USER MOD reduce.3.24.130724 H: found=0, std=0, add=706, rem=0, adj=15 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 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 MET CE :methyl 157:sc= -4.36! (180deg=-6.4!) USER MOD Single : A 21 ASN : amide:sc= -0.846 K(o=-0.85,f=-2.3) USER MOD Single : A 22 TYR OH : rot 180:sc= 0 USER MOD Single : A 25 TYR OH : rot -37:sc= 0.035 USER MOD Single : A 28 SER OG : rot 180:sc=0.000165 USER MOD Single : A 35 THR OG1 : rot 67:sc= 0.981 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 THR OG1 : rot 68:sc= -3.83! USER MOD Single : A 56 THR OG1 : rot 130:sc= 0.673 USER MOD Single : A 59 TYR OH : rot 180:sc= -0.643 USER MOD Single : A 63 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 SER OG : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 LYS NZ :NH3+ 160:sc= -0.0519 (180deg=-0.33) USER MOD Single : A 75 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 86 MET CE :methyl -175:sc= -0.681 (180deg=-0.716) USER MOD Single : A 87 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 91 SER OG : rot 89:sc= 0.756 USER MOD Single : A 92 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 75 N LEU A 5 9.899 -7.646 -6.628 1.00 0.00 N ATOM 76 CA LEU A 5 10.939 -7.569 -7.648 1.00 0.00 C ATOM 77 C LEU A 5 11.161 -8.928 -8.304 1.00 0.00 C ATOM 78 O LEU A 5 11.071 -9.967 -7.650 1.00 0.00 O ATOM 79 CB LEU A 5 12.247 -7.067 -7.033 1.00 0.00 C ATOM 80 CG LEU A 5 12.363 -5.554 -6.844 1.00 0.00 C ATOM 81 CD1 LEU A 5 12.224 -4.838 -8.178 1.00 0.00 C ATOM 82 CD2 LEU A 5 11.316 -5.058 -5.858 1.00 0.00 C ATOM 0 HA LEU A 5 10.611 -6.866 -8.414 1.00 0.00 H new ATOM 0 HB2 LEU A 5 12.376 -7.545 -6.062 1.00 0.00 H new ATOM 0 HB3 LEU A 5 13.072 -7.399 -7.663 1.00 0.00 H new ATOM 0 HG LEU A 5 13.350 -5.332 -6.437 1.00 0.00 H new ATOM 0 HD11 LEU A 5 12.309 -3.762 -8.024 1.00 0.00 H new ATOM 0 HD12 LEU A 5 13.012 -5.171 -8.854 1.00 0.00 H new ATOM 0 HD13 LEU A 5 11.251 -5.066 -8.614 1.00 0.00 H new ATOM 0 HD21 LEU A 5 11.413 -3.979 -5.736 1.00 0.00 H new ATOM 0 HD22 LEU A 5 10.321 -5.292 -6.236 1.00 0.00 H new ATOM 0 HD23 LEU A 5 11.463 -5.547 -4.895 1.00 0.00 H new ATOM 94 N LYS A 6 11.453 -8.913 -9.600 1.00 0.00 N ATOM 95 CA LYS A 6 11.691 -10.143 -10.346 1.00 0.00 C ATOM 96 C LYS A 6 13.043 -10.098 -11.050 1.00 0.00 C ATOM 97 O LYS A 6 13.362 -9.132 -11.743 1.00 0.00 O ATOM 98 CB LYS A 6 10.577 -10.367 -11.370 1.00 0.00 C ATOM 99 CG LYS A 6 10.173 -9.106 -12.115 1.00 0.00 C ATOM 100 CD LYS A 6 9.065 -9.381 -13.118 1.00 0.00 C ATOM 101 CE LYS A 6 7.772 -9.778 -12.423 1.00 0.00 C ATOM 102 NZ LYS A 6 6.602 -9.695 -13.341 1.00 0.00 N ATOM 0 H LYS A 6 11.531 -8.061 -10.156 1.00 0.00 H new ATOM 0 HA LYS A 6 11.697 -10.972 -9.639 1.00 0.00 H new ATOM 0 HB2 LYS A 6 10.903 -11.116 -12.091 1.00 0.00 H new ATOM 0 HB3 LYS A 6 9.703 -10.774 -10.861 1.00 0.00 H new ATOM 0 HG2 LYS A 6 9.840 -8.352 -11.402 1.00 0.00 H new ATOM 0 HG3 LYS A 6 11.040 -8.695 -12.633 1.00 0.00 H new ATOM 0 HD2 LYS A 6 8.895 -8.493 -13.727 1.00 0.00 H new ATOM 0 HD3 LYS A 6 9.375 -10.177 -13.795 1.00 0.00 H new ATOM 0 HE2 LYS A 6 7.862 -10.795 -12.041 1.00 0.00 H new ATOM 0 HE3 LYS A 6 7.607 -9.128 -11.564 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 5.740 -9.973 -12.830 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 6.500 -8.719 -13.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 6.748 -10.334 -14.148 1.00 0.00 H new ATOM 116 N VAL A 7 13.834 -11.152 -10.871 1.00 0.00 N ATOM 117 CA VAL A 7 15.151 -11.234 -11.492 1.00 0.00 C ATOM 118 C VAL A 7 15.220 -12.392 -12.482 1.00 0.00 C ATOM 119 O VAL A 7 14.882 -13.528 -12.150 1.00 0.00 O ATOM 120 CB VAL A 7 16.259 -11.408 -10.437 1.00 0.00 C ATOM 121 CG1 VAL A 7 16.506 -10.099 -9.701 1.00 0.00 C ATOM 122 CG2 VAL A 7 15.896 -12.517 -9.461 1.00 0.00 C ATOM 0 H VAL A 7 13.585 -11.961 -10.301 1.00 0.00 H new ATOM 0 HA VAL A 7 15.310 -10.296 -12.023 1.00 0.00 H new ATOM 0 HB VAL A 7 17.180 -11.691 -10.946 1.00 0.00 H new ATOM 0 HG11 VAL A 7 17.292 -10.241 -8.959 1.00 0.00 H new ATOM 0 HG12 VAL A 7 16.813 -9.333 -10.413 1.00 0.00 H new ATOM 0 HG13 VAL A 7 15.590 -9.783 -9.202 1.00 0.00 H new ATOM 0 HG21 VAL A 7 16.690 -12.626 -8.722 1.00 0.00 H new ATOM 0 HG22 VAL A 7 14.963 -12.266 -8.956 1.00 0.00 H new ATOM 0 HG23 VAL A 7 15.774 -13.454 -10.004 1.00 0.00 H new ATOM 132 N LYS A 8 15.662 -12.096 -13.699 1.00 0.00 N ATOM 133 CA LYS A 8 15.779 -13.112 -14.739 1.00 0.00 C ATOM 134 C LYS A 8 17.102 -12.977 -15.485 1.00 0.00 C ATOM 135 O LYS A 8 17.691 -11.898 -15.534 1.00 0.00 O ATOM 136 CB LYS A 8 14.612 -13.000 -15.723 1.00 0.00 C ATOM 137 CG LYS A 8 14.567 -11.675 -16.465 1.00 0.00 C ATOM 138 CD LYS A 8 13.676 -10.669 -15.755 1.00 0.00 C ATOM 139 CE LYS A 8 12.234 -10.773 -16.226 1.00 0.00 C ATOM 140 NZ LYS A 8 11.491 -9.498 -16.021 1.00 0.00 N ATOM 0 H LYS A 8 15.945 -11.160 -13.990 1.00 0.00 H new ATOM 0 HA LYS A 8 15.751 -14.091 -14.261 1.00 0.00 H new ATOM 0 HB2 LYS A 8 14.680 -13.811 -16.448 1.00 0.00 H new ATOM 0 HB3 LYS A 8 13.676 -13.135 -15.181 1.00 0.00 H new ATOM 0 HG2 LYS A 8 15.576 -11.271 -16.552 1.00 0.00 H new ATOM 0 HG3 LYS A 8 14.200 -11.837 -17.478 1.00 0.00 H new ATOM 0 HD2 LYS A 8 13.722 -10.837 -14.679 1.00 0.00 H new ATOM 0 HD3 LYS A 8 14.047 -9.660 -15.936 1.00 0.00 H new ATOM 0 HE2 LYS A 8 12.215 -11.039 -17.283 1.00 0.00 H new ATOM 0 HE3 LYS A 8 11.733 -11.577 -15.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 10.512 -9.609 -16.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 11.487 -9.257 -15.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 11.955 -8.736 -16.556 1.00 0.00 H new ATOM 154 N VAL A 9 17.563 -14.080 -16.067 1.00 0.00 N ATOM 155 CA VAL A 9 18.816 -14.084 -16.813 1.00 0.00 C ATOM 156 C VAL A 9 18.678 -13.313 -18.121 1.00 0.00 C ATOM 157 O VAL A 9 17.757 -13.553 -18.900 1.00 0.00 O ATOM 158 CB VAL A 9 19.280 -15.520 -17.122 1.00 0.00 C ATOM 159 CG1 VAL A 9 20.602 -15.503 -17.874 1.00 0.00 C ATOM 160 CG2 VAL A 9 19.397 -16.329 -15.840 1.00 0.00 C ATOM 0 H VAL A 9 17.088 -14.982 -16.036 1.00 0.00 H new ATOM 0 HA VAL A 9 19.561 -13.597 -16.184 1.00 0.00 H new ATOM 0 HB VAL A 9 18.534 -15.996 -17.758 1.00 0.00 H new ATOM 0 HG11 VAL A 9 20.914 -16.526 -18.084 1.00 0.00 H new ATOM 0 HG12 VAL A 9 20.480 -14.961 -18.812 1.00 0.00 H new ATOM 0 HG13 VAL A 9 21.360 -15.010 -17.266 1.00 0.00 H new ATOM 0 HG21 VAL A 9 19.726 -17.341 -16.077 1.00 0.00 H new ATOM 0 HG22 VAL A 9 20.123 -15.858 -15.177 1.00 0.00 H new ATOM 0 HG23 VAL A 9 18.427 -16.369 -15.345 1.00 0.00 H new ATOM 170 N GLU A 10 19.603 -12.387 -18.355 1.00 0.00 N ATOM 171 CA GLU A 10 19.584 -11.580 -19.570 1.00 0.00 C ATOM 172 C GLU A 10 20.736 -11.963 -20.495 1.00 0.00 C ATOM 173 O GLU A 10 20.680 -11.730 -21.703 1.00 0.00 O ATOM 174 CB GLU A 10 19.667 -10.093 -19.222 1.00 0.00 C ATOM 175 CG GLU A 10 20.960 -9.701 -18.527 1.00 0.00 C ATOM 176 CD GLU A 10 21.359 -8.264 -18.804 1.00 0.00 C ATOM 177 OE1 GLU A 10 20.461 -7.445 -19.092 1.00 0.00 O ATOM 178 OE2 GLU A 10 22.568 -7.960 -18.733 1.00 0.00 O ATOM 0 H GLU A 10 20.374 -12.177 -17.721 1.00 0.00 H new ATOM 0 HA GLU A 10 18.645 -11.772 -20.089 1.00 0.00 H new ATOM 0 HB2 GLU A 10 19.564 -9.508 -20.136 1.00 0.00 H new ATOM 0 HB3 GLU A 10 18.826 -9.831 -18.580 1.00 0.00 H new ATOM 0 HG2 GLU A 10 20.848 -9.842 -17.452 1.00 0.00 H new ATOM 0 HG3 GLU A 10 21.760 -10.366 -18.854 1.00 0.00 H new ATOM 185 N ASP A 11 21.779 -12.549 -19.919 1.00 0.00 N ATOM 186 CA ASP A 11 22.945 -12.965 -20.690 1.00 0.00 C ATOM 187 C ASP A 11 23.895 -13.796 -19.834 1.00 0.00 C ATOM 188 O ASP A 11 24.528 -13.281 -18.912 1.00 0.00 O ATOM 189 CB ASP A 11 23.677 -11.742 -21.247 1.00 0.00 C ATOM 190 CG ASP A 11 24.501 -12.071 -22.476 1.00 0.00 C ATOM 191 OD1 ASP A 11 23.901 -12.335 -23.539 1.00 0.00 O ATOM 192 OD2 ASP A 11 25.746 -12.064 -22.375 1.00 0.00 O ATOM 0 H ASP A 11 21.841 -12.747 -18.920 1.00 0.00 H new ATOM 0 HA ASP A 11 22.600 -13.582 -21.520 1.00 0.00 H new ATOM 0 HB2 ASP A 11 22.950 -10.969 -21.497 1.00 0.00 H new ATOM 0 HB3 ASP A 11 24.328 -11.330 -20.476 1.00 0.00 H new ATOM 197 N PHE A 12 23.989 -15.085 -20.144 1.00 0.00 N ATOM 198 CA PHE A 12 24.860 -15.988 -19.402 1.00 0.00 C ATOM 199 C PHE A 12 26.093 -16.353 -20.224 1.00 0.00 C ATOM 200 O PHE A 12 26.087 -16.253 -21.450 1.00 0.00 O ATOM 201 CB PHE A 12 24.101 -17.257 -19.011 1.00 0.00 C ATOM 202 CG PHE A 12 23.505 -17.984 -20.183 1.00 0.00 C ATOM 203 CD1 PHE A 12 24.294 -18.788 -20.990 1.00 0.00 C ATOM 204 CD2 PHE A 12 22.157 -17.863 -20.478 1.00 0.00 C ATOM 205 CE1 PHE A 12 23.750 -19.459 -22.069 1.00 0.00 C ATOM 206 CE2 PHE A 12 21.607 -18.532 -21.555 1.00 0.00 C ATOM 207 CZ PHE A 12 22.404 -19.330 -22.352 1.00 0.00 C ATOM 0 H PHE A 12 23.472 -15.527 -20.904 1.00 0.00 H new ATOM 0 HA PHE A 12 25.187 -15.475 -18.497 1.00 0.00 H new ATOM 0 HB2 PHE A 12 24.779 -17.928 -18.484 1.00 0.00 H new ATOM 0 HB3 PHE A 12 23.306 -16.995 -18.314 1.00 0.00 H new ATOM 0 HD1 PHE A 12 25.347 -18.892 -20.773 1.00 0.00 H new ATOM 0 HD2 PHE A 12 21.529 -17.239 -19.860 1.00 0.00 H new ATOM 0 HE1 PHE A 12 24.376 -20.083 -22.690 1.00 0.00 H new ATOM 0 HE2 PHE A 12 20.554 -18.431 -21.773 1.00 0.00 H new ATOM 0 HZ PHE A 12 21.976 -19.852 -23.195 1.00 0.00 H new ATOM 217 N GLY A 13 27.151 -16.776 -19.538 1.00 0.00 N ATOM 218 CA GLY A 13 28.377 -17.148 -20.220 1.00 0.00 C ATOM 219 C GLY A 13 29.419 -17.709 -19.273 1.00 0.00 C ATOM 220 O GLY A 13 29.369 -17.465 -18.067 1.00 0.00 O ATOM 0 H GLY A 13 27.181 -16.868 -18.523 1.00 0.00 H new ATOM 0 HA2 GLY A 13 28.152 -17.888 -20.988 1.00 0.00 H new ATOM 0 HA3 GLY A 13 28.785 -16.275 -20.729 1.00 0.00 H new ATOM 224 N PHE A 14 30.367 -18.464 -19.819 1.00 0.00 N ATOM 225 CA PHE A 14 31.425 -19.063 -19.015 1.00 0.00 C ATOM 226 C PHE A 14 32.800 -18.622 -19.507 1.00 0.00 C ATOM 227 O PHE A 14 33.039 -18.529 -20.712 1.00 0.00 O ATOM 228 CB PHE A 14 31.323 -20.590 -19.054 1.00 0.00 C ATOM 229 CG PHE A 14 32.544 -21.286 -18.527 1.00 0.00 C ATOM 230 CD1 PHE A 14 32.819 -21.299 -17.169 1.00 0.00 C ATOM 231 CD2 PHE A 14 33.419 -21.928 -19.390 1.00 0.00 C ATOM 232 CE1 PHE A 14 33.942 -21.940 -16.680 1.00 0.00 C ATOM 233 CE2 PHE A 14 34.543 -22.570 -18.907 1.00 0.00 C ATOM 234 CZ PHE A 14 34.806 -22.575 -17.551 1.00 0.00 C ATOM 0 H PHE A 14 30.424 -18.675 -20.815 1.00 0.00 H new ATOM 0 HA PHE A 14 31.301 -18.723 -17.987 1.00 0.00 H new ATOM 0 HB2 PHE A 14 30.456 -20.903 -18.472 1.00 0.00 H new ATOM 0 HB3 PHE A 14 31.148 -20.908 -20.082 1.00 0.00 H new ATOM 0 HD1 PHE A 14 32.148 -20.802 -16.484 1.00 0.00 H new ATOM 0 HD2 PHE A 14 33.220 -21.926 -20.451 1.00 0.00 H new ATOM 0 HE1 PHE A 14 34.143 -21.944 -15.619 1.00 0.00 H new ATOM 0 HE2 PHE A 14 35.216 -23.068 -19.590 1.00 0.00 H new ATOM 0 HZ PHE A 14 35.686 -23.074 -17.172 1.00 0.00 H new ATOM 244 N ARG A 15 33.699 -18.349 -18.568 1.00 0.00 N ATOM 245 CA ARG A 15 35.050 -17.916 -18.905 1.00 0.00 C ATOM 246 C ARG A 15 36.068 -19.003 -18.578 1.00 0.00 C ATOM 247 O ARG A 15 36.322 -19.297 -17.410 1.00 0.00 O ATOM 248 CB ARG A 15 35.399 -16.631 -18.151 1.00 0.00 C ATOM 249 CG ARG A 15 36.158 -15.618 -18.993 1.00 0.00 C ATOM 250 CD ARG A 15 35.215 -14.784 -19.846 1.00 0.00 C ATOM 251 NE ARG A 15 34.910 -15.433 -21.119 1.00 0.00 N ATOM 252 CZ ARG A 15 35.797 -15.589 -22.095 1.00 0.00 C ATOM 253 NH1 ARG A 15 37.037 -15.145 -21.945 1.00 0.00 N ATOM 254 NH2 ARG A 15 35.444 -16.190 -23.224 1.00 0.00 N ATOM 0 H ARG A 15 33.517 -18.420 -17.567 1.00 0.00 H new ATOM 0 HA ARG A 15 35.085 -17.722 -19.977 1.00 0.00 H new ATOM 0 HB2 ARG A 15 34.480 -16.172 -17.787 1.00 0.00 H new ATOM 0 HB3 ARG A 15 35.997 -16.884 -17.276 1.00 0.00 H new ATOM 0 HG2 ARG A 15 36.737 -14.963 -18.342 1.00 0.00 H new ATOM 0 HG3 ARG A 15 36.869 -16.137 -19.636 1.00 0.00 H new ATOM 0 HD2 ARG A 15 34.289 -14.609 -19.298 1.00 0.00 H new ATOM 0 HD3 ARG A 15 35.664 -13.809 -20.035 1.00 0.00 H new ATOM 0 HE ARG A 15 33.964 -15.785 -21.266 1.00 0.00 H new ATOM 0 HH11 ARG A 15 37.312 -14.682 -21.078 1.00 0.00 H new ATOM 0 HH12 ARG A 15 37.716 -15.266 -22.696 1.00 0.00 H new ATOM 0 HH21 ARG A 15 34.491 -16.533 -23.343 1.00 0.00 H new ATOM 0 HH22 ARG A 15 36.126 -16.309 -23.973 1.00 0.00 H new ATOM 268 N GLU A 16 36.647 -19.597 -19.617 1.00 0.00 N ATOM 269 CA GLU A 16 37.636 -20.654 -19.439 1.00 0.00 C ATOM 270 C GLU A 16 38.943 -20.088 -18.890 1.00 0.00 C ATOM 271 O GLU A 16 39.714 -20.794 -18.240 1.00 0.00 O ATOM 272 CB GLU A 16 37.895 -21.370 -20.766 1.00 0.00 C ATOM 273 CG GLU A 16 38.460 -20.464 -21.846 1.00 0.00 C ATOM 274 CD GLU A 16 38.609 -21.169 -23.180 1.00 0.00 C ATOM 275 OE1 GLU A 16 38.729 -22.412 -23.185 1.00 0.00 O ATOM 276 OE2 GLU A 16 38.606 -20.478 -24.220 1.00 0.00 O ATOM 0 H GLU A 16 36.448 -19.364 -20.590 1.00 0.00 H new ATOM 0 HA GLU A 16 37.239 -21.371 -18.720 1.00 0.00 H new ATOM 0 HB2 GLU A 16 38.588 -22.194 -20.595 1.00 0.00 H new ATOM 0 HB3 GLU A 16 36.962 -21.807 -21.122 1.00 0.00 H new ATOM 0 HG2 GLU A 16 37.808 -19.599 -21.967 1.00 0.00 H new ATOM 0 HG3 GLU A 16 39.432 -20.088 -21.528 1.00 0.00 H new ATOM 283 N ASP A 17 39.186 -18.809 -19.158 1.00 0.00 N ATOM 284 CA ASP A 17 40.399 -18.147 -18.692 1.00 0.00 C ATOM 285 C ASP A 17 40.385 -17.995 -17.174 1.00 0.00 C ATOM 286 O ASP A 17 41.436 -17.926 -16.538 1.00 0.00 O ATOM 287 CB ASP A 17 40.543 -16.776 -19.353 1.00 0.00 C ATOM 288 CG ASP A 17 41.626 -15.933 -18.708 1.00 0.00 C ATOM 289 OD1 ASP A 17 42.815 -16.166 -19.006 1.00 0.00 O ATOM 290 OD2 ASP A 17 41.283 -15.041 -17.904 1.00 0.00 O ATOM 0 H ASP A 17 38.559 -18.210 -19.695 1.00 0.00 H new ATOM 0 HA ASP A 17 41.252 -18.766 -18.970 1.00 0.00 H new ATOM 0 HB2 ASP A 17 40.771 -16.908 -20.411 1.00 0.00 H new ATOM 0 HB3 ASP A 17 39.592 -16.247 -19.296 1.00 0.00 H new ATOM 295 N MET A 18 39.187 -17.941 -16.600 1.00 0.00 N ATOM 296 CA MET A 18 39.037 -17.796 -15.157 1.00 0.00 C ATOM 297 C MET A 18 38.715 -19.138 -14.507 1.00 0.00 C ATOM 298 O MET A 18 39.184 -19.436 -13.409 1.00 0.00 O ATOM 299 CB MET A 18 37.937 -16.783 -14.836 1.00 0.00 C ATOM 300 CG MET A 18 38.412 -15.339 -14.871 1.00 0.00 C ATOM 301 SD MET A 18 37.365 -14.240 -13.898 1.00 0.00 S ATOM 302 CE MET A 18 35.866 -14.244 -14.879 1.00 0.00 C ATOM 0 H MET A 18 38.307 -17.995 -17.112 1.00 0.00 H new ATOM 0 HA MET A 18 39.982 -17.434 -14.753 1.00 0.00 H new ATOM 0 HB2 MET A 18 37.122 -16.906 -15.549 1.00 0.00 H new ATOM 0 HB3 MET A 18 37.532 -17.000 -13.848 1.00 0.00 H new ATOM 0 HG2 MET A 18 39.434 -15.288 -14.496 1.00 0.00 H new ATOM 0 HG3 MET A 18 38.434 -14.993 -15.904 1.00 0.00 H new ATOM 0 HE1 MET A 18 35.019 -13.972 -14.250 1.00 0.00 H new ATOM 0 HE2 MET A 18 35.961 -13.523 -15.691 1.00 0.00 H new ATOM 0 HE3 MET A 18 35.705 -15.239 -15.294 1.00 0.00 H new ATOM 312 N GLY A 19 37.909 -19.944 -15.192 1.00 0.00 N ATOM 313 CA GLY A 19 37.537 -21.244 -14.664 1.00 0.00 C ATOM 314 C GLY A 19 36.233 -21.205 -13.892 1.00 0.00 C ATOM 315 O GLY A 19 35.925 -22.125 -13.132 1.00 0.00 O ATOM 0 H GLY A 19 37.507 -19.720 -16.102 1.00 0.00 H new ATOM 0 HA2 GLY A 19 37.448 -21.954 -15.486 1.00 0.00 H new ATOM 0 HA3 GLY A 19 38.331 -21.609 -14.012 1.00 0.00 H new ATOM 319 N LEU A 20 35.466 -20.138 -14.084 1.00 0.00 N ATOM 320 CA LEU A 20 34.188 -19.982 -13.398 1.00 0.00 C ATOM 321 C LEU A 20 33.100 -19.534 -14.369 1.00 0.00 C ATOM 322 O LEU A 20 33.391 -19.041 -15.457 1.00 0.00 O ATOM 323 CB LEU A 20 34.319 -18.970 -12.258 1.00 0.00 C ATOM 324 CG LEU A 20 35.196 -17.749 -12.542 1.00 0.00 C ATOM 325 CD1 LEU A 20 34.544 -16.855 -13.585 1.00 0.00 C ATOM 326 CD2 LEU A 20 35.460 -16.973 -11.260 1.00 0.00 C ATOM 0 H LEU A 20 35.706 -19.368 -14.709 1.00 0.00 H new ATOM 0 HA LEU A 20 33.904 -20.950 -12.985 1.00 0.00 H new ATOM 0 HB2 LEU A 20 33.321 -18.622 -11.992 1.00 0.00 H new ATOM 0 HB3 LEU A 20 34.720 -19.486 -11.385 1.00 0.00 H new ATOM 0 HG LEU A 20 36.151 -18.095 -12.937 1.00 0.00 H new ATOM 0 HD11 LEU A 20 35.182 -15.992 -13.774 1.00 0.00 H new ATOM 0 HD12 LEU A 20 34.407 -17.415 -14.510 1.00 0.00 H new ATOM 0 HD13 LEU A 20 33.575 -16.517 -13.219 1.00 0.00 H new ATOM 0 HD21 LEU A 20 36.085 -16.108 -11.481 1.00 0.00 H new ATOM 0 HD22 LEU A 20 34.513 -16.638 -10.836 1.00 0.00 H new ATOM 0 HD23 LEU A 20 35.971 -17.617 -10.544 1.00 0.00 H new ATOM 338 N ASN A 21 31.846 -19.707 -13.965 1.00 0.00 N ATOM 339 CA ASN A 21 30.714 -19.319 -14.798 1.00 0.00 C ATOM 340 C ASN A 21 30.109 -18.004 -14.317 1.00 0.00 C ATOM 341 O ASN A 21 30.101 -17.714 -13.120 1.00 0.00 O ATOM 342 CB ASN A 21 29.648 -20.417 -14.791 1.00 0.00 C ATOM 343 CG ASN A 21 30.191 -21.754 -15.258 1.00 0.00 C ATOM 344 OD1 ASN A 21 31.132 -22.292 -14.675 1.00 0.00 O ATOM 345 ND2 ASN A 21 29.598 -22.296 -16.315 1.00 0.00 N ATOM 0 H ASN A 21 31.588 -20.113 -13.066 1.00 0.00 H new ATOM 0 HA ASN A 21 31.076 -19.180 -15.817 1.00 0.00 H new ATOM 0 HB2 ASN A 21 29.246 -20.523 -13.783 1.00 0.00 H new ATOM 0 HB3 ASN A 21 28.820 -20.120 -15.434 1.00 0.00 H new ATOM 0 HD21 ASN A 21 29.919 -23.195 -16.675 1.00 0.00 H new ATOM 0 HD22 ASN A 21 28.821 -21.814 -16.767 1.00 0.00 H new ATOM 352 N TYR A 22 29.602 -17.213 -15.256 1.00 0.00 N ATOM 353 CA TYR A 22 28.997 -15.928 -14.928 1.00 0.00 C ATOM 354 C TYR A 22 27.659 -15.758 -15.642 1.00 0.00 C ATOM 355 O TYR A 22 27.412 -16.376 -16.678 1.00 0.00 O ATOM 356 CB TYR A 22 29.939 -14.785 -15.308 1.00 0.00 C ATOM 357 CG TYR A 22 30.017 -14.533 -16.797 1.00 0.00 C ATOM 358 CD1 TYR A 22 29.097 -13.707 -17.430 1.00 0.00 C ATOM 359 CD2 TYR A 22 31.009 -15.123 -17.570 1.00 0.00 C ATOM 360 CE1 TYR A 22 29.163 -13.475 -18.791 1.00 0.00 C ATOM 361 CE2 TYR A 22 31.084 -14.895 -18.931 1.00 0.00 C ATOM 362 CZ TYR A 22 30.159 -14.070 -19.536 1.00 0.00 C ATOM 363 OH TYR A 22 30.230 -13.842 -20.891 1.00 0.00 O ATOM 0 H TYR A 22 29.598 -17.439 -16.251 1.00 0.00 H new ATOM 0 HA TYR A 22 28.821 -15.902 -13.853 1.00 0.00 H new ATOM 0 HB2 TYR A 22 29.609 -13.873 -14.811 1.00 0.00 H new ATOM 0 HB3 TYR A 22 30.938 -15.009 -14.933 1.00 0.00 H new ATOM 0 HD1 TYR A 22 28.317 -13.238 -16.849 1.00 0.00 H new ATOM 0 HD2 TYR A 22 31.734 -15.771 -17.099 1.00 0.00 H new ATOM 0 HE1 TYR A 22 28.439 -12.831 -19.268 1.00 0.00 H new ATOM 0 HE2 TYR A 22 31.862 -15.360 -19.517 1.00 0.00 H new ATOM 0 HH TYR A 22 30.990 -14.334 -21.266 1.00 0.00 H new ATOM 373 N VAL A 23 26.799 -14.915 -15.080 1.00 0.00 N ATOM 374 CA VAL A 23 25.486 -14.661 -15.662 1.00 0.00 C ATOM 375 C VAL A 23 24.991 -13.263 -15.311 1.00 0.00 C ATOM 376 O VAL A 23 25.199 -12.781 -14.197 1.00 0.00 O ATOM 377 CB VAL A 23 24.450 -15.696 -15.184 1.00 0.00 C ATOM 378 CG1 VAL A 23 24.486 -15.827 -13.669 1.00 0.00 C ATOM 379 CG2 VAL A 23 23.058 -15.314 -15.662 1.00 0.00 C ATOM 0 H VAL A 23 26.988 -14.396 -14.222 1.00 0.00 H new ATOM 0 HA VAL A 23 25.598 -14.743 -16.743 1.00 0.00 H new ATOM 0 HB VAL A 23 24.704 -16.665 -15.614 1.00 0.00 H new ATOM 0 HG11 VAL A 23 23.748 -16.562 -13.350 1.00 0.00 H new ATOM 0 HG12 VAL A 23 25.479 -16.150 -13.355 1.00 0.00 H new ATOM 0 HG13 VAL A 23 24.258 -14.863 -13.215 1.00 0.00 H new ATOM 0 HG21 VAL A 23 22.338 -16.056 -15.316 1.00 0.00 H new ATOM 0 HG22 VAL A 23 22.792 -14.336 -15.262 1.00 0.00 H new ATOM 0 HG23 VAL A 23 23.045 -15.277 -16.751 1.00 0.00 H new ATOM 389 N ARG A 24 24.334 -12.616 -16.269 1.00 0.00 N ATOM 390 CA ARG A 24 23.809 -11.272 -16.061 1.00 0.00 C ATOM 391 C ARG A 24 22.322 -11.315 -15.724 1.00 0.00 C ATOM 392 O ARG A 24 21.532 -11.937 -16.435 1.00 0.00 O ATOM 393 CB ARG A 24 24.036 -10.414 -17.308 1.00 0.00 C ATOM 394 CG ARG A 24 25.400 -9.745 -17.347 1.00 0.00 C ATOM 395 CD ARG A 24 26.515 -10.763 -17.529 1.00 0.00 C ATOM 396 NE ARG A 24 27.408 -10.406 -18.628 1.00 0.00 N ATOM 397 CZ ARG A 24 28.225 -9.359 -18.601 1.00 0.00 C ATOM 398 NH1 ARG A 24 28.262 -8.571 -17.536 1.00 0.00 N ATOM 399 NH2 ARG A 24 29.007 -9.100 -19.641 1.00 0.00 N ATOM 0 H ARG A 24 24.153 -13.001 -17.196 1.00 0.00 H new ATOM 0 HA ARG A 24 24.341 -10.827 -15.220 1.00 0.00 H new ATOM 0 HB2 ARG A 24 23.922 -11.038 -18.194 1.00 0.00 H new ATOM 0 HB3 ARG A 24 23.263 -9.647 -17.357 1.00 0.00 H new ATOM 0 HG2 ARG A 24 25.429 -9.022 -18.163 1.00 0.00 H new ATOM 0 HG3 ARG A 24 25.560 -9.189 -16.423 1.00 0.00 H new ATOM 0 HD2 ARG A 24 27.089 -10.840 -16.606 1.00 0.00 H new ATOM 0 HD3 ARG A 24 26.082 -11.745 -17.718 1.00 0.00 H new ATOM 0 HE ARG A 24 27.404 -10.993 -19.462 1.00 0.00 H new ATOM 0 HH11 ARG A 24 27.662 -8.768 -16.735 1.00 0.00 H new ATOM 0 HH12 ARG A 24 28.890 -7.768 -17.518 1.00 0.00 H new ATOM 0 HH21 ARG A 24 28.981 -9.705 -20.462 1.00 0.00 H new ATOM 0 HH22 ARG A 24 29.634 -8.296 -19.620 1.00 0.00 H new ATOM 413 N TYR A 25 21.948 -10.652 -14.636 1.00 0.00 N ATOM 414 CA TYR A 25 20.556 -10.617 -14.202 1.00 0.00 C ATOM 415 C TYR A 25 19.920 -9.267 -14.520 1.00 0.00 C ATOM 416 O TYR A 25 20.585 -8.232 -14.487 1.00 0.00 O ATOM 417 CB TYR A 25 20.460 -10.898 -12.702 1.00 0.00 C ATOM 418 CG TYR A 25 21.047 -12.231 -12.297 1.00 0.00 C ATOM 419 CD1 TYR A 25 20.495 -13.423 -12.751 1.00 0.00 C ATOM 420 CD2 TYR A 25 22.154 -12.300 -11.460 1.00 0.00 C ATOM 421 CE1 TYR A 25 21.027 -14.643 -12.383 1.00 0.00 C ATOM 422 CE2 TYR A 25 22.694 -13.516 -11.088 1.00 0.00 C ATOM 423 CZ TYR A 25 22.127 -14.684 -11.552 1.00 0.00 C ATOM 424 OH TYR A 25 22.662 -15.897 -11.183 1.00 0.00 O ATOM 0 H TYR A 25 22.589 -10.131 -14.038 1.00 0.00 H new ATOM 0 HA TYR A 25 20.013 -11.391 -14.745 1.00 0.00 H new ATOM 0 HB2 TYR A 25 20.973 -10.104 -12.159 1.00 0.00 H new ATOM 0 HB3 TYR A 25 19.413 -10.865 -12.401 1.00 0.00 H new ATOM 0 HD1 TYR A 25 19.635 -13.395 -13.403 1.00 0.00 H new ATOM 0 HD2 TYR A 25 22.600 -11.387 -11.094 1.00 0.00 H new ATOM 0 HE1 TYR A 25 20.584 -15.560 -12.744 1.00 0.00 H new ATOM 0 HE2 TYR A 25 23.555 -13.551 -10.437 1.00 0.00 H new ATOM 0 HH TYR A 25 21.940 -16.544 -11.043 1.00 0.00 H new ATOM 434 N ARG A 26 18.627 -9.287 -14.827 1.00 0.00 N ATOM 435 CA ARG A 26 17.900 -8.065 -15.151 1.00 0.00 C ATOM 436 C ARG A 26 16.935 -7.693 -14.029 1.00 0.00 C ATOM 437 O ARG A 26 15.963 -8.403 -13.771 1.00 0.00 O ATOM 438 CB ARG A 26 17.132 -8.237 -16.463 1.00 0.00 C ATOM 439 CG ARG A 26 16.904 -6.933 -17.210 1.00 0.00 C ATOM 440 CD ARG A 26 15.598 -6.958 -17.989 1.00 0.00 C ATOM 441 NE ARG A 26 15.772 -7.507 -19.331 1.00 0.00 N ATOM 442 CZ ARG A 26 14.772 -7.686 -20.186 1.00 0.00 C ATOM 443 NH1 ARG A 26 13.533 -7.361 -19.842 1.00 0.00 N ATOM 444 NH2 ARG A 26 15.009 -8.192 -21.390 1.00 0.00 N ATOM 0 H ARG A 26 18.062 -10.135 -14.858 1.00 0.00 H new ATOM 0 HA ARG A 26 18.625 -7.259 -15.265 1.00 0.00 H new ATOM 0 HB2 ARG A 26 17.680 -8.924 -17.108 1.00 0.00 H new ATOM 0 HB3 ARG A 26 16.167 -8.699 -16.252 1.00 0.00 H new ATOM 0 HG2 ARG A 26 16.891 -6.104 -16.502 1.00 0.00 H new ATOM 0 HG3 ARG A 26 17.734 -6.754 -17.894 1.00 0.00 H new ATOM 0 HD2 ARG A 26 14.863 -7.553 -17.446 1.00 0.00 H new ATOM 0 HD3 ARG A 26 15.199 -5.946 -18.060 1.00 0.00 H new ATOM 0 HE ARG A 26 16.713 -7.767 -19.628 1.00 0.00 H new ATOM 0 HH11 ARG A 26 13.346 -6.972 -18.918 1.00 0.00 H new ATOM 0 HH12 ARG A 26 12.767 -7.500 -20.502 1.00 0.00 H new ATOM 0 HH21 ARG A 26 15.960 -8.444 -21.659 1.00 0.00 H new ATOM 0 HH22 ARG A 26 14.240 -8.329 -22.046 1.00 0.00 H new ATOM 458 N VAL A 27 17.210 -6.575 -13.365 1.00 0.00 N ATOM 459 CA VAL A 27 16.367 -6.108 -12.271 1.00 0.00 C ATOM 460 C VAL A 27 15.844 -4.702 -12.542 1.00 0.00 C ATOM 461 O VAL A 27 16.614 -3.788 -12.834 1.00 0.00 O ATOM 462 CB VAL A 27 17.130 -6.111 -10.933 1.00 0.00 C ATOM 463 CG1 VAL A 27 16.175 -5.877 -9.773 1.00 0.00 C ATOM 464 CG2 VAL A 27 17.888 -7.418 -10.755 1.00 0.00 C ATOM 0 H VAL A 27 18.010 -5.976 -13.566 1.00 0.00 H new ATOM 0 HA VAL A 27 15.526 -6.799 -12.203 1.00 0.00 H new ATOM 0 HB VAL A 27 17.854 -5.296 -10.946 1.00 0.00 H new ATOM 0 HG11 VAL A 27 16.732 -5.882 -8.836 1.00 0.00 H new ATOM 0 HG12 VAL A 27 15.682 -4.913 -9.896 1.00 0.00 H new ATOM 0 HG13 VAL A 27 15.425 -6.668 -9.754 1.00 0.00 H new ATOM 0 HG21 VAL A 27 18.421 -7.403 -9.805 1.00 0.00 H new ATOM 0 HG22 VAL A 27 17.185 -8.251 -10.763 1.00 0.00 H new ATOM 0 HG23 VAL A 27 18.602 -7.538 -11.570 1.00 0.00 H new ATOM 474 N SER A 28 14.529 -4.537 -12.444 1.00 0.00 N ATOM 475 CA SER A 28 13.901 -3.242 -12.682 1.00 0.00 C ATOM 476 C SER A 28 13.222 -2.727 -11.417 1.00 0.00 C ATOM 477 O SER A 28 12.534 -3.472 -10.721 1.00 0.00 O ATOM 478 CB SER A 28 12.880 -3.348 -13.816 1.00 0.00 C ATOM 479 OG SER A 28 12.364 -4.664 -13.917 1.00 0.00 O ATOM 0 H SER A 28 13.878 -5.283 -12.202 1.00 0.00 H new ATOM 0 HA SER A 28 14.680 -2.535 -12.969 1.00 0.00 H new ATOM 0 HB2 SER A 28 12.064 -2.647 -13.642 1.00 0.00 H new ATOM 0 HB3 SER A 28 13.348 -3.064 -14.759 1.00 0.00 H new ATOM 0 HG SER A 28 11.713 -4.705 -14.648 1.00 0.00 H new ATOM 485 N GLY A 29 13.421 -1.445 -11.126 1.00 0.00 N ATOM 486 CA GLY A 29 12.822 -0.850 -9.946 1.00 0.00 C ATOM 487 C GLY A 29 13.819 -0.053 -9.128 1.00 0.00 C ATOM 488 O GLY A 29 13.475 0.978 -8.549 1.00 0.00 O ATOM 0 H GLY A 29 13.987 -0.808 -11.687 1.00 0.00 H new ATOM 0 HA2 GLY A 29 12.002 -0.199 -10.248 1.00 0.00 H new ATOM 0 HA3 GLY A 29 12.393 -1.636 -9.325 1.00 0.00 H new ATOM 492 N LEU A 30 15.058 -0.531 -9.080 1.00 0.00 N ATOM 493 CA LEU A 30 16.109 0.143 -8.326 1.00 0.00 C ATOM 494 C LEU A 30 16.258 1.593 -8.777 1.00 0.00 C ATOM 495 O LEU A 30 15.579 2.039 -9.701 1.00 0.00 O ATOM 496 CB LEU A 30 17.438 -0.594 -8.494 1.00 0.00 C ATOM 497 CG LEU A 30 17.386 -2.115 -8.341 1.00 0.00 C ATOM 498 CD1 LEU A 30 18.133 -2.792 -9.480 1.00 0.00 C ATOM 499 CD2 LEU A 30 17.963 -2.536 -6.998 1.00 0.00 C ATOM 0 H LEU A 30 15.359 -1.382 -9.554 1.00 0.00 H new ATOM 0 HA LEU A 30 15.828 0.136 -7.273 1.00 0.00 H new ATOM 0 HB2 LEU A 30 17.837 -0.362 -9.481 1.00 0.00 H new ATOM 0 HB3 LEU A 30 18.144 -0.199 -7.764 1.00 0.00 H new ATOM 0 HG LEU A 30 16.343 -2.429 -8.380 1.00 0.00 H new ATOM 0 HD11 LEU A 30 18.085 -3.874 -9.354 1.00 0.00 H new ATOM 0 HD12 LEU A 30 17.675 -2.517 -10.430 1.00 0.00 H new ATOM 0 HD13 LEU A 30 19.175 -2.472 -9.473 1.00 0.00 H new ATOM 0 HD21 LEU A 30 17.918 -3.621 -6.907 1.00 0.00 H new ATOM 0 HD22 LEU A 30 19.001 -2.209 -6.929 1.00 0.00 H new ATOM 0 HD23 LEU A 30 17.385 -2.080 -6.194 1.00 0.00 H new ATOM 511 N ASP A 31 17.153 2.322 -8.119 1.00 0.00 N ATOM 512 CA ASP A 31 17.394 3.721 -8.454 1.00 0.00 C ATOM 513 C ASP A 31 18.872 3.963 -8.743 1.00 0.00 C ATOM 514 O ASP A 31 19.721 3.132 -8.422 1.00 0.00 O ATOM 515 CB ASP A 31 16.929 4.628 -7.314 1.00 0.00 C ATOM 516 CG ASP A 31 15.522 5.151 -7.528 1.00 0.00 C ATOM 517 OD1 ASP A 31 15.147 5.388 -8.696 1.00 0.00 O ATOM 518 OD2 ASP A 31 14.795 5.323 -6.527 1.00 0.00 O ATOM 0 H ASP A 31 17.723 1.968 -7.351 1.00 0.00 H new ATOM 0 HA ASP A 31 16.823 3.958 -9.352 1.00 0.00 H new ATOM 0 HB2 ASP A 31 16.970 4.076 -6.375 1.00 0.00 H new ATOM 0 HB3 ASP A 31 17.616 5.469 -7.219 1.00 0.00 H new ATOM 523 N GLU A 32 19.172 5.107 -9.351 1.00 0.00 N ATOM 524 CA GLU A 32 20.547 5.457 -9.684 1.00 0.00 C ATOM 525 C GLU A 32 21.425 5.461 -8.436 1.00 0.00 C ATOM 526 O GLU A 32 22.534 4.927 -8.443 1.00 0.00 O ATOM 527 CB GLU A 32 20.599 6.827 -10.362 1.00 0.00 C ATOM 528 CG GLU A 32 19.583 6.992 -11.480 1.00 0.00 C ATOM 529 CD GLU A 32 18.323 7.701 -11.025 1.00 0.00 C ATOM 530 OE1 GLU A 32 18.348 8.945 -10.921 1.00 0.00 O ATOM 531 OE2 GLU A 32 17.313 7.012 -10.772 1.00 0.00 O ATOM 0 H GLU A 32 18.481 5.806 -9.623 1.00 0.00 H new ATOM 0 HA GLU A 32 20.929 4.704 -10.374 1.00 0.00 H new ATOM 0 HB2 GLU A 32 20.431 7.600 -9.613 1.00 0.00 H new ATOM 0 HB3 GLU A 32 21.599 6.986 -10.765 1.00 0.00 H new ATOM 0 HG2 GLU A 32 20.036 7.553 -12.297 1.00 0.00 H new ATOM 0 HG3 GLU A 32 19.320 6.010 -11.875 1.00 0.00 H new ATOM 538 N GLU A 33 20.920 6.068 -7.367 1.00 0.00 N ATOM 539 CA GLU A 33 21.659 6.144 -6.112 1.00 0.00 C ATOM 540 C GLU A 33 21.604 4.813 -5.367 1.00 0.00 C ATOM 541 O GLU A 33 22.597 4.371 -4.787 1.00 0.00 O ATOM 542 CB GLU A 33 21.095 7.258 -5.228 1.00 0.00 C ATOM 543 CG GLU A 33 21.905 7.503 -3.966 1.00 0.00 C ATOM 544 CD GLU A 33 23.124 8.370 -4.213 1.00 0.00 C ATOM 545 OE1 GLU A 33 23.587 8.427 -5.372 1.00 0.00 O ATOM 546 OE2 GLU A 33 23.614 8.992 -3.248 1.00 0.00 O ATOM 0 H GLU A 33 20.003 6.514 -7.345 1.00 0.00 H new ATOM 0 HA GLU A 33 22.700 6.368 -6.347 1.00 0.00 H new ATOM 0 HB2 GLU A 33 21.050 8.181 -5.806 1.00 0.00 H new ATOM 0 HB3 GLU A 33 20.072 7.006 -4.950 1.00 0.00 H new ATOM 0 HG2 GLU A 33 21.271 7.980 -3.219 1.00 0.00 H new ATOM 0 HG3 GLU A 33 22.223 6.546 -3.551 1.00 0.00 H new ATOM 553 N LEU A 34 20.437 4.178 -5.388 1.00 0.00 N ATOM 554 CA LEU A 34 20.251 2.897 -4.715 1.00 0.00 C ATOM 555 C LEU A 34 21.252 1.865 -5.222 1.00 0.00 C ATOM 556 O LEU A 34 21.799 1.080 -4.446 1.00 0.00 O ATOM 557 CB LEU A 34 18.824 2.389 -4.930 1.00 0.00 C ATOM 558 CG LEU A 34 17.826 2.697 -3.813 1.00 0.00 C ATOM 559 CD1 LEU A 34 16.421 2.284 -4.223 1.00 0.00 C ATOM 560 CD2 LEU A 34 18.235 1.997 -2.525 1.00 0.00 C ATOM 0 H LEU A 34 19.606 4.529 -5.864 1.00 0.00 H new ATOM 0 HA LEU A 34 20.421 3.046 -3.649 1.00 0.00 H new ATOM 0 HB2 LEU A 34 18.444 2.816 -5.858 1.00 0.00 H new ATOM 0 HB3 LEU A 34 18.861 1.308 -5.069 1.00 0.00 H new ATOM 0 HG LEU A 34 17.829 3.772 -3.636 1.00 0.00 H new ATOM 0 HD11 LEU A 34 15.725 2.511 -3.416 1.00 0.00 H new ATOM 0 HD12 LEU A 34 16.128 2.831 -5.119 1.00 0.00 H new ATOM 0 HD13 LEU A 34 16.402 1.214 -4.429 1.00 0.00 H new ATOM 0 HD21 LEU A 34 17.514 2.227 -1.741 1.00 0.00 H new ATOM 0 HD22 LEU A 34 18.261 0.920 -2.689 1.00 0.00 H new ATOM 0 HD23 LEU A 34 19.223 2.342 -2.221 1.00 0.00 H new ATOM 572 N THR A 35 21.490 1.871 -6.530 1.00 0.00 N ATOM 573 CA THR A 35 22.427 0.937 -7.141 1.00 0.00 C ATOM 574 C THR A 35 23.779 0.976 -6.440 1.00 0.00 C ATOM 575 O THR A 35 24.410 -0.060 -6.230 1.00 0.00 O ATOM 576 CB THR A 35 22.628 1.241 -8.638 1.00 0.00 C ATOM 577 OG1 THR A 35 21.385 1.110 -9.336 1.00 0.00 O ATOM 578 CG2 THR A 35 23.659 0.302 -9.247 1.00 0.00 C ATOM 0 H THR A 35 21.046 2.513 -7.187 1.00 0.00 H new ATOM 0 HA THR A 35 21.995 -0.058 -7.035 1.00 0.00 H new ATOM 0 HB THR A 35 22.991 2.264 -8.733 1.00 0.00 H new ATOM 0 HG1 THR A 35 20.767 1.809 -9.038 1.00 0.00 H new ATOM 0 HG21 THR A 35 23.784 0.536 -10.304 1.00 0.00 H new ATOM 0 HG22 THR A 35 24.612 0.425 -8.733 1.00 0.00 H new ATOM 0 HG23 THR A 35 23.320 -0.729 -9.141 1.00 0.00 H new ATOM 586 N GLU A 36 24.219 2.177 -6.079 1.00 0.00 N ATOM 587 CA GLU A 36 25.499 2.350 -5.401 1.00 0.00 C ATOM 588 C GLU A 36 25.517 1.597 -4.074 1.00 0.00 C ATOM 589 O GLU A 36 26.576 1.202 -3.585 1.00 0.00 O ATOM 590 CB GLU A 36 25.777 3.835 -5.161 1.00 0.00 C ATOM 591 CG GLU A 36 25.999 4.627 -6.438 1.00 0.00 C ATOM 592 CD GLU A 36 27.099 5.662 -6.300 1.00 0.00 C ATOM 593 OE1 GLU A 36 27.041 6.467 -5.347 1.00 0.00 O ATOM 594 OE2 GLU A 36 28.019 5.666 -7.145 1.00 0.00 O ATOM 0 H GLU A 36 23.709 3.044 -6.244 1.00 0.00 H new ATOM 0 HA GLU A 36 26.280 1.941 -6.042 1.00 0.00 H new ATOM 0 HB2 GLU A 36 24.939 4.269 -4.615 1.00 0.00 H new ATOM 0 HB3 GLU A 36 26.657 3.933 -4.525 1.00 0.00 H new ATOM 0 HG2 GLU A 36 26.250 3.941 -7.247 1.00 0.00 H new ATOM 0 HG3 GLU A 36 25.071 5.124 -6.718 1.00 0.00 H new ATOM 601 N LYS A 37 24.337 1.401 -3.496 1.00 0.00 N ATOM 602 CA LYS A 37 24.214 0.694 -2.226 1.00 0.00 C ATOM 603 C LYS A 37 24.456 -0.801 -2.410 1.00 0.00 C ATOM 604 O LYS A 37 25.302 -1.390 -1.737 1.00 0.00 O ATOM 605 CB LYS A 37 22.828 0.928 -1.621 1.00 0.00 C ATOM 606 CG LYS A 37 22.367 2.373 -1.697 1.00 0.00 C ATOM 607 CD LYS A 37 23.329 3.304 -0.978 1.00 0.00 C ATOM 608 CE LYS A 37 24.153 4.121 -1.961 1.00 0.00 C ATOM 609 NZ LYS A 37 25.612 4.015 -1.685 1.00 0.00 N ATOM 0 H LYS A 37 23.451 1.722 -3.887 1.00 0.00 H new ATOM 0 HA LYS A 37 24.971 1.085 -1.546 1.00 0.00 H new ATOM 0 HB2 LYS A 37 22.104 0.297 -2.137 1.00 0.00 H new ATOM 0 HB3 LYS A 37 22.838 0.613 -0.577 1.00 0.00 H new ATOM 0 HG2 LYS A 37 22.280 2.674 -2.741 1.00 0.00 H new ATOM 0 HG3 LYS A 37 21.374 2.463 -1.256 1.00 0.00 H new ATOM 0 HD2 LYS A 37 22.769 3.974 -0.326 1.00 0.00 H new ATOM 0 HD3 LYS A 37 23.994 2.721 -0.341 1.00 0.00 H new ATOM 0 HE2 LYS A 37 23.950 3.780 -2.976 1.00 0.00 H new ATOM 0 HE3 LYS A 37 23.849 5.166 -1.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 26.139 4.586 -2.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 25.810 4.364 -0.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 25.908 3.021 -1.760 1.00 0.00 H new ATOM 623 N LEU A 38 23.708 -1.408 -3.325 1.00 0.00 N ATOM 624 CA LEU A 38 23.842 -2.835 -3.598 1.00 0.00 C ATOM 625 C LEU A 38 25.217 -3.152 -4.176 1.00 0.00 C ATOM 626 O LEU A 38 25.898 -4.069 -3.716 1.00 0.00 O ATOM 627 CB LEU A 38 22.750 -3.293 -4.566 1.00 0.00 C ATOM 628 CG LEU A 38 21.324 -2.859 -4.225 1.00 0.00 C ATOM 629 CD1 LEU A 38 21.156 -2.715 -2.721 1.00 0.00 C ATOM 630 CD2 LEU A 38 20.981 -1.554 -4.929 1.00 0.00 C ATOM 0 H LEU A 38 23.003 -0.935 -3.890 1.00 0.00 H new ATOM 0 HA LEU A 38 23.732 -3.373 -2.656 1.00 0.00 H new ATOM 0 HB2 LEU A 38 22.994 -2.919 -5.560 1.00 0.00 H new ATOM 0 HB3 LEU A 38 22.774 -4.381 -4.620 1.00 0.00 H new ATOM 0 HG LEU A 38 20.637 -3.629 -4.575 1.00 0.00 H new ATOM 0 HD11 LEU A 38 20.135 -2.406 -2.497 1.00 0.00 H new ATOM 0 HD12 LEU A 38 21.359 -3.671 -2.239 1.00 0.00 H new ATOM 0 HD13 LEU A 38 21.853 -1.965 -2.347 1.00 0.00 H new ATOM 0 HD21 LEU A 38 19.963 -1.260 -4.675 1.00 0.00 H new ATOM 0 HD22 LEU A 38 21.674 -0.775 -4.610 1.00 0.00 H new ATOM 0 HD23 LEU A 38 21.061 -1.690 -6.007 1.00 0.00 H new ATOM 642 N ILE A 39 25.619 -2.386 -5.185 1.00 0.00 N ATOM 643 CA ILE A 39 26.915 -2.584 -5.824 1.00 0.00 C ATOM 644 C ILE A 39 28.043 -2.550 -4.799 1.00 0.00 C ATOM 645 O ILE A 39 29.083 -3.181 -4.987 1.00 0.00 O ATOM 646 CB ILE A 39 27.181 -1.515 -6.900 1.00 0.00 C ATOM 647 CG1 ILE A 39 28.257 -1.997 -7.874 1.00 0.00 C ATOM 648 CG2 ILE A 39 27.596 -0.203 -6.251 1.00 0.00 C ATOM 649 CD1 ILE A 39 28.697 -0.939 -8.862 1.00 0.00 C ATOM 0 H ILE A 39 25.067 -1.623 -5.577 1.00 0.00 H new ATOM 0 HA ILE A 39 26.887 -3.565 -6.298 1.00 0.00 H new ATOM 0 HB ILE A 39 26.261 -1.347 -7.459 1.00 0.00 H new ATOM 0 HG12 ILE A 39 29.124 -2.335 -7.306 1.00 0.00 H new ATOM 0 HG13 ILE A 39 27.879 -2.860 -8.422 1.00 0.00 H new ATOM 0 HG21 ILE A 39 27.781 0.543 -7.024 1.00 0.00 H new ATOM 0 HG22 ILE A 39 26.800 0.145 -5.593 1.00 0.00 H new ATOM 0 HG23 ILE A 39 28.505 -0.356 -5.670 1.00 0.00 H new ATOM 0 HD11 ILE A 39 29.461 -1.352 -9.521 1.00 0.00 H new ATOM 0 HD12 ILE A 39 27.841 -0.617 -9.456 1.00 0.00 H new ATOM 0 HD13 ILE A 39 29.106 -0.085 -8.322 1.00 0.00 H new ATOM 661 N GLU A 40 27.829 -1.812 -3.715 1.00 0.00 N ATOM 662 CA GLU A 40 28.829 -1.697 -2.660 1.00 0.00 C ATOM 663 C GLU A 40 28.824 -2.936 -1.769 1.00 0.00 C ATOM 664 O GLU A 40 29.875 -3.505 -1.473 1.00 0.00 O ATOM 665 CB GLU A 40 28.572 -0.447 -1.816 1.00 0.00 C ATOM 666 CG GLU A 40 29.361 0.769 -2.272 1.00 0.00 C ATOM 667 CD GLU A 40 30.852 0.617 -2.041 1.00 0.00 C ATOM 668 OE1 GLU A 40 31.512 -0.063 -2.854 1.00 0.00 O ATOM 669 OE2 GLU A 40 31.358 1.178 -1.047 1.00 0.00 O ATOM 0 H GLU A 40 26.973 -1.285 -3.544 1.00 0.00 H new ATOM 0 HA GLU A 40 29.808 -1.613 -3.131 1.00 0.00 H new ATOM 0 HB2 GLU A 40 27.508 -0.211 -1.846 1.00 0.00 H new ATOM 0 HB3 GLU A 40 28.822 -0.663 -0.777 1.00 0.00 H new ATOM 0 HG2 GLU A 40 29.177 0.940 -3.333 1.00 0.00 H new ATOM 0 HG3 GLU A 40 29.003 1.650 -1.740 1.00 0.00 H new ATOM 676 N ARG A 41 27.634 -3.347 -1.344 1.00 0.00 N ATOM 677 CA ARG A 41 27.492 -4.516 -0.485 1.00 0.00 C ATOM 678 C ARG A 41 27.902 -5.787 -1.224 1.00 0.00 C ATOM 679 O ARG A 41 28.632 -6.622 -0.688 1.00 0.00 O ATOM 680 CB ARG A 41 26.048 -4.643 0.005 1.00 0.00 C ATOM 681 CG ARG A 41 25.621 -3.521 0.938 1.00 0.00 C ATOM 682 CD ARG A 41 24.156 -3.645 1.324 1.00 0.00 C ATOM 683 NE ARG A 41 23.834 -2.854 2.509 1.00 0.00 N ATOM 684 CZ ARG A 41 24.198 -3.193 3.741 1.00 0.00 C ATOM 685 NH1 ARG A 41 24.893 -4.302 3.948 1.00 0.00 N ATOM 686 NH2 ARG A 41 23.866 -2.421 4.768 1.00 0.00 N ATOM 0 H ARG A 41 26.754 -2.888 -1.581 1.00 0.00 H new ATOM 0 HA ARG A 41 28.151 -4.386 0.374 1.00 0.00 H new ATOM 0 HB2 ARG A 41 25.381 -4.661 -0.857 1.00 0.00 H new ATOM 0 HB3 ARG A 41 25.930 -5.597 0.519 1.00 0.00 H new ATOM 0 HG2 ARG A 41 26.238 -3.539 1.836 1.00 0.00 H new ATOM 0 HG3 ARG A 41 25.791 -2.559 0.454 1.00 0.00 H new ATOM 0 HD2 ARG A 41 23.533 -3.320 0.491 1.00 0.00 H new ATOM 0 HD3 ARG A 41 23.918 -4.692 1.511 1.00 0.00 H new ATOM 0 HE ARG A 41 23.300 -1.994 2.384 1.00 0.00 H new ATOM 0 HH11 ARG A 41 25.150 -4.897 3.161 1.00 0.00 H new ATOM 0 HH12 ARG A 41 25.171 -4.560 4.895 1.00 0.00 H new ATOM 0 HH21 ARG A 41 23.331 -1.567 4.612 1.00 0.00 H new ATOM 0 HH22 ARG A 41 24.146 -2.682 5.714 1.00 0.00 H new ATOM 700 N LEU A 42 27.428 -5.927 -2.457 1.00 0.00 N ATOM 701 CA LEU A 42 27.745 -7.096 -3.271 1.00 0.00 C ATOM 702 C LEU A 42 29.128 -6.962 -3.900 1.00 0.00 C ATOM 703 O LEU A 42 29.794 -7.960 -4.175 1.00 0.00 O ATOM 704 CB LEU A 42 26.690 -7.282 -4.363 1.00 0.00 C ATOM 705 CG LEU A 42 25.258 -7.517 -3.881 1.00 0.00 C ATOM 706 CD1 LEU A 42 24.313 -7.658 -5.064 1.00 0.00 C ATOM 707 CD2 LEU A 42 25.190 -8.750 -2.992 1.00 0.00 C ATOM 0 H LEU A 42 26.823 -5.246 -2.915 1.00 0.00 H new ATOM 0 HA LEU A 42 27.745 -7.972 -2.622 1.00 0.00 H new ATOM 0 HB2 LEU A 42 26.697 -6.398 -5.001 1.00 0.00 H new ATOM 0 HB3 LEU A 42 26.986 -8.127 -4.985 1.00 0.00 H new ATOM 0 HG LEU A 42 24.946 -6.653 -3.294 1.00 0.00 H new ATOM 0 HD11 LEU A 42 23.299 -7.825 -4.702 1.00 0.00 H new ATOM 0 HD12 LEU A 42 24.340 -6.747 -5.662 1.00 0.00 H new ATOM 0 HD13 LEU A 42 24.622 -8.504 -5.678 1.00 0.00 H new ATOM 0 HD21 LEU A 42 24.164 -8.902 -2.658 1.00 0.00 H new ATOM 0 HD22 LEU A 42 25.522 -9.623 -3.554 1.00 0.00 H new ATOM 0 HD23 LEU A 42 25.836 -8.610 -2.125 1.00 0.00 H new ATOM 719 N ASP A 43 29.553 -5.724 -4.124 1.00 0.00 N ATOM 720 CA ASP A 43 30.859 -5.460 -4.717 1.00 0.00 C ATOM 721 C ASP A 43 30.931 -6.012 -6.138 1.00 0.00 C ATOM 722 O ASP A 43 32.017 -6.234 -6.672 1.00 0.00 O ATOM 723 CB ASP A 43 31.966 -6.075 -3.861 1.00 0.00 C ATOM 724 CG ASP A 43 31.793 -5.771 -2.386 1.00 0.00 C ATOM 725 OD1 ASP A 43 31.121 -6.563 -1.692 1.00 0.00 O ATOM 726 OD2 ASP A 43 32.331 -4.743 -1.925 1.00 0.00 O ATOM 0 H ASP A 43 29.013 -4.887 -3.904 1.00 0.00 H new ATOM 0 HA ASP A 43 31.001 -4.380 -4.758 1.00 0.00 H new ATOM 0 HB2 ASP A 43 31.977 -7.155 -4.008 1.00 0.00 H new ATOM 0 HB3 ASP A 43 32.932 -5.698 -4.196 1.00 0.00 H new ATOM 731 N GLU A 44 29.768 -6.230 -6.743 1.00 0.00 N ATOM 732 CA GLU A 44 29.701 -6.758 -8.100 1.00 0.00 C ATOM 733 C GLU A 44 29.698 -5.627 -9.124 1.00 0.00 C ATOM 734 O GLU A 44 29.946 -4.469 -8.787 1.00 0.00 O ATOM 735 CB GLU A 44 28.450 -7.622 -8.274 1.00 0.00 C ATOM 736 CG GLU A 44 27.167 -6.817 -8.404 1.00 0.00 C ATOM 737 CD GLU A 44 25.959 -7.553 -7.860 1.00 0.00 C ATOM 738 OE1 GLU A 44 26.105 -8.732 -7.476 1.00 0.00 O ATOM 739 OE2 GLU A 44 24.866 -6.949 -7.819 1.00 0.00 O ATOM 0 H GLU A 44 28.860 -6.049 -6.315 1.00 0.00 H new ATOM 0 HA GLU A 44 30.585 -7.374 -8.267 1.00 0.00 H new ATOM 0 HB2 GLU A 44 28.569 -8.245 -9.160 1.00 0.00 H new ATOM 0 HB3 GLU A 44 28.362 -8.295 -7.421 1.00 0.00 H new ATOM 0 HG2 GLU A 44 27.281 -5.871 -7.874 1.00 0.00 H new ATOM 0 HG3 GLU A 44 26.999 -6.576 -9.454 1.00 0.00 H new ATOM 746 N ASP A 45 29.416 -5.971 -10.376 1.00 0.00 N ATOM 747 CA ASP A 45 29.380 -4.985 -11.450 1.00 0.00 C ATOM 748 C ASP A 45 27.941 -4.621 -11.806 1.00 0.00 C ATOM 749 O ASP A 45 27.255 -5.366 -12.507 1.00 0.00 O ATOM 750 CB ASP A 45 30.104 -5.520 -12.687 1.00 0.00 C ATOM 751 CG ASP A 45 31.246 -4.623 -13.122 1.00 0.00 C ATOM 752 OD1 ASP A 45 31.960 -4.102 -12.240 1.00 0.00 O ATOM 753 OD2 ASP A 45 31.424 -4.440 -14.345 1.00 0.00 O ATOM 0 H ASP A 45 29.209 -6.925 -10.672 1.00 0.00 H new ATOM 0 HA ASP A 45 29.888 -4.086 -11.101 1.00 0.00 H new ATOM 0 HB2 ASP A 45 30.489 -6.517 -12.476 1.00 0.00 H new ATOM 0 HB3 ASP A 45 29.392 -5.620 -13.506 1.00 0.00 H new ATOM 758 N THR A 46 27.489 -3.470 -11.317 1.00 0.00 N ATOM 759 CA THR A 46 26.132 -3.008 -11.580 1.00 0.00 C ATOM 760 C THR A 46 26.133 -1.812 -12.525 1.00 0.00 C ATOM 761 O THR A 46 27.031 -0.973 -12.477 1.00 0.00 O ATOM 762 CB THR A 46 25.408 -2.619 -10.278 1.00 0.00 C ATOM 763 OG1 THR A 46 25.993 -1.433 -9.728 1.00 0.00 O ATOM 764 CG2 THR A 46 25.483 -3.746 -9.259 1.00 0.00 C ATOM 0 H THR A 46 28.043 -2.841 -10.736 1.00 0.00 H new ATOM 0 HA THR A 46 25.601 -3.837 -12.047 1.00 0.00 H new ATOM 0 HB THR A 46 24.360 -2.432 -10.513 1.00 0.00 H new ATOM 0 HG1 THR A 46 25.803 -0.672 -10.315 1.00 0.00 H new ATOM 0 HG21 THR A 46 24.965 -3.448 -8.348 1.00 0.00 H new ATOM 0 HG22 THR A 46 25.011 -4.639 -9.669 1.00 0.00 H new ATOM 0 HG23 THR A 46 26.527 -3.960 -9.029 1.00 0.00 H new ATOM 772 N GLU A 47 25.119 -1.741 -13.383 1.00 0.00 N ATOM 773 CA GLU A 47 25.005 -0.646 -14.339 1.00 0.00 C ATOM 774 C GLU A 47 23.572 -0.517 -14.848 1.00 0.00 C ATOM 775 O GLU A 47 22.783 -1.458 -14.762 1.00 0.00 O ATOM 776 CB GLU A 47 25.957 -0.866 -15.516 1.00 0.00 C ATOM 777 CG GLU A 47 27.290 -0.152 -15.362 1.00 0.00 C ATOM 778 CD GLU A 47 27.889 0.258 -16.693 1.00 0.00 C ATOM 779 OE1 GLU A 47 27.316 1.150 -17.353 1.00 0.00 O ATOM 780 OE2 GLU A 47 28.933 -0.312 -17.074 1.00 0.00 O ATOM 0 H GLU A 47 24.366 -2.428 -13.435 1.00 0.00 H new ATOM 0 HA GLU A 47 25.277 0.278 -13.829 1.00 0.00 H new ATOM 0 HB2 GLU A 47 26.138 -1.935 -15.631 1.00 0.00 H new ATOM 0 HB3 GLU A 47 25.475 -0.524 -16.432 1.00 0.00 H new ATOM 0 HG2 GLU A 47 27.154 0.733 -14.741 1.00 0.00 H new ATOM 0 HG3 GLU A 47 27.989 -0.804 -14.839 1.00 0.00 H new ATOM 787 N ARG A 48 23.242 0.657 -15.377 1.00 0.00 N ATOM 788 CA ARG A 48 21.904 0.912 -15.898 1.00 0.00 C ATOM 789 C ARG A 48 21.794 0.468 -17.354 1.00 0.00 C ATOM 790 O ARG A 48 22.710 0.681 -18.149 1.00 0.00 O ATOM 791 CB ARG A 48 21.562 2.398 -15.779 1.00 0.00 C ATOM 792 CG ARG A 48 21.459 2.886 -14.344 1.00 0.00 C ATOM 793 CD ARG A 48 22.116 4.246 -14.169 1.00 0.00 C ATOM 794 NE ARG A 48 21.133 5.324 -14.094 1.00 0.00 N ATOM 795 CZ ARG A 48 20.616 5.923 -15.161 1.00 0.00 C ATOM 796 NH1 ARG A 48 20.986 5.551 -16.378 1.00 0.00 N ATOM 797 NH2 ARG A 48 19.726 6.896 -15.011 1.00 0.00 N ATOM 0 H ARG A 48 23.883 1.447 -15.456 1.00 0.00 H new ATOM 0 HA ARG A 48 21.194 0.335 -15.306 1.00 0.00 H new ATOM 0 HB2 ARG A 48 22.324 2.980 -16.298 1.00 0.00 H new ATOM 0 HB3 ARG A 48 20.616 2.586 -16.287 1.00 0.00 H new ATOM 0 HG2 ARG A 48 20.410 2.948 -14.054 1.00 0.00 H new ATOM 0 HG3 ARG A 48 21.932 2.164 -13.678 1.00 0.00 H new ATOM 0 HD2 ARG A 48 22.720 4.243 -13.262 1.00 0.00 H new ATOM 0 HD3 ARG A 48 22.794 4.431 -15.002 1.00 0.00 H new ATOM 0 HE ARG A 48 20.827 5.634 -13.172 1.00 0.00 H new ATOM 0 HH11 ARG A 48 21.669 4.803 -16.497 1.00 0.00 H new ATOM 0 HH12 ARG A 48 20.587 6.013 -17.196 1.00 0.00 H new ATOM 0 HH21 ARG A 48 19.438 7.184 -14.076 1.00 0.00 H new ATOM 0 HH22 ARG A 48 19.330 7.355 -15.831 1.00 0.00 H new ATOM 811 N ASP A 49 20.669 -0.149 -17.695 1.00 0.00 N ATOM 812 CA ASP A 49 20.438 -0.622 -19.056 1.00 0.00 C ATOM 813 C ASP A 49 18.956 -0.558 -19.410 1.00 0.00 C ATOM 814 O ASP A 49 18.182 -1.443 -19.045 1.00 0.00 O ATOM 815 CB ASP A 49 20.952 -2.054 -19.214 1.00 0.00 C ATOM 816 CG ASP A 49 21.266 -2.401 -20.656 1.00 0.00 C ATOM 817 OD1 ASP A 49 22.201 -1.795 -21.221 1.00 0.00 O ATOM 818 OD2 ASP A 49 20.576 -3.276 -21.220 1.00 0.00 O ATOM 0 H ASP A 49 19.902 -0.334 -17.048 1.00 0.00 H new ATOM 0 HA ASP A 49 20.984 0.030 -19.739 1.00 0.00 H new ATOM 0 HB2 ASP A 49 21.849 -2.184 -18.609 1.00 0.00 H new ATOM 0 HB3 ASP A 49 20.205 -2.749 -18.830 1.00 0.00 H new ATOM 823 N ASP A 50 18.568 0.495 -20.120 1.00 0.00 N ATOM 824 CA ASP A 50 17.178 0.676 -20.524 1.00 0.00 C ATOM 825 C ASP A 50 16.263 0.743 -19.305 1.00 0.00 C ATOM 826 O ASP A 50 15.069 0.460 -19.396 1.00 0.00 O ATOM 827 CB ASP A 50 16.740 -0.465 -21.444 1.00 0.00 C ATOM 828 CG ASP A 50 17.091 -0.205 -22.896 1.00 0.00 C ATOM 829 OD1 ASP A 50 17.221 0.979 -23.271 1.00 0.00 O ATOM 830 OD2 ASP A 50 17.233 -1.185 -23.657 1.00 0.00 O ATOM 0 H ASP A 50 19.196 1.237 -20.428 1.00 0.00 H new ATOM 0 HA ASP A 50 17.102 1.619 -21.066 1.00 0.00 H new ATOM 0 HB2 ASP A 50 17.213 -1.392 -21.119 1.00 0.00 H new ATOM 0 HB3 ASP A 50 15.663 -0.608 -21.353 1.00 0.00 H new ATOM 835 N GLY A 51 16.832 1.118 -18.163 1.00 0.00 N ATOM 836 CA GLY A 51 16.053 1.214 -16.943 1.00 0.00 C ATOM 837 C GLY A 51 16.333 0.073 -15.985 1.00 0.00 C ATOM 838 O GLY A 51 16.180 0.219 -14.772 1.00 0.00 O ATOM 0 H GLY A 51 17.818 1.357 -18.062 1.00 0.00 H new ATOM 0 HA2 GLY A 51 16.272 2.161 -16.449 1.00 0.00 H new ATOM 0 HA3 GLY A 51 14.992 1.223 -17.193 1.00 0.00 H new ATOM 842 N ASP A 52 16.742 -1.068 -16.530 1.00 0.00 N ATOM 843 CA ASP A 52 17.043 -2.240 -15.716 1.00 0.00 C ATOM 844 C ASP A 52 18.488 -2.205 -15.227 1.00 0.00 C ATOM 845 O ASP A 52 19.282 -1.372 -15.664 1.00 0.00 O ATOM 846 CB ASP A 52 16.792 -3.520 -16.514 1.00 0.00 C ATOM 847 CG ASP A 52 15.412 -4.096 -16.266 1.00 0.00 C ATOM 848 OD1 ASP A 52 14.470 -3.709 -16.988 1.00 0.00 O ATOM 849 OD2 ASP A 52 15.274 -4.934 -15.350 1.00 0.00 O ATOM 0 H ASP A 52 16.873 -1.206 -17.532 1.00 0.00 H new ATOM 0 HA ASP A 52 16.384 -2.228 -14.848 1.00 0.00 H new ATOM 0 HB2 ASP A 52 16.909 -3.311 -17.577 1.00 0.00 H new ATOM 0 HB3 ASP A 52 17.545 -4.263 -16.250 1.00 0.00 H new ATOM 854 N LEU A 53 18.821 -3.114 -14.317 1.00 0.00 N ATOM 855 CA LEU A 53 20.170 -3.188 -13.767 1.00 0.00 C ATOM 856 C LEU A 53 20.808 -4.539 -14.070 1.00 0.00 C ATOM 857 O LEU A 53 20.147 -5.576 -14.010 1.00 0.00 O ATOM 858 CB LEU A 53 20.139 -2.952 -12.256 1.00 0.00 C ATOM 859 CG LEU A 53 21.082 -1.871 -11.726 1.00 0.00 C ATOM 860 CD1 LEU A 53 20.500 -0.488 -11.974 1.00 0.00 C ATOM 861 CD2 LEU A 53 21.353 -2.079 -10.243 1.00 0.00 C ATOM 0 H LEU A 53 18.175 -3.810 -13.944 1.00 0.00 H new ATOM 0 HA LEU A 53 20.771 -2.410 -14.238 1.00 0.00 H new ATOM 0 HB2 LEU A 53 19.120 -2.689 -11.970 1.00 0.00 H new ATOM 0 HB3 LEU A 53 20.378 -3.891 -11.757 1.00 0.00 H new ATOM 0 HG LEU A 53 22.028 -1.947 -12.262 1.00 0.00 H new ATOM 0 HD11 LEU A 53 21.184 0.269 -11.590 1.00 0.00 H new ATOM 0 HD12 LEU A 53 20.358 -0.340 -13.044 1.00 0.00 H new ATOM 0 HD13 LEU A 53 19.540 -0.401 -11.465 1.00 0.00 H new ATOM 0 HD21 LEU A 53 22.026 -1.301 -9.883 1.00 0.00 H new ATOM 0 HD22 LEU A 53 20.414 -2.031 -9.691 1.00 0.00 H new ATOM 0 HD23 LEU A 53 21.813 -3.055 -10.091 1.00 0.00 H new ATOM 873 N ILE A 54 22.097 -4.520 -14.393 1.00 0.00 N ATOM 874 CA ILE A 54 22.825 -5.744 -14.701 1.00 0.00 C ATOM 875 C ILE A 54 23.611 -6.236 -13.490 1.00 0.00 C ATOM 876 O ILE A 54 24.219 -5.444 -12.769 1.00 0.00 O ATOM 877 CB ILE A 54 23.795 -5.541 -15.880 1.00 0.00 C ATOM 878 CG1 ILE A 54 23.101 -4.785 -17.015 1.00 0.00 C ATOM 879 CG2 ILE A 54 24.319 -6.882 -16.373 1.00 0.00 C ATOM 880 CD1 ILE A 54 21.827 -5.446 -17.492 1.00 0.00 C ATOM 0 H ILE A 54 22.658 -3.670 -14.448 1.00 0.00 H new ATOM 0 HA ILE A 54 22.082 -6.492 -14.977 1.00 0.00 H new ATOM 0 HB ILE A 54 24.641 -4.947 -15.536 1.00 0.00 H new ATOM 0 HG12 ILE A 54 22.872 -3.773 -16.680 1.00 0.00 H new ATOM 0 HG13 ILE A 54 23.790 -4.694 -17.855 1.00 0.00 H new ATOM 0 HG21 ILE A 54 25.003 -6.721 -17.206 1.00 0.00 H new ATOM 0 HG22 ILE A 54 24.846 -7.387 -15.563 1.00 0.00 H new ATOM 0 HG23 ILE A 54 23.484 -7.500 -16.703 1.00 0.00 H new ATOM 0 HD11 ILE A 54 21.390 -4.855 -18.297 1.00 0.00 H new ATOM 0 HD12 ILE A 54 22.052 -6.448 -17.858 1.00 0.00 H new ATOM 0 HD13 ILE A 54 21.120 -5.512 -16.665 1.00 0.00 H new ATOM 892 N ILE A 55 23.597 -7.547 -13.275 1.00 0.00 N ATOM 893 CA ILE A 55 24.310 -8.145 -12.154 1.00 0.00 C ATOM 894 C ILE A 55 25.071 -9.393 -12.588 1.00 0.00 C ATOM 895 O ILE A 55 24.471 -10.391 -12.990 1.00 0.00 O ATOM 896 CB ILE A 55 23.350 -8.515 -11.008 1.00 0.00 C ATOM 897 CG1 ILE A 55 22.528 -7.295 -10.588 1.00 0.00 C ATOM 898 CG2 ILE A 55 24.127 -9.070 -9.824 1.00 0.00 C ATOM 899 CD1 ILE A 55 21.455 -7.611 -9.569 1.00 0.00 C ATOM 0 H ILE A 55 23.099 -8.215 -13.863 1.00 0.00 H new ATOM 0 HA ILE A 55 25.018 -7.397 -11.796 1.00 0.00 H new ATOM 0 HB ILE A 55 22.666 -9.286 -11.362 1.00 0.00 H new ATOM 0 HG12 ILE A 55 23.198 -6.540 -10.176 1.00 0.00 H new ATOM 0 HG13 ILE A 55 22.062 -6.859 -11.472 1.00 0.00 H new ATOM 0 HG21 ILE A 55 23.434 -9.327 -9.022 1.00 0.00 H new ATOM 0 HG22 ILE A 55 24.672 -9.962 -10.132 1.00 0.00 H new ATOM 0 HG23 ILE A 55 24.832 -8.319 -9.468 1.00 0.00 H new ATOM 0 HD11 ILE A 55 20.912 -6.700 -9.318 1.00 0.00 H new ATOM 0 HD12 ILE A 55 20.763 -8.343 -9.985 1.00 0.00 H new ATOM 0 HD13 ILE A 55 21.916 -8.018 -8.669 1.00 0.00 H new ATOM 911 N THR A 56 26.396 -9.332 -12.504 1.00 0.00 N ATOM 912 CA THR A 56 27.239 -10.457 -12.888 1.00 0.00 C ATOM 913 C THR A 56 27.953 -11.047 -11.677 1.00 0.00 C ATOM 914 O THR A 56 28.753 -10.375 -11.026 1.00 0.00 O ATOM 915 CB THR A 56 28.289 -10.040 -13.935 1.00 0.00 C ATOM 916 OG1 THR A 56 27.724 -9.089 -14.844 1.00 0.00 O ATOM 917 CG2 THR A 56 28.792 -11.250 -14.708 1.00 0.00 C ATOM 0 H THR A 56 26.909 -8.515 -12.173 1.00 0.00 H new ATOM 0 HA THR A 56 26.582 -11.211 -13.323 1.00 0.00 H new ATOM 0 HB THR A 56 29.131 -9.586 -13.412 1.00 0.00 H new ATOM 0 HG1 THR A 56 28.321 -8.316 -14.921 1.00 0.00 H new ATOM 0 HG21 THR A 56 29.532 -10.931 -15.442 1.00 0.00 H new ATOM 0 HG22 THR A 56 29.248 -11.959 -14.017 1.00 0.00 H new ATOM 0 HG23 THR A 56 27.957 -11.728 -15.220 1.00 0.00 H new ATOM 925 N VAL A 57 27.658 -12.309 -11.379 1.00 0.00 N ATOM 926 CA VAL A 57 28.273 -12.991 -10.247 1.00 0.00 C ATOM 927 C VAL A 57 28.822 -14.352 -10.658 1.00 0.00 C ATOM 928 O VAL A 57 28.070 -15.246 -11.046 1.00 0.00 O ATOM 929 CB VAL A 57 27.269 -13.182 -9.094 1.00 0.00 C ATOM 930 CG1 VAL A 57 26.959 -11.849 -8.430 1.00 0.00 C ATOM 931 CG2 VAL A 57 25.997 -13.844 -9.600 1.00 0.00 C ATOM 0 H VAL A 57 26.997 -12.879 -11.906 1.00 0.00 H new ATOM 0 HA VAL A 57 29.093 -12.360 -9.905 1.00 0.00 H new ATOM 0 HB VAL A 57 27.719 -13.836 -8.347 1.00 0.00 H new ATOM 0 HG11 VAL A 57 26.248 -12.003 -7.618 1.00 0.00 H new ATOM 0 HG12 VAL A 57 27.878 -11.419 -8.031 1.00 0.00 H new ATOM 0 HG13 VAL A 57 26.529 -11.168 -9.164 1.00 0.00 H new ATOM 0 HG21 VAL A 57 25.299 -13.971 -8.772 1.00 0.00 H new ATOM 0 HG22 VAL A 57 25.541 -13.217 -10.366 1.00 0.00 H new ATOM 0 HG23 VAL A 57 26.238 -14.819 -10.024 1.00 0.00 H new ATOM 941 N PHE A 58 30.140 -14.504 -10.569 1.00 0.00 N ATOM 942 CA PHE A 58 30.792 -15.756 -10.933 1.00 0.00 C ATOM 943 C PHE A 58 31.569 -16.328 -9.750 1.00 0.00 C ATOM 944 O PHE A 58 32.121 -15.585 -8.939 1.00 0.00 O ATOM 945 CB PHE A 58 31.733 -15.541 -12.120 1.00 0.00 C ATOM 946 CG PHE A 58 32.595 -14.319 -11.987 1.00 0.00 C ATOM 947 CD1 PHE A 58 33.628 -14.281 -11.064 1.00 0.00 C ATOM 948 CD2 PHE A 58 32.373 -13.208 -12.785 1.00 0.00 C ATOM 949 CE1 PHE A 58 34.423 -13.157 -10.939 1.00 0.00 C ATOM 950 CE2 PHE A 58 33.165 -12.081 -12.665 1.00 0.00 C ATOM 951 CZ PHE A 58 34.192 -12.056 -11.741 1.00 0.00 C ATOM 0 H PHE A 58 30.777 -13.775 -10.248 1.00 0.00 H new ATOM 0 HA PHE A 58 30.019 -16.470 -11.217 1.00 0.00 H new ATOM 0 HB2 PHE A 58 32.372 -16.417 -12.230 1.00 0.00 H new ATOM 0 HB3 PHE A 58 31.142 -15.461 -13.032 1.00 0.00 H new ATOM 0 HD1 PHE A 58 33.814 -15.139 -10.435 1.00 0.00 H new ATOM 0 HD2 PHE A 58 31.572 -13.223 -13.509 1.00 0.00 H new ATOM 0 HE1 PHE A 58 35.224 -13.140 -10.215 1.00 0.00 H new ATOM 0 HE2 PHE A 58 32.981 -11.222 -13.293 1.00 0.00 H new ATOM 0 HZ PHE A 58 34.813 -11.178 -11.646 1.00 0.00 H new ATOM 961 N TYR A 59 31.607 -17.653 -9.660 1.00 0.00 N ATOM 962 CA TYR A 59 32.313 -18.325 -8.576 1.00 0.00 C ATOM 963 C TYR A 59 32.967 -19.613 -9.067 1.00 0.00 C ATOM 964 O TYR A 59 32.360 -20.384 -9.810 1.00 0.00 O ATOM 965 CB TYR A 59 31.352 -18.634 -7.427 1.00 0.00 C ATOM 966 CG TYR A 59 30.434 -17.484 -7.079 1.00 0.00 C ATOM 967 CD1 TYR A 59 29.266 -17.260 -7.798 1.00 0.00 C ATOM 968 CD2 TYR A 59 30.735 -16.620 -6.034 1.00 0.00 C ATOM 969 CE1 TYR A 59 28.424 -16.210 -7.485 1.00 0.00 C ATOM 970 CE2 TYR A 59 29.899 -15.568 -5.712 1.00 0.00 C ATOM 971 CZ TYR A 59 28.745 -15.367 -6.441 1.00 0.00 C ATOM 972 OH TYR A 59 27.910 -14.320 -6.125 1.00 0.00 O ATOM 0 H TYR A 59 31.157 -18.283 -10.325 1.00 0.00 H new ATOM 0 HA TYR A 59 33.095 -17.656 -8.217 1.00 0.00 H new ATOM 0 HB2 TYR A 59 30.749 -19.502 -7.693 1.00 0.00 H new ATOM 0 HB3 TYR A 59 31.930 -18.906 -6.544 1.00 0.00 H new ATOM 0 HD1 TYR A 59 29.012 -17.918 -8.616 1.00 0.00 H new ATOM 0 HD2 TYR A 59 31.639 -16.773 -5.463 1.00 0.00 H new ATOM 0 HE1 TYR A 59 27.520 -16.050 -8.054 1.00 0.00 H new ATOM 0 HE2 TYR A 59 30.147 -14.907 -4.895 1.00 0.00 H new ATOM 0 HH TYR A 59 28.280 -13.824 -5.365 1.00 0.00 H new ATOM 982 N GLU A 60 34.207 -19.837 -8.646 1.00 0.00 N ATOM 983 CA GLU A 60 34.944 -21.031 -9.044 1.00 0.00 C ATOM 984 C GLU A 60 34.794 -22.135 -8.000 1.00 0.00 C ATOM 985 O GLU A 60 34.059 -21.985 -7.024 1.00 0.00 O ATOM 986 CB GLU A 60 36.424 -20.701 -9.244 1.00 0.00 C ATOM 987 CG GLU A 60 37.228 -20.700 -7.954 1.00 0.00 C ATOM 988 CD GLU A 60 38.304 -19.632 -7.939 1.00 0.00 C ATOM 989 OE1 GLU A 60 37.980 -18.468 -7.626 1.00 0.00 O ATOM 990 OE2 GLU A 60 39.471 -19.961 -8.241 1.00 0.00 O ATOM 0 H GLU A 60 34.722 -19.208 -8.030 1.00 0.00 H new ATOM 0 HA GLU A 60 34.528 -21.386 -9.987 1.00 0.00 H new ATOM 0 HB2 GLU A 60 36.859 -21.425 -9.933 1.00 0.00 H new ATOM 0 HB3 GLU A 60 36.509 -19.722 -9.716 1.00 0.00 H new ATOM 0 HG2 GLU A 60 36.555 -20.544 -7.111 1.00 0.00 H new ATOM 0 HG3 GLU A 60 37.690 -21.678 -7.817 1.00 0.00 H new ATOM 997 N ARG A 61 35.496 -23.243 -8.215 1.00 0.00 N ATOM 998 CA ARG A 61 35.440 -24.373 -7.295 1.00 0.00 C ATOM 999 C ARG A 61 35.528 -23.900 -5.847 1.00 0.00 C ATOM 1000 O ARG A 61 34.867 -24.446 -4.965 1.00 0.00 O ATOM 1001 CB ARG A 61 36.574 -25.356 -7.592 1.00 0.00 C ATOM 1002 CG ARG A 61 37.919 -24.685 -7.814 1.00 0.00 C ATOM 1003 CD ARG A 61 39.010 -25.704 -8.101 1.00 0.00 C ATOM 1004 NE ARG A 61 39.481 -25.628 -9.482 1.00 0.00 N ATOM 1005 CZ ARG A 61 40.403 -26.439 -9.989 1.00 0.00 C ATOM 1006 NH1 ARG A 61 40.950 -27.381 -9.234 1.00 0.00 N ATOM 1007 NH2 ARG A 61 40.780 -26.307 -11.255 1.00 0.00 N ATOM 0 H ARG A 61 36.110 -23.382 -9.018 1.00 0.00 H new ATOM 0 HA ARG A 61 34.484 -24.878 -7.436 1.00 0.00 H new ATOM 0 HB2 ARG A 61 36.661 -26.059 -6.763 1.00 0.00 H new ATOM 0 HB3 ARG A 61 36.317 -25.937 -8.477 1.00 0.00 H new ATOM 0 HG2 ARG A 61 37.845 -23.986 -8.647 1.00 0.00 H new ATOM 0 HG3 ARG A 61 38.186 -24.103 -6.932 1.00 0.00 H new ATOM 0 HD2 ARG A 61 39.847 -25.539 -7.423 1.00 0.00 H new ATOM 0 HD3 ARG A 61 38.631 -26.706 -7.902 1.00 0.00 H new ATOM 0 HE ARG A 61 39.080 -24.914 -10.090 1.00 0.00 H new ATOM 0 HH11 ARG A 61 40.663 -27.485 -8.261 1.00 0.00 H new ATOM 0 HH12 ARG A 61 41.658 -28.002 -9.626 1.00 0.00 H new ATOM 0 HH21 ARG A 61 40.362 -25.583 -11.839 1.00 0.00 H new ATOM 0 HH22 ARG A 61 41.488 -26.930 -11.644 1.00 0.00 H new ATOM 1021 N GLU A 62 36.350 -22.882 -5.612 1.00 0.00 N ATOM 1022 CA GLU A 62 36.525 -22.338 -4.270 1.00 0.00 C ATOM 1023 C GLU A 62 35.176 -22.028 -3.628 1.00 0.00 C ATOM 1024 O GLU A 62 34.983 -22.238 -2.430 1.00 0.00 O ATOM 1025 CB GLU A 62 37.382 -21.071 -4.318 1.00 0.00 C ATOM 1026 CG GLU A 62 38.869 -21.347 -4.463 1.00 0.00 C ATOM 1027 CD GLU A 62 39.404 -22.249 -3.369 1.00 0.00 C ATOM 1028 OE1 GLU A 62 38.775 -22.312 -2.291 1.00 0.00 O ATOM 1029 OE2 GLU A 62 40.452 -22.893 -3.588 1.00 0.00 O ATOM 0 H GLU A 62 36.904 -22.418 -6.332 1.00 0.00 H new ATOM 0 HA GLU A 62 37.032 -23.089 -3.664 1.00 0.00 H new ATOM 0 HB2 GLU A 62 37.053 -20.451 -5.152 1.00 0.00 H new ATOM 0 HB3 GLU A 62 37.215 -20.495 -3.408 1.00 0.00 H new ATOM 0 HG2 GLU A 62 39.056 -21.808 -5.433 1.00 0.00 H new ATOM 0 HG3 GLU A 62 39.413 -20.403 -4.449 1.00 0.00 H new ATOM 1036 N TYR A 63 34.245 -21.528 -4.433 1.00 0.00 N ATOM 1037 CA TYR A 63 32.914 -21.187 -3.944 1.00 0.00 C ATOM 1038 C TYR A 63 31.849 -22.043 -4.622 1.00 0.00 C ATOM 1039 O TYR A 63 30.655 -21.757 -4.530 1.00 0.00 O ATOM 1040 CB TYR A 63 32.624 -19.705 -4.187 1.00 0.00 C ATOM 1041 CG TYR A 63 32.717 -18.857 -2.938 1.00 0.00 C ATOM 1042 CD1 TYR A 63 33.867 -18.858 -2.159 1.00 0.00 C ATOM 1043 CD2 TYR A 63 31.654 -18.058 -2.537 1.00 0.00 C ATOM 1044 CE1 TYR A 63 33.956 -18.086 -1.016 1.00 0.00 C ATOM 1045 CE2 TYR A 63 31.735 -17.281 -1.397 1.00 0.00 C ATOM 1046 CZ TYR A 63 32.887 -17.299 -0.640 1.00 0.00 C ATOM 1047 OH TYR A 63 32.971 -16.528 0.497 1.00 0.00 O ATOM 0 H TYR A 63 34.387 -21.350 -5.427 1.00 0.00 H new ATOM 0 HA TYR A 63 32.886 -21.386 -2.873 1.00 0.00 H new ATOM 0 HB2 TYR A 63 33.326 -19.323 -4.929 1.00 0.00 H new ATOM 0 HB3 TYR A 63 31.625 -19.604 -4.611 1.00 0.00 H new ATOM 0 HD1 TYR A 63 34.706 -19.472 -2.451 1.00 0.00 H new ATOM 0 HD2 TYR A 63 30.749 -18.044 -3.126 1.00 0.00 H new ATOM 0 HE1 TYR A 63 34.857 -18.099 -0.421 1.00 0.00 H new ATOM 0 HE2 TYR A 63 30.900 -16.663 -1.101 1.00 0.00 H new ATOM 0 HH TYR A 63 32.134 -16.033 0.619 1.00 0.00 H new ATOM 1057 N PHE A 64 32.290 -23.096 -5.302 1.00 0.00 N ATOM 1058 CA PHE A 64 31.375 -23.996 -5.996 1.00 0.00 C ATOM 1059 C PHE A 64 30.645 -23.267 -7.120 1.00 0.00 C ATOM 1060 O PHE A 64 29.688 -22.526 -6.895 1.00 0.00 O ATOM 1061 CB PHE A 64 30.362 -24.586 -5.012 1.00 0.00 C ATOM 1062 CG PHE A 64 30.571 -26.048 -4.742 1.00 0.00 C ATOM 1063 CD1 PHE A 64 31.722 -26.493 -4.111 1.00 0.00 C ATOM 1064 CD2 PHE A 64 29.617 -26.979 -5.120 1.00 0.00 C ATOM 1065 CE1 PHE A 64 31.917 -27.838 -3.861 1.00 0.00 C ATOM 1066 CE2 PHE A 64 29.806 -28.326 -4.872 1.00 0.00 C ATOM 1067 CZ PHE A 64 30.958 -28.756 -4.243 1.00 0.00 C ATOM 0 H PHE A 64 33.275 -23.347 -5.388 1.00 0.00 H new ATOM 0 HA PHE A 64 31.961 -24.805 -6.432 1.00 0.00 H new ATOM 0 HB2 PHE A 64 30.420 -24.039 -4.071 1.00 0.00 H new ATOM 0 HB3 PHE A 64 29.356 -24.437 -5.405 1.00 0.00 H new ATOM 0 HD1 PHE A 64 32.476 -25.780 -3.811 1.00 0.00 H new ATOM 0 HD2 PHE A 64 28.715 -26.649 -5.614 1.00 0.00 H new ATOM 0 HE1 PHE A 64 32.818 -28.171 -3.368 1.00 0.00 H new ATOM 0 HE2 PHE A 64 29.054 -29.041 -5.170 1.00 0.00 H new ATOM 0 HZ PHE A 64 31.109 -29.808 -4.050 1.00 0.00 H new ATOM 1077 N PRO A 65 31.106 -23.481 -8.361 1.00 0.00 N ATOM 1078 CA PRO A 65 30.512 -22.855 -9.546 1.00 0.00 C ATOM 1079 C PRO A 65 29.126 -23.407 -9.860 1.00 0.00 C ATOM 1080 O PRO A 65 28.831 -24.569 -9.580 1.00 0.00 O ATOM 1081 CB PRO A 65 31.495 -23.208 -10.664 1.00 0.00 C ATOM 1082 CG PRO A 65 32.163 -24.457 -10.201 1.00 0.00 C ATOM 1083 CD PRO A 65 32.243 -24.353 -8.703 1.00 0.00 C ATOM 0 HA PRO A 65 30.366 -21.783 -9.411 1.00 0.00 H new ATOM 0 HB2 PRO A 65 30.978 -23.363 -11.611 1.00 0.00 H new ATOM 0 HB3 PRO A 65 32.218 -22.408 -10.823 1.00 0.00 H new ATOM 0 HG2 PRO A 65 31.595 -25.338 -10.501 1.00 0.00 H new ATOM 0 HG3 PRO A 65 33.156 -24.554 -10.639 1.00 0.00 H new ATOM 0 HD2 PRO A 65 32.158 -25.330 -8.227 1.00 0.00 H new ATOM 0 HD3 PRO A 65 33.191 -23.923 -8.380 1.00 0.00 H new ATOM 1091 N PHE A 66 28.277 -22.567 -10.444 1.00 0.00 N ATOM 1092 CA PHE A 66 26.921 -22.972 -10.796 1.00 0.00 C ATOM 1093 C PHE A 66 26.901 -23.692 -12.141 1.00 0.00 C ATOM 1094 O PHE A 66 27.527 -23.250 -13.104 1.00 0.00 O ATOM 1095 CB PHE A 66 25.999 -21.752 -10.843 1.00 0.00 C ATOM 1096 CG PHE A 66 26.167 -20.921 -12.082 1.00 0.00 C ATOM 1097 CD1 PHE A 66 25.455 -21.217 -13.234 1.00 0.00 C ATOM 1098 CD2 PHE A 66 27.037 -19.842 -12.096 1.00 0.00 C ATOM 1099 CE1 PHE A 66 25.609 -20.453 -14.375 1.00 0.00 C ATOM 1100 CE2 PHE A 66 27.195 -19.075 -13.235 1.00 0.00 C ATOM 1101 CZ PHE A 66 26.479 -19.380 -14.376 1.00 0.00 C ATOM 0 H PHE A 66 28.504 -21.602 -10.683 1.00 0.00 H new ATOM 0 HA PHE A 66 26.563 -23.660 -10.031 1.00 0.00 H new ATOM 0 HB2 PHE A 66 24.964 -22.086 -10.777 1.00 0.00 H new ATOM 0 HB3 PHE A 66 26.189 -21.129 -9.969 1.00 0.00 H new ATOM 0 HD1 PHE A 66 24.772 -22.054 -13.240 1.00 0.00 H new ATOM 0 HD2 PHE A 66 27.598 -19.598 -11.206 1.00 0.00 H new ATOM 0 HE1 PHE A 66 25.049 -20.695 -15.266 1.00 0.00 H new ATOM 0 HE2 PHE A 66 27.878 -18.238 -13.233 1.00 0.00 H new ATOM 0 HZ PHE A 66 26.599 -18.781 -15.267 1.00 0.00 H new ATOM 1111 N GLY A 67 26.175 -24.805 -12.199 1.00 0.00 N ATOM 1112 CA GLY A 67 26.086 -25.569 -13.430 1.00 0.00 C ATOM 1113 C GLY A 67 24.965 -26.589 -13.399 1.00 0.00 C ATOM 1114 O GLY A 67 23.824 -26.276 -13.737 1.00 0.00 O ATOM 0 H GLY A 67 25.647 -25.191 -11.416 1.00 0.00 H new ATOM 0 HA2 GLY A 67 25.930 -24.888 -14.266 1.00 0.00 H new ATOM 0 HA3 GLY A 67 27.033 -26.079 -13.607 1.00 0.00 H new ATOM 1118 N SER A 68 25.291 -27.812 -12.995 1.00 0.00 N ATOM 1119 CA SER A 68 24.304 -28.883 -12.927 1.00 0.00 C ATOM 1120 C SER A 68 23.774 -29.223 -14.317 1.00 0.00 C ATOM 1121 O SER A 68 22.748 -29.888 -14.456 1.00 0.00 O ATOM 1122 CB SER A 68 23.146 -28.481 -12.012 1.00 0.00 C ATOM 1123 OG SER A 68 23.012 -29.386 -10.930 1.00 0.00 O ATOM 0 H SER A 68 26.231 -28.086 -12.710 1.00 0.00 H new ATOM 0 HA SER A 68 24.792 -29.767 -12.517 1.00 0.00 H new ATOM 0 HB2 SER A 68 23.314 -27.474 -11.629 1.00 0.00 H new ATOM 0 HB3 SER A 68 22.219 -28.454 -12.584 1.00 0.00 H new ATOM 0 HG SER A 68 22.266 -29.106 -10.359 1.00 0.00 H new ATOM 1129 N GLU A 69 24.483 -28.761 -15.343 1.00 0.00 N ATOM 1130 CA GLU A 69 24.084 -29.015 -16.722 1.00 0.00 C ATOM 1131 C GLU A 69 24.198 -30.499 -17.057 1.00 0.00 C ATOM 1132 O GLU A 69 23.557 -30.987 -17.987 1.00 0.00 O ATOM 1133 CB GLU A 69 24.946 -28.196 -17.685 1.00 0.00 C ATOM 1134 CG GLU A 69 26.436 -28.457 -17.541 1.00 0.00 C ATOM 1135 CD GLU A 69 26.966 -29.409 -18.595 1.00 0.00 C ATOM 1136 OE1 GLU A 69 26.154 -30.157 -19.180 1.00 0.00 O ATOM 1137 OE2 GLU A 69 28.191 -29.406 -18.836 1.00 0.00 O ATOM 0 H GLU A 69 25.335 -28.210 -15.245 1.00 0.00 H new ATOM 0 HA GLU A 69 23.042 -28.714 -16.833 1.00 0.00 H new ATOM 0 HB2 GLU A 69 24.644 -28.419 -18.708 1.00 0.00 H new ATOM 0 HB3 GLU A 69 24.754 -27.136 -17.519 1.00 0.00 H new ATOM 0 HG2 GLU A 69 26.975 -27.512 -17.607 1.00 0.00 H new ATOM 0 HG3 GLU A 69 26.635 -28.869 -16.552 1.00 0.00 H new ATOM 1144 N GLU A 70 25.020 -31.211 -16.292 1.00 0.00 N ATOM 1145 CA GLU A 70 25.219 -32.639 -16.508 1.00 0.00 C ATOM 1146 C GLU A 70 23.964 -33.426 -16.143 1.00 0.00 C ATOM 1147 O GLU A 70 23.742 -34.529 -16.642 1.00 0.00 O ATOM 1148 CB GLU A 70 26.407 -33.142 -15.684 1.00 0.00 C ATOM 1149 CG GLU A 70 26.868 -34.537 -16.070 1.00 0.00 C ATOM 1150 CD GLU A 70 28.112 -34.969 -15.318 1.00 0.00 C ATOM 1151 OE1 GLU A 70 28.597 -34.187 -14.474 1.00 0.00 O ATOM 1152 OE2 GLU A 70 28.600 -36.090 -15.574 1.00 0.00 O ATOM 0 H GLU A 70 25.558 -30.822 -15.518 1.00 0.00 H new ATOM 0 HA GLU A 70 25.428 -32.793 -17.567 1.00 0.00 H new ATOM 0 HB2 GLU A 70 27.239 -32.448 -15.801 1.00 0.00 H new ATOM 0 HB3 GLU A 70 26.134 -33.138 -14.629 1.00 0.00 H new ATOM 0 HG2 GLU A 70 26.065 -35.248 -15.875 1.00 0.00 H new ATOM 0 HG3 GLU A 70 27.067 -34.566 -17.141 1.00 0.00 H new ATOM 1159 N SER A 71 23.145 -32.849 -15.268 1.00 0.00 N ATOM 1160 CA SER A 71 21.914 -33.497 -14.832 1.00 0.00 C ATOM 1161 C SER A 71 20.755 -33.139 -15.757 1.00 0.00 C ATOM 1162 O SER A 71 20.107 -34.016 -16.329 1.00 0.00 O ATOM 1163 CB SER A 71 21.580 -33.090 -13.396 1.00 0.00 C ATOM 1164 OG SER A 71 22.549 -33.583 -12.487 1.00 0.00 O ATOM 0 H SER A 71 23.312 -31.935 -14.848 1.00 0.00 H new ATOM 0 HA SER A 71 22.067 -34.576 -14.870 1.00 0.00 H new ATOM 0 HB2 SER A 71 21.530 -32.003 -13.325 1.00 0.00 H new ATOM 0 HB3 SER A 71 20.596 -33.473 -13.126 1.00 0.00 H new ATOM 0 HG SER A 71 22.313 -33.308 -11.576 1.00 0.00 H new ATOM 1170 N LYS A 72 20.498 -31.843 -15.899 1.00 0.00 N ATOM 1171 CA LYS A 72 19.418 -31.366 -16.754 1.00 0.00 C ATOM 1172 C LYS A 72 19.760 -31.570 -18.227 1.00 0.00 C ATOM 1173 O LYS A 72 18.877 -31.572 -19.085 1.00 0.00 O ATOM 1174 CB LYS A 72 19.143 -29.885 -16.485 1.00 0.00 C ATOM 1175 CG LYS A 72 17.677 -29.575 -16.235 1.00 0.00 C ATOM 1176 CD LYS A 72 17.507 -28.304 -15.419 1.00 0.00 C ATOM 1177 CE LYS A 72 16.695 -28.556 -14.158 1.00 0.00 C ATOM 1178 NZ LYS A 72 15.881 -27.368 -13.776 1.00 0.00 N ATOM 0 H LYS A 72 21.024 -31.104 -15.432 1.00 0.00 H new ATOM 0 HA LYS A 72 18.523 -31.944 -16.523 1.00 0.00 H new ATOM 0 HB2 LYS A 72 19.726 -29.567 -15.620 1.00 0.00 H new ATOM 0 HB3 LYS A 72 19.490 -29.299 -17.336 1.00 0.00 H new ATOM 0 HG2 LYS A 72 17.159 -29.469 -17.188 1.00 0.00 H new ATOM 0 HG3 LYS A 72 17.212 -30.410 -15.711 1.00 0.00 H new ATOM 0 HD2 LYS A 72 18.487 -27.910 -15.149 1.00 0.00 H new ATOM 0 HD3 LYS A 72 17.013 -27.544 -16.025 1.00 0.00 H new ATOM 0 HE2 LYS A 72 16.038 -29.412 -14.314 1.00 0.00 H new ATOM 0 HE3 LYS A 72 17.366 -28.815 -13.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 15.342 -27.580 -12.912 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 16.510 -26.558 -13.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 15.222 -27.136 -14.547 1.00 0.00 H new ATOM 1192 N VAL A 73 21.046 -31.743 -18.513 1.00 0.00 N ATOM 1193 CA VAL A 73 21.504 -31.951 -19.881 1.00 0.00 C ATOM 1194 C VAL A 73 20.780 -31.024 -20.850 1.00 0.00 C ATOM 1195 O VAL A 73 20.479 -31.402 -21.982 1.00 0.00 O ATOM 1196 CB VAL A 73 21.292 -33.410 -20.329 1.00 0.00 C ATOM 1197 CG1 VAL A 73 19.808 -33.730 -20.420 1.00 0.00 C ATOM 1198 CG2 VAL A 73 21.983 -33.664 -21.660 1.00 0.00 C ATOM 0 H VAL A 73 21.790 -31.743 -17.815 1.00 0.00 H new ATOM 0 HA VAL A 73 22.570 -31.726 -19.895 1.00 0.00 H new ATOM 0 HB VAL A 73 21.736 -34.069 -19.583 1.00 0.00 H new ATOM 0 HG11 VAL A 73 19.678 -34.764 -20.738 1.00 0.00 H new ATOM 0 HG12 VAL A 73 19.345 -33.589 -19.443 1.00 0.00 H new ATOM 0 HG13 VAL A 73 19.336 -33.066 -21.144 1.00 0.00 H new ATOM 0 HG21 VAL A 73 21.823 -34.699 -21.961 1.00 0.00 H new ATOM 0 HG22 VAL A 73 21.570 -32.998 -22.417 1.00 0.00 H new ATOM 0 HG23 VAL A 73 23.052 -33.477 -21.556 1.00 0.00 H new ATOM 1208 N LYS A 74 20.503 -29.805 -20.398 1.00 0.00 N ATOM 1209 CA LYS A 74 19.815 -28.820 -21.225 1.00 0.00 C ATOM 1210 C LYS A 74 20.097 -27.405 -20.732 1.00 0.00 C ATOM 1211 O LYS A 74 20.372 -27.192 -19.552 1.00 0.00 O ATOM 1212 CB LYS A 74 18.307 -29.083 -21.219 1.00 0.00 C ATOM 1213 CG LYS A 74 17.844 -29.993 -22.344 1.00 0.00 C ATOM 1214 CD LYS A 74 16.427 -29.662 -22.781 1.00 0.00 C ATOM 1215 CE LYS A 74 15.773 -30.839 -23.488 1.00 0.00 C ATOM 1216 NZ LYS A 74 15.491 -31.962 -22.551 1.00 0.00 N ATOM 0 H LYS A 74 20.745 -29.476 -19.463 1.00 0.00 H new ATOM 0 HA LYS A 74 20.189 -28.912 -22.244 1.00 0.00 H new ATOM 0 HB2 LYS A 74 18.028 -29.529 -20.264 1.00 0.00 H new ATOM 0 HB3 LYS A 74 17.780 -28.132 -21.292 1.00 0.00 H new ATOM 0 HG2 LYS A 74 18.520 -29.896 -23.194 1.00 0.00 H new ATOM 0 HG3 LYS A 74 17.892 -31.031 -22.016 1.00 0.00 H new ATOM 0 HD2 LYS A 74 15.833 -29.383 -21.911 1.00 0.00 H new ATOM 0 HD3 LYS A 74 16.443 -28.799 -23.447 1.00 0.00 H new ATOM 0 HE2 LYS A 74 14.843 -30.512 -23.953 1.00 0.00 H new ATOM 0 HE3 LYS A 74 16.424 -31.189 -24.289 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 14.766 -32.584 -22.962 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 16.362 -32.506 -22.389 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 15.148 -31.581 -21.646 1.00 0.00 H new ATOM 1230 N MET A 75 20.024 -26.440 -21.643 1.00 0.00 N ATOM 1231 CA MET A 75 20.269 -25.044 -21.300 1.00 0.00 C ATOM 1232 C MET A 75 19.377 -24.605 -20.143 1.00 0.00 C ATOM 1233 O MET A 75 19.725 -23.696 -19.389 1.00 0.00 O ATOM 1234 CB MET A 75 20.027 -24.147 -22.515 1.00 0.00 C ATOM 1235 CG MET A 75 18.557 -23.979 -22.863 1.00 0.00 C ATOM 1236 SD MET A 75 18.298 -22.878 -24.268 1.00 0.00 S ATOM 1237 CE MET A 75 18.118 -24.063 -25.599 1.00 0.00 C ATOM 0 H MET A 75 19.797 -26.599 -22.625 1.00 0.00 H new ATOM 0 HA MET A 75 21.310 -24.949 -20.990 1.00 0.00 H new ATOM 0 HB2 MET A 75 20.461 -23.166 -22.324 1.00 0.00 H new ATOM 0 HB3 MET A 75 20.550 -24.565 -23.375 1.00 0.00 H new ATOM 0 HG2 MET A 75 18.127 -24.955 -23.087 1.00 0.00 H new ATOM 0 HG3 MET A 75 18.025 -23.587 -21.996 1.00 0.00 H new ATOM 0 HE1 MET A 75 17.951 -23.534 -26.537 1.00 0.00 H new ATOM 0 HE2 MET A 75 19.025 -24.663 -25.677 1.00 0.00 H new ATOM 0 HE3 MET A 75 17.268 -24.714 -25.394 1.00 0.00 H new ATOM 1247 N ALA A 76 18.225 -25.254 -20.010 1.00 0.00 N ATOM 1248 CA ALA A 76 17.285 -24.931 -18.945 1.00 0.00 C ATOM 1249 C ALA A 76 17.977 -24.917 -17.586 1.00 0.00 C ATOM 1250 O ALA A 76 17.573 -24.189 -16.680 1.00 0.00 O ATOM 1251 CB ALA A 76 16.130 -25.923 -18.941 1.00 0.00 C ATOM 0 H ALA A 76 17.921 -26.007 -20.627 1.00 0.00 H new ATOM 0 HA ALA A 76 16.891 -23.932 -19.133 1.00 0.00 H new ATOM 0 HB1 ALA A 76 15.435 -25.670 -18.140 1.00 0.00 H new ATOM 0 HB2 ALA A 76 15.611 -25.881 -19.898 1.00 0.00 H new ATOM 0 HB3 ALA A 76 16.516 -26.930 -18.782 1.00 0.00 H new ATOM 1257 N ASP A 77 19.022 -25.727 -17.452 1.00 0.00 N ATOM 1258 CA ASP A 77 19.771 -25.808 -16.203 1.00 0.00 C ATOM 1259 C ASP A 77 20.432 -24.472 -15.879 1.00 0.00 C ATOM 1260 O ASP A 77 20.528 -24.081 -14.715 1.00 0.00 O ATOM 1261 CB ASP A 77 20.831 -26.907 -16.290 1.00 0.00 C ATOM 1262 CG ASP A 77 22.145 -26.402 -16.852 1.00 0.00 C ATOM 1263 OD1 ASP A 77 22.902 -25.754 -16.100 1.00 0.00 O ATOM 1264 OD2 ASP A 77 22.416 -26.653 -18.046 1.00 0.00 O ATOM 0 H ASP A 77 19.369 -26.336 -18.192 1.00 0.00 H new ATOM 0 HA ASP A 77 19.071 -26.051 -15.403 1.00 0.00 H new ATOM 0 HB2 ASP A 77 21.000 -27.324 -15.297 1.00 0.00 H new ATOM 0 HB3 ASP A 77 20.459 -27.718 -16.917 1.00 0.00 H new ATOM 1269 N PHE A 78 20.886 -23.775 -16.915 1.00 0.00 N ATOM 1270 CA PHE A 78 21.540 -22.483 -16.740 1.00 0.00 C ATOM 1271 C PHE A 78 20.540 -21.426 -16.281 1.00 0.00 C ATOM 1272 O PHE A 78 20.748 -20.759 -15.267 1.00 0.00 O ATOM 1273 CB PHE A 78 22.203 -22.042 -18.047 1.00 0.00 C ATOM 1274 CG PHE A 78 23.477 -22.777 -18.351 1.00 0.00 C ATOM 1275 CD1 PHE A 78 24.684 -22.342 -17.828 1.00 0.00 C ATOM 1276 CD2 PHE A 78 23.468 -23.903 -19.158 1.00 0.00 C ATOM 1277 CE1 PHE A 78 25.858 -23.016 -18.106 1.00 0.00 C ATOM 1278 CE2 PHE A 78 24.638 -24.581 -19.440 1.00 0.00 C ATOM 1279 CZ PHE A 78 25.835 -24.138 -18.913 1.00 0.00 C ATOM 0 H PHE A 78 20.813 -24.083 -17.885 1.00 0.00 H new ATOM 0 HA PHE A 78 22.305 -22.592 -15.972 1.00 0.00 H new ATOM 0 HB2 PHE A 78 21.502 -22.191 -18.869 1.00 0.00 H new ATOM 0 HB3 PHE A 78 22.413 -20.974 -17.996 1.00 0.00 H new ATOM 0 HD1 PHE A 78 24.708 -21.466 -17.196 1.00 0.00 H new ATOM 0 HD2 PHE A 78 22.535 -24.255 -19.572 1.00 0.00 H new ATOM 0 HE1 PHE A 78 26.793 -22.666 -17.693 1.00 0.00 H new ATOM 0 HE2 PHE A 78 24.617 -25.457 -20.072 1.00 0.00 H new ATOM 0 HZ PHE A 78 26.751 -24.667 -19.131 1.00 0.00 H new ATOM 1289 N ILE A 79 19.456 -21.278 -17.036 1.00 0.00 N ATOM 1290 CA ILE A 79 18.425 -20.302 -16.707 1.00 0.00 C ATOM 1291 C ILE A 79 17.743 -20.647 -15.387 1.00 0.00 C ATOM 1292 O ILE A 79 17.366 -19.761 -14.621 1.00 0.00 O ATOM 1293 CB ILE A 79 17.359 -20.215 -17.815 1.00 0.00 C ATOM 1294 CG1 ILE A 79 16.168 -19.378 -17.343 1.00 0.00 C ATOM 1295 CG2 ILE A 79 16.905 -21.608 -18.225 1.00 0.00 C ATOM 1296 CD1 ILE A 79 15.020 -20.207 -16.811 1.00 0.00 C ATOM 0 H ILE A 79 19.270 -21.821 -17.879 1.00 0.00 H new ATOM 0 HA ILE A 79 18.922 -19.336 -16.615 1.00 0.00 H new ATOM 0 HB ILE A 79 17.800 -19.728 -18.685 1.00 0.00 H new ATOM 0 HG12 ILE A 79 16.502 -18.692 -16.564 1.00 0.00 H new ATOM 0 HG13 ILE A 79 15.811 -18.768 -18.173 1.00 0.00 H new ATOM 0 HG21 ILE A 79 16.152 -21.529 -19.009 1.00 0.00 H new ATOM 0 HG22 ILE A 79 17.759 -22.174 -18.598 1.00 0.00 H new ATOM 0 HG23 ILE A 79 16.479 -22.120 -17.362 1.00 0.00 H new ATOM 0 HD11 ILE A 79 14.211 -19.548 -16.495 1.00 0.00 H new ATOM 0 HD12 ILE A 79 14.659 -20.874 -17.594 1.00 0.00 H new ATOM 0 HD13 ILE A 79 15.361 -20.797 -15.960 1.00 0.00 H new ATOM 1308 N ALA A 80 17.588 -21.941 -15.128 1.00 0.00 N ATOM 1309 CA ALA A 80 16.955 -22.404 -13.899 1.00 0.00 C ATOM 1310 C ALA A 80 17.867 -22.187 -12.696 1.00 0.00 C ATOM 1311 O ALA A 80 17.443 -21.650 -11.673 1.00 0.00 O ATOM 1312 CB ALA A 80 16.579 -23.873 -14.020 1.00 0.00 C ATOM 0 H ALA A 80 17.892 -22.688 -15.753 1.00 0.00 H new ATOM 0 HA ALA A 80 16.048 -21.820 -13.744 1.00 0.00 H new ATOM 0 HB1 ALA A 80 16.107 -24.205 -13.095 1.00 0.00 H new ATOM 0 HB2 ALA A 80 15.884 -24.003 -14.849 1.00 0.00 H new ATOM 0 HB3 ALA A 80 17.476 -24.464 -14.202 1.00 0.00 H new ATOM 1318 N ARG A 81 19.121 -22.608 -12.826 1.00 0.00 N ATOM 1319 CA ARG A 81 20.092 -22.461 -11.749 1.00 0.00 C ATOM 1320 C ARG A 81 20.431 -20.991 -11.520 1.00 0.00 C ATOM 1321 O ARG A 81 20.681 -20.571 -10.390 1.00 0.00 O ATOM 1322 CB ARG A 81 21.366 -23.245 -12.071 1.00 0.00 C ATOM 1323 CG ARG A 81 22.353 -23.304 -10.917 1.00 0.00 C ATOM 1324 CD ARG A 81 23.162 -24.591 -10.941 1.00 0.00 C ATOM 1325 NE ARG A 81 22.502 -25.666 -10.204 1.00 0.00 N ATOM 1326 CZ ARG A 81 22.526 -25.772 -8.880 1.00 0.00 C ATOM 1327 NH1 ARG A 81 23.173 -24.873 -8.151 1.00 0.00 N ATOM 1328 NH2 ARG A 81 21.901 -26.778 -8.283 1.00 0.00 N ATOM 0 H ARG A 81 19.488 -23.054 -13.667 1.00 0.00 H new ATOM 0 HA ARG A 81 19.649 -22.861 -10.837 1.00 0.00 H new ATOM 0 HB2 ARG A 81 21.094 -24.261 -12.358 1.00 0.00 H new ATOM 0 HB3 ARG A 81 21.854 -22.790 -12.933 1.00 0.00 H new ATOM 0 HG2 ARG A 81 23.027 -22.449 -10.969 1.00 0.00 H new ATOM 0 HG3 ARG A 81 21.815 -23.229 -9.972 1.00 0.00 H new ATOM 0 HD2 ARG A 81 23.318 -24.902 -11.974 1.00 0.00 H new ATOM 0 HD3 ARG A 81 24.147 -24.408 -10.511 1.00 0.00 H new ATOM 0 HE ARG A 81 21.995 -26.374 -10.735 1.00 0.00 H new ATOM 0 HH11 ARG A 81 23.654 -24.097 -8.607 1.00 0.00 H new ATOM 0 HH12 ARG A 81 23.190 -24.957 -7.135 1.00 0.00 H new ATOM 0 HH21 ARG A 81 21.402 -27.471 -8.841 1.00 0.00 H new ATOM 0 HH22 ARG A 81 21.920 -26.859 -7.266 1.00 0.00 H new ATOM 1342 N GLU A 82 20.439 -20.216 -12.599 1.00 0.00 N ATOM 1343 CA GLU A 82 20.749 -18.793 -12.515 1.00 0.00 C ATOM 1344 C GLU A 82 19.589 -18.019 -11.896 1.00 0.00 C ATOM 1345 O GLU A 82 19.780 -17.223 -10.978 1.00 0.00 O ATOM 1346 CB GLU A 82 21.067 -18.234 -13.903 1.00 0.00 C ATOM 1347 CG GLU A 82 22.428 -18.656 -14.432 1.00 0.00 C ATOM 1348 CD GLU A 82 22.547 -18.488 -15.934 1.00 0.00 C ATOM 1349 OE1 GLU A 82 21.503 -18.312 -16.596 1.00 0.00 O ATOM 1350 OE2 GLU A 82 23.684 -18.533 -16.448 1.00 0.00 O ATOM 0 H GLU A 82 20.235 -20.549 -13.541 1.00 0.00 H new ATOM 0 HA GLU A 82 21.624 -18.675 -11.875 1.00 0.00 H new ATOM 0 HB2 GLU A 82 20.297 -18.561 -14.602 1.00 0.00 H new ATOM 0 HB3 GLU A 82 21.022 -17.146 -13.866 1.00 0.00 H new ATOM 0 HG2 GLU A 82 23.203 -18.067 -13.942 1.00 0.00 H new ATOM 0 HG3 GLU A 82 22.608 -19.699 -14.171 1.00 0.00 H new ATOM 1357 N GLU A 83 18.385 -18.259 -12.408 1.00 0.00 N ATOM 1358 CA GLU A 83 17.194 -17.583 -11.907 1.00 0.00 C ATOM 1359 C GLU A 83 17.003 -17.851 -10.417 1.00 0.00 C ATOM 1360 O GLU A 83 16.865 -16.922 -9.621 1.00 0.00 O ATOM 1361 CB GLU A 83 15.957 -18.042 -12.682 1.00 0.00 C ATOM 1362 CG GLU A 83 15.773 -17.330 -14.012 1.00 0.00 C ATOM 1363 CD GLU A 83 14.463 -17.685 -14.687 1.00 0.00 C ATOM 1364 OE1 GLU A 83 13.664 -18.427 -14.078 1.00 0.00 O ATOM 1365 OE2 GLU A 83 14.236 -17.221 -15.824 1.00 0.00 O ATOM 0 H GLU A 83 18.209 -18.916 -13.168 1.00 0.00 H new ATOM 0 HA GLU A 83 17.327 -16.511 -12.051 1.00 0.00 H new ATOM 0 HB2 GLU A 83 16.028 -19.115 -12.861 1.00 0.00 H new ATOM 0 HB3 GLU A 83 15.072 -17.879 -12.067 1.00 0.00 H new ATOM 0 HG2 GLU A 83 15.815 -16.253 -13.852 1.00 0.00 H new ATOM 0 HG3 GLU A 83 16.600 -17.586 -14.674 1.00 0.00 H new ATOM 1372 N ILE A 84 16.995 -19.128 -10.048 1.00 0.00 N ATOM 1373 CA ILE A 84 16.821 -19.518 -8.654 1.00 0.00 C ATOM 1374 C ILE A 84 17.969 -19.003 -7.792 1.00 0.00 C ATOM 1375 O ILE A 84 17.784 -18.701 -6.613 1.00 0.00 O ATOM 1376 CB ILE A 84 16.729 -21.048 -8.506 1.00 0.00 C ATOM 1377 CG1 ILE A 84 18.070 -21.698 -8.852 1.00 0.00 C ATOM 1378 CG2 ILE A 84 15.622 -21.601 -9.392 1.00 0.00 C ATOM 1379 CD1 ILE A 84 18.912 -22.030 -7.640 1.00 0.00 C ATOM 0 H ILE A 84 17.107 -19.909 -10.694 1.00 0.00 H new ATOM 0 HA ILE A 84 15.886 -19.071 -8.315 1.00 0.00 H new ATOM 0 HB ILE A 84 16.489 -21.283 -7.469 1.00 0.00 H new ATOM 0 HG12 ILE A 84 17.886 -22.611 -9.418 1.00 0.00 H new ATOM 0 HG13 ILE A 84 18.632 -21.028 -9.502 1.00 0.00 H new ATOM 0 HG21 ILE A 84 15.570 -22.684 -9.276 1.00 0.00 H new ATOM 0 HG22 ILE A 84 14.669 -21.159 -9.102 1.00 0.00 H new ATOM 0 HG23 ILE A 84 15.833 -21.357 -10.433 1.00 0.00 H new ATOM 0 HD11 ILE A 84 19.848 -22.488 -7.961 1.00 0.00 H new ATOM 0 HD12 ILE A 84 19.127 -21.117 -7.085 1.00 0.00 H new ATOM 0 HD13 ILE A 84 18.369 -22.725 -6.999 1.00 0.00 H new ATOM 1391 N GLU A 85 19.152 -18.905 -8.389 1.00 0.00 N ATOM 1392 CA GLU A 85 20.330 -18.425 -7.675 1.00 0.00 C ATOM 1393 C GLU A 85 20.127 -16.992 -7.192 1.00 0.00 C ATOM 1394 O GLU A 85 20.451 -16.658 -6.053 1.00 0.00 O ATOM 1395 CB GLU A 85 21.566 -18.502 -8.573 1.00 0.00 C ATOM 1396 CG GLU A 85 22.771 -17.765 -8.015 1.00 0.00 C ATOM 1397 CD GLU A 85 23.155 -18.240 -6.628 1.00 0.00 C ATOM 1398 OE1 GLU A 85 23.023 -19.452 -6.358 1.00 0.00 O ATOM 1399 OE2 GLU A 85 23.589 -17.400 -5.812 1.00 0.00 O ATOM 0 H GLU A 85 19.321 -19.151 -9.364 1.00 0.00 H new ATOM 0 HA GLU A 85 20.482 -19.065 -6.806 1.00 0.00 H new ATOM 0 HB2 GLU A 85 21.829 -19.549 -8.725 1.00 0.00 H new ATOM 0 HB3 GLU A 85 21.320 -18.090 -9.552 1.00 0.00 H new ATOM 0 HG2 GLU A 85 23.618 -17.899 -8.688 1.00 0.00 H new ATOM 0 HG3 GLU A 85 22.556 -16.697 -7.982 1.00 0.00 H new ATOM 1406 N MET A 86 19.588 -16.150 -8.068 1.00 0.00 N ATOM 1407 CA MET A 86 19.342 -14.752 -7.731 1.00 0.00 C ATOM 1408 C MET A 86 18.096 -14.614 -6.861 1.00 0.00 C ATOM 1409 O MET A 86 18.107 -13.910 -5.853 1.00 0.00 O ATOM 1410 CB MET A 86 19.183 -13.919 -9.004 1.00 0.00 C ATOM 1411 CG MET A 86 19.796 -12.532 -8.903 1.00 0.00 C ATOM 1412 SD MET A 86 19.015 -11.519 -7.631 1.00 0.00 S ATOM 1413 CE MET A 86 20.312 -11.467 -6.396 1.00 0.00 C ATOM 0 H MET A 86 19.314 -16.411 -9.015 1.00 0.00 H new ATOM 0 HA MET A 86 20.200 -14.383 -7.168 1.00 0.00 H new ATOM 0 HB2 MET A 86 19.644 -14.451 -9.836 1.00 0.00 H new ATOM 0 HB3 MET A 86 18.122 -13.823 -9.235 1.00 0.00 H new ATOM 0 HG2 MET A 86 20.860 -12.624 -8.686 1.00 0.00 H new ATOM 0 HG3 MET A 86 19.709 -12.030 -9.866 1.00 0.00 H new ATOM 0 HE1 MET A 86 19.948 -10.951 -5.508 1.00 0.00 H new ATOM 0 HE2 MET A 86 20.603 -12.483 -6.131 1.00 0.00 H new ATOM 0 HE3 MET A 86 21.175 -10.935 -6.797 1.00 0.00 H new ATOM 1423 N MET A 87 17.024 -15.292 -7.259 1.00 0.00 N ATOM 1424 CA MET A 87 15.771 -15.245 -6.514 1.00 0.00 C ATOM 1425 C MET A 87 15.971 -15.731 -5.083 1.00 0.00 C ATOM 1426 O MET A 87 15.518 -15.095 -4.131 1.00 0.00 O ATOM 1427 CB MET A 87 14.707 -16.095 -7.211 1.00 0.00 C ATOM 1428 CG MET A 87 14.445 -15.682 -8.650 1.00 0.00 C ATOM 1429 SD MET A 87 12.934 -14.714 -8.830 1.00 0.00 S ATOM 1430 CE MET A 87 11.926 -15.837 -9.795 1.00 0.00 C ATOM 0 H MET A 87 16.998 -15.880 -8.092 1.00 0.00 H new ATOM 0 HA MET A 87 15.434 -14.209 -6.482 1.00 0.00 H new ATOM 0 HB2 MET A 87 15.019 -17.139 -7.193 1.00 0.00 H new ATOM 0 HB3 MET A 87 13.776 -16.030 -6.648 1.00 0.00 H new ATOM 0 HG2 MET A 87 15.291 -15.100 -9.017 1.00 0.00 H new ATOM 0 HG3 MET A 87 14.377 -16.574 -9.273 1.00 0.00 H new ATOM 0 HE1 MET A 87 10.956 -15.380 -9.989 1.00 0.00 H new ATOM 0 HE2 MET A 87 12.423 -16.050 -10.742 1.00 0.00 H new ATOM 0 HE3 MET A 87 11.785 -16.766 -9.242 1.00 0.00 H new ATOM 1440 N VAL A 88 16.653 -16.864 -4.937 1.00 0.00 N ATOM 1441 CA VAL A 88 16.913 -17.435 -3.621 1.00 0.00 C ATOM 1442 C VAL A 88 17.910 -16.586 -2.841 1.00 0.00 C ATOM 1443 O VAL A 88 17.780 -16.413 -1.629 1.00 0.00 O ATOM 1444 CB VAL A 88 17.455 -18.873 -3.731 1.00 0.00 C ATOM 1445 CG1 VAL A 88 17.906 -19.379 -2.369 1.00 0.00 C ATOM 1446 CG2 VAL A 88 16.403 -19.794 -4.330 1.00 0.00 C ATOM 0 H VAL A 88 17.035 -17.404 -5.714 1.00 0.00 H new ATOM 0 HA VAL A 88 15.962 -17.453 -3.089 1.00 0.00 H new ATOM 0 HB VAL A 88 18.320 -18.868 -4.394 1.00 0.00 H new ATOM 0 HG11 VAL A 88 18.286 -20.396 -2.466 1.00 0.00 H new ATOM 0 HG12 VAL A 88 18.694 -18.733 -1.984 1.00 0.00 H new ATOM 0 HG13 VAL A 88 17.061 -19.371 -1.680 1.00 0.00 H new ATOM 0 HG21 VAL A 88 16.803 -20.806 -4.400 1.00 0.00 H new ATOM 0 HG22 VAL A 88 15.518 -19.797 -3.694 1.00 0.00 H new ATOM 0 HG23 VAL A 88 16.134 -19.440 -5.325 1.00 0.00 H new ATOM 1456 N PHE A 89 18.906 -16.057 -3.544 1.00 0.00 N ATOM 1457 CA PHE A 89 19.926 -15.225 -2.917 1.00 0.00 C ATOM 1458 C PHE A 89 19.292 -14.055 -2.170 1.00 0.00 C ATOM 1459 O PHE A 89 19.534 -13.859 -0.979 1.00 0.00 O ATOM 1460 CB PHE A 89 20.906 -14.702 -3.970 1.00 0.00 C ATOM 1461 CG PHE A 89 21.861 -13.671 -3.440 1.00 0.00 C ATOM 1462 CD1 PHE A 89 21.527 -12.326 -3.452 1.00 0.00 C ATOM 1463 CD2 PHE A 89 23.094 -14.047 -2.930 1.00 0.00 C ATOM 1464 CE1 PHE A 89 22.404 -11.375 -2.966 1.00 0.00 C ATOM 1465 CE2 PHE A 89 23.974 -13.100 -2.442 1.00 0.00 C ATOM 1466 CZ PHE A 89 23.630 -11.763 -2.460 1.00 0.00 C ATOM 0 H PHE A 89 19.028 -16.190 -4.548 1.00 0.00 H new ATOM 0 HA PHE A 89 20.469 -15.840 -2.199 1.00 0.00 H new ATOM 0 HB2 PHE A 89 21.475 -15.540 -4.373 1.00 0.00 H new ATOM 0 HB3 PHE A 89 20.342 -14.272 -4.798 1.00 0.00 H new ATOM 0 HD1 PHE A 89 20.570 -12.017 -3.846 1.00 0.00 H new ATOM 0 HD2 PHE A 89 23.370 -15.091 -2.914 1.00 0.00 H new ATOM 0 HE1 PHE A 89 22.132 -10.330 -2.982 1.00 0.00 H new ATOM 0 HE2 PHE A 89 24.931 -13.406 -2.046 1.00 0.00 H new ATOM 0 HZ PHE A 89 24.317 -11.022 -2.079 1.00 0.00 H new ATOM 1476 N LEU A 90 18.478 -13.280 -2.880 1.00 0.00 N ATOM 1477 CA LEU A 90 17.808 -12.128 -2.286 1.00 0.00 C ATOM 1478 C LEU A 90 16.776 -12.571 -1.254 1.00 0.00 C ATOM 1479 O LEU A 90 16.550 -11.890 -0.255 1.00 0.00 O ATOM 1480 CB LEU A 90 17.133 -11.290 -3.373 1.00 0.00 C ATOM 1481 CG LEU A 90 16.173 -12.039 -4.298 1.00 0.00 C ATOM 1482 CD1 LEU A 90 14.781 -12.099 -3.688 1.00 0.00 C ATOM 1483 CD2 LEU A 90 16.128 -11.378 -5.668 1.00 0.00 C ATOM 0 H LEU A 90 18.266 -13.429 -3.867 1.00 0.00 H new ATOM 0 HA LEU A 90 18.560 -11.521 -1.782 1.00 0.00 H new ATOM 0 HB2 LEU A 90 16.585 -10.480 -2.892 1.00 0.00 H new ATOM 0 HB3 LEU A 90 17.910 -10.830 -3.984 1.00 0.00 H new ATOM 0 HG LEU A 90 16.538 -13.059 -4.420 1.00 0.00 H new ATOM 0 HD11 LEU A 90 14.112 -12.636 -4.361 1.00 0.00 H new ATOM 0 HD12 LEU A 90 14.825 -12.618 -2.730 1.00 0.00 H new ATOM 0 HD13 LEU A 90 14.407 -11.087 -3.535 1.00 0.00 H new ATOM 0 HD21 LEU A 90 15.440 -11.924 -6.313 1.00 0.00 H new ATOM 0 HD22 LEU A 90 15.787 -10.348 -5.564 1.00 0.00 H new ATOM 0 HD23 LEU A 90 17.124 -11.388 -6.110 1.00 0.00 H new ATOM 1495 N SER A 91 16.152 -13.719 -1.504 1.00 0.00 N ATOM 1496 CA SER A 91 15.142 -14.252 -0.597 1.00 0.00 C ATOM 1497 C SER A 91 15.770 -14.673 0.728 1.00 0.00 C ATOM 1498 O SER A 91 15.132 -14.604 1.779 1.00 0.00 O ATOM 1499 CB SER A 91 14.430 -15.444 -1.239 1.00 0.00 C ATOM 1500 OG SER A 91 13.484 -15.015 -2.202 1.00 0.00 O ATOM 0 H SER A 91 16.328 -14.297 -2.326 1.00 0.00 H new ATOM 0 HA SER A 91 14.414 -13.465 -0.400 1.00 0.00 H new ATOM 0 HB2 SER A 91 15.163 -16.098 -1.711 1.00 0.00 H new ATOM 0 HB3 SER A 91 13.929 -16.030 -0.469 1.00 0.00 H new ATOM 0 HG SER A 91 13.920 -14.934 -3.076 1.00 0.00 H new ATOM 1506 N SER A 92 17.024 -15.110 0.670 1.00 0.00 N ATOM 1507 CA SER A 92 17.738 -15.546 1.864 1.00 0.00 C ATOM 1508 C SER A 92 18.031 -14.365 2.784 1.00 0.00 C ATOM 1509 O SER A 92 18.073 -14.510 4.005 1.00 0.00 O ATOM 1510 CB SER A 92 19.044 -16.242 1.477 1.00 0.00 C ATOM 1511 OG SER A 92 19.464 -17.138 2.491 1.00 0.00 O ATOM 0 H SER A 92 17.567 -15.171 -0.192 1.00 0.00 H new ATOM 0 HA SER A 92 17.103 -16.252 2.399 1.00 0.00 H new ATOM 0 HB2 SER A 92 18.907 -16.785 0.542 1.00 0.00 H new ATOM 0 HB3 SER A 92 19.819 -15.496 1.302 1.00 0.00 H new ATOM 0 HG SER A 92 20.300 -17.571 2.219 1.00 0.00 H new