ATOM 684 CA ARG A 44 -1.583 6.990 3.015 1.00 22.13 C ATOM 685 C ARG A 44 -1.612 5.893 4.099 1.00 41.23 C ATOM 686 O ARG A 44 -1.001 6.041 5.157 1.00 60.25 O ATOM 687 CB ARG A 44 -2.635 8.078 3.295 1.00 55.43 C ATOM 688 CG ARG A 44 -4.080 7.588 3.283 1.00 74.02 C ATOM 689 CD ARG A 44 -5.073 8.748 3.300 1.00 11.41 C ATOM 690 NE ARG A 44 -4.886 9.624 4.459 1.00 31.32 N ATOM 691 CZ ARG A 44 -4.400 10.838 4.395 1.00 60.42 C ATOM 692 NH1 ARG A 44 -4.059 11.356 3.258 1.00 11.31 N ATOM 693 NH2 ARG A 44 -4.273 11.537 5.475 1.00 34.33 N ATOM 0 H ARG A 44 -2.682 6.596 1.259 1.00 14.22 H new ATOM 0 HA ARG A 44 -0.598 7.456 3.049 1.00 22.13 H new ATOM 0 HB2 ARG A 44 -2.426 8.525 4.267 1.00 55.43 H new ATOM 0 HB3 ARG A 44 -2.528 8.868 2.551 1.00 55.43 H new ATOM 0 HG2 ARG A 44 -4.249 6.978 2.396 1.00 74.02 H new ATOM 0 HG3 ARG A 44 -4.254 6.948 4.148 1.00 74.02 H new ATOM 0 HD2 ARG A 44 -4.963 9.331 2.386 1.00 11.41 H new ATOM 0 HD3 ARG A 44 -6.089 8.353 3.306 1.00 11.41 H new ATOM 0 HE ARG A 44 -5.152 9.265 5.376 1.00 31.32 H new ATOM 0 HH11 ARG A 44 -4.168 10.817 2.399 1.00 11.31 H new ATOM 0 HH12 ARG A 44 -3.682 12.303 3.222 1.00 11.31 H new ATOM 0 HH21 ARG A 44 -4.551 11.142 6.374 1.00 34.33 H new ATOM 0 HH22 ARG A 44 -3.895 12.483 5.429 1.00 34.33 H new ATOM 707 N ILE A 45 -2.313 4.789 3.823 1.00 53.41 N ATOM 708 CA ILE A 45 -2.314 3.619 4.716 1.00 33.40 C ATOM 709 C ILE A 45 -0.891 3.078 4.936 1.00 43.41 C ATOM 710 O ILE A 45 -0.432 2.942 6.076 1.00 25.12 O ATOM 711 CB ILE A 45 -3.224 2.480 4.165 1.00 71.55 C ATOM 712 CG1 ILE A 45 -4.705 2.783 4.458 1.00 4.51 C ATOM 713 CG2 ILE A 45 -2.826 1.117 4.736 1.00 60.13 C ATOM 714 CD1 ILE A 45 -5.661 1.716 3.959 1.00 74.23 C ATOM 0 H ILE A 45 -2.889 4.678 2.988 1.00 53.41 H new ATOM 0 HA ILE A 45 -2.714 3.956 5.672 1.00 33.40 H new ATOM 0 HB ILE A 45 -3.085 2.436 3.085 1.00 71.55 H new ATOM 0 HG12 ILE A 45 -4.836 2.900 5.534 1.00 4.51 H new ATOM 0 HG13 ILE A 45 -4.968 3.736 3.999 1.00 4.51 H new ATOM 0 HG21 ILE A 45 -3.482 0.347 4.330 1.00 60.13 H new ATOM 0 HG22 ILE A 45 -1.794 0.896 4.463 1.00 60.13 H new ATOM 0 HG23 ILE A 45 -2.918 1.136 5.822 1.00 60.13 H new ATOM 0 HD11 ILE A 45 -6.684 2.001 4.203 1.00 74.23 H new ATOM 0 HD12 ILE A 45 -5.561 1.614 2.878 1.00 74.23 H new ATOM 0 HD13 ILE A 45 -5.426 0.765 4.437 1.00 74.23 H new ATOM 726 N ILE A 46 -0.199 2.763 3.843 1.00 52.43 N ATOM 727 CA ILE A 46 1.177 2.265 3.930 1.00 0.22 C ATOM 728 C ILE A 46 2.144 3.366 4.392 1.00 35.21 C ATOM 729 O ILE A 46 3.045 3.108 5.188 1.00 4.22 O ATOM 730 CB ILE A 46 1.664 1.671 2.581 1.00 20.53 C ATOM 731 CG1 ILE A 46 1.635 2.730 1.465 1.00 63.15 C ATOM 732 CG2 ILE A 46 0.816 0.459 2.198 1.00 71.42 C ATOM 733 CD1 ILE A 46 2.151 2.235 0.128 1.00 24.12 C ATOM 0 H ILE A 46 -0.562 2.842 2.893 1.00 52.43 H new ATOM 0 HA ILE A 46 1.172 1.468 4.673 1.00 0.22 H new ATOM 0 HB ILE A 46 2.697 1.348 2.705 1.00 20.53 H new ATOM 0 HG12 ILE A 46 0.611 3.082 1.339 1.00 63.15 H new ATOM 0 HG13 ILE A 46 2.231 3.588 1.777 1.00 63.15 H new ATOM 0 HG21 ILE A 46 1.169 0.053 1.250 1.00 71.42 H new ATOM 0 HG22 ILE A 46 0.900 -0.303 2.973 1.00 71.42 H new ATOM 0 HG23 ILE A 46 -0.226 0.761 2.098 1.00 71.42 H new ATOM 0 HD11 ILE A 46 2.097 3.041 -0.604 1.00 24.12 H new ATOM 0 HD12 ILE A 46 3.186 1.911 0.235 1.00 24.12 H new ATOM 0 HD13 ILE A 46 1.541 1.397 -0.210 1.00 24.12 H new ATOM 745 N LEU A 47 1.939 4.591 3.905 1.00 73.33 N ATOM 746 CA LEU A 47 2.773 5.737 4.292 1.00 42.53 C ATOM 747 C LEU A 47 2.814 5.899 5.820 1.00 50.50 C ATOM 748 O LEU A 47 3.885 5.874 6.430 1.00 53.35 O ATOM 749 CB LEU A 47 2.235 7.021 3.640 1.00 33.10 C ATOM 750 CG LEU A 47 3.085 8.283 3.854 1.00 32.21 C ATOM 751 CD1 LEU A 47 4.468 8.112 3.229 1.00 14.04 C ATOM 752 CD2 LEU A 47 2.377 9.511 3.286 1.00 23.22 C ATOM 0 H LEU A 47 1.200 4.818 3.239 1.00 73.33 H new ATOM 0 HA LEU A 47 3.789 5.554 3.942 1.00 42.53 H new ATOM 0 HB2 LEU A 47 2.137 6.849 2.568 1.00 33.10 H new ATOM 0 HB3 LEU A 47 1.233 7.210 4.026 1.00 33.10 H new ATOM 0 HG LEU A 47 3.215 8.433 4.926 1.00 32.21 H new ATOM 0 HD11 LEU A 47 5.055 9.016 3.391 1.00 14.04 H new ATOM 0 HD12 LEU A 47 4.973 7.264 3.691 1.00 14.04 H new ATOM 0 HD13 LEU A 47 4.364 7.934 2.159 1.00 14.04 H new ATOM 0 HD21 LEU A 47 2.995 10.394 3.447 1.00 23.22 H new ATOM 0 HD22 LEU A 47 2.212 9.374 2.217 1.00 23.22 H new ATOM 0 HD23 LEU A 47 1.418 9.642 3.787 1.00 23.22 H new ATOM 764 N ASN A 48 1.633 6.041 6.431 1.00 31.35 N ATOM 765 CA ASN A 48 1.522 6.145 7.893 1.00 3.32 C ATOM 766 C ASN A 48 2.213 4.964 8.592 1.00 23.23 C ATOM 767 O ASN A 48 2.987 5.150 9.527 1.00 64.53 O ATOM 768 CB ASN A 48 0.046 6.201 8.325 1.00 42.24 C ATOM 769 CG ASN A 48 -0.677 7.447 7.839 1.00 24.31 C ATOM 770 OD1 ASN A 48 -0.080 8.500 7.649 1.00 33.32 O ATOM 771 ND2 ASN A 48 -1.978 7.339 7.644 1.00 62.14 N ATOM 0 H ASN A 48 0.741 6.087 5.938 1.00 31.35 H new ATOM 0 HA ASN A 48 2.020 7.068 8.191 1.00 3.32 H new ATOM 0 HB2 ASN A 48 -0.470 5.319 7.946 1.00 42.24 H new ATOM 0 HB3 ASN A 48 -0.009 6.159 9.413 1.00 42.24 H new ATOM 0 HD21 ASN A 48 -2.515 8.146 7.326 1.00 62.14 H new ATOM 0 HD22 ASN A 48 -2.447 6.448 7.811 1.00 62.14 H new ATOM 778 N HIS A 49 1.947 3.750 8.112 1.00 24.10 N ATOM 779 CA HIS A 49 2.483 2.533 8.732 1.00 74.54 C ATOM 780 C HIS A 49 4.021 2.474 8.643 1.00 70.54 C ATOM 781 O HIS A 49 4.688 2.032 9.579 1.00 11.14 O ATOM 782 CB HIS A 49 1.860 1.296 8.067 1.00 35.12 C ATOM 783 CG HIS A 49 2.141 0.006 8.782 1.00 70.21 C ATOM 784 ND1 HIS A 49 1.228 -0.599 9.617 1.00 44.11 N ATOM 785 CD2 HIS A 49 3.226 -0.808 8.771 1.00 53.42 C ATOM 786 CE1 HIS A 49 1.729 -1.723 10.081 1.00 71.11 C ATOM 787 NE2 HIS A 49 2.939 -1.875 9.585 1.00 74.14 N ATOM 0 H HIS A 49 1.362 3.580 7.294 1.00 24.10 H new ATOM 0 HA HIS A 49 2.220 2.549 9.790 1.00 74.54 H new ATOM 0 HB2 HIS A 49 0.781 1.436 8.004 1.00 35.12 H new ATOM 0 HB3 HIS A 49 2.232 1.221 7.045 1.00 35.12 H new ATOM 0 HD2 HIS A 49 4.143 -0.647 8.224 1.00 53.42 H new ATOM 0 HE1 HIS A 49 1.232 -2.405 10.755 1.00 71.11 H new ATOM 0 HE2 HIS A 49 3.563 -2.659 9.775 1.00 74.14 H new ATOM 796 N LEU A 50 4.580 2.919 7.517 1.00 43.43 N ATOM 797 CA LEU A 50 6.034 2.889 7.309 1.00 45.21 C ATOM 798 C LEU A 50 6.764 3.937 8.163 1.00 34.43 C ATOM 799 O LEU A 50 7.780 3.629 8.792 1.00 52.25 O ATOM 800 CB LEU A 50 6.379 3.073 5.815 1.00 12.01 C ATOM 801 CG LEU A 50 6.510 1.773 4.997 1.00 71.13 C ATOM 802 CD1 LEU A 50 7.647 0.909 5.540 1.00 40.23 C ATOM 803 CD2 LEU A 50 5.197 0.987 4.986 1.00 32.23 C ATOM 0 H LEU A 50 4.052 3.304 6.734 1.00 43.43 H new ATOM 0 HA LEU A 50 6.382 1.908 7.631 1.00 45.21 H new ATOM 0 HB2 LEU A 50 5.609 3.694 5.356 1.00 12.01 H new ATOM 0 HB3 LEU A 50 7.317 3.623 5.742 1.00 12.01 H new ATOM 0 HG LEU A 50 6.743 2.049 3.968 1.00 71.13 H new ATOM 0 HD11 LEU A 50 7.724 -0.004 4.950 1.00 40.23 H new ATOM 0 HD12 LEU A 50 8.585 1.461 5.478 1.00 40.23 H new ATOM 0 HD13 LEU A 50 7.445 0.653 6.580 1.00 40.23 H new ATOM 0 HD21 LEU A 50 5.323 0.076 4.401 1.00 32.23 H new ATOM 0 HD22 LEU A 50 4.920 0.727 6.008 1.00 32.23 H new ATOM 0 HD23 LEU A 50 4.411 1.598 4.542 1.00 32.23 H new ATOM 815 N GLU A 51 6.260 5.172 8.187 1.00 23.00 N ATOM 816 CA GLU A 51 6.882 6.230 8.996 1.00 61.14 C ATOM 817 C GLU A 51 6.637 6.008 10.498 1.00 12.31 C ATOM 818 O GLU A 51 7.478 6.354 11.333 1.00 60.52 O ATOM 819 CB GLU A 51 6.379 7.620 8.570 1.00 42.13 C ATOM 820 CG GLU A 51 4.879 7.830 8.742 1.00 4.22 C ATOM 821 CD GLU A 51 4.446 9.239 8.374 1.00 11.02 C ATOM 822 OE1 GLU A 51 4.113 9.481 7.196 1.00 12.03 O ATOM 823 OE2 GLU A 51 4.451 10.118 9.262 1.00 64.35 O ATOM 0 H GLU A 51 5.434 5.465 7.665 1.00 23.00 H new ATOM 0 HA GLU A 51 7.957 6.183 8.820 1.00 61.14 H new ATOM 0 HB2 GLU A 51 6.908 8.377 9.149 1.00 42.13 H new ATOM 0 HB3 GLU A 51 6.638 7.781 7.524 1.00 42.13 H new ATOM 0 HG2 GLU A 51 4.341 7.114 8.121 1.00 4.22 H new ATOM 0 HG3 GLU A 51 4.603 7.626 9.776 1.00 4.22 H new ATOM 830 N ASP A 52 5.489 5.424 10.839 1.00 24.11 N ATOM 831 CA ASP A 52 5.176 5.088 12.229 1.00 0.30 C ATOM 832 C ASP A 52 6.062 3.932 12.727 1.00 24.23 C ATOM 833 O ASP A 52 6.725 4.045 13.757 1.00 1.42 O ATOM 834 CB ASP A 52 3.693 4.725 12.359 1.00 5.12 C ATOM 835 CG ASP A 52 3.279 4.474 13.795 1.00 35.25 C ATOM 836 OD1 ASP A 52 3.381 5.411 14.612 1.00 74.24 O ATOM 837 OD2 ASP A 52 2.842 3.346 14.110 1.00 72.22 O ATOM 0 H ASP A 52 4.759 5.173 10.172 1.00 24.11 H new ATOM 0 HA ASP A 52 5.381 5.959 12.851 1.00 0.30 H new ATOM 0 HB2 ASP A 52 3.088 5.532 11.946 1.00 5.12 H new ATOM 0 HB3 ASP A 52 3.487 3.835 11.764 1.00 5.12 H new ATOM 1022 N ASP B 212 -8.324 -14.902 -6.524 1.00 42.10 N ATOM 1023 CA ASP B 212 -9.278 -14.215 -5.647 1.00 34.53 C ATOM 1024 C ASP B 212 -9.049 -12.696 -5.608 1.00 13.03 C ATOM 1025 O ASP B 212 -9.998 -11.910 -5.606 1.00 74.12 O ATOM 1026 CB ASP B 212 -9.151 -14.788 -4.229 1.00 25.12 C ATOM 1027 CG ASP B 212 -9.048 -16.301 -4.236 1.00 54.24 C ATOM 1028 OD1 ASP B 212 -8.029 -16.820 -4.738 1.00 45.12 O ATOM 1029 OD2 ASP B 212 -9.969 -16.974 -3.742 1.00 32.31 O ATOM 0 HA ASP B 212 -10.279 -14.381 -6.046 1.00 34.53 H new ATOM 0 HB2 ASP B 212 -8.270 -14.367 -3.745 1.00 25.12 H new ATOM 0 HB3 ASP B 212 -10.015 -14.486 -3.637 1.00 25.12 H new ATOM 1034 N THR B 213 -7.783 -12.295 -5.585 1.00 2.42 N ATOM 1035 CA THR B 213 -7.417 -10.888 -5.371 1.00 43.31 C ATOM 1036 C THR B 213 -7.616 -10.019 -6.619 1.00 61.55 C ATOM 1037 O THR B 213 -7.632 -10.511 -7.750 1.00 63.11 O ATOM 1038 CB THR B 213 -5.944 -10.752 -4.922 1.00 21.53 C ATOM 1039 OG1 THR B 213 -5.063 -11.196 -5.969 1.00 13.42 O ATOM 1040 CG2 THR B 213 -5.676 -11.551 -3.649 1.00 44.32 C ATOM 0 H THR B 213 -6.987 -12.921 -5.711 1.00 2.42 H new ATOM 0 HA THR B 213 -8.088 -10.534 -4.589 1.00 43.31 H new ATOM 0 HB THR B 213 -5.755 -9.699 -4.711 1.00 21.53 H new ATOM 0 HG1 THR B 213 -4.185 -11.409 -5.589 1.00 13.42 H new ATOM 0 HG21 THR B 213 -4.632 -11.435 -3.359 1.00 44.32 H new ATOM 0 HG22 THR B 213 -6.318 -11.185 -2.848 1.00 44.32 H new ATOM 0 HG23 THR B 213 -5.887 -12.605 -3.830 1.00 44.32 H new ATOM 1048 N LYS B 214 -7.773 -8.714 -6.393 1.00 2.11 N ATOM 1049 CA LYS B 214 -7.840 -7.726 -7.470 1.00 11.43 C ATOM 1050 C LYS B 214 -6.570 -6.857 -7.474 1.00 33.13 C ATOM 1051 O LYS B 214 -6.175 -6.325 -6.433 1.00 32.31 O ATOM 1052 CB LYS B 214 -9.077 -6.828 -7.300 1.00 74.33 C ATOM 1053 CG LYS B 214 -10.409 -7.578 -7.329 1.00 23.31 C ATOM 1054 CD LYS B 214 -10.689 -8.219 -8.688 1.00 73.44 C ATOM 1055 CE LYS B 214 -10.744 -7.185 -9.807 1.00 22.10 C ATOM 1056 NZ LYS B 214 -11.230 -7.773 -11.082 1.00 74.11 N ATOM 0 H LYS B 214 -7.857 -8.313 -5.459 1.00 2.11 H new ATOM 0 HA LYS B 214 -7.915 -8.258 -8.418 1.00 11.43 H new ATOM 0 HB2 LYS B 214 -8.995 -6.293 -6.354 1.00 74.33 H new ATOM 0 HB3 LYS B 214 -9.078 -6.078 -8.091 1.00 74.33 H new ATOM 0 HG2 LYS B 214 -10.404 -8.351 -6.560 1.00 23.31 H new ATOM 0 HG3 LYS B 214 -11.216 -6.888 -7.083 1.00 23.31 H new ATOM 0 HD2 LYS B 214 -9.913 -8.952 -8.910 1.00 73.44 H new ATOM 0 HD3 LYS B 214 -11.635 -8.759 -8.646 1.00 73.44 H new ATOM 0 HE2 LYS B 214 -11.400 -6.366 -9.512 1.00 22.10 H new ATOM 0 HE3 LYS B 214 -9.751 -6.761 -9.958 1.00 22.10 H new ATOM 0 HZ1 LYS B 214 -11.253 -7.038 -11.817 1.00 74.11 H new ATOM 0 HZ2 LYS B 214 -10.591 -8.538 -11.377 1.00 74.11 H new ATOM 0 HZ3 LYS B 214 -12.187 -8.155 -10.945 1.00 74.11 H new ATOM 1070 N PRO B 215 -5.905 -6.710 -8.634 1.00 73.13 N ATOM 1071 CA PRO B 215 -4.682 -5.897 -8.743 1.00 52.44 C ATOM 1072 C PRO B 215 -4.959 -4.381 -8.728 1.00 51.44 C ATOM 1073 O PRO B 215 -5.473 -3.820 -9.702 1.00 63.35 O ATOM 1074 CB PRO B 215 -4.096 -6.338 -10.092 1.00 21.33 C ATOM 1075 CG PRO B 215 -5.284 -6.745 -10.901 1.00 34.25 C ATOM 1076 CD PRO B 215 -6.277 -7.329 -9.925 1.00 3.44 C ATOM 0 HA PRO B 215 -4.013 -6.051 -7.897 1.00 52.44 H new ATOM 0 HB2 PRO B 215 -3.549 -5.526 -10.571 1.00 21.33 H new ATOM 0 HB3 PRO B 215 -3.397 -7.165 -9.970 1.00 21.33 H new ATOM 0 HG2 PRO B 215 -5.710 -5.889 -11.425 1.00 34.25 H new ATOM 0 HG3 PRO B 215 -5.006 -7.477 -11.659 1.00 34.25 H new ATOM 0 HD2 PRO B 215 -7.303 -7.087 -10.204 1.00 3.44 H new ATOM 0 HD3 PRO B 215 -6.206 -8.416 -9.883 1.00 3.44 H new ATOM 1084 N VAL B 216 -4.627 -3.722 -7.620 1.00 33.51 N ATOM 1085 CA VAL B 216 -4.805 -2.271 -7.491 1.00 30.15 C ATOM 1086 C VAL B 216 -3.442 -1.557 -7.414 1.00 55.41 C ATOM 1087 O VAL B 216 -2.514 -2.031 -6.757 1.00 21.33 O ATOM 1088 CB VAL B 216 -5.675 -1.915 -6.251 1.00 44.01 C ATOM 1089 CG1 VAL B 216 -5.062 -2.460 -4.961 1.00 0.54 C ATOM 1090 CG2 VAL B 216 -5.899 -0.403 -6.155 1.00 23.43 C ATOM 0 H VAL B 216 -4.231 -4.169 -6.793 1.00 33.51 H new ATOM 0 HA VAL B 216 -5.329 -1.923 -8.381 1.00 30.15 H new ATOM 0 HB VAL B 216 -6.645 -2.394 -6.382 1.00 44.01 H new ATOM 0 HG11 VAL B 216 -5.696 -2.193 -4.116 1.00 0.54 H new ATOM 0 HG12 VAL B 216 -4.983 -3.545 -5.026 1.00 0.54 H new ATOM 0 HG13 VAL B 216 -4.070 -2.031 -4.820 1.00 0.54 H new ATOM 0 HG21 VAL B 216 -6.510 -0.181 -5.280 1.00 23.43 H new ATOM 0 HG22 VAL B 216 -4.937 0.102 -6.064 1.00 23.43 H new ATOM 0 HG23 VAL B 216 -6.409 -0.053 -7.052 1.00 23.43 H new ATOM 1100 N VAL B 217 -3.323 -0.427 -8.106 1.00 71.41 N ATOM 1101 CA VAL B 217 -2.054 0.306 -8.172 1.00 74.31 C ATOM 1102 C VAL B 217 -1.904 1.327 -7.028 1.00 41.15 C ATOM 1103 O VAL B 217 -2.769 2.179 -6.807 1.00 41.44 O ATOM 1104 CB VAL B 217 -1.888 1.028 -9.538 1.00 44.52 C ATOM 1105 CG1 VAL B 217 -3.034 2.008 -9.790 1.00 4.33 C ATOM 1106 CG2 VAL B 217 -0.532 1.734 -9.616 1.00 23.11 C ATOM 0 H VAL B 217 -4.086 0.003 -8.629 1.00 71.41 H new ATOM 0 HA VAL B 217 -1.268 -0.441 -8.063 1.00 74.31 H new ATOM 0 HB VAL B 217 -1.923 0.273 -10.323 1.00 44.52 H new ATOM 0 HG11 VAL B 217 -2.889 2.497 -10.753 1.00 4.33 H new ATOM 0 HG12 VAL B 217 -3.980 1.467 -9.796 1.00 4.33 H new ATOM 0 HG13 VAL B 217 -3.051 2.759 -9.000 1.00 4.33 H new ATOM 0 HG21 VAL B 217 -0.437 2.233 -10.580 1.00 23.11 H new ATOM 0 HG22 VAL B 217 -0.459 2.472 -8.817 1.00 23.11 H new ATOM 0 HG23 VAL B 217 0.267 1.001 -9.506 1.00 23.11 H new ATOM 1116 N VAL B 218 -0.795 1.228 -6.300 1.00 33.22 N ATOM 1117 CA VAL B 218 -0.450 2.200 -5.259 1.00 32.24 C ATOM 1118 C VAL B 218 1.003 2.681 -5.442 1.00 65.42 C ATOM 1119 O VAL B 218 1.848 1.941 -5.948 1.00 41.12 O ATOM 1120 CB VAL B 218 -0.645 1.602 -3.838 1.00 54.23 C ATOM 1121 CG1 VAL B 218 0.236 0.373 -3.629 1.00 51.12 C ATOM 1122 CG2 VAL B 218 -0.381 2.653 -2.760 1.00 32.31 C ATOM 0 H VAL B 218 -0.112 0.478 -6.411 1.00 33.22 H new ATOM 0 HA VAL B 218 -1.123 3.052 -5.358 1.00 32.24 H new ATOM 0 HB VAL B 218 -1.684 1.285 -3.752 1.00 54.23 H new ATOM 0 HG11 VAL B 218 0.077 -0.022 -2.626 1.00 51.12 H new ATOM 0 HG12 VAL B 218 -0.022 -0.389 -4.364 1.00 51.12 H new ATOM 0 HG13 VAL B 218 1.283 0.652 -3.747 1.00 51.12 H new ATOM 0 HG21 VAL B 218 -0.524 2.208 -1.775 1.00 32.31 H new ATOM 0 HG22 VAL B 218 0.643 3.016 -2.849 1.00 32.31 H new ATOM 0 HG23 VAL B 218 -1.073 3.486 -2.886 1.00 32.31 H new ATOM 1132 N ARG B 219 1.289 3.925 -5.056 1.00 45.41 N ATOM 1133 CA ARG B 219 2.627 4.503 -5.255 1.00 72.03 C ATOM 1134 C ARG B 219 3.187 5.127 -3.966 1.00 42.23 C ATOM 1135 O ARG B 219 2.466 5.797 -3.226 1.00 32.52 O ATOM 1136 CB ARG B 219 2.593 5.546 -6.384 1.00 63.41 C ATOM 1137 CG ARG B 219 2.198 4.959 -7.738 1.00 11.23 C ATOM 1138 CD ARG B 219 2.394 5.950 -8.878 1.00 64.21 C ATOM 1139 NE ARG B 219 1.467 7.076 -8.792 1.00 43.13 N ATOM 1140 CZ ARG B 219 1.822 8.326 -8.895 1.00 65.34 C ATOM 1141 NH1 ARG B 219 3.068 8.649 -9.033 1.00 63.42 N ATOM 1142 NH2 ARG B 219 0.929 9.257 -8.853 1.00 73.33 N ATOM 0 H ARG B 219 0.621 4.551 -4.607 1.00 45.41 H new ATOM 0 HA ARG B 219 3.295 3.689 -5.537 1.00 72.03 H new ATOM 0 HB2 ARG B 219 1.889 6.335 -6.119 1.00 63.41 H new ATOM 0 HB3 ARG B 219 3.575 6.010 -6.470 1.00 63.41 H new ATOM 0 HG2 ARG B 219 2.791 4.065 -7.931 1.00 11.23 H new ATOM 0 HG3 ARG B 219 1.154 4.648 -7.706 1.00 11.23 H new ATOM 0 HD2 ARG B 219 3.418 6.322 -8.862 1.00 64.21 H new ATOM 0 HD3 ARG B 219 2.255 5.439 -9.830 1.00 64.21 H new ATOM 0 HE ARG B 219 0.479 6.871 -8.642 1.00 43.13 H new ATOM 0 HH11 ARG B 219 3.783 7.922 -9.062 1.00 63.42 H new ATOM 0 HH12 ARG B 219 3.335 9.630 -9.113 1.00 63.42 H new ATOM 0 HH21 ARG B 219 -0.055 9.015 -8.739 1.00 73.33 H new ATOM 0 HH22 ARG B 219 1.208 10.235 -8.934 1.00 73.33 H new ATOM 1156 N LEU B 220 4.482 4.912 -3.721 1.00 53.23 N ATOM 1157 CA LEU B 220 5.148 5.400 -2.501 1.00 11.24 C ATOM 1158 C LEU B 220 6.355 6.299 -2.850 1.00 32.51 C ATOM 1159 O LEU B 220 6.817 6.323 -3.995 1.00 24.31 O ATOM 1160 CB LEU B 220 5.596 4.199 -1.642 1.00 65.23 C ATOM 1161 CG LEU B 220 6.134 4.537 -0.236 1.00 1.32 C ATOM 1162 CD1 LEU B 220 5.060 5.227 0.605 1.00 15.34 C ATOM 1163 CD2 LEU B 220 6.648 3.280 0.466 1.00 3.24 C ATOM 0 H LEU B 220 5.097 4.400 -4.353 1.00 53.23 H new ATOM 0 HA LEU B 220 4.440 6.003 -1.933 1.00 11.24 H new ATOM 0 HB2 LEU B 220 4.750 3.520 -1.532 1.00 65.23 H new ATOM 0 HB3 LEU B 220 6.371 3.658 -2.185 1.00 65.23 H new ATOM 0 HG LEU B 220 6.970 5.227 -0.351 1.00 1.32 H new ATOM 0 HD11 LEU B 220 5.462 5.456 1.592 1.00 15.34 H new ATOM 0 HD12 LEU B 220 4.752 6.151 0.115 1.00 15.34 H new ATOM 0 HD13 LEU B 220 4.199 4.567 0.708 1.00 15.34 H new ATOM 0 HD21 LEU B 220 7.022 3.543 1.455 1.00 3.24 H new ATOM 0 HD22 LEU B 220 5.835 2.560 0.565 1.00 3.24 H new ATOM 0 HD23 LEU B 220 7.454 2.839 -0.121 1.00 3.24 H new ATOM 1175 N TYR B 221 6.861 7.037 -1.858 1.00 44.33 N ATOM 1176 CA TYR B 221 7.948 8.006 -2.070 1.00 72.25 C ATOM 1177 C TYR B 221 9.332 7.329 -2.176 1.00 11.30 C ATOM 1178 O TYR B 221 9.661 6.439 -1.391 1.00 53.12 O ATOM 1179 CB TYR B 221 7.937 9.042 -0.939 1.00 21.21 C ATOM 1180 CG TYR B 221 6.629 9.810 -0.870 1.00 51.03 C ATOM 1181 CD1 TYR B 221 5.533 9.294 -0.186 1.00 12.31 C ATOM 1182 CD2 TYR B 221 6.484 11.037 -1.510 1.00 55.51 C ATOM 1183 CE1 TYR B 221 4.331 9.977 -0.142 1.00 1.33 C ATOM 1184 CE2 TYR B 221 5.289 11.728 -1.466 1.00 71.52 C ATOM 1185 CZ TYR B 221 4.215 11.192 -0.782 1.00 35.03 C ATOM 1186 OH TYR B 221 3.017 11.869 -0.751 1.00 0.52 O ATOM 0 H TYR B 221 6.535 6.983 -0.893 1.00 44.33 H new ATOM 0 HA TYR B 221 7.771 8.501 -3.025 1.00 72.25 H new ATOM 0 HB2 TYR B 221 8.110 8.539 0.012 1.00 21.21 H new ATOM 0 HB3 TYR B 221 8.759 9.743 -1.084 1.00 21.21 H new ATOM 0 HD1 TYR B 221 5.622 8.344 0.319 1.00 12.31 H new ATOM 0 HD2 TYR B 221 7.320 11.456 -2.050 1.00 55.51 H new ATOM 0 HE1 TYR B 221 3.489 9.561 0.391 1.00 1.33 H new ATOM 0 HE2 TYR B 221 5.195 12.682 -1.963 1.00 71.52 H new ATOM 0 HH TYR B 221 3.103 12.709 -1.249 1.00 0.52 H new ATOM 1196 N PRO B 222 10.166 7.781 -3.145 1.00 74.42 N ATOM 1197 CA PRO B 222 11.466 7.152 -3.475 1.00 33.25 C ATOM 1198 C PRO B 222 12.333 6.773 -2.257 1.00 53.04 C ATOM 1199 O PRO B 222 12.644 5.595 -2.056 1.00 74.22 O ATOM 1200 CB PRO B 222 12.159 8.232 -4.312 1.00 11.32 C ATOM 1201 CG PRO B 222 11.042 8.944 -4.992 1.00 12.45 C ATOM 1202 CD PRO B 222 9.906 8.962 -4.001 1.00 62.12 C ATOM 0 HA PRO B 222 11.318 6.197 -3.979 1.00 33.25 H new ATOM 0 HB2 PRO B 222 12.739 8.909 -3.686 1.00 11.32 H new ATOM 0 HB3 PRO B 222 12.849 7.794 -5.033 1.00 11.32 H new ATOM 0 HG2 PRO B 222 11.335 9.956 -5.270 1.00 12.45 H new ATOM 0 HG3 PRO B 222 10.753 8.432 -5.910 1.00 12.45 H new ATOM 0 HD2 PRO B 222 9.897 9.884 -3.419 1.00 62.12 H new ATOM 0 HD3 PRO B 222 8.939 8.890 -4.499 1.00 62.12 H new ATOM 1210 N ASP B 223 12.722 7.768 -1.454 1.00 44.45 N ATOM 1211 CA ASP B 223 13.565 7.531 -0.272 1.00 74.44 C ATOM 1212 C ASP B 223 12.983 6.431 0.633 1.00 23.12 C ATOM 1213 O ASP B 223 13.683 5.493 1.028 1.00 44.10 O ATOM 1214 CB ASP B 223 13.719 8.828 0.528 1.00 42.52 C ATOM 1215 CG ASP B 223 14.449 9.909 -0.246 1.00 4.51 C ATOM 1216 OD1 ASP B 223 13.823 10.555 -1.110 1.00 70.25 O ATOM 1217 OD2 ASP B 223 15.656 10.120 0.007 1.00 44.24 O ATOM 0 H ASP B 223 12.468 8.745 -1.598 1.00 44.45 H new ATOM 0 HA ASP B 223 14.540 7.195 -0.624 1.00 74.44 H new ATOM 0 HB2 ASP B 223 12.733 9.194 0.813 1.00 42.52 H new ATOM 0 HB3 ASP B 223 14.260 8.619 1.451 1.00 42.52 H new ATOM 1222 N GLU B 224 11.695 6.549 0.938 1.00 70.43 N ATOM 1223 CA GLU B 224 11.009 5.594 1.813 1.00 72.00 C ATOM 1224 C GLU B 224 10.905 4.199 1.169 1.00 33.54 C ATOM 1225 O GLU B 224 10.790 3.194 1.869 1.00 15.13 O ATOM 1226 CB GLU B 224 9.616 6.132 2.183 1.00 65.00 C ATOM 1227 CG GLU B 224 9.662 7.468 2.926 1.00 35.05 C ATOM 1228 CD GLU B 224 8.285 8.009 3.285 1.00 54.33 C ATOM 1229 OE1 GLU B 224 7.705 8.758 2.471 1.00 53.33 O ATOM 1230 OE2 GLU B 224 7.789 7.701 4.392 1.00 20.13 O ATOM 0 H GLU B 224 11.098 7.300 0.592 1.00 70.43 H new ATOM 0 HA GLU B 224 11.601 5.482 2.721 1.00 72.00 H new ATOM 0 HB2 GLU B 224 9.026 6.250 1.274 1.00 65.00 H new ATOM 0 HB3 GLU B 224 9.103 5.397 2.803 1.00 65.00 H new ATOM 0 HG2 GLU B 224 10.246 7.348 3.838 1.00 35.05 H new ATOM 0 HG3 GLU B 224 10.182 8.201 2.309 1.00 35.05 H new ATOM 1237 N ILE B 225 10.961 4.141 -0.163 1.00 4.54 N ATOM 1238 CA ILE B 225 10.948 2.858 -0.882 1.00 35.13 C ATOM 1239 C ILE B 225 12.285 2.112 -0.738 1.00 21.20 C ATOM 1240 O ILE B 225 12.306 0.891 -0.564 1.00 54.05 O ATOM 1241 CB ILE B 225 10.620 3.041 -2.385 1.00 53.33 C ATOM 1242 CG1 ILE B 225 9.190 3.578 -2.549 1.00 14.44 C ATOM 1243 CG2 ILE B 225 10.798 1.727 -3.155 1.00 41.41 C ATOM 1244 CD1 ILE B 225 8.773 3.782 -3.987 1.00 1.24 C ATOM 0 H ILE B 225 11.016 4.961 -0.767 1.00 4.54 H new ATOM 0 HA ILE B 225 10.160 2.261 -0.424 1.00 35.13 H new ATOM 0 HB ILE B 225 11.319 3.766 -2.803 1.00 53.33 H new ATOM 0 HG12 ILE B 225 8.496 2.885 -2.075 1.00 14.44 H new ATOM 0 HG13 ILE B 225 9.106 4.526 -2.019 1.00 14.44 H new ATOM 0 HG21 ILE B 225 10.561 1.887 -4.207 1.00 41.41 H new ATOM 0 HG22 ILE B 225 11.830 1.388 -3.063 1.00 41.41 H new ATOM 0 HG23 ILE B 225 10.130 0.971 -2.743 1.00 41.41 H new ATOM 0 HD11 ILE B 225 7.752 4.162 -4.019 1.00 1.24 H new ATOM 0 HD12 ILE B 225 9.443 4.499 -4.462 1.00 1.24 H new ATOM 0 HD13 ILE B 225 8.823 2.832 -4.519 1.00 1.24 H new ATOM 1256 N GLU B 226 13.407 2.833 -0.810 1.00 45.00 N ATOM 1257 CA GLU B 226 14.713 2.198 -0.596 1.00 71.02 C ATOM 1258 C GLU B 226 14.853 1.748 0.866 1.00 1.21 C ATOM 1259 O GLU B 226 15.425 0.694 1.154 1.00 4.23 O ATOM 1260 CB GLU B 226 15.871 3.130 -0.993 1.00 23.31 C ATOM 1261 CG GLU B 226 17.228 2.425 -0.995 1.00 34.30 C ATOM 1262 CD GLU B 226 18.352 3.287 -1.548 1.00 71.15 C ATOM 1263 OE1 GLU B 226 18.365 3.540 -2.770 1.00 63.32 O ATOM 1264 OE2 GLU B 226 19.236 3.702 -0.768 1.00 4.40 O ATOM 0 H GLU B 226 13.441 3.833 -1.010 1.00 45.00 H new ATOM 0 HA GLU B 226 14.767 1.321 -1.241 1.00 71.02 H new ATOM 0 HB2 GLU B 226 15.678 3.539 -1.985 1.00 23.31 H new ATOM 0 HB3 GLU B 226 15.906 3.972 -0.302 1.00 23.31 H new ATOM 0 HG2 GLU B 226 17.476 2.126 0.023 1.00 34.30 H new ATOM 0 HG3 GLU B 226 17.155 1.512 -1.586 1.00 34.30 H new ATOM 1271 N ALA B 227 14.313 2.547 1.785 1.00 32.54 N ATOM 1272 CA ALA B 227 14.219 2.148 3.194 1.00 30.22 C ATOM 1273 C ALA B 227 13.310 0.915 3.351 1.00 44.13 C ATOM 1274 O ALA B 227 13.611 -0.007 4.115 1.00 53.52 O ATOM 1275 CB ALA B 227 13.696 3.309 4.034 1.00 62.14 C ATOM 0 H ALA B 227 13.934 3.472 1.583 1.00 32.54 H new ATOM 0 HA ALA B 227 15.215 1.882 3.547 1.00 30.22 H new ATOM 0 HB1 ALA B 227 13.630 3.002 5.078 1.00 62.14 H new ATOM 0 HB2 ALA B 227 14.376 4.156 3.947 1.00 62.14 H new ATOM 0 HB3 ALA B 227 12.707 3.599 3.678 1.00 62.14 H new ATOM 1281 N LEU B 228 12.199 0.907 2.612 1.00 60.31 N ATOM 1282 CA LEU B 228 11.281 -0.238 2.576 1.00 62.03 C ATOM 1283 C LEU B 228 12.016 -1.533 2.185 1.00 23.04 C ATOM 1284 O LEU B 228 12.054 -2.493 2.955 1.00 54.31 O ATOM 1285 CB LEU B 228 10.143 0.041 1.580 1.00 12.10 C ATOM 1286 CG LEU B 228 9.120 -1.093 1.399 1.00 75.21 C ATOM 1287 CD1 LEU B 228 8.364 -1.355 2.699 1.00 51.24 C ATOM 1288 CD2 LEU B 228 8.155 -0.767 0.260 1.00 13.41 C ATOM 0 H LEU B 228 11.909 1.688 2.024 1.00 60.31 H new ATOM 0 HA LEU B 228 10.868 -0.375 3.575 1.00 62.03 H new ATOM 0 HB2 LEU B 228 9.612 0.936 1.905 1.00 12.10 H new ATOM 0 HB3 LEU B 228 10.583 0.267 0.609 1.00 12.10 H new ATOM 0 HG LEU B 228 9.659 -2.003 1.137 1.00 75.21 H new ATOM 0 HD11 LEU B 228 7.646 -2.161 2.546 1.00 51.24 H new ATOM 0 HD12 LEU B 228 9.070 -1.640 3.479 1.00 51.24 H new ATOM 0 HD13 LEU B 228 7.835 -0.451 3.001 1.00 51.24 H new ATOM 0 HD21 LEU B 228 7.438 -1.580 0.146 1.00 13.41 H new ATOM 0 HD22 LEU B 228 7.623 0.157 0.487 1.00 13.41 H new ATOM 0 HD23 LEU B 228 8.715 -0.644 -0.667 1.00 13.41 H new ATOM 1300 N LYS B 229 12.630 -1.537 0.997 1.00 41.13 N ATOM 1301 CA LYS B 229 13.341 -2.725 0.492 1.00 71.23 C ATOM 1302 C LYS B 229 14.590 -3.058 1.336 1.00 45.13 C ATOM 1303 O LYS B 229 15.278 -4.047 1.078 1.00 52.50 O ATOM 1304 CB LYS B 229 13.734 -2.530 -0.983 1.00 15.04 C ATOM 1305 CG LYS B 229 14.712 -1.383 -1.219 1.00 74.41 C ATOM 1306 CD LYS B 229 15.037 -1.202 -2.702 1.00 12.32 C ATOM 1307 CE LYS B 229 13.808 -0.808 -3.519 1.00 71.40 C ATOM 1308 NZ LYS B 229 14.133 -0.645 -4.962 1.00 3.24 N ATOM 0 H LYS B 229 12.651 -0.736 0.366 1.00 41.13 H new ATOM 0 HA LYS B 229 12.656 -3.569 0.573 1.00 71.23 H new ATOM 0 HB2 LYS B 229 14.177 -3.454 -1.355 1.00 15.04 H new ATOM 0 HB3 LYS B 229 12.832 -2.351 -1.568 1.00 15.04 H new ATOM 0 HG2 LYS B 229 14.288 -0.459 -0.825 1.00 74.41 H new ATOM 0 HG3 LYS B 229 15.633 -1.572 -0.667 1.00 74.41 H new ATOM 0 HD2 LYS B 229 15.805 -0.437 -2.813 1.00 12.32 H new ATOM 0 HD3 LYS B 229 15.452 -2.129 -3.097 1.00 12.32 H new ATOM 0 HE2 LYS B 229 13.036 -1.569 -3.404 1.00 71.40 H new ATOM 0 HE3 LYS B 229 13.397 0.124 -3.131 1.00 71.40 H new ATOM 0 HZ1 LYS B 229 13.274 -0.378 -5.483 1.00 3.24 H new ATOM 0 HZ2 LYS B 229 14.852 0.098 -5.074 1.00 3.24 H new ATOM 0 HZ3 LYS B 229 14.501 -1.542 -5.338 1.00 3.24 H new ATOM 1322 N SER B 230 14.884 -2.220 2.331 1.00 70.11 N ATOM 1323 CA SER B 230 15.961 -2.493 3.295 1.00 33.21 C ATOM 1324 C SER B 230 15.439 -3.312 4.485 1.00 2.24 C ATOM 1325 O SER B 230 16.123 -4.201 4.995 1.00 34.24 O ATOM 1326 CB SER B 230 16.570 -1.178 3.805 1.00 55.24 C ATOM 1327 OG SER B 230 17.583 -1.414 4.769 1.00 72.41 O ATOM 0 H SER B 230 14.391 -1.342 2.494 1.00 70.11 H new ATOM 0 HA SER B 230 16.729 -3.071 2.782 1.00 33.21 H new ATOM 0 HB2 SER B 230 16.987 -0.620 2.967 1.00 55.24 H new ATOM 0 HB3 SER B 230 15.787 -0.559 4.243 1.00 55.24 H new ATOM 0 HG SER B 230 17.951 -0.558 5.073 1.00 72.41 H new ATOM 1333 N ARG B 231 14.206 -3.023 4.908 1.00 73.44 N ATOM 1334 CA ARG B 231 13.607 -3.686 6.078 1.00 31.33 C ATOM 1335 C ARG B 231 12.736 -4.896 5.682 1.00 62.33 C ATOM 1336 O ARG B 231 12.004 -5.444 6.514 1.00 24.34 O ATOM 1337 CB ARG B 231 12.782 -2.672 6.890 1.00 51.03 C ATOM 1338 CG ARG B 231 11.668 -1.993 6.096 1.00 63.44 C ATOM 1339 CD ARG B 231 10.963 -0.915 6.914 1.00 53.25 C ATOM 1340 NE ARG B 231 10.292 -1.467 8.094 1.00 14.22 N ATOM 1341 CZ ARG B 231 10.193 -0.855 9.247 1.00 2.23 C ATOM 1342 NH1 ARG B 231 10.748 0.301 9.438 1.00 70.20 N ATOM 1343 NH2 ARG B 231 9.547 -1.415 10.214 1.00 22.23 N ATOM 0 H ARG B 231 13.600 -2.335 4.461 1.00 73.44 H new ATOM 0 HA ARG B 231 14.422 -4.068 6.693 1.00 31.33 H new ATOM 0 HB2 ARG B 231 12.343 -3.182 7.748 1.00 51.03 H new ATOM 0 HB3 ARG B 231 13.452 -1.907 7.282 1.00 51.03 H new ATOM 0 HG2 ARG B 231 12.085 -1.549 5.192 1.00 63.44 H new ATOM 0 HG3 ARG B 231 10.941 -2.741 5.777 1.00 63.44 H new ATOM 0 HD2 ARG B 231 11.690 -0.166 7.228 1.00 53.25 H new ATOM 0 HD3 ARG B 231 10.231 -0.406 6.287 1.00 53.25 H new ATOM 0 HE ARG B 231 9.873 -2.393 8.011 1.00 14.22 H new ATOM 0 HH11 ARG B 231 11.271 0.746 8.684 1.00 70.20 H new ATOM 0 HH12 ARG B 231 10.662 0.765 10.342 1.00 70.20 H new ATOM 0 HH21 ARG B 231 9.117 -2.330 10.078 1.00 22.23 H new ATOM 0 HH22 ARG B 231 9.467 -0.943 11.115 1.00 22.23 H new ATOM 1357 N VAL B 232 12.812 -5.314 4.417 1.00 4.24 N ATOM 1358 CA VAL B 232 12.095 -6.512 3.956 1.00 3.31 C ATOM 1359 C VAL B 232 12.926 -7.786 4.191 1.00 24.00 C ATOM 1360 O VAL B 232 14.154 -7.766 4.077 1.00 73.05 O ATOM 1361 CB VAL B 232 11.719 -6.423 2.451 1.00 53.32 C ATOM 1362 CG1 VAL B 232 10.781 -5.249 2.187 1.00 74.14 C ATOM 1363 CG2 VAL B 232 12.969 -6.325 1.576 1.00 72.25 C ATOM 0 H VAL B 232 13.359 -4.846 3.694 1.00 4.24 H new ATOM 0 HA VAL B 232 11.178 -6.564 4.543 1.00 3.31 H new ATOM 0 HB VAL B 232 11.193 -7.341 2.187 1.00 53.32 H new ATOM 0 HG11 VAL B 232 10.535 -5.211 1.126 1.00 74.14 H new ATOM 0 HG12 VAL B 232 9.867 -5.376 2.767 1.00 74.14 H new ATOM 0 HG13 VAL B 232 11.270 -4.320 2.479 1.00 74.14 H new ATOM 0 HG21 VAL B 232 12.676 -6.264 0.528 1.00 72.25 H new ATOM 0 HG22 VAL B 232 13.534 -5.433 1.847 1.00 72.25 H new ATOM 0 HG23 VAL B 232 13.590 -7.208 1.728 1.00 72.25 H new ATOM 1373 N PRO B 233 12.271 -8.910 4.547 1.00 4.03 N ATOM 1374 CA PRO B 233 12.955 -10.202 4.735 1.00 11.33 C ATOM 1375 C PRO B 233 13.556 -10.749 3.426 1.00 64.04 C ATOM 1376 O PRO B 233 12.972 -10.597 2.352 1.00 42.23 O ATOM 1377 CB PRO B 233 11.841 -11.136 5.248 1.00 11.31 C ATOM 1378 CG PRO B 233 10.744 -10.228 5.699 1.00 23.41 C ATOM 1379 CD PRO B 233 10.829 -9.017 4.812 1.00 44.33 C ATOM 0 HA PRO B 233 13.800 -10.113 5.418 1.00 11.33 H new ATOM 0 HB2 PRO B 233 11.497 -11.808 4.461 1.00 11.31 H new ATOM 0 HB3 PRO B 233 12.197 -11.760 6.067 1.00 11.31 H new ATOM 0 HG2 PRO B 233 9.772 -10.713 5.608 1.00 23.41 H new ATOM 0 HG3 PRO B 233 10.867 -9.955 6.747 1.00 23.41 H new ATOM 0 HD2 PRO B 233 10.257 -9.147 3.893 1.00 44.33 H new ATOM 0 HD3 PRO B 233 10.441 -8.126 5.305 1.00 44.33 H new ATOM 1387 N ALA B 234 14.705 -11.416 3.529 1.00 44.21 N ATOM 1388 CA ALA B 234 15.426 -11.926 2.353 1.00 73.43 C ATOM 1389 C ALA B 234 14.605 -12.945 1.533 1.00 22.31 C ATOM 1390 O ALA B 234 14.975 -13.284 0.407 1.00 63.43 O ATOM 1391 CB ALA B 234 16.748 -12.549 2.786 1.00 62.11 C ATOM 0 H ALA B 234 15.162 -11.619 4.418 1.00 44.21 H new ATOM 0 HA ALA B 234 15.609 -11.073 1.700 1.00 73.43 H new ATOM 0 HB1 ALA B 234 17.277 -12.925 1.910 1.00 62.11 H new ATOM 0 HB2 ALA B 234 17.359 -11.796 3.284 1.00 62.11 H new ATOM 0 HB3 ALA B 234 16.554 -13.372 3.474 1.00 62.11 H new ATOM 1397 N ASN B 235 13.500 -13.439 2.096 1.00 73.31 N ATOM 1398 CA ASN B 235 12.655 -14.427 1.407 1.00 62.13 C ATOM 1399 C ASN B 235 11.230 -13.900 1.165 1.00 51.43 C ATOM 1400 O ASN B 235 10.349 -14.646 0.732 1.00 42.13 O ATOM 1401 CB ASN B 235 12.603 -15.733 2.210 1.00 75.24 C ATOM 1402 CG ASN B 235 13.985 -16.323 2.431 1.00 22.43 C ATOM 1403 OD1 ASN B 235 14.509 -17.040 1.588 1.00 34.24 O ATOM 1404 ND2 ASN B 235 14.583 -16.042 3.571 1.00 11.14 N ATOM 0 H ASN B 235 13.167 -13.175 3.023 1.00 73.31 H new ATOM 0 HA ASN B 235 13.105 -14.617 0.433 1.00 62.13 H new ATOM 0 HB2 ASN B 235 12.130 -15.547 3.174 1.00 75.24 H new ATOM 0 HB3 ASN B 235 11.980 -16.457 1.684 1.00 75.24 H new ATOM 0 HD21 ASN B 235 15.507 -16.425 3.770 1.00 11.14 H new ATOM 0 HD22 ASN B 235 14.122 -15.441 4.254 1.00 11.14 H new ATOM 1411 N THR B 236 11.008 -12.608 1.417 1.00 74.42 N ATOM 1412 CA THR B 236 9.676 -12.001 1.242 1.00 55.33 C ATOM 1413 C THR B 236 9.709 -10.851 0.229 1.00 75.35 C ATOM 1414 O THR B 236 10.333 -9.815 0.463 1.00 34.23 O ATOM 1415 CB THR B 236 9.102 -11.470 2.581 1.00 74.22 C ATOM 1416 OG1 THR B 236 8.956 -12.545 3.521 1.00 44.44 O ATOM 1417 CG2 THR B 236 7.746 -10.794 2.380 1.00 4.13 C ATOM 0 H THR B 236 11.726 -11.960 1.742 1.00 74.42 H new ATOM 0 HA THR B 236 9.029 -12.795 0.867 1.00 55.33 H new ATOM 0 HB THR B 236 9.805 -10.732 2.968 1.00 74.22 H new ATOM 0 HG1 THR B 236 8.595 -12.197 4.363 1.00 44.44 H new ATOM 0 HG21 THR B 236 7.373 -10.434 3.339 1.00 4.13 H new ATOM 0 HG22 THR B 236 7.856 -9.954 1.695 1.00 4.13 H new ATOM 0 HG23 THR B 236 7.040 -11.512 1.963 1.00 4.13 H new ATOM 1425 N SER B 237 9.032 -11.040 -0.902 1.00 10.53 N ATOM 1426 CA SER B 237 8.957 -10.014 -1.953 1.00 61.42 C ATOM 1427 C SER B 237 8.172 -8.772 -1.497 1.00 4.35 C ATOM 1428 O SER B 237 7.243 -8.867 -0.694 1.00 62.15 O ATOM 1429 CB SER B 237 8.319 -10.597 -3.223 1.00 32.14 C ATOM 1430 OG SER B 237 9.131 -11.622 -3.778 1.00 61.43 O ATOM 0 H SER B 237 8.523 -11.897 -1.119 1.00 10.53 H new ATOM 0 HA SER B 237 9.978 -9.699 -2.168 1.00 61.42 H new ATOM 0 HB2 SER B 237 7.333 -10.997 -2.988 1.00 32.14 H new ATOM 0 HB3 SER B 237 8.175 -9.805 -3.958 1.00 32.14 H new ATOM 0 HG SER B 237 8.703 -11.978 -4.584 1.00 61.43 H new ATOM 1436 N MET B 238 8.545 -7.610 -2.039 1.00 42.51 N ATOM 1437 CA MET B 238 7.942 -6.326 -1.645 1.00 52.31 C ATOM 1438 C MET B 238 6.412 -6.306 -1.825 1.00 15.30 C ATOM 1439 O MET B 238 5.704 -5.688 -1.032 1.00 71.11 O ATOM 1440 CB MET B 238 8.588 -5.177 -2.434 1.00 44.45 C ATOM 1441 CG MET B 238 10.070 -4.984 -2.129 1.00 62.51 C ATOM 1442 SD MET B 238 10.803 -3.613 -3.046 1.00 55.11 S ATOM 1443 CE MET B 238 10.623 -4.185 -4.735 1.00 51.22 C ATOM 0 H MET B 238 9.266 -7.528 -2.756 1.00 42.51 H new ATOM 0 HA MET B 238 8.135 -6.194 -0.580 1.00 52.31 H new ATOM 0 HB2 MET B 238 8.467 -5.367 -3.501 1.00 44.45 H new ATOM 0 HB3 MET B 238 8.057 -4.251 -2.212 1.00 44.45 H new ATOM 0 HG2 MET B 238 10.196 -4.809 -1.061 1.00 62.51 H new ATOM 0 HG3 MET B 238 10.607 -5.902 -2.367 1.00 62.51 H new ATOM 0 HE1 MET B 238 11.295 -3.623 -5.383 1.00 51.22 H new ATOM 0 HE2 MET B 238 10.870 -5.245 -4.788 1.00 51.22 H new ATOM 0 HE3 MET B 238 9.594 -4.036 -5.062 1.00 51.22 H new ATOM 1453 N SER B 239 5.906 -6.985 -2.857 1.00 42.01 N ATOM 1454 CA SER B 239 4.452 -7.047 -3.093 1.00 32.40 C ATOM 1455 C SER B 239 3.727 -7.727 -1.924 1.00 55.03 C ATOM 1456 O SER B 239 2.803 -7.162 -1.348 1.00 11.52 O ATOM 1457 CB SER B 239 4.124 -7.785 -4.401 1.00 44.30 C ATOM 1458 OG SER B 239 2.718 -7.846 -4.621 1.00 53.14 O ATOM 0 H SER B 239 6.469 -7.495 -3.538 1.00 42.01 H new ATOM 0 HA SER B 239 4.101 -6.018 -3.176 1.00 32.40 H new ATOM 0 HB2 SER B 239 4.604 -7.277 -5.238 1.00 44.30 H new ATOM 0 HB3 SER B 239 4.533 -8.795 -4.364 1.00 44.30 H new ATOM 0 HG SER B 239 2.432 -7.058 -5.129 1.00 53.14 H new ATOM 1464 N ALA B 240 4.156 -8.944 -1.578 1.00 34.55 N ATOM 1465 CA ALA B 240 3.596 -9.668 -0.428 1.00 53.43 C ATOM 1466 C ALA B 240 3.801 -8.895 0.885 1.00 15.11 C ATOM 1467 O ALA B 240 2.944 -8.912 1.772 1.00 1.02 O ATOM 1468 CB ALA B 240 4.221 -11.056 -0.325 1.00 31.32 C ATOM 0 H ALA B 240 4.888 -9.450 -2.076 1.00 34.55 H new ATOM 0 HA ALA B 240 2.523 -9.767 -0.590 1.00 53.43 H new ATOM 0 HB1 ALA B 240 3.798 -11.583 0.531 1.00 31.32 H new ATOM 0 HB2 ALA B 240 4.013 -11.617 -1.236 1.00 31.32 H new ATOM 0 HB3 ALA B 240 5.299 -10.961 -0.196 1.00 31.32 H new ATOM 1474 N TYR B 241 4.945 -8.219 0.993 1.00 71.52 N ATOM 1475 CA TYR B 241 5.274 -7.404 2.170 1.00 25.12 C ATOM 1476 C TYR B 241 4.225 -6.295 2.386 1.00 62.14 C ATOM 1477 O TYR B 241 3.551 -6.254 3.417 1.00 11.33 O ATOM 1478 CB TYR B 241 6.673 -6.793 1.985 1.00 23.15 C ATOM 1479 CG TYR B 241 7.290 -6.220 3.247 1.00 4.21 C ATOM 1480 CD1 TYR B 241 7.850 -7.056 4.207 1.00 5.12 C ATOM 1481 CD2 TYR B 241 7.334 -4.846 3.472 1.00 64.21 C ATOM 1482 CE1 TYR B 241 8.432 -6.545 5.350 1.00 21.31 C ATOM 1483 CE2 TYR B 241 7.922 -4.329 4.612 1.00 13.21 C ATOM 1484 CZ TYR B 241 8.466 -5.184 5.548 1.00 45.30 C ATOM 1485 OH TYR B 241 9.065 -4.676 6.678 1.00 23.41 O ATOM 0 H TYR B 241 5.668 -8.218 0.273 1.00 71.52 H new ATOM 0 HA TYR B 241 5.268 -8.040 3.055 1.00 25.12 H new ATOM 0 HB2 TYR B 241 7.339 -7.559 1.588 1.00 23.15 H new ATOM 0 HB3 TYR B 241 6.613 -6.003 1.236 1.00 23.15 H new ATOM 0 HD1 TYR B 241 7.829 -8.125 4.056 1.00 5.12 H new ATOM 0 HD2 TYR B 241 6.902 -4.174 2.745 1.00 64.21 H new ATOM 0 HE1 TYR B 241 8.859 -7.211 6.085 1.00 21.31 H new ATOM 0 HE2 TYR B 241 7.955 -3.261 4.769 1.00 13.21 H new ATOM 0 HH TYR B 241 10.019 -4.900 6.671 1.00 23.41 H new ATOM 1495 N ILE B 242 4.081 -5.412 1.396 1.00 34.44 N ATOM 1496 CA ILE B 242 3.070 -4.343 1.439 1.00 33.52 C ATOM 1497 C ILE B 242 1.647 -4.927 1.506 1.00 71.13 C ATOM 1498 O ILE B 242 0.750 -4.356 2.131 1.00 60.21 O ATOM 1499 CB ILE B 242 3.189 -3.417 0.195 1.00 65.34 C ATOM 1500 CG1 ILE B 242 4.556 -2.711 0.177 1.00 34.00 C ATOM 1501 CG2 ILE B 242 2.052 -2.390 0.156 1.00 43.25 C ATOM 1502 CD1 ILE B 242 4.793 -1.803 1.368 1.00 31.25 C ATOM 0 H ILE B 242 4.652 -5.413 0.550 1.00 34.44 H new ATOM 0 HA ILE B 242 3.255 -3.758 2.340 1.00 33.52 H new ATOM 0 HB ILE B 242 3.107 -4.040 -0.696 1.00 65.34 H new ATOM 0 HG12 ILE B 242 5.343 -3.465 0.144 1.00 34.00 H new ATOM 0 HG13 ILE B 242 4.639 -2.124 -0.738 1.00 34.00 H new ATOM 0 HG21 ILE B 242 2.163 -1.758 -0.725 1.00 43.25 H new ATOM 0 HG22 ILE B 242 1.094 -2.909 0.112 1.00 43.25 H new ATOM 0 HG23 ILE B 242 2.089 -1.772 1.053 1.00 43.25 H new ATOM 0 HD11 ILE B 242 5.777 -1.342 1.284 1.00 31.25 H new ATOM 0 HD12 ILE B 242 4.029 -1.026 1.391 1.00 31.25 H new ATOM 0 HD13 ILE B 242 4.744 -2.388 2.287 1.00 31.25 H new ATOM 1514 N ARG B 243 1.462 -6.082 0.871 1.00 34.43 N ATOM 1515 CA ARG B 243 0.161 -6.757 0.825 1.00 54.43 C ATOM 1516 C ARG B 243 -0.385 -7.037 2.235 1.00 1.11 C ATOM 1517 O ARG B 243 -1.574 -6.849 2.499 1.00 21.04 O ATOM 1518 CB ARG B 243 0.299 -8.067 0.044 1.00 5.11 C ATOM 1519 CG ARG B 243 -1.019 -8.700 -0.393 1.00 13.34 C ATOM 1520 CD ARG B 243 -0.768 -9.950 -1.233 1.00 13.31 C ATOM 1521 NE ARG B 243 0.210 -9.699 -2.294 1.00 43.25 N ATOM 1522 CZ ARG B 243 0.838 -10.636 -2.958 1.00 1.33 C ATOM 1523 NH1 ARG B 243 0.616 -11.890 -2.711 1.00 55.52 N ATOM 1524 NH2 ARG B 243 1.707 -10.311 -3.863 1.00 30.04 N ATOM 0 H ARG B 243 2.204 -6.577 0.375 1.00 34.43 H new ATOM 0 HA ARG B 243 -0.549 -6.098 0.325 1.00 54.43 H new ATOM 0 HB2 ARG B 243 0.907 -7.882 -0.842 1.00 5.11 H new ATOM 0 HB3 ARG B 243 0.842 -8.784 0.660 1.00 5.11 H new ATOM 0 HG2 ARG B 243 -1.612 -8.959 0.484 1.00 13.34 H new ATOM 0 HG3 ARG B 243 -1.600 -7.980 -0.969 1.00 13.34 H new ATOM 0 HD2 ARG B 243 -0.410 -10.755 -0.591 1.00 13.31 H new ATOM 0 HD3 ARG B 243 -1.706 -10.287 -1.674 1.00 13.31 H new ATOM 0 HE ARG B 243 0.416 -8.729 -2.531 1.00 43.25 H new ATOM 0 HH11 ARG B 243 -0.056 -12.157 -1.991 1.00 55.52 H new ATOM 0 HH12 ARG B 243 1.113 -12.609 -3.237 1.00 55.52 H new ATOM 0 HH21 ARG B 243 1.899 -9.328 -4.056 1.00 30.04 H new ATOM 0 HH22 ARG B 243 2.198 -11.038 -4.383 1.00 30.04 H new ATOM 1538 N ARG B 244 0.481 -7.486 3.143 1.00 30.31 N ATOM 1539 CA ARG B 244 0.060 -7.752 4.523 1.00 13.52 C ATOM 1540 C ARG B 244 0.044 -6.458 5.357 1.00 11.44 C ATOM 1541 O ARG B 244 -0.661 -6.366 6.357 1.00 33.12 O ATOM 1542 CB ARG B 244 0.956 -8.809 5.190 1.00 24.42 C ATOM 1543 CG ARG B 244 2.315 -8.293 5.657 1.00 65.12 C ATOM 1544 CD ARG B 244 3.053 -9.345 6.482 1.00 0.54 C ATOM 1545 NE ARG B 244 2.206 -9.892 7.547 1.00 42.50 N ATOM 1546 CZ ARG B 244 2.648 -10.351 8.688 1.00 3.34 C ATOM 1547 NH1 ARG B 244 3.904 -10.296 8.991 1.00 60.13 N ATOM 1548 NH2 ARG B 244 1.819 -10.842 9.545 1.00 44.42 N ATOM 0 H ARG B 244 1.466 -7.672 2.954 1.00 30.31 H new ATOM 0 HA ARG B 244 -0.955 -8.147 4.482 1.00 13.52 H new ATOM 0 HB2 ARG B 244 0.427 -9.225 6.047 1.00 24.42 H new ATOM 0 HB3 ARG B 244 1.115 -9.626 4.487 1.00 24.42 H new ATOM 0 HG2 ARG B 244 2.918 -8.017 4.792 1.00 65.12 H new ATOM 0 HG3 ARG B 244 2.179 -7.390 6.252 1.00 65.12 H new ATOM 0 HD2 ARG B 244 3.384 -10.153 5.829 1.00 0.54 H new ATOM 0 HD3 ARG B 244 3.948 -8.902 6.920 1.00 0.54 H new ATOM 0 HE ARG B 244 1.199 -9.916 7.385 1.00 42.50 H new ATOM 0 HH11 ARG B 244 4.570 -9.889 8.334 1.00 60.13 H new ATOM 0 HH12 ARG B 244 4.229 -10.660 9.887 1.00 60.13 H new ATOM 0 HH21 ARG B 244 0.822 -10.871 9.331 1.00 44.42 H new ATOM 0 HH22 ARG B 244 2.160 -11.201 10.437 1.00 44.42 H new ATOM 1562 N ILE B 245 0.821 -5.456 4.938 1.00 5.25 N ATOM 1563 CA ILE B 245 0.834 -4.154 5.619 1.00 2.44 C ATOM 1564 C ILE B 245 -0.539 -3.465 5.537 1.00 33.22 C ATOM 1565 O ILE B 245 -1.026 -2.907 6.525 1.00 63.11 O ATOM 1566 CB ILE B 245 1.931 -3.218 5.042 1.00 32.34 C ATOM 1567 CG1 ILE B 245 3.328 -3.761 5.389 1.00 51.12 C ATOM 1568 CG2 ILE B 245 1.761 -1.784 5.552 1.00 43.44 C ATOM 1569 CD1 ILE B 245 4.467 -2.896 4.889 1.00 3.55 C ATOM 0 H ILE B 245 1.447 -5.518 4.135 1.00 5.25 H new ATOM 0 HA ILE B 245 1.064 -4.348 6.667 1.00 2.44 H new ATOM 0 HB ILE B 245 1.825 -3.196 3.957 1.00 32.34 H new ATOM 0 HG12 ILE B 245 3.409 -3.861 6.471 1.00 51.12 H new ATOM 0 HG13 ILE B 245 3.433 -4.761 4.968 1.00 51.12 H new ATOM 0 HG21 ILE B 245 2.543 -1.153 5.131 1.00 43.44 H new ATOM 0 HG22 ILE B 245 0.786 -1.403 5.249 1.00 43.44 H new ATOM 0 HG23 ILE B 245 1.833 -1.774 6.640 1.00 43.44 H new ATOM 0 HD11 ILE B 245 5.418 -3.346 5.174 1.00 3.55 H new ATOM 0 HD12 ILE B 245 4.414 -2.816 3.803 1.00 3.55 H new ATOM 0 HD13 ILE B 245 4.390 -1.902 5.330 1.00 3.55 H new ATOM 1581 N ILE B 246 -1.165 -3.504 4.361 1.00 53.00 N ATOM 1582 CA ILE B 246 -2.517 -2.962 4.209 1.00 24.22 C ATOM 1583 C ILE B 246 -3.550 -3.852 4.923 1.00 44.44 C ATOM 1584 O ILE B 246 -4.459 -3.352 5.586 1.00 64.31 O ATOM 1585 CB ILE B 246 -2.924 -2.777 2.721 1.00 0.42 C ATOM 1586 CG1 ILE B 246 -2.942 -4.122 1.975 1.00 30.11 C ATOM 1587 CG2 ILE B 246 -1.983 -1.790 2.033 1.00 71.42 C ATOM 1588 CD1 ILE B 246 -3.420 -4.021 0.540 1.00 41.54 C ATOM 0 H ILE B 246 -0.765 -3.899 3.510 1.00 53.00 H new ATOM 0 HA ILE B 246 -2.505 -1.976 4.673 1.00 24.22 H new ATOM 0 HB ILE B 246 -3.935 -2.372 2.695 1.00 0.42 H new ATOM 0 HG12 ILE B 246 -1.938 -4.545 1.984 1.00 30.11 H new ATOM 0 HG13 ILE B 246 -3.586 -4.817 2.514 1.00 30.11 H new ATOM 0 HG21 ILE B 246 -2.280 -1.670 0.991 1.00 71.42 H new ATOM 0 HG22 ILE B 246 -2.035 -0.826 2.538 1.00 71.42 H new ATOM 0 HG23 ILE B 246 -0.962 -2.169 2.078 1.00 71.42 H new ATOM 0 HD11 ILE B 246 -3.405 -5.009 0.081 1.00 41.54 H new ATOM 0 HD12 ILE B 246 -4.437 -3.628 0.522 1.00 41.54 H new ATOM 0 HD13 ILE B 246 -2.763 -3.352 -0.016 1.00 41.54 H new ATOM 1600 N LEU B 247 -3.391 -5.174 4.804 1.00 52.14 N ATOM 1601 CA LEU B 247 -4.269 -6.133 5.492 1.00 60.24 C ATOM 1602 C LEU B 247 -4.305 -5.861 7.006 1.00 4.12 C ATOM 1603 O LEU B 247 -5.364 -5.584 7.576 1.00 10.23 O ATOM 1604 CB LEU B 247 -3.790 -7.570 5.221 1.00 52.53 C ATOM 1605 CG LEU B 247 -4.606 -8.682 5.905 1.00 21.32 C ATOM 1606 CD1 LEU B 247 -6.072 -8.610 5.490 1.00 32.12 C ATOM 1607 CD2 LEU B 247 -4.014 -10.055 5.584 1.00 55.54 C ATOM 0 H LEU B 247 -2.662 -5.607 4.237 1.00 52.14 H new ATOM 0 HA LEU B 247 -5.280 -6.013 5.103 1.00 60.24 H new ATOM 0 HB2 LEU B 247 -3.805 -7.742 4.145 1.00 52.53 H new ATOM 0 HB3 LEU B 247 -2.752 -7.655 5.543 1.00 52.53 H new ATOM 0 HG LEU B 247 -4.555 -8.533 6.983 1.00 21.32 H new ATOM 0 HD11 LEU B 247 -6.630 -9.405 5.985 1.00 32.12 H new ATOM 0 HD12 LEU B 247 -6.485 -7.643 5.778 1.00 32.12 H new ATOM 0 HD13 LEU B 247 -6.151 -8.730 4.410 1.00 32.12 H new ATOM 0 HD21 LEU B 247 -4.603 -10.829 6.076 1.00 55.54 H new ATOM 0 HD22 LEU B 247 -4.031 -10.216 4.506 1.00 55.54 H new ATOM 0 HD23 LEU B 247 -2.985 -10.100 5.941 1.00 55.54 H new ATOM 1619 N ASN B 248 -3.131 -5.889 7.639 1.00 52.13 N ATOM 1620 CA ASN B 248 -3.003 -5.614 9.078 1.00 31.31 C ATOM 1621 C ASN B 248 -3.350 -4.151 9.425 1.00 51.42 C ATOM 1622 O ASN B 248 -3.194 -3.722 10.569 1.00 2.12 O ATOM 1623 CB ASN B 248 -1.581 -5.945 9.556 1.00 62.04 C ATOM 1624 CG ASN B 248 -1.229 -7.417 9.388 1.00 22.15 C ATOM 1625 OD1 ASN B 248 -1.670 -8.079 8.455 1.00 53.42 O ATOM 1626 ND2 ASN B 248 -0.424 -7.940 10.291 1.00 62.00 N ATOM 0 H ASN B 248 -2.247 -6.101 7.177 1.00 52.13 H new ATOM 0 HA ASN B 248 -3.720 -6.252 9.595 1.00 31.31 H new ATOM 0 HB2 ASN B 248 -0.866 -5.339 9.000 1.00 62.04 H new ATOM 0 HB3 ASN B 248 -1.483 -5.670 10.606 1.00 62.04 H new ATOM 0 HD21 ASN B 248 -0.152 -8.921 10.225 1.00 62.00 H new ATOM 0 HD22 ASN B 248 -0.073 -7.364 11.056 1.00 62.00 H new ATOM 1633 N HIS B 249 -3.799 -3.382 8.435 1.00 24.21 N ATOM 1634 CA HIS B 249 -4.292 -2.022 8.665 1.00 22.42 C ATOM 1635 C HIS B 249 -5.828 -1.995 8.610 1.00 43.12 C ATOM 1636 O HIS B 249 -6.476 -1.364 9.443 1.00 60.11 O ATOM 1637 CB HIS B 249 -3.700 -1.064 7.621 1.00 23.32 C ATOM 1638 CG HIS B 249 -4.006 0.387 7.861 1.00 1.34 C ATOM 1639 ND1 HIS B 249 -3.049 1.298 8.249 1.00 55.13 N ATOM 1640 CD2 HIS B 249 -5.153 1.096 7.716 1.00 25.12 C ATOM 1641 CE1 HIS B 249 -3.587 2.494 8.332 1.00 31.31 C ATOM 1642 NE2 HIS B 249 -4.859 2.400 8.016 1.00 34.42 N ATOM 0 H HIS B 249 -3.832 -3.678 7.460 1.00 24.21 H new ATOM 0 HA HIS B 249 -3.977 -1.696 9.656 1.00 22.42 H new ATOM 0 HB2 HIS B 249 -2.618 -1.195 7.599 1.00 23.32 H new ATOM 0 HB3 HIS B 249 -4.075 -1.343 6.636 1.00 23.32 H new ATOM 0 HD2 HIS B 249 -6.116 0.706 7.420 1.00 25.12 H new ATOM 0 HE1 HIS B 249 -3.071 3.400 8.612 1.00 31.31 H new ATOM 0 HE2 HIS B 249 -5.522 3.175 7.997 1.00 34.42 H new ATOM 1651 N LEU B 250 -6.403 -2.694 7.628 1.00 11.10 N ATOM 1652 CA LEU B 250 -7.864 -2.757 7.467 1.00 5.11 C ATOM 1653 C LEU B 250 -8.539 -3.542 8.611 1.00 62.25 C ATOM 1654 O LEU B 250 -9.680 -3.254 8.980 1.00 41.32 O ATOM 1655 CB LEU B 250 -8.245 -3.371 6.104 1.00 51.35 C ATOM 1656 CG LEU B 250 -8.232 -2.401 4.899 1.00 40.23 C ATOM 1657 CD1 LEU B 250 -9.247 -1.278 5.097 1.00 43.02 C ATOM 1658 CD2 LEU B 250 -6.838 -1.827 4.661 1.00 31.30 C ATOM 0 H LEU B 250 -5.882 -3.225 6.931 1.00 11.10 H new ATOM 0 HA LEU B 250 -8.230 -1.731 7.506 1.00 5.11 H new ATOM 0 HB2 LEU B 250 -7.559 -4.192 5.893 1.00 51.35 H new ATOM 0 HB3 LEU B 250 -9.242 -3.802 6.188 1.00 51.35 H new ATOM 0 HG LEU B 250 -8.514 -2.971 4.014 1.00 40.23 H new ATOM 0 HD11 LEU B 250 -9.221 -0.608 4.238 1.00 43.02 H new ATOM 0 HD12 LEU B 250 -10.246 -1.703 5.195 1.00 43.02 H new ATOM 0 HD13 LEU B 250 -9.000 -0.720 6.000 1.00 43.02 H new ATOM 0 HD21 LEU B 250 -6.864 -1.150 3.807 1.00 31.30 H new ATOM 0 HD22 LEU B 250 -6.513 -1.282 5.547 1.00 31.30 H new ATOM 0 HD23 LEU B 250 -6.140 -2.639 4.458 1.00 31.30 H new ATOM 1670 N GLU B 251 -7.836 -4.538 9.158 1.00 13.55 N ATOM 1671 CA GLU B 251 -8.335 -5.295 10.319 1.00 63.14 C ATOM 1672 C GLU B 251 -7.968 -4.604 11.646 1.00 34.40 C ATOM 1673 O GLU B 251 -8.443 -4.991 12.717 1.00 3.13 O ATOM 1674 CB GLU B 251 -7.773 -6.728 10.313 1.00 31.52 C ATOM 1675 CG GLU B 251 -6.248 -6.797 10.412 1.00 4.53 C ATOM 1676 CD GLU B 251 -5.733 -8.207 10.660 1.00 32.11 C ATOM 1677 OE1 GLU B 251 -5.479 -8.945 9.685 1.00 20.44 O ATOM 1678 OE2 GLU B 251 -5.574 -8.583 11.841 1.00 45.20 O ATOM 0 H GLU B 251 -6.923 -4.841 8.820 1.00 13.55 H new ATOM 0 HA GLU B 251 -9.421 -5.331 10.239 1.00 63.14 H new ATOM 0 HB2 GLU B 251 -8.207 -7.281 11.146 1.00 31.52 H new ATOM 0 HB3 GLU B 251 -8.091 -7.228 9.398 1.00 31.52 H new ATOM 0 HG2 GLU B 251 -5.812 -6.413 9.490 1.00 4.53 H new ATOM 0 HG3 GLU B 251 -5.912 -6.146 11.219 1.00 4.53 H new ATOM 1685 N ASP B 252 -7.122 -3.577 11.568 1.00 12.02 N ATOM 1686 CA ASP B 252 -6.631 -2.876 12.760 1.00 52.12 C ATOM 1687 C ASP B 252 -7.326 -1.511 12.945 1.00 70.02 C ATOM 1688 O ASP B 252 -8.111 -1.327 13.880 1.00 21.21 O ATOM 1689 CB ASP B 252 -5.114 -2.703 12.654 1.00 75.33 C ATOM 1690 CG ASP B 252 -4.517 -1.997 13.855 1.00 53.23 C ATOM 1691 OD1 ASP B 252 -4.533 -2.576 14.959 1.00 54.23 O ATOM 1692 OD2 ASP B 252 -4.010 -0.866 13.693 1.00 64.54 O ATOM 0 H ASP B 252 -6.760 -3.209 10.689 1.00 12.02 H new ATOM 0 HA ASP B 252 -6.869 -3.476 13.639 1.00 52.12 H new ATOM 0 HB2 ASP B 252 -4.648 -3.682 12.546 1.00 75.33 H new ATOM 0 HB3 ASP B 252 -4.880 -2.137 11.752 1.00 75.33 H new ATOM 1697 N GLU B 253 -7.038 -0.556 12.060 1.00 42.42 N ATOM 1698 CA GLU B 253 -7.668 0.777 12.124 1.00 33.02 C ATOM 1699 C GLU B 253 -8.474 1.095 10.839 1.00 20.34 C ATOM 1700 O GLU B 253 -9.526 0.455 10.621 1.00 37.89 O ATOM 1701 CB GLU B 253 -6.605 1.866 12.406 1.00 52.12 C ATOM 1702 CG GLU B 253 -5.410 1.851 11.454 1.00 44.33 C ATOM 1703 CD GLU B 253 -4.500 3.061 11.634 1.00 13.22 C ATOM 1704 OE1 GLU B 253 -4.798 4.131 11.053 1.00 42.40 O ATOM 1705 OE2 GLU B 253 -3.481 2.950 12.346 1.00 21.42 O ATOM 1706 OXT GLU B 253 -8.088 2.009 10.073 1.00 37.89 O ATOM 0 H GLU B 253 -6.377 -0.673 11.292 1.00 42.42 H new ATOM 0 HA GLU B 253 -8.379 0.770 12.950 1.00 33.02 H new ATOM 0 HB2 GLU B 253 -7.083 2.844 12.352 1.00 52.12 H new ATOM 0 HB3 GLU B 253 -6.241 1.744 13.426 1.00 52.12 H new ATOM 0 HG2 GLU B 253 -4.833 0.940 11.616 1.00 44.33 H new ATOM 0 HG3 GLU B 253 -5.770 1.822 10.426 1.00 44.33 H new