USER MOD reduce.3.24.130724 H: found=0, std=0, add=750, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 748 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 Set 1.1: A 1 MET N :NH3+ -155:sc= 0.0779 (180deg=0) USER MOD Set 1.2: B 35 ASN : amide:sc= 0.0743 K(o=0.15,f=-2.6!) USER MOD Set 2.1: B 13 ASN : amide:sc= 0.101 K(o=0.1,f=1.1) USER MOD Set 2.2: B 19 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 35 ASN : amide:sc= 0.0969 K(o=0.19,f=-3.6!) USER MOD Set 3.2: B 1 MET N :NH3+ -152:sc= 0.0974 (180deg=0) USER MOD Set 4.1: A 11 SER OG : rot -114:sc= 0.705 USER MOD Set 4.2: A 21 THR OG1 : rot 180:sc= 0.64 USER MOD Set 5.1: A 13 ASN : amide:sc= 0.411 K(o=0.41,f=1.2) USER MOD Set 5.2: A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl -177:sc= -0.161 (180deg=-0.193) USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ -157:sc= -0.083 (180deg=-0.518) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -0.257 K(o=-0.26,f=-1.6!) USER MOD Single : A 29 GLN : amide:sc= -1.27 K(o=-1.3,f=-4.5!) USER MOD Single : A 38 LYS NZ :NH3+ 168:sc=-0.00506 (180deg=-0.187) USER MOD Single : A 43 HIS : no HD1:sc= -0.838 K(o=-0.84,f=-0.29) USER MOD Single : A 48 TYR OH : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl -179:sc= -0.304 (180deg=-0.325) USER MOD Single : B 5 THR OG1 : rot 170:sc= 0.143 USER MOD Single : B 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 11 SER OG : rot 180:sc= 0 USER MOD Single : B 21 THR OG1 : rot 180:sc= -0.0164 USER MOD Single : B 26 SER OG : rot 180:sc= 0 USER MOD Single : B 28 GLN : amide:sc= -0.236 K(o=-0.24,f=-1.2) USER MOD Single : B 29 GLN : amide:sc= -0.253 K(o=-0.25,f=-2.4) USER MOD Single : B 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 43 HIS : no HD1:sc= -1.01 K(o=-1,f=-0.21) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 23.457 -2.439 -6.490 1.00 1.00 N ATOM 2 CA MET A 1 22.417 -1.643 -7.168 1.00 1.00 C ATOM 3 C MET A 1 23.054 -0.617 -8.095 1.00 1.00 C ATOM 4 O MET A 1 24.112 -0.078 -7.779 1.00 1.00 O ATOM 5 CB MET A 1 21.516 -0.963 -6.131 1.00 1.00 C ATOM 6 CG MET A 1 20.339 -0.251 -6.796 1.00 1.00 C ATOM 7 SD MET A 1 18.947 0.105 -5.688 1.00 1.00 S ATOM 8 CE MET A 1 19.767 1.138 -4.447 1.00 1.00 C ATOM 0 H1 MET A 1 23.064 -3.362 -6.215 1.00 1.00 H new ATOM 0 H2 MET A 1 24.260 -2.583 -7.135 1.00 1.00 H new ATOM 0 H3 MET A 1 23.782 -1.934 -5.641 1.00 1.00 H new ATOM 0 HA MET A 1 21.801 -2.307 -7.774 1.00 1.00 H new ATOM 0 HB2 MET A 1 21.143 -1.707 -5.428 1.00 1.00 H new ATOM 0 HB3 MET A 1 22.099 -0.245 -5.555 1.00 1.00 H new ATOM 0 HG2 MET A 1 20.694 0.686 -7.225 1.00 1.00 H new ATOM 0 HG3 MET A 1 19.981 -0.864 -7.623 1.00 1.00 H new ATOM 0 HE1 MET A 1 19.056 1.397 -3.662 1.00 1.00 H new ATOM 0 HE2 MET A 1 20.603 0.590 -4.013 1.00 1.00 H new ATOM 0 HE3 MET A 1 20.136 2.049 -4.918 1.00 1.00 H new ATOM 20 N LEU A 2 22.412 -0.345 -9.237 1.00 1.00 N ATOM 21 CA LEU A 2 22.870 0.651 -10.194 1.00 1.00 C ATOM 22 C LEU A 2 21.918 1.846 -10.149 1.00 1.00 C ATOM 23 O LEU A 2 20.842 1.814 -10.745 1.00 1.00 O ATOM 24 CB LEU A 2 22.920 0.038 -11.602 1.00 1.00 C ATOM 25 CG LEU A 2 23.953 0.691 -12.535 1.00 1.00 C ATOM 26 CD1 LEU A 2 23.488 0.622 -13.979 1.00 1.00 C ATOM 27 CD2 LEU A 2 24.286 2.143 -12.226 1.00 1.00 C ATOM 0 H LEU A 2 21.553 -0.818 -9.519 1.00 1.00 H new ATOM 0 HA LEU A 2 23.875 0.986 -9.939 1.00 1.00 H new ATOM 0 HB2 LEU A 2 23.145 -1.025 -11.516 1.00 1.00 H new ATOM 0 HB3 LEU A 2 21.933 0.119 -12.057 1.00 1.00 H new ATOM 0 HG LEU A 2 24.861 0.112 -12.366 1.00 1.00 H new ATOM 0 HD11 LEU A 2 24.232 1.089 -14.624 1.00 1.00 H new ATOM 0 HD12 LEU A 2 23.359 -0.420 -14.270 1.00 1.00 H new ATOM 0 HD13 LEU A 2 22.539 1.148 -14.081 1.00 1.00 H new ATOM 0 HD21 LEU A 2 25.023 2.507 -12.942 1.00 1.00 H new ATOM 0 HD22 LEU A 2 23.381 2.747 -12.297 1.00 1.00 H new ATOM 0 HD23 LEU A 2 24.692 2.216 -11.217 1.00 1.00 H new ATOM 39 N ILE A 3 22.314 2.903 -9.441 1.00 1.00 N ATOM 40 CA ILE A 3 21.503 4.099 -9.289 1.00 1.00 C ATOM 41 C ILE A 3 21.743 5.025 -10.478 1.00 1.00 C ATOM 42 O ILE A 3 22.856 5.102 -10.994 1.00 1.00 O ATOM 43 CB ILE A 3 21.856 4.802 -7.969 1.00 1.00 C ATOM 44 CG1 ILE A 3 21.503 3.930 -6.756 1.00 1.00 C ATOM 45 CG2 ILE A 3 21.065 6.108 -7.844 1.00 1.00 C ATOM 46 CD1 ILE A 3 22.575 2.894 -6.432 1.00 1.00 C ATOM 0 H ILE A 3 23.211 2.949 -8.957 1.00 1.00 H new ATOM 0 HA ILE A 3 20.447 3.830 -9.261 1.00 1.00 H new ATOM 0 HB ILE A 3 22.929 4.992 -7.983 1.00 1.00 H new ATOM 0 HG12 ILE A 3 21.351 4.571 -5.887 1.00 1.00 H new ATOM 0 HG13 ILE A 3 20.558 3.420 -6.945 1.00 1.00 H new ATOM 0 HG21 ILE A 3 21.321 6.600 -6.906 1.00 1.00 H new ATOM 0 HG22 ILE A 3 21.313 6.765 -8.678 1.00 1.00 H new ATOM 0 HG23 ILE A 3 19.997 5.890 -7.860 1.00 1.00 H new ATOM 0 HD11 ILE A 3 22.266 2.310 -5.565 1.00 1.00 H new ATOM 0 HD12 ILE A 3 22.711 2.231 -7.287 1.00 1.00 H new ATOM 0 HD13 ILE A 3 23.515 3.400 -6.212 1.00 1.00 H new ATOM 58 N LEU A 4 20.692 5.724 -10.909 1.00 1.00 N ATOM 59 CA LEU A 4 20.758 6.698 -11.985 1.00 1.00 C ATOM 60 C LEU A 4 19.833 7.865 -11.641 1.00 1.00 C ATOM 61 O LEU A 4 18.991 7.751 -10.753 1.00 1.00 O ATOM 62 CB LEU A 4 20.312 6.047 -13.301 1.00 1.00 C ATOM 63 CG LEU A 4 21.219 4.902 -13.772 1.00 1.00 C ATOM 64 CD1 LEU A 4 20.554 4.178 -14.939 1.00 1.00 C ATOM 65 CD2 LEU A 4 22.567 5.410 -14.278 1.00 1.00 C ATOM 0 H LEU A 4 19.759 5.623 -10.510 1.00 1.00 H new ATOM 0 HA LEU A 4 21.780 7.058 -12.102 1.00 1.00 H new ATOM 0 HB2 LEU A 4 19.298 5.667 -13.180 1.00 1.00 H new ATOM 0 HB3 LEU A 4 20.276 6.811 -14.078 1.00 1.00 H new ATOM 0 HG LEU A 4 21.375 4.246 -12.915 1.00 1.00 H new ATOM 0 HD11 LEU A 4 21.196 3.364 -15.276 1.00 1.00 H new ATOM 0 HD12 LEU A 4 19.594 3.774 -14.617 1.00 1.00 H new ATOM 0 HD13 LEU A 4 20.396 4.878 -15.759 1.00 1.00 H new ATOM 0 HD21 LEU A 4 23.176 4.566 -14.601 1.00 1.00 H new ATOM 0 HD22 LEU A 4 22.409 6.086 -15.118 1.00 1.00 H new ATOM 0 HD23 LEU A 4 23.080 5.942 -13.476 1.00 1.00 H new ATOM 77 N THR A 5 19.984 8.988 -12.347 1.00 1.00 N ATOM 78 CA THR A 5 19.109 10.142 -12.182 1.00 1.00 C ATOM 79 C THR A 5 18.510 10.481 -13.541 1.00 1.00 C ATOM 80 O THR A 5 19.015 11.341 -14.262 1.00 1.00 O ATOM 81 CB THR A 5 19.874 11.311 -11.554 1.00 1.00 C ATOM 82 OG1 THR A 5 20.391 10.920 -10.300 1.00 1.00 O ATOM 83 CG2 THR A 5 18.952 12.505 -11.322 1.00 1.00 C ATOM 0 H THR A 5 20.715 9.119 -13.046 1.00 1.00 H new ATOM 0 HA THR A 5 18.293 9.918 -11.495 1.00 1.00 H new ATOM 0 HB THR A 5 20.675 11.591 -12.239 1.00 1.00 H new ATOM 0 HG1 THR A 5 20.881 11.669 -9.901 1.00 1.00 H new ATOM 0 HG21 THR A 5 19.519 13.321 -10.875 1.00 1.00 H new ATOM 0 HG22 THR A 5 18.534 12.832 -12.274 1.00 1.00 H new ATOM 0 HG23 THR A 5 18.144 12.215 -10.651 1.00 1.00 H new ATOM 91 N ARG A 6 17.422 9.790 -13.890 1.00 1.00 N ATOM 92 CA ARG A 6 16.807 9.892 -15.205 1.00 1.00 C ATOM 93 C ARG A 6 15.932 11.139 -15.308 1.00 1.00 C ATOM 94 O ARG A 6 15.383 11.602 -14.311 1.00 1.00 O ATOM 95 CB ARG A 6 15.972 8.623 -15.432 1.00 1.00 C ATOM 96 CG ARG A 6 15.502 8.445 -16.880 1.00 1.00 C ATOM 97 CD ARG A 6 16.551 7.799 -17.789 1.00 1.00 C ATOM 98 NE ARG A 6 17.760 8.616 -17.952 1.00 1.00 N ATOM 99 CZ ARG A 6 18.907 8.424 -17.294 1.00 1.00 C ATOM 100 NH1 ARG A 6 19.032 7.450 -16.396 1.00 1.00 N ATOM 101 NH2 ARG A 6 19.949 9.212 -17.530 1.00 1.00 N ATOM 0 H ARG A 6 16.945 9.143 -13.262 1.00 1.00 H new ATOM 0 HA ARG A 6 17.578 9.980 -15.970 1.00 1.00 H new ATOM 0 HB2 ARG A 6 16.562 7.754 -15.142 1.00 1.00 H new ATOM 0 HB3 ARG A 6 15.101 8.650 -14.777 1.00 1.00 H new ATOM 0 HG2 ARG A 6 14.600 7.833 -16.888 1.00 1.00 H new ATOM 0 HG3 ARG A 6 15.230 9.419 -17.287 1.00 1.00 H new ATOM 0 HD2 ARG A 6 16.829 6.828 -17.378 1.00 1.00 H new ATOM 0 HD3 ARG A 6 16.110 7.616 -18.769 1.00 1.00 H new ATOM 0 HE ARG A 6 17.721 9.388 -18.617 1.00 1.00 H new ATOM 0 HH11 ARG A 6 18.244 6.833 -16.199 1.00 1.00 H new ATOM 0 HH12 ARG A 6 19.916 7.320 -15.904 1.00 1.00 H new ATOM 0 HH21 ARG A 6 19.874 9.965 -18.214 1.00 1.00 H new ATOM 0 HH22 ARG A 6 20.824 9.065 -17.027 1.00 1.00 H new ATOM 115 N LYS A 7 15.806 11.681 -16.523 1.00 1.00 N ATOM 116 CA LYS A 7 14.917 12.800 -16.807 1.00 1.00 C ATOM 117 C LYS A 7 13.509 12.254 -17.035 1.00 1.00 C ATOM 118 O LYS A 7 13.351 11.139 -17.527 1.00 1.00 O ATOM 119 CB LYS A 7 15.373 13.517 -18.084 1.00 1.00 C ATOM 120 CG LYS A 7 16.667 14.329 -17.945 1.00 1.00 C ATOM 121 CD LYS A 7 17.883 13.468 -17.593 1.00 1.00 C ATOM 122 CE LYS A 7 19.185 14.211 -17.894 1.00 1.00 C ATOM 123 NZ LYS A 7 19.375 14.407 -19.343 1.00 1.00 N ATOM 0 H LYS A 7 16.323 11.351 -17.338 1.00 1.00 H new ATOM 0 HA LYS A 7 14.932 13.499 -15.971 1.00 1.00 H new ATOM 0 HB2 LYS A 7 15.510 12.775 -18.870 1.00 1.00 H new ATOM 0 HB3 LYS A 7 14.576 14.185 -18.412 1.00 1.00 H new ATOM 0 HG2 LYS A 7 16.861 14.855 -18.880 1.00 1.00 H new ATOM 0 HG3 LYS A 7 16.531 15.088 -17.174 1.00 1.00 H new ATOM 0 HD2 LYS A 7 17.849 13.199 -16.537 1.00 1.00 H new ATOM 0 HD3 LYS A 7 17.851 12.538 -18.160 1.00 1.00 H new ATOM 0 HE2 LYS A 7 19.176 15.179 -17.393 1.00 1.00 H new ATOM 0 HE3 LYS A 7 20.027 13.650 -17.489 1.00 1.00 H new ATOM 0 HZ1 LYS A 7 20.386 14.543 -19.545 1.00 1.00 H new ATOM 0 HZ2 LYS A 7 19.029 13.570 -19.855 1.00 1.00 H new ATOM 0 HZ3 LYS A 7 18.844 15.246 -19.652 1.00 1.00 H new ATOM 137 N VAL A 8 12.483 13.029 -16.682 1.00 1.00 N ATOM 138 CA VAL A 8 11.101 12.652 -16.948 1.00 1.00 C ATOM 139 C VAL A 8 10.901 12.520 -18.456 1.00 1.00 C ATOM 140 O VAL A 8 11.333 13.381 -19.221 1.00 1.00 O ATOM 141 CB VAL A 8 10.173 13.724 -16.369 1.00 1.00 C ATOM 142 CG1 VAL A 8 8.735 13.501 -16.835 1.00 1.00 C ATOM 143 CG2 VAL A 8 10.224 13.669 -14.841 1.00 1.00 C ATOM 0 H VAL A 8 12.588 13.926 -16.208 1.00 1.00 H new ATOM 0 HA VAL A 8 10.869 11.695 -16.480 1.00 1.00 H new ATOM 0 HB VAL A 8 10.507 14.701 -16.719 1.00 1.00 H new ATOM 0 HG11 VAL A 8 8.092 14.273 -16.413 1.00 1.00 H new ATOM 0 HG12 VAL A 8 8.694 13.549 -17.923 1.00 1.00 H new ATOM 0 HG13 VAL A 8 8.392 12.521 -16.502 1.00 1.00 H new ATOM 0 HG21 VAL A 8 9.564 14.431 -14.427 1.00 1.00 H new ATOM 0 HG22 VAL A 8 9.900 12.685 -14.501 1.00 1.00 H new ATOM 0 HG23 VAL A 8 11.245 13.851 -14.504 1.00 1.00 H new ATOM 153 N GLY A 9 10.245 11.438 -18.880 1.00 1.00 N ATOM 154 CA GLY A 9 9.944 11.173 -20.279 1.00 1.00 C ATOM 155 C GLY A 9 10.964 10.236 -20.925 1.00 1.00 C ATOM 156 O GLY A 9 10.725 9.740 -22.025 1.00 1.00 O ATOM 0 H GLY A 9 9.905 10.713 -18.248 1.00 1.00 H new ATOM 0 HA2 GLY A 9 8.950 10.733 -20.357 1.00 1.00 H new ATOM 0 HA3 GLY A 9 9.920 12.114 -20.828 1.00 1.00 H new ATOM 160 N GLU A 10 12.095 9.991 -20.254 1.00 1.00 N ATOM 161 CA GLU A 10 13.108 9.058 -20.730 1.00 1.00 C ATOM 162 C GLU A 10 12.853 7.678 -20.120 1.00 1.00 C ATOM 163 O GLU A 10 11.852 7.481 -19.430 1.00 1.00 O ATOM 164 CB GLU A 10 14.504 9.572 -20.365 1.00 1.00 C ATOM 165 CG GLU A 10 14.784 10.946 -20.976 1.00 1.00 C ATOM 166 CD GLU A 10 14.728 10.911 -22.503 1.00 1.00 C ATOM 167 OE1 GLU A 10 15.657 10.324 -23.102 1.00 1.00 O ATOM 168 OE2 GLU A 10 13.758 11.471 -23.062 1.00 1.00 O ATOM 0 H GLU A 10 12.329 10.437 -19.367 1.00 1.00 H new ATOM 0 HA GLU A 10 13.052 8.975 -21.815 1.00 1.00 H new ATOM 0 HB2 GLU A 10 14.597 9.631 -19.281 1.00 1.00 H new ATOM 0 HB3 GLU A 10 15.254 8.861 -20.711 1.00 1.00 H new ATOM 0 HG2 GLU A 10 14.055 11.665 -20.602 1.00 1.00 H new ATOM 0 HG3 GLU A 10 15.767 11.292 -20.656 1.00 1.00 H new ATOM 175 N SER A 11 13.747 6.716 -20.369 1.00 1.00 N ATOM 176 CA SER A 11 13.578 5.362 -19.855 1.00 1.00 C ATOM 177 C SER A 11 14.904 4.719 -19.459 1.00 1.00 C ATOM 178 O SER A 11 15.979 5.281 -19.665 1.00 1.00 O ATOM 179 CB SER A 11 12.910 4.490 -20.923 1.00 1.00 C ATOM 180 OG SER A 11 11.663 5.029 -21.304 1.00 1.00 O ATOM 0 H SER A 11 14.592 6.854 -20.923 1.00 1.00 H new ATOM 0 HA SER A 11 12.957 5.432 -18.962 1.00 1.00 H new ATOM 0 HB2 SER A 11 13.560 4.414 -21.795 1.00 1.00 H new ATOM 0 HB3 SER A 11 12.772 3.479 -20.539 1.00 1.00 H new ATOM 0 HG SER A 11 10.946 4.419 -21.032 1.00 1.00 H new ATOM 186 N ILE A 12 14.794 3.519 -18.886 1.00 1.00 N ATOM 187 CA ILE A 12 15.899 2.626 -18.577 1.00 1.00 C ATOM 188 C ILE A 12 15.600 1.304 -19.283 1.00 1.00 C ATOM 189 O ILE A 12 14.463 1.071 -19.690 1.00 1.00 O ATOM 190 CB ILE A 12 16.000 2.427 -17.055 1.00 1.00 C ATOM 191 CG1 ILE A 12 16.186 3.746 -16.296 1.00 1.00 C ATOM 192 CG2 ILE A 12 17.127 1.462 -16.673 1.00 1.00 C ATOM 193 CD1 ILE A 12 17.512 4.434 -16.618 1.00 1.00 C ATOM 0 H ILE A 12 13.890 3.131 -18.615 1.00 1.00 H new ATOM 0 HA ILE A 12 16.852 3.033 -18.914 1.00 1.00 H new ATOM 0 HB ILE A 12 15.045 1.993 -16.759 1.00 1.00 H new ATOM 0 HG12 ILE A 12 15.364 4.419 -16.540 1.00 1.00 H new ATOM 0 HG13 ILE A 12 16.133 3.554 -15.224 1.00 1.00 H new ATOM 0 HG21 ILE A 12 17.160 1.352 -15.589 1.00 1.00 H new ATOM 0 HG22 ILE A 12 16.944 0.490 -17.131 1.00 1.00 H new ATOM 0 HG23 ILE A 12 18.079 1.856 -17.027 1.00 1.00 H new ATOM 0 HD11 ILE A 12 17.587 5.362 -16.051 1.00 1.00 H new ATOM 0 HD12 ILE A 12 18.338 3.776 -16.348 1.00 1.00 H new ATOM 0 HD13 ILE A 12 17.558 4.655 -17.684 1.00 1.00 H new ATOM 205 N ASN A 13 16.600 0.436 -19.435 1.00 1.00 N ATOM 206 CA ASN A 13 16.412 -0.876 -20.024 1.00 1.00 C ATOM 207 C ASN A 13 17.099 -1.926 -19.163 1.00 1.00 C ATOM 208 O ASN A 13 18.123 -1.649 -18.539 1.00 1.00 O ATOM 209 CB ASN A 13 16.971 -0.887 -21.448 1.00 1.00 C ATOM 210 CG ASN A 13 16.100 -0.068 -22.387 1.00 1.00 C ATOM 211 OD1 ASN A 13 16.500 0.992 -22.859 1.00 1.00 O ATOM 212 ND2 ASN A 13 14.898 -0.566 -22.658 1.00 1.00 N ATOM 0 H ASN A 13 17.561 0.629 -19.151 1.00 1.00 H new ATOM 0 HA ASN A 13 15.348 -1.109 -20.070 1.00 1.00 H new ATOM 0 HB2 ASN A 13 17.985 -0.487 -21.447 1.00 1.00 H new ATOM 0 HB3 ASN A 13 17.034 -1.914 -21.809 1.00 1.00 H new ATOM 0 HD21 ASN A 13 14.266 -0.063 -23.281 1.00 1.00 H new ATOM 0 HD22 ASN A 13 14.607 -1.451 -22.243 1.00 1.00 H new ATOM 219 N ILE A 14 16.528 -3.132 -19.138 1.00 1.00 N ATOM 220 CA ILE A 14 17.059 -4.238 -18.354 1.00 1.00 C ATOM 221 C ILE A 14 16.909 -5.531 -19.149 1.00 1.00 C ATOM 222 O ILE A 14 15.925 -5.711 -19.865 1.00 1.00 O ATOM 223 CB ILE A 14 16.312 -4.342 -17.014 1.00 1.00 C ATOM 224 CG1 ILE A 14 16.347 -3.009 -16.252 1.00 1.00 C ATOM 225 CG2 ILE A 14 16.943 -5.449 -16.162 1.00 1.00 C ATOM 226 CD1 ILE A 14 15.507 -3.063 -14.974 1.00 1.00 C ATOM 0 H ILE A 14 15.685 -3.365 -19.662 1.00 1.00 H new ATOM 0 HA ILE A 14 18.115 -4.065 -18.145 1.00 1.00 H new ATOM 0 HB ILE A 14 15.269 -4.584 -17.219 1.00 1.00 H new ATOM 0 HG12 ILE A 14 17.378 -2.762 -15.999 1.00 1.00 H new ATOM 0 HG13 ILE A 14 15.977 -2.212 -16.897 1.00 1.00 H new ATOM 0 HG21 ILE A 14 16.414 -5.523 -15.212 1.00 1.00 H new ATOM 0 HG22 ILE A 14 16.874 -6.399 -16.691 1.00 1.00 H new ATOM 0 HG23 ILE A 14 17.991 -5.213 -15.976 1.00 1.00 H new ATOM 0 HD11 ILE A 14 15.558 -2.101 -14.464 1.00 1.00 H new ATOM 0 HD12 ILE A 14 14.471 -3.284 -15.229 1.00 1.00 H new ATOM 0 HD13 ILE A 14 15.893 -3.843 -14.317 1.00 1.00 H new ATOM 238 N GLY A 15 17.885 -6.434 -19.024 1.00 1.00 N ATOM 239 CA GLY A 15 17.834 -7.748 -19.653 1.00 1.00 C ATOM 240 C GLY A 15 17.689 -7.695 -21.176 1.00 1.00 C ATOM 241 O GLY A 15 17.438 -8.725 -21.797 1.00 1.00 O ATOM 0 H GLY A 15 18.733 -6.270 -18.482 1.00 1.00 H new ATOM 0 HA2 GLY A 15 18.742 -8.297 -19.402 1.00 1.00 H new ATOM 0 HA3 GLY A 15 16.997 -8.308 -19.236 1.00 1.00 H new ATOM 245 N ASP A 16 17.844 -6.507 -21.775 1.00 1.00 N ATOM 246 CA ASP A 16 17.679 -6.263 -23.205 1.00 1.00 C ATOM 247 C ASP A 16 16.267 -6.580 -23.721 1.00 1.00 C ATOM 248 O ASP A 16 16.045 -6.553 -24.930 1.00 1.00 O ATOM 249 CB ASP A 16 18.760 -7.003 -24.001 1.00 1.00 C ATOM 250 CG ASP A 16 20.160 -6.609 -23.538 1.00 1.00 C ATOM 251 OD1 ASP A 16 20.537 -5.440 -23.774 1.00 1.00 O ATOM 252 OD2 ASP A 16 20.844 -7.479 -22.954 1.00 1.00 O ATOM 0 H ASP A 16 18.096 -5.665 -21.257 1.00 1.00 H new ATOM 0 HA ASP A 16 17.805 -5.192 -23.361 1.00 1.00 H new ATOM 0 HB2 ASP A 16 18.626 -8.079 -23.886 1.00 1.00 H new ATOM 0 HB3 ASP A 16 18.650 -6.780 -25.062 1.00 1.00 H new ATOM 257 N ASP A 17 15.315 -6.877 -22.829 1.00 1.00 N ATOM 258 CA ASP A 17 13.934 -7.170 -23.205 1.00 1.00 C ATOM 259 C ASP A 17 12.934 -6.377 -22.361 1.00 1.00 C ATOM 260 O ASP A 17 11.727 -6.523 -22.545 1.00 1.00 O ATOM 261 CB ASP A 17 13.639 -8.664 -23.052 1.00 1.00 C ATOM 262 CG ASP A 17 14.531 -9.534 -23.935 1.00 1.00 C ATOM 263 OD1 ASP A 17 14.469 -9.354 -25.172 1.00 1.00 O ATOM 264 OD2 ASP A 17 15.267 -10.372 -23.369 1.00 1.00 O ATOM 0 H ASP A 17 15.485 -6.920 -21.824 1.00 1.00 H new ATOM 0 HA ASP A 17 13.820 -6.875 -24.248 1.00 1.00 H new ATOM 0 HB2 ASP A 17 13.775 -8.952 -22.010 1.00 1.00 H new ATOM 0 HB3 ASP A 17 12.595 -8.851 -23.301 1.00 1.00 H new ATOM 269 N ILE A 18 13.422 -5.540 -21.439 1.00 1.00 N ATOM 270 CA ILE A 18 12.569 -4.792 -20.528 1.00 1.00 C ATOM 271 C ILE A 18 12.881 -3.302 -20.637 1.00 1.00 C ATOM 272 O ILE A 18 14.007 -2.920 -20.958 1.00 1.00 O ATOM 273 CB ILE A 18 12.785 -5.314 -19.099 1.00 1.00 C ATOM 274 CG1 ILE A 18 12.470 -6.818 -19.043 1.00 1.00 C ATOM 275 CG2 ILE A 18 11.918 -4.545 -18.095 1.00 1.00 C ATOM 276 CD1 ILE A 18 12.803 -7.426 -17.679 1.00 1.00 C ATOM 0 H ILE A 18 14.419 -5.367 -21.309 1.00 1.00 H new ATOM 0 HA ILE A 18 11.520 -4.930 -20.790 1.00 1.00 H new ATOM 0 HB ILE A 18 13.828 -5.157 -18.825 1.00 1.00 H new ATOM 0 HG12 ILE A 18 11.414 -6.975 -19.261 1.00 1.00 H new ATOM 0 HG13 ILE A 18 13.036 -7.335 -19.818 1.00 1.00 H new ATOM 0 HG21 ILE A 18 12.091 -4.935 -17.092 1.00 1.00 H new ATOM 0 HG22 ILE A 18 12.180 -3.487 -18.123 1.00 1.00 H new ATOM 0 HG23 ILE A 18 10.866 -4.666 -18.355 1.00 1.00 H new ATOM 0 HD11 ILE A 18 12.564 -8.489 -17.687 1.00 1.00 H new ATOM 0 HD12 ILE A 18 13.865 -7.294 -17.471 1.00 1.00 H new ATOM 0 HD13 ILE A 18 12.218 -6.928 -16.906 1.00 1.00 H new ATOM 288 N THR A 19 11.879 -2.459 -20.367 1.00 1.00 N ATOM 289 CA THR A 19 12.034 -1.013 -20.368 1.00 1.00 C ATOM 290 C THR A 19 11.331 -0.438 -19.147 1.00 1.00 C ATOM 291 O THR A 19 10.216 -0.844 -18.828 1.00 1.00 O ATOM 292 CB THR A 19 11.438 -0.421 -21.647 1.00 1.00 C ATOM 293 OG1 THR A 19 11.989 -1.053 -22.782 1.00 1.00 O ATOM 294 CG2 THR A 19 11.723 1.076 -21.740 1.00 1.00 C ATOM 0 H THR A 19 10.934 -2.770 -20.141 1.00 1.00 H new ATOM 0 HA THR A 19 13.093 -0.759 -20.332 1.00 1.00 H new ATOM 0 HB THR A 19 10.361 -0.583 -21.614 1.00 1.00 H new ATOM 0 HG1 THR A 19 11.599 -0.666 -23.594 1.00 1.00 H new ATOM 0 HG21 THR A 19 11.289 1.473 -22.658 1.00 1.00 H new ATOM 0 HG22 THR A 19 11.284 1.584 -20.882 1.00 1.00 H new ATOM 0 HG23 THR A 19 12.800 1.242 -21.747 1.00 1.00 H new ATOM 302 N ILE A 20 11.985 0.506 -18.468 1.00 1.00 N ATOM 303 CA ILE A 20 11.450 1.143 -17.272 1.00 1.00 C ATOM 304 C ILE A 20 11.366 2.648 -17.515 1.00 1.00 C ATOM 305 O ILE A 20 12.288 3.391 -17.185 1.00 1.00 O ATOM 306 CB ILE A 20 12.312 0.819 -16.043 1.00 1.00 C ATOM 307 CG1 ILE A 20 12.729 -0.657 -15.954 1.00 1.00 C ATOM 308 CG2 ILE A 20 11.558 1.236 -14.779 1.00 1.00 C ATOM 309 CD1 ILE A 20 11.552 -1.617 -15.803 1.00 1.00 C ATOM 0 H ILE A 20 12.907 0.850 -18.738 1.00 1.00 H new ATOM 0 HA ILE A 20 10.451 0.757 -17.066 1.00 1.00 H new ATOM 0 HB ILE A 20 13.239 1.384 -16.142 1.00 1.00 H new ATOM 0 HG12 ILE A 20 13.290 -0.922 -16.850 1.00 1.00 H new ATOM 0 HG13 ILE A 20 13.402 -0.785 -15.107 1.00 1.00 H new ATOM 0 HG21 ILE A 20 12.164 1.009 -13.902 1.00 1.00 H new ATOM 0 HG22 ILE A 20 11.355 2.306 -14.813 1.00 1.00 H new ATOM 0 HG23 ILE A 20 10.616 0.690 -14.720 1.00 1.00 H new ATOM 0 HD11 ILE A 20 11.922 -2.641 -15.747 1.00 1.00 H new ATOM 0 HD12 ILE A 20 11.003 -1.379 -14.892 1.00 1.00 H new ATOM 0 HD13 ILE A 20 10.889 -1.518 -16.663 1.00 1.00 H new ATOM 321 N THR A 21 10.252 3.098 -18.095 1.00 1.00 N ATOM 322 CA THR A 21 10.042 4.504 -18.407 1.00 1.00 C ATOM 323 C THR A 21 9.709 5.287 -17.139 1.00 1.00 C ATOM 324 O THR A 21 9.195 4.721 -16.176 1.00 1.00 O ATOM 325 CB THR A 21 8.901 4.616 -19.426 1.00 1.00 C ATOM 326 OG1 THR A 21 9.184 3.791 -20.535 1.00 1.00 O ATOM 327 CG2 THR A 21 8.730 6.046 -19.938 1.00 1.00 C ATOM 0 H THR A 21 9.473 2.495 -18.360 1.00 1.00 H new ATOM 0 HA THR A 21 10.953 4.927 -18.831 1.00 1.00 H new ATOM 0 HB THR A 21 7.984 4.310 -18.923 1.00 1.00 H new ATOM 0 HG1 THR A 21 8.456 3.859 -21.188 1.00 1.00 H new ATOM 0 HG21 THR A 21 7.912 6.080 -20.657 1.00 1.00 H new ATOM 0 HG22 THR A 21 8.505 6.708 -19.101 1.00 1.00 H new ATOM 0 HG23 THR A 21 9.651 6.372 -20.421 1.00 1.00 H new ATOM 335 N ILE A 22 9.999 6.591 -17.141 1.00 1.00 N ATOM 336 CA ILE A 22 9.646 7.495 -16.053 1.00 1.00 C ATOM 337 C ILE A 22 8.663 8.529 -16.597 1.00 1.00 C ATOM 338 O ILE A 22 9.050 9.519 -17.214 1.00 1.00 O ATOM 339 CB ILE A 22 10.903 8.099 -15.404 1.00 1.00 C ATOM 340 CG1 ILE A 22 10.558 9.230 -14.431 1.00 1.00 C ATOM 341 CG2 ILE A 22 11.897 8.630 -16.436 1.00 1.00 C ATOM 342 CD1 ILE A 22 9.656 8.741 -13.303 1.00 1.00 C ATOM 0 H ILE A 22 10.491 7.049 -17.908 1.00 1.00 H new ATOM 0 HA ILE A 22 9.151 6.959 -15.243 1.00 1.00 H new ATOM 0 HB ILE A 22 11.367 7.278 -14.857 1.00 1.00 H new ATOM 0 HG12 ILE A 22 11.475 9.643 -14.012 1.00 1.00 H new ATOM 0 HG13 ILE A 22 10.063 10.037 -14.971 1.00 1.00 H new ATOM 0 HG21 ILE A 22 12.765 9.045 -15.925 1.00 1.00 H new ATOM 0 HG22 ILE A 22 12.214 7.816 -17.088 1.00 1.00 H new ATOM 0 HG23 ILE A 22 11.421 9.408 -17.033 1.00 1.00 H new ATOM 0 HD11 ILE A 22 9.431 9.570 -12.632 1.00 1.00 H new ATOM 0 HD12 ILE A 22 8.728 8.352 -13.722 1.00 1.00 H new ATOM 0 HD13 ILE A 22 10.163 7.952 -12.748 1.00 1.00 H new ATOM 354 N LEU A 23 7.371 8.286 -16.362 1.00 1.00 N ATOM 355 CA LEU A 23 6.303 9.095 -16.924 1.00 1.00 C ATOM 356 C LEU A 23 6.249 10.463 -16.252 1.00 1.00 C ATOM 357 O LEU A 23 5.767 11.418 -16.856 1.00 1.00 O ATOM 358 CB LEU A 23 4.959 8.373 -16.780 1.00 1.00 C ATOM 359 CG LEU A 23 4.976 6.973 -17.405 1.00 1.00 C ATOM 360 CD1 LEU A 23 3.567 6.383 -17.375 1.00 1.00 C ATOM 361 CD2 LEU A 23 5.441 7.018 -18.859 1.00 1.00 C ATOM 0 H LEU A 23 7.042 7.520 -15.775 1.00 1.00 H new ATOM 0 HA LEU A 23 6.507 9.246 -17.984 1.00 1.00 H new ATOM 0 HB2 LEU A 23 4.705 8.293 -15.723 1.00 1.00 H new ATOM 0 HB3 LEU A 23 4.178 8.969 -17.252 1.00 1.00 H new ATOM 0 HG LEU A 23 5.668 6.361 -16.827 1.00 1.00 H new ATOM 0 HD11 LEU A 23 3.580 5.388 -17.819 1.00 1.00 H new ATOM 0 HD12 LEU A 23 3.223 6.315 -16.343 1.00 1.00 H new ATOM 0 HD13 LEU A 23 2.892 7.025 -17.941 1.00 1.00 H new ATOM 0 HD21 LEU A 23 5.442 6.009 -19.272 1.00 1.00 H new ATOM 0 HD22 LEU A 23 4.765 7.647 -19.438 1.00 1.00 H new ATOM 0 HD23 LEU A 23 6.449 7.430 -18.906 1.00 1.00 H new ATOM 373 N GLY A 24 6.738 10.563 -15.011 1.00 1.00 N ATOM 374 CA GLY A 24 6.918 11.867 -14.391 1.00 1.00 C ATOM 375 C GLY A 24 6.727 11.864 -12.882 1.00 1.00 C ATOM 376 O GLY A 24 6.310 10.869 -12.289 1.00 1.00 O ATOM 0 H GLY A 24 7.010 9.769 -14.431 1.00 1.00 H new ATOM 0 HA2 GLY A 24 7.919 12.232 -14.620 1.00 1.00 H new ATOM 0 HA3 GLY A 24 6.213 12.570 -14.835 1.00 1.00 H new ATOM 380 N VAL A 25 7.040 13.009 -12.271 1.00 1.00 N ATOM 381 CA VAL A 25 6.874 13.215 -10.842 1.00 1.00 C ATOM 382 C VAL A 25 5.395 13.378 -10.504 1.00 1.00 C ATOM 383 O VAL A 25 4.578 13.672 -11.377 1.00 1.00 O ATOM 384 CB VAL A 25 7.663 14.454 -10.393 1.00 1.00 C ATOM 385 CG1 VAL A 25 9.152 14.288 -10.706 1.00 1.00 C ATOM 386 CG2 VAL A 25 7.157 15.723 -11.083 1.00 1.00 C ATOM 0 H VAL A 25 7.417 13.820 -12.762 1.00 1.00 H new ATOM 0 HA VAL A 25 7.259 12.344 -10.312 1.00 1.00 H new ATOM 0 HB VAL A 25 7.517 14.552 -9.317 1.00 1.00 H new ATOM 0 HG11 VAL A 25 9.693 15.176 -10.380 1.00 1.00 H new ATOM 0 HG12 VAL A 25 9.539 13.414 -10.181 1.00 1.00 H new ATOM 0 HG13 VAL A 25 9.285 14.155 -11.780 1.00 1.00 H new ATOM 0 HG21 VAL A 25 7.738 16.579 -10.741 1.00 1.00 H new ATOM 0 HG22 VAL A 25 7.266 15.618 -12.162 1.00 1.00 H new ATOM 0 HG23 VAL A 25 6.106 15.876 -10.837 1.00 1.00 H new ATOM 396 N SER A 26 5.060 13.185 -9.228 1.00 1.00 N ATOM 397 CA SER A 26 3.705 13.304 -8.709 1.00 1.00 C ATOM 398 C SER A 26 3.774 13.777 -7.259 1.00 1.00 C ATOM 399 O SER A 26 3.036 13.295 -6.401 1.00 1.00 O ATOM 400 CB SER A 26 2.991 11.955 -8.819 1.00 1.00 C ATOM 401 OG SER A 26 2.875 11.561 -10.171 1.00 1.00 O ATOM 0 H SER A 26 5.743 12.936 -8.513 1.00 1.00 H new ATOM 0 HA SER A 26 3.138 14.032 -9.290 1.00 1.00 H new ATOM 0 HB2 SER A 26 3.543 11.199 -8.261 1.00 1.00 H new ATOM 0 HB3 SER A 26 2.001 12.024 -8.369 1.00 1.00 H new ATOM 0 HG SER A 26 2.418 10.696 -10.221 1.00 1.00 H new ATOM 407 N GLY A 27 4.670 14.732 -6.986 1.00 1.00 N ATOM 408 CA GLY A 27 4.905 15.237 -5.642 1.00 1.00 C ATOM 409 C GLY A 27 5.749 14.232 -4.870 1.00 1.00 C ATOM 410 O GLY A 27 6.836 13.866 -5.314 1.00 1.00 O ATOM 0 H GLY A 27 5.251 15.174 -7.698 1.00 1.00 H new ATOM 0 HA2 GLY A 27 5.414 16.200 -5.686 1.00 1.00 H new ATOM 0 HA3 GLY A 27 3.956 15.401 -5.131 1.00 1.00 H new ATOM 414 N GLN A 28 5.252 13.785 -3.716 1.00 1.00 N ATOM 415 CA GLN A 28 5.906 12.739 -2.945 1.00 1.00 C ATOM 416 C GLN A 28 5.774 11.388 -3.659 1.00 1.00 C ATOM 417 O GLN A 28 6.304 10.383 -3.187 1.00 1.00 O ATOM 418 CB GLN A 28 5.277 12.691 -1.550 1.00 1.00 C ATOM 419 CG GLN A 28 6.171 11.976 -0.532 1.00 1.00 C ATOM 420 CD GLN A 28 7.467 12.740 -0.290 1.00 1.00 C ATOM 421 OE1 GLN A 28 8.552 12.248 -0.585 1.00 1.00 O ATOM 422 NE2 GLN A 28 7.366 13.953 0.249 1.00 1.00 N ATOM 0 H GLN A 28 4.392 14.137 -3.296 1.00 1.00 H new ATOM 0 HA GLN A 28 6.970 12.956 -2.850 1.00 1.00 H new ATOM 0 HB2 GLN A 28 5.081 13.707 -1.207 1.00 1.00 H new ATOM 0 HB3 GLN A 28 4.315 12.182 -1.605 1.00 1.00 H new ATOM 0 HG2 GLN A 28 5.633 11.863 0.409 1.00 1.00 H new ATOM 0 HG3 GLN A 28 6.401 10.973 -0.890 1.00 1.00 H new ATOM 0 HE21 GLN A 28 6.448 14.333 0.482 1.00 1.00 H new ATOM 0 HE22 GLN A 28 8.206 14.503 0.429 1.00 1.00 H new ATOM 431 N GLN A 29 5.067 11.358 -4.796 1.00 1.00 N ATOM 432 CA GLN A 29 4.877 10.143 -5.569 1.00 1.00 C ATOM 433 C GLN A 29 5.579 10.260 -6.921 1.00 1.00 C ATOM 434 O GLN A 29 6.005 11.347 -7.311 1.00 1.00 O ATOM 435 CB GLN A 29 3.383 9.859 -5.746 1.00 1.00 C ATOM 436 CG GLN A 29 2.610 9.980 -4.433 1.00 1.00 C ATOM 437 CD GLN A 29 1.154 9.603 -4.637 1.00 1.00 C ATOM 438 OE1 GLN A 29 0.696 8.565 -4.170 1.00 1.00 O ATOM 439 NE2 GLN A 29 0.412 10.446 -5.343 1.00 1.00 N ATOM 0 H GLN A 29 4.615 12.179 -5.198 1.00 1.00 H new ATOM 0 HA GLN A 29 5.321 9.306 -5.030 1.00 1.00 H new ATOM 0 HB2 GLN A 29 2.967 10.554 -6.475 1.00 1.00 H new ATOM 0 HB3 GLN A 29 3.252 8.856 -6.151 1.00 1.00 H new ATOM 0 HG2 GLN A 29 3.058 9.332 -3.680 1.00 1.00 H new ATOM 0 HG3 GLN A 29 2.678 11.001 -4.057 1.00 1.00 H new ATOM 0 HE21 GLN A 29 0.826 11.300 -5.716 1.00 1.00 H new ATOM 0 HE22 GLN A 29 -0.573 10.240 -5.512 1.00 1.00 H new ATOM 448 N VAL A 30 5.699 9.138 -7.639 1.00 1.00 N ATOM 449 CA VAL A 30 6.369 9.078 -8.931 1.00 1.00 C ATOM 450 C VAL A 30 5.712 8.012 -9.803 1.00 1.00 C ATOM 451 O VAL A 30 5.598 6.857 -9.389 1.00 1.00 O ATOM 452 CB VAL A 30 7.849 8.732 -8.728 1.00 1.00 C ATOM 453 CG1 VAL A 30 8.542 8.563 -10.078 1.00 1.00 C ATOM 454 CG2 VAL A 30 8.579 9.834 -7.959 1.00 1.00 C ATOM 0 H VAL A 30 5.328 8.239 -7.331 1.00 1.00 H new ATOM 0 HA VAL A 30 6.287 10.047 -9.423 1.00 1.00 H new ATOM 0 HB VAL A 30 7.887 7.804 -8.157 1.00 1.00 H new ATOM 0 HG11 VAL A 30 9.592 8.318 -9.920 1.00 1.00 H new ATOM 0 HG12 VAL A 30 8.061 7.759 -10.636 1.00 1.00 H new ATOM 0 HG13 VAL A 30 8.468 9.492 -10.644 1.00 1.00 H new ATOM 0 HG21 VAL A 30 9.626 9.557 -7.832 1.00 1.00 H new ATOM 0 HG22 VAL A 30 8.516 10.769 -8.515 1.00 1.00 H new ATOM 0 HG23 VAL A 30 8.117 9.962 -6.980 1.00 1.00 H new ATOM 464 N ARG A 31 5.278 8.395 -11.010 1.00 1.00 N ATOM 465 CA ARG A 31 4.681 7.458 -11.952 1.00 1.00 C ATOM 466 C ARG A 31 5.750 6.877 -12.872 1.00 1.00 C ATOM 467 O ARG A 31 6.342 7.594 -13.683 1.00 1.00 O ATOM 468 CB ARG A 31 3.557 8.123 -12.745 1.00 1.00 C ATOM 469 CG ARG A 31 2.917 7.080 -13.662 1.00 1.00 C ATOM 470 CD ARG A 31 1.640 7.612 -14.313 1.00 1.00 C ATOM 471 NE ARG A 31 0.544 7.666 -13.339 1.00 1.00 N ATOM 472 CZ ARG A 31 -0.751 7.768 -13.650 1.00 1.00 C ATOM 473 NH1 ARG A 31 -1.157 7.839 -14.916 1.00 1.00 N ATOM 474 NH2 ARG A 31 -1.661 7.800 -12.681 1.00 1.00 N ATOM 0 H ARG A 31 5.332 9.354 -11.353 1.00 1.00 H new ATOM 0 HA ARG A 31 4.239 6.635 -11.391 1.00 1.00 H new ATOM 0 HB2 ARG A 31 2.811 8.538 -12.067 1.00 1.00 H new ATOM 0 HB3 ARG A 31 3.950 8.952 -13.333 1.00 1.00 H new ATOM 0 HG2 ARG A 31 3.627 6.790 -14.436 1.00 1.00 H new ATOM 0 HG3 ARG A 31 2.687 6.182 -13.088 1.00 1.00 H new ATOM 0 HD2 ARG A 31 1.821 8.607 -14.720 1.00 1.00 H new ATOM 0 HD3 ARG A 31 1.359 6.972 -15.149 1.00 1.00 H new ATOM 0 HE ARG A 31 0.789 7.622 -12.350 1.00 1.00 H new ATOM 0 HH11 ARG A 31 -0.474 7.816 -15.673 1.00 1.00 H new ATOM 0 HH12 ARG A 31 -2.151 7.916 -15.129 1.00 1.00 H new ATOM 0 HH21 ARG A 31 -1.369 7.747 -11.705 1.00 1.00 H new ATOM 0 HH22 ARG A 31 -2.651 7.878 -12.914 1.00 1.00 H new ATOM 488 N ILE A 32 5.979 5.570 -12.725 1.00 1.00 N ATOM 489 CA ILE A 32 6.935 4.786 -13.496 1.00 1.00 C ATOM 490 C ILE A 32 6.160 3.806 -14.383 1.00 1.00 C ATOM 491 O ILE A 32 5.014 3.473 -14.085 1.00 1.00 O ATOM 492 CB ILE A 32 7.872 4.050 -12.522 1.00 1.00 C ATOM 493 CG1 ILE A 32 8.538 5.064 -11.580 1.00 1.00 C ATOM 494 CG2 ILE A 32 8.950 3.259 -13.270 1.00 1.00 C ATOM 495 CD1 ILE A 32 9.413 4.390 -10.521 1.00 1.00 C ATOM 0 H ILE A 32 5.480 5.009 -12.035 1.00 1.00 H new ATOM 0 HA ILE A 32 7.543 5.424 -14.137 1.00 1.00 H new ATOM 0 HB ILE A 32 7.273 3.345 -11.946 1.00 1.00 H new ATOM 0 HG12 ILE A 32 9.147 5.754 -12.165 1.00 1.00 H new ATOM 0 HG13 ILE A 32 7.768 5.658 -11.087 1.00 1.00 H new ATOM 0 HG21 ILE A 32 9.594 2.752 -12.551 1.00 1.00 H new ATOM 0 HG22 ILE A 32 8.476 2.521 -13.917 1.00 1.00 H new ATOM 0 HG23 ILE A 32 9.548 3.941 -13.875 1.00 1.00 H new ATOM 0 HD11 ILE A 32 9.861 5.150 -9.881 1.00 1.00 H new ATOM 0 HD12 ILE A 32 8.801 3.721 -9.916 1.00 1.00 H new ATOM 0 HD13 ILE A 32 10.201 3.818 -11.011 1.00 1.00 H new ATOM 507 N GLY A 33 6.776 3.341 -15.474 1.00 1.00 N ATOM 508 CA GLY A 33 6.148 2.429 -16.419 1.00 1.00 C ATOM 509 C GLY A 33 7.050 1.233 -16.699 1.00 1.00 C ATOM 510 O GLY A 33 8.021 1.352 -17.443 1.00 1.00 O ATOM 0 H GLY A 33 7.733 3.593 -15.723 1.00 1.00 H new ATOM 0 HA2 GLY A 33 5.194 2.085 -16.020 1.00 1.00 H new ATOM 0 HA3 GLY A 33 5.933 2.954 -17.350 1.00 1.00 H new ATOM 514 N ILE A 34 6.730 0.078 -16.105 1.00 1.00 N ATOM 515 CA ILE A 34 7.522 -1.132 -16.255 1.00 1.00 C ATOM 516 C ILE A 34 6.978 -1.915 -17.445 1.00 1.00 C ATOM 517 O ILE A 34 5.809 -2.296 -17.449 1.00 1.00 O ATOM 518 CB ILE A 34 7.451 -1.987 -14.980 1.00 1.00 C ATOM 519 CG1 ILE A 34 8.073 -1.296 -13.757 1.00 1.00 C ATOM 520 CG2 ILE A 34 8.228 -3.285 -15.219 1.00 1.00 C ATOM 521 CD1 ILE A 34 7.163 -0.236 -13.129 1.00 1.00 C ATOM 0 H ILE A 34 5.912 -0.037 -15.507 1.00 1.00 H new ATOM 0 HA ILE A 34 8.567 -0.870 -16.423 1.00 1.00 H new ATOM 0 HB ILE A 34 6.396 -2.162 -14.771 1.00 1.00 H new ATOM 0 HG12 ILE A 34 8.313 -2.049 -13.006 1.00 1.00 H new ATOM 0 HG13 ILE A 34 9.013 -0.829 -14.052 1.00 1.00 H new ATOM 0 HG21 ILE A 34 8.187 -3.904 -14.323 1.00 1.00 H new ATOM 0 HG22 ILE A 34 7.784 -3.827 -16.054 1.00 1.00 H new ATOM 0 HG23 ILE A 34 9.267 -3.050 -15.451 1.00 1.00 H new ATOM 0 HD11 ILE A 34 7.664 0.212 -12.271 1.00 1.00 H new ATOM 0 HD12 ILE A 34 6.943 0.537 -13.865 1.00 1.00 H new ATOM 0 HD13 ILE A 34 6.233 -0.702 -12.804 1.00 1.00 H new ATOM 533 N ASN A 35 7.811 -2.160 -18.458 1.00 1.00 N ATOM 534 CA ASN A 35 7.385 -2.865 -19.655 1.00 1.00 C ATOM 535 C ASN A 35 8.268 -4.078 -19.913 1.00 1.00 C ATOM 536 O ASN A 35 9.427 -3.949 -20.300 1.00 1.00 O ATOM 537 CB ASN A 35 7.380 -1.905 -20.842 1.00 1.00 C ATOM 538 CG ASN A 35 6.745 -2.549 -22.063 1.00 1.00 C ATOM 539 OD1 ASN A 35 5.557 -2.858 -22.056 1.00 1.00 O ATOM 540 ND2 ASN A 35 7.526 -2.756 -23.120 1.00 1.00 N ATOM 0 H ASN A 35 8.791 -1.876 -18.467 1.00 1.00 H new ATOM 0 HA ASN A 35 6.370 -3.235 -19.511 1.00 1.00 H new ATOM 0 HB2 ASN A 35 6.834 -0.999 -20.579 1.00 1.00 H new ATOM 0 HB3 ASN A 35 8.402 -1.605 -21.075 1.00 1.00 H new ATOM 0 HD21 ASN A 35 7.142 -3.185 -23.962 1.00 1.00 H new ATOM 0 HD22 ASN A 35 8.509 -2.486 -23.088 1.00 1.00 H new ATOM 547 N ALA A 36 7.692 -5.257 -19.688 1.00 1.00 N ATOM 548 CA ALA A 36 8.342 -6.551 -19.833 1.00 1.00 C ATOM 549 C ALA A 36 7.341 -7.540 -20.434 1.00 1.00 C ATOM 550 O ALA A 36 6.132 -7.329 -20.327 1.00 1.00 O ATOM 551 CB ALA A 36 8.783 -7.016 -18.446 1.00 1.00 C ATOM 0 H ALA A 36 6.720 -5.337 -19.388 1.00 1.00 H new ATOM 0 HA ALA A 36 9.210 -6.485 -20.490 1.00 1.00 H new ATOM 0 HB1 ALA A 36 9.274 -7.986 -18.526 1.00 1.00 H new ATOM 0 HB2 ALA A 36 9.478 -6.291 -18.023 1.00 1.00 H new ATOM 0 HB3 ALA A 36 7.911 -7.104 -17.797 1.00 1.00 H new ATOM 557 N PRO A 37 7.817 -8.620 -21.065 1.00 1.00 N ATOM 558 CA PRO A 37 6.954 -9.649 -21.616 1.00 1.00 C ATOM 559 C PRO A 37 6.359 -10.492 -20.492 1.00 1.00 C ATOM 560 O PRO A 37 6.836 -10.455 -19.359 1.00 1.00 O ATOM 561 CB PRO A 37 7.869 -10.483 -22.511 1.00 1.00 C ATOM 562 CG PRO A 37 9.227 -10.363 -21.820 1.00 1.00 C ATOM 563 CD PRO A 37 9.214 -8.928 -21.296 1.00 1.00 C ATOM 0 HA PRO A 37 6.111 -9.240 -22.173 1.00 1.00 H new ATOM 0 HB2 PRO A 37 7.538 -11.520 -22.573 1.00 1.00 H new ATOM 0 HB3 PRO A 37 7.899 -10.097 -23.530 1.00 1.00 H new ATOM 0 HG2 PRO A 37 9.336 -11.087 -21.013 1.00 1.00 H new ATOM 0 HG3 PRO A 37 10.050 -10.533 -22.514 1.00 1.00 H new ATOM 0 HD2 PRO A 37 9.794 -8.839 -20.377 1.00 1.00 H new ATOM 0 HD3 PRO A 37 9.654 -8.241 -22.019 1.00 1.00 H new ATOM 571 N LYS A 38 5.309 -11.261 -20.796 1.00 1.00 N ATOM 572 CA LYS A 38 4.671 -12.136 -19.819 1.00 1.00 C ATOM 573 C LYS A 38 5.562 -13.331 -19.469 1.00 1.00 C ATOM 574 O LYS A 38 5.170 -14.175 -18.667 1.00 1.00 O ATOM 575 CB LYS A 38 3.306 -12.587 -20.346 1.00 1.00 C ATOM 576 CG LYS A 38 2.280 -11.456 -20.224 1.00 1.00 C ATOM 577 CD LYS A 38 1.859 -11.267 -18.764 1.00 1.00 C ATOM 578 CE LYS A 38 0.851 -10.126 -18.631 1.00 1.00 C ATOM 579 NZ LYS A 38 -0.405 -10.417 -19.347 1.00 1.00 N ATOM 0 H LYS A 38 4.882 -11.292 -21.722 1.00 1.00 H new ATOM 0 HA LYS A 38 4.521 -11.577 -18.895 1.00 1.00 H new ATOM 0 HB2 LYS A 38 3.396 -12.893 -21.388 1.00 1.00 H new ATOM 0 HB3 LYS A 38 2.964 -13.458 -19.787 1.00 1.00 H new ATOM 0 HG2 LYS A 38 2.705 -10.529 -20.609 1.00 1.00 H new ATOM 0 HG3 LYS A 38 1.406 -11.683 -20.834 1.00 1.00 H new ATOM 0 HD2 LYS A 38 1.421 -12.190 -18.385 1.00 1.00 H new ATOM 0 HD3 LYS A 38 2.736 -11.056 -18.153 1.00 1.00 H new ATOM 0 HE2 LYS A 38 0.636 -9.952 -17.577 1.00 1.00 H new ATOM 0 HE3 LYS A 38 1.288 -9.208 -19.023 1.00 1.00 H new ATOM 0 HZ1 LYS A 38 -1.130 -9.725 -19.071 1.00 1.00 H new ATOM 0 HZ2 LYS A 38 -0.242 -10.357 -20.372 1.00 1.00 H new ATOM 0 HZ3 LYS A 38 -0.730 -11.375 -19.103 1.00 1.00 H new ATOM 593 N ASP A 39 6.756 -13.408 -20.064 1.00 1.00 N ATOM 594 CA ASP A 39 7.747 -14.418 -19.721 1.00 1.00 C ATOM 595 C ASP A 39 8.341 -14.127 -18.342 1.00 1.00 C ATOM 596 O ASP A 39 9.058 -14.959 -17.789 1.00 1.00 O ATOM 597 CB ASP A 39 8.853 -14.418 -20.774 1.00 1.00 C ATOM 598 CG ASP A 39 8.343 -14.938 -22.116 1.00 1.00 C ATOM 599 OD1 ASP A 39 8.231 -16.178 -22.249 1.00 1.00 O ATOM 600 OD2 ASP A 39 8.068 -14.095 -22.998 1.00 1.00 O ATOM 0 H ASP A 39 7.058 -12.768 -20.798 1.00 1.00 H new ATOM 0 HA ASP A 39 7.269 -15.397 -19.695 1.00 1.00 H new ATOM 0 HB2 ASP A 39 9.240 -13.407 -20.897 1.00 1.00 H new ATOM 0 HB3 ASP A 39 9.682 -15.038 -20.433 1.00 1.00 H new ATOM 605 N VAL A 40 8.044 -12.944 -17.792 1.00 1.00 N ATOM 606 CA VAL A 40 8.500 -12.524 -16.477 1.00 1.00 C ATOM 607 C VAL A 40 7.354 -11.846 -15.731 1.00 1.00 C ATOM 608 O VAL A 40 6.294 -11.589 -16.305 1.00 1.00 O ATOM 609 CB VAL A 40 9.707 -11.583 -16.606 1.00 1.00 C ATOM 610 CG1 VAL A 40 10.831 -12.223 -17.420 1.00 1.00 C ATOM 611 CG2 VAL A 40 9.333 -10.280 -17.304 1.00 1.00 C ATOM 0 H VAL A 40 7.469 -12.245 -18.263 1.00 1.00 H new ATOM 0 HA VAL A 40 8.817 -13.398 -15.908 1.00 1.00 H new ATOM 0 HB VAL A 40 10.039 -11.384 -15.587 1.00 1.00 H new ATOM 0 HG11 VAL A 40 11.669 -11.530 -17.491 1.00 1.00 H new ATOM 0 HG12 VAL A 40 11.159 -13.139 -16.930 1.00 1.00 H new ATOM 0 HG13 VAL A 40 10.468 -12.457 -18.421 1.00 1.00 H new ATOM 0 HG21 VAL A 40 10.213 -9.641 -17.377 1.00 1.00 H new ATOM 0 HG22 VAL A 40 8.959 -10.498 -18.304 1.00 1.00 H new ATOM 0 HG23 VAL A 40 8.559 -9.769 -16.731 1.00 1.00 H new ATOM 621 N ALA A 41 7.562 -11.550 -14.444 1.00 1.00 N ATOM 622 CA ALA A 41 6.536 -10.928 -13.625 1.00 1.00 C ATOM 623 C ALA A 41 6.983 -9.547 -13.154 1.00 1.00 C ATOM 624 O ALA A 41 8.168 -9.218 -13.202 1.00 1.00 O ATOM 625 CB ALA A 41 6.219 -11.841 -12.442 1.00 1.00 C ATOM 0 H ALA A 41 8.437 -11.735 -13.953 1.00 1.00 H new ATOM 0 HA ALA A 41 5.632 -10.790 -14.218 1.00 1.00 H new ATOM 0 HB1 ALA A 41 5.449 -11.380 -11.823 1.00 1.00 H new ATOM 0 HB2 ALA A 41 5.861 -12.802 -12.810 1.00 1.00 H new ATOM 0 HB3 ALA A 41 7.120 -11.993 -11.848 1.00 1.00 H new ATOM 631 N VAL A 42 6.019 -8.743 -12.696 1.00 1.00 N ATOM 632 CA VAL A 42 6.254 -7.403 -12.179 1.00 1.00 C ATOM 633 C VAL A 42 5.176 -7.068 -11.153 1.00 1.00 C ATOM 634 O VAL A 42 3.994 -6.985 -11.481 1.00 1.00 O ATOM 635 CB VAL A 42 6.307 -6.374 -13.323 1.00 1.00 C ATOM 636 CG1 VAL A 42 5.311 -6.692 -14.436 1.00 1.00 C ATOM 637 CG2 VAL A 42 6.040 -4.954 -12.819 1.00 1.00 C ATOM 0 H VAL A 42 5.036 -9.016 -12.676 1.00 1.00 H new ATOM 0 HA VAL A 42 7.224 -7.365 -11.684 1.00 1.00 H new ATOM 0 HB VAL A 42 7.318 -6.434 -13.726 1.00 1.00 H new ATOM 0 HG11 VAL A 42 5.387 -5.937 -15.219 1.00 1.00 H new ATOM 0 HG12 VAL A 42 5.534 -7.673 -14.855 1.00 1.00 H new ATOM 0 HG13 VAL A 42 4.299 -6.693 -14.030 1.00 1.00 H new ATOM 0 HG21 VAL A 42 6.086 -4.256 -13.655 1.00 1.00 H new ATOM 0 HG22 VAL A 42 5.051 -4.910 -12.363 1.00 1.00 H new ATOM 0 HG23 VAL A 42 6.793 -4.683 -12.079 1.00 1.00 H new ATOM 647 N HIS A 43 5.597 -6.874 -9.902 1.00 1.00 N ATOM 648 CA HIS A 43 4.716 -6.491 -8.807 1.00 1.00 C ATOM 649 C HIS A 43 5.428 -5.514 -7.875 1.00 1.00 C ATOM 650 O HIS A 43 6.655 -5.443 -7.864 1.00 1.00 O ATOM 651 CB HIS A 43 4.295 -7.734 -8.013 1.00 1.00 C ATOM 652 CG HIS A 43 3.433 -8.702 -8.782 1.00 1.00 C ATOM 653 ND1 HIS A 43 2.077 -8.882 -8.621 1.00 1.00 N ATOM 654 CD2 HIS A 43 3.854 -9.561 -9.761 1.00 1.00 C ATOM 655 CE1 HIS A 43 1.691 -9.826 -9.497 1.00 1.00 C ATOM 656 NE2 HIS A 43 2.738 -10.270 -10.213 1.00 1.00 N ATOM 0 H HIS A 43 6.572 -6.981 -9.622 1.00 1.00 H new ATOM 0 HA HIS A 43 3.832 -6.010 -9.225 1.00 1.00 H new ATOM 0 HB2 HIS A 43 5.191 -8.254 -7.674 1.00 1.00 H new ATOM 0 HB3 HIS A 43 3.755 -7.415 -7.121 1.00 1.00 H new ATOM 0 HD2 HIS A 43 4.867 -9.671 -10.120 1.00 1.00 H new ATOM 0 HE1 HIS A 43 0.677 -10.180 -9.610 1.00 1.00 H new ATOM 0 HE2 HIS A 43 2.721 -10.983 -10.942 1.00 1.00 H new ATOM 664 N ARG A 44 4.656 -4.758 -7.089 1.00 1.00 N ATOM 665 CA ARG A 44 5.207 -3.863 -6.078 1.00 1.00 C ATOM 666 C ARG A 44 5.547 -4.664 -4.819 1.00 1.00 C ATOM 667 O ARG A 44 5.142 -5.817 -4.689 1.00 1.00 O ATOM 668 CB ARG A 44 4.206 -2.742 -5.786 1.00 1.00 C ATOM 669 CG ARG A 44 2.921 -3.320 -5.193 1.00 1.00 C ATOM 670 CD ARG A 44 1.883 -2.239 -4.918 1.00 1.00 C ATOM 671 NE ARG A 44 1.131 -1.881 -6.120 1.00 1.00 N ATOM 672 CZ ARG A 44 0.160 -0.966 -6.131 1.00 1.00 C ATOM 673 NH1 ARG A 44 -0.169 -0.300 -5.025 1.00 1.00 N ATOM 674 NH2 ARG A 44 -0.488 -0.719 -7.262 1.00 1.00 N ATOM 0 H ARG A 44 3.637 -4.752 -7.138 1.00 1.00 H new ATOM 0 HA ARG A 44 6.126 -3.403 -6.441 1.00 1.00 H new ATOM 0 HB2 ARG A 44 4.645 -2.025 -5.092 1.00 1.00 H new ATOM 0 HB3 ARG A 44 3.979 -2.199 -6.704 1.00 1.00 H new ATOM 0 HG2 ARG A 44 2.504 -4.057 -5.880 1.00 1.00 H new ATOM 0 HG3 ARG A 44 3.153 -3.844 -4.266 1.00 1.00 H new ATOM 0 HD2 ARG A 44 1.193 -2.587 -4.149 1.00 1.00 H new ATOM 0 HD3 ARG A 44 2.379 -1.352 -4.524 1.00 1.00 H new ATOM 0 HE ARG A 44 1.360 -2.355 -6.994 1.00 1.00 H new ATOM 0 HH11 ARG A 44 0.324 -0.486 -4.152 1.00 1.00 H new ATOM 0 HH12 ARG A 44 -0.914 0.396 -5.052 1.00 1.00 H new ATOM 0 HH21 ARG A 44 -0.242 -1.227 -8.112 1.00 1.00 H new ATOM 0 HH22 ARG A 44 -1.232 -0.022 -7.282 1.00 1.00 H new ATOM 688 N GLU A 45 6.289 -4.065 -3.885 1.00 1.00 N ATOM 689 CA GLU A 45 6.705 -4.758 -2.671 1.00 1.00 C ATOM 690 C GLU A 45 5.503 -5.147 -1.805 1.00 1.00 C ATOM 691 O GLU A 45 5.449 -6.256 -1.277 1.00 1.00 O ATOM 692 CB GLU A 45 7.657 -3.847 -1.891 1.00 1.00 C ATOM 693 CG GLU A 45 8.227 -4.535 -0.650 1.00 1.00 C ATOM 694 CD GLU A 45 9.119 -5.721 -1.020 1.00 1.00 C ATOM 695 OE1 GLU A 45 10.297 -5.471 -1.357 1.00 1.00 O ATOM 696 OE2 GLU A 45 8.618 -6.866 -0.962 1.00 1.00 O ATOM 0 H GLU A 45 6.613 -3.100 -3.949 1.00 1.00 H new ATOM 0 HA GLU A 45 7.213 -5.683 -2.946 1.00 1.00 H new ATOM 0 HB2 GLU A 45 8.475 -3.538 -2.541 1.00 1.00 H new ATOM 0 HB3 GLU A 45 7.128 -2.942 -1.592 1.00 1.00 H new ATOM 0 HG2 GLU A 45 8.802 -3.816 -0.067 1.00 1.00 H new ATOM 0 HG3 GLU A 45 7.409 -4.878 -0.016 1.00 1.00 H new ATOM 703 N GLU A 46 4.537 -4.235 -1.659 1.00 1.00 N ATOM 704 CA GLU A 46 3.357 -4.439 -0.824 1.00 1.00 C ATOM 705 C GLU A 46 2.400 -5.482 -1.405 1.00 1.00 C ATOM 706 O GLU A 46 1.366 -5.774 -0.804 1.00 1.00 O ATOM 707 CB GLU A 46 2.616 -3.110 -0.668 1.00 1.00 C ATOM 708 CG GLU A 46 3.506 -2.050 -0.019 1.00 1.00 C ATOM 709 CD GLU A 46 2.737 -0.744 0.173 1.00 1.00 C ATOM 710 OE1 GLU A 46 2.443 -0.092 -0.853 1.00 1.00 O ATOM 711 OE2 GLU A 46 2.450 -0.409 1.343 1.00 1.00 O ATOM 0 H GLU A 46 4.556 -3.327 -2.123 1.00 1.00 H new ATOM 0 HA GLU A 46 3.700 -4.811 0.142 1.00 1.00 H new ATOM 0 HB2 GLU A 46 2.283 -2.760 -1.645 1.00 1.00 H new ATOM 0 HB3 GLU A 46 1.723 -3.258 -0.062 1.00 1.00 H new ATOM 0 HG2 GLU A 46 3.866 -2.411 0.944 1.00 1.00 H new ATOM 0 HG3 GLU A 46 4.383 -1.873 -0.642 1.00 1.00 H new ATOM 718 N ILE A 47 2.737 -6.045 -2.569 1.00 1.00 N ATOM 719 CA ILE A 47 1.873 -6.957 -3.305 1.00 1.00 C ATOM 720 C ILE A 47 2.616 -8.244 -3.653 1.00 1.00 C ATOM 721 O ILE A 47 1.987 -9.272 -3.893 1.00 1.00 O ATOM 722 CB ILE A 47 1.385 -6.209 -4.549 1.00 1.00 C ATOM 723 CG1 ILE A 47 0.398 -5.101 -4.160 1.00 1.00 C ATOM 724 CG2 ILE A 47 0.752 -7.084 -5.622 1.00 1.00 C ATOM 725 CD1 ILE A 47 -0.961 -5.623 -3.702 1.00 1.00 C ATOM 0 H ILE A 47 3.631 -5.874 -3.028 1.00 1.00 H new ATOM 0 HA ILE A 47 1.017 -7.262 -2.704 1.00 1.00 H new ATOM 0 HB ILE A 47 2.290 -5.792 -4.990 1.00 1.00 H new ATOM 0 HG12 ILE A 47 0.835 -4.501 -3.361 1.00 1.00 H new ATOM 0 HG13 ILE A 47 0.254 -4.439 -5.014 1.00 1.00 H new ATOM 0 HG21 ILE A 47 0.439 -6.462 -6.461 1.00 1.00 H new ATOM 0 HG22 ILE A 47 1.478 -7.820 -5.967 1.00 1.00 H new ATOM 0 HG23 ILE A 47 -0.116 -7.597 -5.208 1.00 1.00 H new ATOM 0 HD11 ILE A 47 -1.605 -4.783 -3.444 1.00 1.00 H new ATOM 0 HD12 ILE A 47 -1.420 -6.198 -4.506 1.00 1.00 H new ATOM 0 HD13 ILE A 47 -0.830 -6.262 -2.828 1.00 1.00 H new ATOM 737 N TYR A 48 3.950 -8.202 -3.684 1.00 1.00 N ATOM 738 CA TYR A 48 4.749 -9.398 -3.887 1.00 1.00 C ATOM 739 C TYR A 48 4.628 -10.318 -2.673 1.00 1.00 C ATOM 740 O TYR A 48 4.555 -11.536 -2.821 1.00 1.00 O ATOM 741 CB TYR A 48 6.207 -8.994 -4.098 1.00 1.00 C ATOM 742 CG TYR A 48 7.158 -10.167 -4.051 1.00 1.00 C ATOM 743 CD1 TYR A 48 7.190 -11.092 -5.105 1.00 1.00 C ATOM 744 CD2 TYR A 48 8.004 -10.330 -2.943 1.00 1.00 C ATOM 745 CE1 TYR A 48 8.063 -12.188 -5.049 1.00 1.00 C ATOM 746 CE2 TYR A 48 8.878 -11.422 -2.880 1.00 1.00 C ATOM 747 CZ TYR A 48 8.910 -12.358 -3.934 1.00 1.00 C ATOM 748 OH TYR A 48 9.758 -13.424 -3.877 1.00 1.00 O ATOM 0 H TYR A 48 4.495 -7.347 -3.570 1.00 1.00 H new ATOM 0 HA TYR A 48 4.390 -9.934 -4.766 1.00 1.00 H new ATOM 0 HB2 TYR A 48 6.304 -8.494 -5.061 1.00 1.00 H new ATOM 0 HB3 TYR A 48 6.492 -8.271 -3.333 1.00 1.00 H new ATOM 0 HD1 TYR A 48 6.543 -10.960 -5.959 1.00 1.00 H new ATOM 0 HD2 TYR A 48 7.981 -9.611 -2.137 1.00 1.00 H new ATOM 0 HE1 TYR A 48 8.087 -12.902 -5.859 1.00 1.00 H new ATOM 0 HE2 TYR A 48 9.527 -11.547 -2.026 1.00 1.00 H new ATOM 0 HH TYR A 48 10.271 -13.390 -3.043 1.00 1.00 H new ATOM 846 N MET B 1 2.622 -2.482 -21.210 1.00 1.00 N ATOM 847 CA MET B 1 3.301 -1.833 -20.072 1.00 1.00 C ATOM 848 C MET B 1 2.442 -1.924 -18.817 1.00 1.00 C ATOM 849 O MET B 1 1.218 -1.930 -18.908 1.00 1.00 O ATOM 850 CB MET B 1 3.630 -0.376 -20.412 1.00 1.00 C ATOM 851 CG MET B 1 4.404 0.317 -19.294 1.00 1.00 C ATOM 852 SD MET B 1 5.279 1.818 -19.816 1.00 1.00 S ATOM 853 CE MET B 1 3.907 2.789 -20.495 1.00 1.00 C ATOM 0 H1 MET B 1 3.332 -2.837 -21.881 1.00 1.00 H new ATOM 0 H2 MET B 1 2.046 -3.275 -20.864 1.00 1.00 H new ATOM 0 H3 MET B 1 2.009 -1.791 -21.688 1.00 1.00 H new ATOM 0 HA MET B 1 4.237 -2.355 -19.876 1.00 1.00 H new ATOM 0 HB2 MET B 1 4.215 -0.343 -21.331 1.00 1.00 H new ATOM 0 HB3 MET B 1 2.705 0.168 -20.603 1.00 1.00 H new ATOM 0 HG2 MET B 1 3.711 0.574 -18.493 1.00 1.00 H new ATOM 0 HG3 MET B 1 5.126 -0.385 -18.878 1.00 1.00 H new ATOM 0 HE1 MET B 1 4.286 3.738 -20.876 1.00 1.00 H new ATOM 0 HE2 MET B 1 3.436 2.235 -21.307 1.00 1.00 H new ATOM 0 HE3 MET B 1 3.173 2.979 -19.712 1.00 1.00 H new ATOM 865 N LEU B 2 3.089 -1.992 -17.650 1.00 1.00 N ATOM 866 CA LEU B 2 2.421 -2.020 -16.360 1.00 1.00 C ATOM 867 C LEU B 2 2.803 -0.754 -15.597 1.00 1.00 C ATOM 868 O LEU B 2 3.849 -0.694 -14.952 1.00 1.00 O ATOM 869 CB LEU B 2 2.831 -3.275 -15.578 1.00 1.00 C ATOM 870 CG LEU B 2 1.756 -3.775 -14.603 1.00 1.00 C ATOM 871 CD1 LEU B 2 2.394 -4.431 -13.389 1.00 1.00 C ATOM 872 CD2 LEU B 2 0.801 -2.702 -14.097 1.00 1.00 C ATOM 0 H LEU B 2 4.106 -2.029 -17.581 1.00 1.00 H new ATOM 0 HA LEU B 2 1.340 -2.054 -16.494 1.00 1.00 H new ATOM 0 HB2 LEU B 2 3.067 -4.071 -16.284 1.00 1.00 H new ATOM 0 HB3 LEU B 2 3.743 -3.063 -15.021 1.00 1.00 H new ATOM 0 HG LEU B 2 1.172 -4.484 -15.190 1.00 1.00 H new ATOM 0 HD11 LEU B 2 1.614 -4.778 -12.711 1.00 1.00 H new ATOM 0 HD12 LEU B 2 3.000 -5.279 -13.710 1.00 1.00 H new ATOM 0 HD13 LEU B 2 3.026 -3.707 -12.875 1.00 1.00 H new ATOM 0 HD21 LEU B 2 0.078 -3.150 -13.415 1.00 1.00 H new ATOM 0 HD22 LEU B 2 1.365 -1.931 -13.572 1.00 1.00 H new ATOM 0 HD23 LEU B 2 0.275 -2.256 -14.941 1.00 1.00 H new ATOM 884 N ILE B 3 1.948 0.265 -15.671 1.00 1.00 N ATOM 885 CA ILE B 3 2.220 1.542 -15.041 1.00 1.00 C ATOM 886 C ILE B 3 1.854 1.470 -13.561 1.00 1.00 C ATOM 887 O ILE B 3 0.876 0.824 -13.189 1.00 1.00 O ATOM 888 CB ILE B 3 1.422 2.636 -15.762 1.00 1.00 C ATOM 889 CG1 ILE B 3 1.826 2.725 -17.241 1.00 1.00 C ATOM 890 CG2 ILE B 3 1.700 3.992 -15.111 1.00 1.00 C ATOM 891 CD1 ILE B 3 1.025 1.784 -18.140 1.00 1.00 C ATOM 0 H ILE B 3 1.057 0.223 -16.166 1.00 1.00 H new ATOM 0 HA ILE B 3 3.281 1.783 -15.114 1.00 1.00 H new ATOM 0 HB ILE B 3 0.364 2.383 -15.688 1.00 1.00 H new ATOM 0 HG12 ILE B 3 1.692 3.750 -17.587 1.00 1.00 H new ATOM 0 HG13 ILE B 3 2.887 2.493 -17.336 1.00 1.00 H new ATOM 0 HG21 ILE B 3 1.131 4.766 -15.626 1.00 1.00 H new ATOM 0 HG22 ILE B 3 1.403 3.960 -14.063 1.00 1.00 H new ATOM 0 HG23 ILE B 3 2.764 4.217 -15.180 1.00 1.00 H new ATOM 0 HD11 ILE B 3 1.358 1.895 -19.172 1.00 1.00 H new ATOM 0 HD12 ILE B 3 1.179 0.754 -17.818 1.00 1.00 H new ATOM 0 HD13 ILE B 3 -0.035 2.031 -18.073 1.00 1.00 H new ATOM 903 N LEU B 4 2.644 2.138 -12.718 1.00 1.00 N ATOM 904 CA LEU B 4 2.400 2.244 -11.286 1.00 1.00 C ATOM 905 C LEU B 4 2.809 3.646 -10.835 1.00 1.00 C ATOM 906 O LEU B 4 3.539 4.333 -11.546 1.00 1.00 O ATOM 907 CB LEU B 4 3.228 1.194 -10.528 1.00 1.00 C ATOM 908 CG LEU B 4 2.835 -0.256 -10.835 1.00 1.00 C ATOM 909 CD1 LEU B 4 3.834 -1.201 -10.174 1.00 1.00 C ATOM 910 CD2 LEU B 4 1.459 -0.603 -10.274 1.00 1.00 C ATOM 0 H LEU B 4 3.486 2.628 -13.021 1.00 1.00 H new ATOM 0 HA LEU B 4 1.345 2.069 -11.075 1.00 1.00 H new ATOM 0 HB2 LEU B 4 4.281 1.333 -10.772 1.00 1.00 H new ATOM 0 HB3 LEU B 4 3.123 1.368 -9.457 1.00 1.00 H new ATOM 0 HG LEU B 4 2.825 -0.363 -11.920 1.00 1.00 H new ATOM 0 HD11 LEU B 4 3.557 -2.233 -10.391 1.00 1.00 H new ATOM 0 HD12 LEU B 4 4.833 -1.004 -10.563 1.00 1.00 H new ATOM 0 HD13 LEU B 4 3.827 -1.042 -9.096 1.00 1.00 H new ATOM 0 HD21 LEU B 4 1.219 -1.639 -10.514 1.00 1.00 H new ATOM 0 HD22 LEU B 4 1.464 -0.473 -9.192 1.00 1.00 H new ATOM 0 HD23 LEU B 4 0.710 0.054 -10.715 1.00 1.00 H new ATOM 922 N THR B 5 2.346 4.076 -9.658 1.00 1.00 N ATOM 923 CA THR B 5 2.713 5.377 -9.111 1.00 1.00 C ATOM 924 C THR B 5 3.208 5.198 -7.682 1.00 1.00 C ATOM 925 O THR B 5 2.455 5.365 -6.726 1.00 1.00 O ATOM 926 CB THR B 5 1.539 6.357 -9.201 1.00 1.00 C ATOM 927 OG1 THR B 5 1.075 6.437 -10.533 1.00 1.00 O ATOM 928 CG2 THR B 5 1.966 7.757 -8.771 1.00 1.00 C ATOM 0 H THR B 5 1.714 3.537 -9.067 1.00 1.00 H new ATOM 0 HA THR B 5 3.522 5.809 -9.700 1.00 1.00 H new ATOM 0 HB THR B 5 0.753 5.990 -8.541 1.00 1.00 H new ATOM 0 HG1 THR B 5 0.231 6.935 -10.556 1.00 1.00 H new ATOM 0 HG21 THR B 5 1.116 8.435 -8.843 1.00 1.00 H new ATOM 0 HG22 THR B 5 2.321 7.729 -7.741 1.00 1.00 H new ATOM 0 HG23 THR B 5 2.767 8.109 -9.421 1.00 1.00 H new ATOM 936 N ARG B 6 4.490 4.855 -7.540 1.00 1.00 N ATOM 937 CA ARG B 6 5.101 4.576 -6.246 1.00 1.00 C ATOM 938 C ARG B 6 5.328 5.872 -5.478 1.00 1.00 C ATOM 939 O ARG B 6 5.114 6.960 -6.009 1.00 1.00 O ATOM 940 CB ARG B 6 6.434 3.849 -6.465 1.00 1.00 C ATOM 941 CG ARG B 6 6.233 2.441 -7.036 1.00 1.00 C ATOM 942 CD ARG B 6 6.042 1.394 -5.935 1.00 1.00 C ATOM 943 NE ARG B 6 4.940 1.730 -5.030 1.00 1.00 N ATOM 944 CZ ARG B 6 3.645 1.503 -5.261 1.00 1.00 C ATOM 945 NH1 ARG B 6 3.239 0.920 -6.386 1.00 1.00 N ATOM 946 NH2 ARG B 6 2.751 1.869 -4.348 1.00 1.00 N ATOM 0 H ARG B 6 5.134 4.763 -8.326 1.00 1.00 H new ATOM 0 HA ARG B 6 4.434 3.943 -5.660 1.00 1.00 H new ATOM 0 HB2 ARG B 6 7.057 4.430 -7.145 1.00 1.00 H new ATOM 0 HB3 ARG B 6 6.971 3.783 -5.519 1.00 1.00 H new ATOM 0 HG2 ARG B 6 5.364 2.438 -7.693 1.00 1.00 H new ATOM 0 HG3 ARG B 6 7.095 2.171 -7.646 1.00 1.00 H new ATOM 0 HD2 ARG B 6 5.851 0.422 -6.391 1.00 1.00 H new ATOM 0 HD3 ARG B 6 6.964 1.301 -5.361 1.00 1.00 H new ATOM 0 HE ARG B 6 5.184 2.177 -4.146 1.00 1.00 H new ATOM 0 HH11 ARG B 6 3.922 0.638 -7.090 1.00 1.00 H new ATOM 0 HH12 ARG B 6 2.245 0.755 -6.545 1.00 1.00 H new ATOM 0 HH21 ARG B 6 3.058 2.317 -3.485 1.00 1.00 H new ATOM 0 HH22 ARG B 6 1.758 1.702 -4.511 1.00 1.00 H new ATOM 960 N LYS B 7 5.764 5.751 -4.221 1.00 1.00 N ATOM 961 CA LYS B 7 6.118 6.901 -3.405 1.00 1.00 C ATOM 962 C LYS B 7 7.597 6.821 -3.049 1.00 1.00 C ATOM 963 O LYS B 7 8.178 5.739 -3.070 1.00 1.00 O ATOM 964 CB LYS B 7 5.232 6.966 -2.155 1.00 1.00 C ATOM 965 CG LYS B 7 3.755 6.753 -2.500 1.00 1.00 C ATOM 966 CD LYS B 7 2.862 7.234 -1.353 1.00 1.00 C ATOM 967 CE LYS B 7 1.417 6.789 -1.584 1.00 1.00 C ATOM 968 NZ LYS B 7 0.520 7.305 -0.533 1.00 1.00 N ATOM 0 H LYS B 7 5.879 4.855 -3.748 1.00 1.00 H new ATOM 0 HA LYS B 7 5.946 7.820 -3.965 1.00 1.00 H new ATOM 0 HB2 LYS B 7 5.553 6.207 -1.441 1.00 1.00 H new ATOM 0 HB3 LYS B 7 5.357 7.934 -1.669 1.00 1.00 H new ATOM 0 HG2 LYS B 7 3.507 7.294 -3.413 1.00 1.00 H new ATOM 0 HG3 LYS B 7 3.570 5.697 -2.695 1.00 1.00 H new ATOM 0 HD2 LYS B 7 3.226 6.834 -0.407 1.00 1.00 H new ATOM 0 HD3 LYS B 7 2.908 8.320 -1.278 1.00 1.00 H new ATOM 0 HE2 LYS B 7 1.078 7.140 -2.558 1.00 1.00 H new ATOM 0 HE3 LYS B 7 1.369 5.700 -1.603 1.00 1.00 H new ATOM 0 HZ1 LYS B 7 -0.452 6.986 -0.719 1.00 1.00 H new ATOM 0 HZ2 LYS B 7 0.830 6.949 0.394 1.00 1.00 H new ATOM 0 HZ3 LYS B 7 0.548 8.345 -0.532 1.00 1.00 H new ATOM 982 N VAL B 8 8.210 7.959 -2.721 1.00 1.00 N ATOM 983 CA VAL B 8 9.632 8.009 -2.403 1.00 1.00 C ATOM 984 C VAL B 8 9.951 7.043 -1.264 1.00 1.00 C ATOM 985 O VAL B 8 9.349 7.115 -0.194 1.00 1.00 O ATOM 986 CB VAL B 8 10.023 9.443 -2.032 1.00 1.00 C ATOM 987 CG1 VAL B 8 11.484 9.501 -1.592 1.00 1.00 C ATOM 988 CG2 VAL B 8 9.828 10.360 -3.241 1.00 1.00 C ATOM 0 H VAL B 8 7.738 8.862 -2.669 1.00 1.00 H new ATOM 0 HA VAL B 8 10.211 7.704 -3.275 1.00 1.00 H new ATOM 0 HB VAL B 8 9.388 9.773 -1.209 1.00 1.00 H new ATOM 0 HG11 VAL B 8 11.745 10.527 -1.332 1.00 1.00 H new ATOM 0 HG12 VAL B 8 11.628 8.859 -0.723 1.00 1.00 H new ATOM 0 HG13 VAL B 8 12.123 9.159 -2.406 1.00 1.00 H new ATOM 0 HG21 VAL B 8 10.107 11.379 -2.973 1.00 1.00 H new ATOM 0 HG22 VAL B 8 10.455 10.016 -4.063 1.00 1.00 H new ATOM 0 HG23 VAL B 8 8.783 10.339 -3.549 1.00 1.00 H new ATOM 998 N GLY B 9 10.902 6.139 -1.507 1.00 1.00 N ATOM 999 CA GLY B 9 11.348 5.155 -0.532 1.00 1.00 C ATOM 1000 C GLY B 9 10.705 3.786 -0.753 1.00 1.00 C ATOM 1001 O GLY B 9 11.133 2.808 -0.142 1.00 1.00 O ATOM 0 H GLY B 9 11.388 6.073 -2.401 1.00 1.00 H new ATOM 0 HA2 GLY B 9 12.432 5.058 -0.587 1.00 1.00 H new ATOM 0 HA3 GLY B 9 11.110 5.508 0.472 1.00 1.00 H new ATOM 1005 N GLU B 10 9.688 3.700 -1.616 1.00 1.00 N ATOM 1006 CA GLU B 10 9.054 2.430 -1.941 1.00 1.00 C ATOM 1007 C GLU B 10 9.837 1.714 -3.043 1.00 1.00 C ATOM 1008 O GLU B 10 10.769 2.273 -3.622 1.00 1.00 O ATOM 1009 CB GLU B 10 7.605 2.656 -2.381 1.00 1.00 C ATOM 1010 CG GLU B 10 6.788 3.303 -1.260 1.00 1.00 C ATOM 1011 CD GLU B 10 5.306 3.394 -1.624 1.00 1.00 C ATOM 1012 OE1 GLU B 10 4.998 3.345 -2.836 1.00 1.00 O ATOM 1013 OE2 GLU B 10 4.492 3.512 -0.682 1.00 1.00 O ATOM 0 H GLU B 10 9.288 4.503 -2.102 1.00 1.00 H new ATOM 0 HA GLU B 10 9.053 1.803 -1.049 1.00 1.00 H new ATOM 0 HB2 GLU B 10 7.584 3.293 -3.265 1.00 1.00 H new ATOM 0 HB3 GLU B 10 7.154 1.705 -2.663 1.00 1.00 H new ATOM 0 HG2 GLU B 10 6.903 2.724 -0.344 1.00 1.00 H new ATOM 0 HG3 GLU B 10 7.175 4.301 -1.056 1.00 1.00 H new ATOM 1020 N SER B 11 9.453 0.468 -3.334 1.00 1.00 N ATOM 1021 CA SER B 11 10.142 -0.339 -4.329 1.00 1.00 C ATOM 1022 C SER B 11 9.189 -1.232 -5.114 1.00 1.00 C ATOM 1023 O SER B 11 8.002 -1.337 -4.808 1.00 1.00 O ATOM 1024 CB SER B 11 11.216 -1.187 -3.645 1.00 1.00 C ATOM 1025 OG SER B 11 10.671 -1.913 -2.564 1.00 1.00 O ATOM 0 H SER B 11 8.664 -0.000 -2.889 1.00 1.00 H new ATOM 0 HA SER B 11 10.603 0.341 -5.045 1.00 1.00 H new ATOM 0 HB2 SER B 11 11.655 -1.876 -4.366 1.00 1.00 H new ATOM 0 HB3 SER B 11 12.020 -0.544 -3.288 1.00 1.00 H new ATOM 0 HG SER B 11 11.375 -2.449 -2.142 1.00 1.00 H new ATOM 1031 N ILE B 12 9.750 -1.873 -6.140 1.00 1.00 N ATOM 1032 CA ILE B 12 9.070 -2.767 -7.061 1.00 1.00 C ATOM 1033 C ILE B 12 9.986 -3.962 -7.324 1.00 1.00 C ATOM 1034 O ILE B 12 11.177 -3.911 -7.021 1.00 1.00 O ATOM 1035 CB ILE B 12 8.747 -1.978 -8.342 1.00 1.00 C ATOM 1036 CG1 ILE B 12 7.507 -1.113 -8.083 1.00 1.00 C ATOM 1037 CG2 ILE B 12 8.515 -2.891 -9.549 1.00 1.00 C ATOM 1038 CD1 ILE B 12 7.143 -0.244 -9.285 1.00 1.00 C ATOM 0 H ILE B 12 10.742 -1.774 -6.357 1.00 1.00 H new ATOM 0 HA ILE B 12 8.132 -3.146 -6.656 1.00 1.00 H new ATOM 0 HB ILE B 12 9.606 -1.353 -8.586 1.00 1.00 H new ATOM 0 HG12 ILE B 12 6.663 -1.757 -7.835 1.00 1.00 H new ATOM 0 HG13 ILE B 12 7.687 -0.475 -7.218 1.00 1.00 H new ATOM 0 HG21 ILE B 12 8.291 -2.284 -10.426 1.00 1.00 H new ATOM 0 HG22 ILE B 12 9.412 -3.482 -9.736 1.00 1.00 H new ATOM 0 HG23 ILE B 12 7.677 -3.558 -9.345 1.00 1.00 H new ATOM 0 HD11 ILE B 12 6.259 0.349 -9.051 1.00 1.00 H new ATOM 0 HD12 ILE B 12 7.975 0.421 -9.518 1.00 1.00 H new ATOM 0 HD13 ILE B 12 6.935 -0.881 -10.145 1.00 1.00 H new ATOM 1050 N ASN B 13 9.435 -5.038 -7.887 1.00 1.00 N ATOM 1051 CA ASN B 13 10.194 -6.234 -8.216 1.00 1.00 C ATOM 1052 C ASN B 13 9.872 -6.680 -9.634 1.00 1.00 C ATOM 1053 O ASN B 13 8.764 -6.468 -10.124 1.00 1.00 O ATOM 1054 CB ASN B 13 9.868 -7.340 -7.212 1.00 1.00 C ATOM 1055 CG ASN B 13 10.438 -7.020 -5.840 1.00 1.00 C ATOM 1056 OD1 ASN B 13 9.702 -6.716 -4.906 1.00 1.00 O ATOM 1057 ND2 ASN B 13 11.759 -7.088 -5.719 1.00 1.00 N ATOM 0 H ASN B 13 8.445 -5.100 -8.127 1.00 1.00 H new ATOM 0 HA ASN B 13 11.260 -6.015 -8.160 1.00 1.00 H new ATOM 0 HB2 ASN B 13 8.787 -7.463 -7.140 1.00 1.00 H new ATOM 0 HB3 ASN B 13 10.274 -8.288 -7.566 1.00 1.00 H new ATOM 0 HD21 ASN B 13 12.200 -6.883 -4.822 1.00 1.00 H new ATOM 0 HD22 ASN B 13 12.332 -7.345 -6.523 1.00 1.00 H new ATOM 1064 N ILE B 14 10.856 -7.302 -10.291 1.00 1.00 N ATOM 1065 CA ILE B 14 10.722 -7.782 -11.658 1.00 1.00 C ATOM 1066 C ILE B 14 11.473 -9.104 -11.796 1.00 1.00 C ATOM 1067 O ILE B 14 12.508 -9.301 -11.160 1.00 1.00 O ATOM 1068 CB ILE B 14 11.284 -6.734 -12.637 1.00 1.00 C ATOM 1069 CG1 ILE B 14 10.576 -5.383 -12.457 1.00 1.00 C ATOM 1070 CG2 ILE B 14 11.117 -7.225 -14.078 1.00 1.00 C ATOM 1071 CD1 ILE B 14 11.163 -4.298 -13.362 1.00 1.00 C ATOM 0 H ILE B 14 11.772 -7.485 -9.881 1.00 1.00 H new ATOM 0 HA ILE B 14 9.670 -7.942 -11.895 1.00 1.00 H new ATOM 0 HB ILE B 14 12.344 -6.596 -12.424 1.00 1.00 H new ATOM 0 HG12 ILE B 14 9.514 -5.499 -12.674 1.00 1.00 H new ATOM 0 HG13 ILE B 14 10.656 -5.068 -11.416 1.00 1.00 H new ATOM 0 HG21 ILE B 14 11.516 -6.479 -14.765 1.00 1.00 H new ATOM 0 HG22 ILE B 14 11.656 -8.163 -14.207 1.00 1.00 H new ATOM 0 HG23 ILE B 14 10.059 -7.382 -14.288 1.00 1.00 H new ATOM 0 HD11 ILE B 14 10.630 -3.361 -13.199 1.00 1.00 H new ATOM 0 HD12 ILE B 14 12.219 -4.161 -13.128 1.00 1.00 H new ATOM 0 HD13 ILE B 14 11.059 -4.598 -14.405 1.00 1.00 H new ATOM 1083 N GLY B 15 10.956 -10.014 -12.626 1.00 1.00 N ATOM 1084 CA GLY B 15 11.613 -11.279 -12.935 1.00 1.00 C ATOM 1085 C GLY B 15 11.890 -12.150 -11.707 1.00 1.00 C ATOM 1086 O GLY B 15 12.602 -13.144 -11.822 1.00 1.00 O ATOM 0 H GLY B 15 10.064 -9.889 -13.104 1.00 1.00 H new ATOM 0 HA2 GLY B 15 10.991 -11.839 -13.633 1.00 1.00 H new ATOM 0 HA3 GLY B 15 12.555 -11.073 -13.442 1.00 1.00 H new ATOM 1090 N ASP B 16 11.336 -11.786 -10.544 1.00 1.00 N ATOM 1091 CA ASP B 16 11.545 -12.466 -9.269 1.00 1.00 C ATOM 1092 C ASP B 16 13.013 -12.485 -8.819 1.00 1.00 C ATOM 1093 O ASP B 16 13.337 -13.138 -7.827 1.00 1.00 O ATOM 1094 CB ASP B 16 10.942 -13.874 -9.315 1.00 1.00 C ATOM 1095 CG ASP B 16 9.462 -13.833 -9.688 1.00 1.00 C ATOM 1096 OD1 ASP B 16 8.672 -13.347 -8.850 1.00 1.00 O ATOM 1097 OD2 ASP B 16 9.134 -14.287 -10.807 1.00 1.00 O ATOM 0 H ASP B 16 10.711 -10.984 -10.467 1.00 1.00 H new ATOM 0 HA ASP B 16 11.022 -11.886 -8.508 1.00 1.00 H new ATOM 0 HB2 ASP B 16 11.485 -14.481 -10.040 1.00 1.00 H new ATOM 0 HB3 ASP B 16 11.061 -14.355 -8.344 1.00 1.00 H new ATOM 1102 N ASP B 17 13.903 -11.782 -9.531 1.00 1.00 N ATOM 1103 CA ASP B 17 15.319 -11.697 -9.182 1.00 1.00 C ATOM 1104 C ASP B 17 15.825 -10.255 -9.237 1.00 1.00 C ATOM 1105 O ASP B 17 17.003 -10.009 -8.982 1.00 1.00 O ATOM 1106 CB ASP B 17 16.159 -12.557 -10.131 1.00 1.00 C ATOM 1107 CG ASP B 17 15.784 -14.037 -10.073 1.00 1.00 C ATOM 1108 OD1 ASP B 17 15.944 -14.630 -8.983 1.00 1.00 O ATOM 1109 OD2 ASP B 17 15.339 -14.565 -11.116 1.00 1.00 O ATOM 0 H ASP B 17 13.656 -11.255 -10.369 1.00 1.00 H new ATOM 0 HA ASP B 17 15.422 -12.066 -8.161 1.00 1.00 H new ATOM 0 HB2 ASP B 17 16.033 -12.194 -11.151 1.00 1.00 H new ATOM 0 HB3 ASP B 17 17.214 -12.443 -9.880 1.00 1.00 H new ATOM 1114 N ILE B 18 14.948 -9.302 -9.566 1.00 1.00 N ATOM 1115 CA ILE B 18 15.328 -7.906 -9.720 1.00 1.00 C ATOM 1116 C ILE B 18 14.461 -7.035 -8.815 1.00 1.00 C ATOM 1117 O ILE B 18 13.316 -7.378 -8.519 1.00 1.00 O ATOM 1118 CB ILE B 18 15.202 -7.506 -11.199 1.00 1.00 C ATOM 1119 CG1 ILE B 18 16.084 -8.433 -12.049 1.00 1.00 C ATOM 1120 CG2 ILE B 18 15.593 -6.040 -11.408 1.00 1.00 C ATOM 1121 CD1 ILE B 18 15.969 -8.137 -13.543 1.00 1.00 C ATOM 0 H ILE B 18 13.958 -9.482 -9.732 1.00 1.00 H new ATOM 0 HA ILE B 18 16.366 -7.760 -9.420 1.00 1.00 H new ATOM 0 HB ILE B 18 14.163 -7.613 -11.510 1.00 1.00 H new ATOM 0 HG12 ILE B 18 17.123 -8.326 -11.739 1.00 1.00 H new ATOM 0 HG13 ILE B 18 15.801 -9.469 -11.864 1.00 1.00 H new ATOM 0 HG21 ILE B 18 15.495 -5.784 -12.463 1.00 1.00 H new ATOM 0 HG22 ILE B 18 14.937 -5.401 -10.817 1.00 1.00 H new ATOM 0 HG23 ILE B 18 16.626 -5.890 -11.093 1.00 1.00 H new ATOM 0 HD11 ILE B 18 16.612 -8.819 -14.100 1.00 1.00 H new ATOM 0 HD12 ILE B 18 14.935 -8.271 -13.862 1.00 1.00 H new ATOM 0 HD13 ILE B 18 16.278 -7.110 -13.735 1.00 1.00 H new ATOM 1133 N THR B 19 15.013 -5.901 -8.377 1.00 1.00 N ATOM 1134 CA THR B 19 14.313 -4.954 -7.526 1.00 1.00 C ATOM 1135 C THR B 19 14.585 -3.540 -8.016 1.00 1.00 C ATOM 1136 O THR B 19 15.704 -3.228 -8.418 1.00 1.00 O ATOM 1137 CB THR B 19 14.792 -5.116 -6.078 1.00 1.00 C ATOM 1138 OG1 THR B 19 14.644 -6.455 -5.662 1.00 1.00 O ATOM 1139 CG2 THR B 19 13.992 -4.224 -5.131 1.00 1.00 C ATOM 0 H THR B 19 15.965 -5.618 -8.608 1.00 1.00 H new ATOM 0 HA THR B 19 13.240 -5.144 -7.566 1.00 1.00 H new ATOM 0 HB THR B 19 15.842 -4.826 -6.046 1.00 1.00 H new ATOM 0 HG1 THR B 19 14.954 -6.546 -4.737 1.00 1.00 H new ATOM 0 HG21 THR B 19 14.353 -4.360 -4.112 1.00 1.00 H new ATOM 0 HG22 THR B 19 14.114 -3.181 -5.424 1.00 1.00 H new ATOM 0 HG23 THR B 19 12.937 -4.494 -5.181 1.00 1.00 H new ATOM 1147 N ILE B 20 13.561 -2.685 -7.981 1.00 1.00 N ATOM 1148 CA ILE B 20 13.669 -1.293 -8.389 1.00 1.00 C ATOM 1149 C ILE B 20 13.259 -0.433 -7.196 1.00 1.00 C ATOM 1150 O ILE B 20 12.393 -0.844 -6.425 1.00 1.00 O ATOM 1151 CB ILE B 20 12.758 -1.020 -9.595 1.00 1.00 C ATOM 1152 CG1 ILE B 20 12.822 -2.112 -10.673 1.00 1.00 C ATOM 1153 CG2 ILE B 20 13.111 0.335 -10.215 1.00 1.00 C ATOM 1154 CD1 ILE B 20 14.199 -2.256 -11.320 1.00 1.00 C ATOM 0 H ILE B 20 12.627 -2.947 -7.665 1.00 1.00 H new ATOM 0 HA ILE B 20 14.690 -1.058 -8.691 1.00 1.00 H new ATOM 0 HB ILE B 20 11.736 -1.015 -9.215 1.00 1.00 H new ATOM 0 HG12 ILE B 20 12.537 -3.066 -10.229 1.00 1.00 H new ATOM 0 HG13 ILE B 20 12.088 -1.889 -11.447 1.00 1.00 H new ATOM 0 HG21 ILE B 20 12.462 0.524 -11.070 1.00 1.00 H new ATOM 0 HG22 ILE B 20 12.972 1.122 -9.473 1.00 1.00 H new ATOM 0 HG23 ILE B 20 14.150 0.325 -10.543 1.00 1.00 H new ATOM 0 HD11 ILE B 20 14.167 -3.046 -12.071 1.00 1.00 H new ATOM 0 HD12 ILE B 20 14.478 -1.315 -11.794 1.00 1.00 H new ATOM 0 HD13 ILE B 20 14.935 -2.510 -10.557 1.00 1.00 H new ATOM 1166 N THR B 21 13.858 0.747 -7.029 1.00 1.00 N ATOM 1167 CA THR B 21 13.558 1.588 -5.877 1.00 1.00 C ATOM 1168 C THR B 21 13.585 3.062 -6.260 1.00 1.00 C ATOM 1169 O THR B 21 14.528 3.516 -6.906 1.00 1.00 O ATOM 1170 CB THR B 21 14.585 1.323 -4.769 1.00 1.00 C ATOM 1171 OG1 THR B 21 14.706 -0.063 -4.533 1.00 1.00 O ATOM 1172 CG2 THR B 21 14.160 1.994 -3.463 1.00 1.00 C ATOM 0 H THR B 21 14.547 1.136 -7.672 1.00 1.00 H new ATOM 0 HA THR B 21 12.558 1.344 -5.519 1.00 1.00 H new ATOM 0 HB THR B 21 15.539 1.733 -5.100 1.00 1.00 H new ATOM 0 HG1 THR B 21 15.366 -0.218 -3.825 1.00 1.00 H new ATOM 0 HG21 THR B 21 14.903 1.792 -2.692 1.00 1.00 H new ATOM 0 HG22 THR B 21 14.079 3.070 -3.616 1.00 1.00 H new ATOM 0 HG23 THR B 21 13.194 1.599 -3.148 1.00 1.00 H new ATOM 1180 N ILE B 22 12.554 3.812 -5.864 1.00 1.00 N ATOM 1181 CA ILE B 22 12.501 5.247 -6.095 1.00 1.00 C ATOM 1182 C ILE B 22 13.179 5.945 -4.915 1.00 1.00 C ATOM 1183 O ILE B 22 12.591 6.093 -3.845 1.00 1.00 O ATOM 1184 CB ILE B 22 11.051 5.703 -6.330 1.00 1.00 C ATOM 1185 CG1 ILE B 22 10.918 7.229 -6.280 1.00 1.00 C ATOM 1186 CG2 ILE B 22 10.076 5.088 -5.323 1.00 1.00 C ATOM 1187 CD1 ILE B 22 11.798 7.900 -7.334 1.00 1.00 C ATOM 0 H ILE B 22 11.739 3.439 -5.377 1.00 1.00 H new ATOM 0 HA ILE B 22 13.041 5.520 -7.002 1.00 1.00 H new ATOM 0 HB ILE B 22 10.792 5.351 -7.328 1.00 1.00 H new ATOM 0 HG12 ILE B 22 9.877 7.510 -6.440 1.00 1.00 H new ATOM 0 HG13 ILE B 22 11.197 7.588 -5.289 1.00 1.00 H new ATOM 0 HG21 ILE B 22 9.066 5.441 -5.532 1.00 1.00 H new ATOM 0 HG22 ILE B 22 10.105 4.002 -5.406 1.00 1.00 H new ATOM 0 HG23 ILE B 22 10.362 5.383 -4.313 1.00 1.00 H new ATOM 0 HD11 ILE B 22 11.680 8.982 -7.271 1.00 1.00 H new ATOM 0 HD12 ILE B 22 12.841 7.638 -7.157 1.00 1.00 H new ATOM 0 HD13 ILE B 22 11.501 7.559 -8.326 1.00 1.00 H new ATOM 1199 N LEU B 23 14.428 6.376 -5.112 1.00 1.00 N ATOM 1200 CA LEU B 23 15.213 6.964 -4.040 1.00 1.00 C ATOM 1201 C LEU B 23 14.722 8.376 -3.729 1.00 1.00 C ATOM 1202 O LEU B 23 14.876 8.848 -2.604 1.00 1.00 O ATOM 1203 CB LEU B 23 16.696 6.996 -4.422 1.00 1.00 C ATOM 1204 CG LEU B 23 17.201 5.671 -5.003 1.00 1.00 C ATOM 1205 CD1 LEU B 23 18.720 5.738 -5.108 1.00 1.00 C ATOM 1206 CD2 LEU B 23 16.834 4.472 -4.131 1.00 1.00 C ATOM 0 H LEU B 23 14.912 6.326 -6.008 1.00 1.00 H new ATOM 0 HA LEU B 23 15.092 6.349 -3.149 1.00 1.00 H new ATOM 0 HB2 LEU B 23 16.859 7.790 -5.151 1.00 1.00 H new ATOM 0 HB3 LEU B 23 17.286 7.246 -3.540 1.00 1.00 H new ATOM 0 HG LEU B 23 16.730 5.535 -5.976 1.00 1.00 H new ATOM 0 HD11 LEU B 23 19.098 4.802 -5.520 1.00 1.00 H new ATOM 0 HD12 LEU B 23 19.004 6.563 -5.761 1.00 1.00 H new ATOM 0 HD13 LEU B 23 19.147 5.897 -4.118 1.00 1.00 H new ATOM 0 HD21 LEU B 23 17.216 3.559 -4.588 1.00 1.00 H new ATOM 0 HD22 LEU B 23 17.274 4.594 -3.141 1.00 1.00 H new ATOM 0 HD23 LEU B 23 15.750 4.406 -4.040 1.00 1.00 H new ATOM 1218 N GLY B 24 14.132 9.046 -4.724 1.00 1.00 N ATOM 1219 CA GLY B 24 13.501 10.339 -4.517 1.00 1.00 C ATOM 1220 C GLY B 24 13.452 11.169 -5.794 1.00 1.00 C ATOM 1221 O GLY B 24 14.061 10.816 -6.803 1.00 1.00 O ATOM 0 H GLY B 24 14.082 8.705 -5.684 1.00 1.00 H new ATOM 0 HA2 GLY B 24 12.488 10.191 -4.143 1.00 1.00 H new ATOM 0 HA3 GLY B 24 14.046 10.888 -3.750 1.00 1.00 H new ATOM 1225 N VAL B 25 12.719 12.283 -5.739 1.00 1.00 N ATOM 1226 CA VAL B 25 12.610 13.203 -6.862 1.00 1.00 C ATOM 1227 C VAL B 25 13.893 14.021 -6.996 1.00 1.00 C ATOM 1228 O VAL B 25 14.703 14.080 -6.071 1.00 1.00 O ATOM 1229 CB VAL B 25 11.399 14.128 -6.680 1.00 1.00 C ATOM 1230 CG1 VAL B 25 10.110 13.308 -6.619 1.00 1.00 C ATOM 1231 CG2 VAL B 25 11.517 14.969 -5.408 1.00 1.00 C ATOM 0 H VAL B 25 12.188 12.568 -4.916 1.00 1.00 H new ATOM 0 HA VAL B 25 12.467 12.626 -7.776 1.00 1.00 H new ATOM 0 HB VAL B 25 11.373 14.799 -7.538 1.00 1.00 H new ATOM 0 HG11 VAL B 25 9.259 13.977 -6.490 1.00 1.00 H new ATOM 0 HG12 VAL B 25 9.992 12.746 -7.545 1.00 1.00 H new ATOM 0 HG13 VAL B 25 10.158 12.616 -5.778 1.00 1.00 H new ATOM 0 HG21 VAL B 25 10.641 15.611 -5.314 1.00 1.00 H new ATOM 0 HG22 VAL B 25 11.580 14.311 -4.541 1.00 1.00 H new ATOM 0 HG23 VAL B 25 12.415 15.585 -5.461 1.00 1.00 H new ATOM 1241 N SER B 26 14.072 14.651 -8.158 1.00 1.00 N ATOM 1242 CA SER B 26 15.233 15.475 -8.467 1.00 1.00 C ATOM 1243 C SER B 26 14.810 16.620 -9.385 1.00 1.00 C ATOM 1244 O SER B 26 15.536 16.989 -10.307 1.00 1.00 O ATOM 1245 CB SER B 26 16.318 14.615 -9.119 1.00 1.00 C ATOM 1246 OG SER B 26 16.712 13.567 -8.256 1.00 1.00 O ATOM 0 H SER B 26 13.399 14.599 -8.923 1.00 1.00 H new ATOM 0 HA SER B 26 15.643 15.900 -7.551 1.00 1.00 H new ATOM 0 HB2 SER B 26 15.946 14.201 -10.056 1.00 1.00 H new ATOM 0 HB3 SER B 26 17.181 15.234 -9.365 1.00 1.00 H new ATOM 0 HG SER B 26 17.405 13.028 -8.691 1.00 1.00 H new ATOM 1252 N GLY B 27 13.626 17.185 -9.133 1.00 1.00 N ATOM 1253 CA GLY B 27 13.066 18.248 -9.950 1.00 1.00 C ATOM 1254 C GLY B 27 12.500 17.658 -11.234 1.00 1.00 C ATOM 1255 O GLY B 27 11.627 16.793 -11.183 1.00 1.00 O ATOM 0 H GLY B 27 13.031 16.911 -8.351 1.00 1.00 H new ATOM 0 HA2 GLY B 27 12.282 18.769 -9.400 1.00 1.00 H new ATOM 0 HA3 GLY B 27 13.835 18.985 -10.184 1.00 1.00 H new ATOM 1259 N GLN B 28 12.993 18.121 -12.385 1.00 1.00 N ATOM 1260 CA GLN B 28 12.608 17.562 -13.672 1.00 1.00 C ATOM 1261 C GLN B 28 13.258 16.187 -13.876 1.00 1.00 C ATOM 1262 O GLN B 28 13.037 15.535 -14.896 1.00 1.00 O ATOM 1263 CB GLN B 28 13.010 18.545 -14.776 1.00 1.00 C ATOM 1264 CG GLN B 28 12.314 18.250 -16.107 1.00 1.00 C ATOM 1265 CD GLN B 28 10.799 18.372 -15.988 1.00 1.00 C ATOM 1266 OE1 GLN B 28 10.076 17.389 -16.120 1.00 1.00 O ATOM 1267 NE2 GLN B 28 10.304 19.582 -15.738 1.00 1.00 N ATOM 0 H GLN B 28 13.664 18.887 -12.446 1.00 1.00 H new ATOM 0 HA GLN B 28 11.529 17.415 -13.707 1.00 1.00 H new ATOM 0 HB2 GLN B 28 12.768 19.560 -14.460 1.00 1.00 H new ATOM 0 HB3 GLN B 28 14.090 18.505 -14.918 1.00 1.00 H new ATOM 0 HG2 GLN B 28 12.676 18.941 -16.868 1.00 1.00 H new ATOM 0 HG3 GLN B 28 12.574 17.245 -16.439 1.00 1.00 H new ATOM 0 HE21 GLN B 28 10.932 20.379 -15.634 1.00 1.00 H new ATOM 0 HE22 GLN B 28 9.296 19.713 -15.651 1.00 1.00 H new ATOM 1276 N GLN B 29 14.062 15.741 -12.905 1.00 1.00 N ATOM 1277 CA GLN B 29 14.683 14.426 -12.928 1.00 1.00 C ATOM 1278 C GLN B 29 14.170 13.593 -11.757 1.00 1.00 C ATOM 1279 O GLN B 29 13.449 14.097 -10.897 1.00 1.00 O ATOM 1280 CB GLN B 29 16.203 14.562 -12.849 1.00 1.00 C ATOM 1281 CG GLN B 29 16.781 15.385 -14.001 1.00 1.00 C ATOM 1282 CD GLN B 29 18.296 15.461 -13.901 1.00 1.00 C ATOM 1283 OE1 GLN B 29 19.007 15.188 -14.862 1.00 1.00 O ATOM 1284 NE2 GLN B 29 18.805 15.833 -12.731 1.00 1.00 N ATOM 0 H GLN B 29 14.297 16.291 -12.079 1.00 1.00 H new ATOM 0 HA GLN B 29 14.424 13.926 -13.861 1.00 1.00 H new ATOM 0 HB2 GLN B 29 16.473 15.029 -11.902 1.00 1.00 H new ATOM 0 HB3 GLN B 29 16.654 13.570 -12.855 1.00 1.00 H new ATOM 0 HG2 GLN B 29 16.497 14.937 -14.953 1.00 1.00 H new ATOM 0 HG3 GLN B 29 16.360 16.390 -13.983 1.00 1.00 H new ATOM 0 HE21 GLN B 29 18.185 16.053 -11.952 1.00 1.00 H new ATOM 0 HE22 GLN B 29 19.816 15.898 -12.612 1.00 1.00 H new ATOM 1293 N VAL B 30 14.545 12.312 -11.726 1.00 1.00 N ATOM 1294 CA VAL B 30 14.157 11.391 -10.669 1.00 1.00 C ATOM 1295 C VAL B 30 15.293 10.408 -10.407 1.00 1.00 C ATOM 1296 O VAL B 30 15.780 9.765 -11.337 1.00 1.00 O ATOM 1297 CB VAL B 30 12.897 10.628 -11.090 1.00 1.00 C ATOM 1298 CG1 VAL B 30 12.465 9.691 -9.967 1.00 1.00 C ATOM 1299 CG2 VAL B 30 11.735 11.577 -11.384 1.00 1.00 C ATOM 0 H VAL B 30 15.132 11.886 -12.443 1.00 1.00 H new ATOM 0 HA VAL B 30 13.949 11.951 -9.757 1.00 1.00 H new ATOM 0 HB VAL B 30 13.141 10.071 -11.995 1.00 1.00 H new ATOM 0 HG11 VAL B 30 11.569 9.150 -10.269 1.00 1.00 H new ATOM 0 HG12 VAL B 30 13.265 8.980 -9.758 1.00 1.00 H new ATOM 0 HG13 VAL B 30 12.252 10.272 -9.070 1.00 1.00 H new ATOM 0 HG21 VAL B 30 10.859 10.999 -11.679 1.00 1.00 H new ATOM 0 HG22 VAL B 30 11.503 12.156 -10.490 1.00 1.00 H new ATOM 0 HG23 VAL B 30 12.013 12.253 -12.192 1.00 1.00 H new ATOM 1309 N ARG B 31 15.720 10.286 -9.145 1.00 1.00 N ATOM 1310 CA ARG B 31 16.748 9.325 -8.776 1.00 1.00 C ATOM 1311 C ARG B 31 16.103 7.980 -8.461 1.00 1.00 C ATOM 1312 O ARG B 31 15.449 7.822 -7.428 1.00 1.00 O ATOM 1313 CB ARG B 31 17.579 9.833 -7.596 1.00 1.00 C ATOM 1314 CG ARG B 31 18.784 8.913 -7.400 1.00 1.00 C ATOM 1315 CD ARG B 31 19.755 9.481 -6.364 1.00 1.00 C ATOM 1316 NE ARG B 31 20.372 10.718 -6.860 1.00 1.00 N ATOM 1317 CZ ARG B 31 21.598 11.160 -6.554 1.00 1.00 C ATOM 1318 NH1 ARG B 31 22.392 10.497 -5.717 1.00 1.00 N ATOM 1319 NH2 ARG B 31 22.038 12.288 -7.102 1.00 1.00 N ATOM 0 H ARG B 31 15.366 10.843 -8.368 1.00 1.00 H new ATOM 0 HA ARG B 31 17.429 9.197 -9.617 1.00 1.00 H new ATOM 0 HB2 ARG B 31 17.912 10.854 -7.782 1.00 1.00 H new ATOM 0 HB3 ARG B 31 16.972 9.856 -6.691 1.00 1.00 H new ATOM 0 HG2 ARG B 31 18.444 7.928 -7.081 1.00 1.00 H new ATOM 0 HG3 ARG B 31 19.300 8.779 -8.351 1.00 1.00 H new ATOM 0 HD2 ARG B 31 19.226 9.680 -5.432 1.00 1.00 H new ATOM 0 HD3 ARG B 31 20.528 8.746 -6.141 1.00 1.00 H new ATOM 0 HE ARG B 31 19.817 11.292 -7.495 1.00 1.00 H new ATOM 0 HH11 ARG B 31 22.071 9.628 -5.290 1.00 1.00 H new ATOM 0 HH12 ARG B 31 23.322 10.858 -5.502 1.00 1.00 H new ATOM 0 HH21 ARG B 31 21.443 12.807 -7.748 1.00 1.00 H new ATOM 0 HH22 ARG B 31 22.970 12.635 -6.876 1.00 1.00 H new ATOM 1333 N ILE B 32 16.296 7.019 -9.366 1.00 1.00 N ATOM 1334 CA ILE B 32 15.790 5.659 -9.235 1.00 1.00 C ATOM 1335 C ILE B 32 16.980 4.700 -9.197 1.00 1.00 C ATOM 1336 O ILE B 32 18.049 5.017 -9.718 1.00 1.00 O ATOM 1337 CB ILE B 32 14.858 5.342 -10.419 1.00 1.00 C ATOM 1338 CG1 ILE B 32 13.787 6.433 -10.559 1.00 1.00 C ATOM 1339 CG2 ILE B 32 14.193 3.974 -10.229 1.00 1.00 C ATOM 1340 CD1 ILE B 32 12.865 6.196 -11.755 1.00 1.00 C ATOM 0 H ILE B 32 16.820 7.172 -10.228 1.00 1.00 H new ATOM 0 HA ILE B 32 15.216 5.548 -8.315 1.00 1.00 H new ATOM 0 HB ILE B 32 15.456 5.315 -11.330 1.00 1.00 H new ATOM 0 HG12 ILE B 32 13.191 6.472 -9.647 1.00 1.00 H new ATOM 0 HG13 ILE B 32 14.272 7.403 -10.665 1.00 1.00 H new ATOM 0 HG21 ILE B 32 13.538 3.767 -11.075 1.00 1.00 H new ATOM 0 HG22 ILE B 32 14.960 3.202 -10.167 1.00 1.00 H new ATOM 0 HG23 ILE B 32 13.607 3.979 -9.310 1.00 1.00 H new ATOM 0 HD11 ILE B 32 12.126 6.995 -11.809 1.00 1.00 H new ATOM 0 HD12 ILE B 32 13.454 6.184 -12.672 1.00 1.00 H new ATOM 0 HD13 ILE B 32 12.356 5.239 -11.638 1.00 1.00 H new ATOM 1352 N GLY B 33 16.800 3.529 -8.584 1.00 1.00 N ATOM 1353 CA GLY B 33 17.828 2.505 -8.535 1.00 1.00 C ATOM 1354 C GLY B 33 17.307 1.206 -9.134 1.00 1.00 C ATOM 1355 O GLY B 33 16.109 0.930 -9.087 1.00 1.00 O ATOM 0 H GLY B 33 15.935 3.270 -8.109 1.00 1.00 H new ATOM 0 HA2 GLY B 33 18.710 2.838 -9.083 1.00 1.00 H new ATOM 0 HA3 GLY B 33 18.137 2.339 -7.503 1.00 1.00 H new ATOM 1359 N ILE B 34 18.219 0.411 -9.698 1.00 1.00 N ATOM 1360 CA ILE B 34 17.907 -0.859 -10.333 1.00 1.00 C ATOM 1361 C ILE B 34 18.868 -1.907 -9.780 1.00 1.00 C ATOM 1362 O ILE B 34 20.082 -1.732 -9.868 1.00 1.00 O ATOM 1363 CB ILE B 34 18.057 -0.746 -11.859 1.00 1.00 C ATOM 1364 CG1 ILE B 34 17.103 0.287 -12.476 1.00 1.00 C ATOM 1365 CG2 ILE B 34 17.762 -2.109 -12.489 1.00 1.00 C ATOM 1366 CD1 ILE B 34 17.721 1.688 -12.525 1.00 1.00 C ATOM 0 H ILE B 34 19.212 0.642 -9.723 1.00 1.00 H new ATOM 0 HA ILE B 34 16.876 -1.144 -10.122 1.00 1.00 H new ATOM 0 HB ILE B 34 19.078 -0.420 -12.059 1.00 1.00 H new ATOM 0 HG12 ILE B 34 16.835 -0.026 -13.485 1.00 1.00 H new ATOM 0 HG13 ILE B 34 16.180 0.319 -11.897 1.00 1.00 H new ATOM 0 HG21 ILE B 34 17.866 -2.039 -13.572 1.00 1.00 H new ATOM 0 HG22 ILE B 34 18.465 -2.848 -12.104 1.00 1.00 H new ATOM 0 HG23 ILE B 34 16.745 -2.412 -12.241 1.00 1.00 H new ATOM 0 HD11 ILE B 34 17.010 2.384 -12.969 1.00 1.00 H new ATOM 0 HD12 ILE B 34 17.965 2.014 -11.514 1.00 1.00 H new ATOM 0 HD13 ILE B 34 18.629 1.664 -13.127 1.00 1.00 H new ATOM 1378 N ASN B 35 18.342 -2.993 -9.211 1.00 1.00 N ATOM 1379 CA ASN B 35 19.168 -4.015 -8.590 1.00 1.00 C ATOM 1380 C ASN B 35 18.886 -5.388 -9.183 1.00 1.00 C ATOM 1381 O ASN B 35 17.842 -5.987 -8.933 1.00 1.00 O ATOM 1382 CB ASN B 35 18.950 -3.999 -7.082 1.00 1.00 C ATOM 1383 CG ASN B 35 19.971 -4.877 -6.375 1.00 1.00 C ATOM 1384 OD1 ASN B 35 21.153 -4.546 -6.332 1.00 1.00 O ATOM 1385 ND2 ASN B 35 19.526 -6.000 -5.820 1.00 1.00 N ATOM 0 H ASN B 35 17.341 -3.183 -9.170 1.00 1.00 H new ATOM 0 HA ASN B 35 20.216 -3.795 -8.792 1.00 1.00 H new ATOM 0 HB2 ASN B 35 19.025 -2.977 -6.711 1.00 1.00 H new ATOM 0 HB3 ASN B 35 17.943 -4.349 -6.853 1.00 1.00 H new ATOM 0 HD21 ASN B 35 20.174 -6.622 -5.337 1.00 1.00 H new ATOM 0 HD22 ASN B 35 18.536 -6.240 -5.877 1.00 1.00 H new ATOM 1392 N ALA B 36 19.844 -5.868 -9.974 1.00 1.00 N ATOM 1393 CA ALA B 36 19.805 -7.145 -10.666 1.00 1.00 C ATOM 1394 C ALA B 36 21.194 -7.779 -10.580 1.00 1.00 C ATOM 1395 O ALA B 36 22.175 -7.073 -10.341 1.00 1.00 O ATOM 1396 CB ALA B 36 19.423 -6.882 -12.124 1.00 1.00 C ATOM 0 H ALA B 36 20.704 -5.351 -10.155 1.00 1.00 H new ATOM 0 HA ALA B 36 19.076 -7.821 -10.219 1.00 1.00 H new ATOM 0 HB1 ALA B 36 19.387 -7.827 -12.667 1.00 1.00 H new ATOM 0 HB2 ALA B 36 18.445 -6.403 -12.163 1.00 1.00 H new ATOM 0 HB3 ALA B 36 20.165 -6.229 -12.582 1.00 1.00 H new ATOM 1402 N PRO B 37 21.305 -9.100 -10.769 1.00 1.00 N ATOM 1403 CA PRO B 37 22.590 -9.773 -10.777 1.00 1.00 C ATOM 1404 C PRO B 37 23.354 -9.392 -12.042 1.00 1.00 C ATOM 1405 O PRO B 37 22.765 -8.906 -13.006 1.00 1.00 O ATOM 1406 CB PRO B 37 22.254 -11.264 -10.744 1.00 1.00 C ATOM 1407 CG PRO B 37 20.894 -11.329 -11.438 1.00 1.00 C ATOM 1408 CD PRO B 37 20.218 -10.036 -10.987 1.00 1.00 C ATOM 0 HA PRO B 37 23.225 -9.498 -9.935 1.00 1.00 H new ATOM 0 HB2 PRO B 37 23.003 -11.858 -11.268 1.00 1.00 H new ATOM 0 HB3 PRO B 37 22.204 -11.643 -9.723 1.00 1.00 H new ATOM 0 HG2 PRO B 37 20.996 -11.375 -12.522 1.00 1.00 H new ATOM 0 HG3 PRO B 37 20.327 -12.209 -11.134 1.00 1.00 H new ATOM 0 HD2 PRO B 37 19.526 -9.668 -11.744 1.00 1.00 H new ATOM 0 HD3 PRO B 37 19.641 -10.190 -10.075 1.00 1.00 H new ATOM 1416 N LYS B 38 24.671 -9.608 -12.053 1.00 1.00 N ATOM 1417 CA LYS B 38 25.481 -9.299 -13.225 1.00 1.00 C ATOM 1418 C LYS B 38 25.237 -10.308 -14.348 1.00 1.00 C ATOM 1419 O LYS B 38 25.853 -10.218 -15.408 1.00 1.00 O ATOM 1420 CB LYS B 38 26.958 -9.199 -12.833 1.00 1.00 C ATOM 1421 CG LYS B 38 27.122 -8.032 -11.852 1.00 1.00 C ATOM 1422 CD LYS B 38 28.589 -7.741 -11.535 1.00 1.00 C ATOM 1423 CE LYS B 38 29.318 -7.231 -12.778 1.00 1.00 C ATOM 1424 NZ LYS B 38 30.722 -6.898 -12.472 1.00 1.00 N ATOM 0 H LYS B 38 25.194 -9.994 -11.267 1.00 1.00 H new ATOM 0 HA LYS B 38 25.181 -8.327 -13.617 1.00 1.00 H new ATOM 0 HB2 LYS B 38 27.292 -10.130 -12.374 1.00 1.00 H new ATOM 0 HB3 LYS B 38 27.575 -9.040 -13.717 1.00 1.00 H new ATOM 0 HG2 LYS B 38 26.660 -7.139 -12.273 1.00 1.00 H new ATOM 0 HG3 LYS B 38 26.591 -8.260 -10.928 1.00 1.00 H new ATOM 0 HD2 LYS B 38 28.654 -6.999 -10.739 1.00 1.00 H new ATOM 0 HD3 LYS B 38 29.074 -8.646 -11.168 1.00 1.00 H new ATOM 0 HE2 LYS B 38 29.283 -7.989 -13.560 1.00 1.00 H new ATOM 0 HE3 LYS B 38 28.808 -6.349 -13.166 1.00 1.00 H new ATOM 0 HZ1 LYS B 38 31.193 -6.555 -13.333 1.00 1.00 H new ATOM 0 HZ2 LYS B 38 30.752 -6.158 -11.742 1.00 1.00 H new ATOM 0 HZ3 LYS B 38 31.212 -7.747 -12.124 1.00 1.00 H new ATOM 1438 N ASP B 39 24.336 -11.269 -14.116 1.00 1.00 N ATOM 1439 CA ASP B 39 23.884 -12.209 -15.131 1.00 1.00 C ATOM 1440 C ASP B 39 23.072 -11.488 -16.207 1.00 1.00 C ATOM 1441 O ASP B 39 22.831 -12.041 -17.279 1.00 1.00 O ATOM 1442 CB ASP B 39 23.006 -13.267 -14.465 1.00 1.00 C ATOM 1443 CG ASP B 39 22.673 -14.410 -15.422 1.00 1.00 C ATOM 1444 OD1 ASP B 39 23.629 -15.070 -15.887 1.00 1.00 O ATOM 1445 OD2 ASP B 39 21.466 -14.615 -15.680 1.00 1.00 O ATOM 0 H ASP B 39 23.899 -11.412 -13.206 1.00 1.00 H new ATOM 0 HA ASP B 39 24.752 -12.673 -15.600 1.00 1.00 H new ATOM 0 HB2 ASP B 39 23.517 -13.664 -13.588 1.00 1.00 H new ATOM 0 HB3 ASP B 39 22.083 -12.805 -14.114 1.00 1.00 H new ATOM 1450 N VAL B 40 22.651 -10.251 -15.917 1.00 1.00 N ATOM 1451 CA VAL B 40 21.857 -9.437 -16.825 1.00 1.00 C ATOM 1452 C VAL B 40 22.447 -8.033 -16.906 1.00 1.00 C ATOM 1453 O VAL B 40 23.350 -7.688 -16.141 1.00 1.00 O ATOM 1454 CB VAL B 40 20.393 -9.401 -16.365 1.00 1.00 C ATOM 1455 CG1 VAL B 40 19.855 -10.819 -16.159 1.00 1.00 C ATOM 1456 CG2 VAL B 40 20.225 -8.647 -15.048 1.00 1.00 C ATOM 0 H VAL B 40 22.859 -9.788 -15.032 1.00 1.00 H new ATOM 0 HA VAL B 40 21.881 -9.877 -17.822 1.00 1.00 H new ATOM 0 HB VAL B 40 19.839 -8.887 -17.150 1.00 1.00 H new ATOM 0 HG11 VAL B 40 18.816 -10.770 -15.833 1.00 1.00 H new ATOM 0 HG12 VAL B 40 19.916 -11.371 -17.097 1.00 1.00 H new ATOM 0 HG13 VAL B 40 20.450 -11.327 -15.400 1.00 1.00 H new ATOM 0 HG21 VAL B 40 19.174 -8.647 -14.761 1.00 1.00 H new ATOM 0 HG22 VAL B 40 20.813 -9.136 -14.271 1.00 1.00 H new ATOM 0 HG23 VAL B 40 20.568 -7.620 -15.171 1.00 1.00 H new ATOM 1466 N ALA B 41 21.942 -7.218 -17.834 1.00 1.00 N ATOM 1467 CA ALA B 41 22.448 -5.871 -18.028 1.00 1.00 C ATOM 1468 C ALA B 41 21.390 -4.836 -17.660 1.00 1.00 C ATOM 1469 O ALA B 41 20.198 -5.139 -17.626 1.00 1.00 O ATOM 1470 CB ALA B 41 22.896 -5.710 -19.479 1.00 1.00 C ATOM 0 H ALA B 41 21.180 -7.475 -18.462 1.00 1.00 H new ATOM 0 HA ALA B 41 23.303 -5.707 -17.372 1.00 1.00 H new ATOM 0 HB1 ALA B 41 23.277 -4.700 -19.632 1.00 1.00 H new ATOM 0 HB2 ALA B 41 23.682 -6.432 -19.699 1.00 1.00 H new ATOM 0 HB3 ALA B 41 22.049 -5.882 -20.143 1.00 1.00 H new ATOM 1476 N VAL B 42 21.844 -3.612 -17.386 1.00 1.00 N ATOM 1477 CA VAL B 42 20.989 -2.478 -17.067 1.00 1.00 C ATOM 1478 C VAL B 42 21.661 -1.203 -17.561 1.00 1.00 C ATOM 1479 O VAL B 42 22.730 -0.825 -17.084 1.00 1.00 O ATOM 1480 CB VAL B 42 20.673 -2.427 -15.561 1.00 1.00 C ATOM 1481 CG1 VAL B 42 21.855 -2.870 -14.701 1.00 1.00 C ATOM 1482 CG2 VAL B 42 20.249 -1.021 -15.128 1.00 1.00 C ATOM 0 H VAL B 42 22.838 -3.381 -17.381 1.00 1.00 H new ATOM 0 HA VAL B 42 20.030 -2.584 -17.574 1.00 1.00 H new ATOM 0 HB VAL B 42 19.850 -3.125 -15.406 1.00 1.00 H new ATOM 0 HG11 VAL B 42 21.579 -2.815 -13.648 1.00 1.00 H new ATOM 0 HG12 VAL B 42 22.124 -3.896 -14.953 1.00 1.00 H new ATOM 0 HG13 VAL B 42 22.706 -2.215 -14.888 1.00 1.00 H new ATOM 0 HG21 VAL B 42 20.033 -1.019 -14.060 1.00 1.00 H new ATOM 0 HG22 VAL B 42 21.055 -0.317 -15.337 1.00 1.00 H new ATOM 0 HG23 VAL B 42 19.357 -0.724 -15.679 1.00 1.00 H new ATOM 1492 N HIS B 43 21.023 -0.538 -18.528 1.00 1.00 N ATOM 1493 CA HIS B 43 21.516 0.709 -19.096 1.00 1.00 C ATOM 1494 C HIS B 43 20.364 1.685 -19.317 1.00 1.00 C ATOM 1495 O HIS B 43 19.215 1.279 -19.476 1.00 1.00 O ATOM 1496 CB HIS B 43 22.242 0.428 -20.417 1.00 1.00 C ATOM 1497 CG HIS B 43 23.514 -0.361 -20.242 1.00 1.00 C ATOM 1498 ND1 HIS B 43 24.794 0.134 -20.351 1.00 1.00 N ATOM 1499 CD2 HIS B 43 23.609 -1.694 -19.945 1.00 1.00 C ATOM 1500 CE1 HIS B 43 25.642 -0.876 -20.085 1.00 1.00 C ATOM 1501 NE2 HIS B 43 24.966 -2.012 -19.840 1.00 1.00 N ATOM 0 H HIS B 43 20.145 -0.856 -18.938 1.00 1.00 H new ATOM 0 HA HIS B 43 22.219 1.162 -18.397 1.00 1.00 H new ATOM 0 HB2 HIS B 43 21.573 -0.118 -21.082 1.00 1.00 H new ATOM 0 HB3 HIS B 43 22.474 1.375 -20.905 1.00 1.00 H new ATOM 0 HD2 HIS B 43 22.783 -2.378 -19.815 1.00 1.00 H new ATOM 0 HE1 HIS B 43 26.718 -0.787 -20.070 1.00 1.00 H new ATOM 0 HE2 HIS B 43 25.364 -2.925 -19.621 1.00 1.00 H new ATOM 1509 N ARG B 44 20.684 2.980 -19.327 1.00 1.00 N ATOM 1510 CA ARG B 44 19.729 4.060 -19.546 1.00 1.00 C ATOM 1511 C ARG B 44 19.427 4.215 -21.035 1.00 1.00 C ATOM 1512 O ARG B 44 20.182 3.732 -21.876 1.00 1.00 O ATOM 1513 CB ARG B 44 20.335 5.346 -18.981 1.00 1.00 C ATOM 1514 CG ARG B 44 21.629 5.657 -19.730 1.00 1.00 C ATOM 1515 CD ARG B 44 22.630 6.444 -18.889 1.00 1.00 C ATOM 1516 NE ARG B 44 22.356 7.878 -18.957 1.00 1.00 N ATOM 1517 CZ ARG B 44 23.191 8.827 -18.530 1.00 1.00 C ATOM 1518 NH1 ARG B 44 24.352 8.503 -17.967 1.00 1.00 N ATOM 1519 NH2 ARG B 44 22.864 10.109 -18.668 1.00 1.00 N ATOM 0 H ARG B 44 21.637 3.311 -19.179 1.00 1.00 H new ATOM 0 HA ARG B 44 18.788 3.838 -19.044 1.00 1.00 H new ATOM 0 HB2 ARG B 44 19.631 6.172 -19.086 1.00 1.00 H new ATOM 0 HB3 ARG B 44 20.535 5.232 -17.916 1.00 1.00 H new ATOM 0 HG2 ARG B 44 22.089 4.723 -20.053 1.00 1.00 H new ATOM 0 HG3 ARG B 44 21.394 6.224 -20.630 1.00 1.00 H new ATOM 0 HD2 ARG B 44 22.582 6.110 -17.853 1.00 1.00 H new ATOM 0 HD3 ARG B 44 23.642 6.246 -19.242 1.00 1.00 H new ATOM 0 HE ARG B 44 21.466 8.173 -19.358 1.00 1.00 H new ATOM 0 HH11 ARG B 44 24.610 7.522 -17.859 1.00 1.00 H new ATOM 0 HH12 ARG B 44 24.984 9.235 -17.644 1.00 1.00 H new ATOM 0 HH21 ARG B 44 21.976 10.365 -19.100 1.00 1.00 H new ATOM 0 HH22 ARG B 44 23.501 10.836 -18.342 1.00 1.00 H new