USER MOD reduce.3.24.130724 H: found=0, std=0, add=458, rem=0, adj=8 USER MOD reduce.3.24.130724 removed 459 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 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 THR OG1 : rot 180:sc= 0 USER MOD Single : A 133 MET CE :methyl -123:sc= -0.0405 (180deg=-0.499) USER MOD Single : A 137 ASN : amide:sc= -1.45! C(o=-1.5!,f=-7.2!) USER MOD Single : A 145 ASN : amide:sc= 0 K(o=0,f=-1.5) USER MOD Single : A 153 TYR OH : rot 180:sc= 0 USER MOD Single : A 155 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 156 SER OG : rot 180:sc= -0.397 USER MOD Single : A 159 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 SER OG : rot 180:sc= 0 USER MOD Single : A 163 SER OG : rot 180:sc= 0 USER MOD Single : A 169 THR OG1 : rot 180:sc= -0.0277 USER MOD Single : A 176 SER OG : rot 180:sc= 0 USER MOD Single : A 177 GLN : amide:sc= 0.798 K(o=0.8,f=-6.8!) USER MOD Single : A 180 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ARG A 123 12.414 -11.517 25.475 1.00 0.00 N ATOM 2 CA ARG A 123 11.482 -11.918 24.384 1.00 0.00 C ATOM 3 C ARG A 123 10.430 -10.825 24.185 1.00 0.00 C ATOM 4 O ARG A 123 9.351 -10.882 24.741 1.00 0.00 O ATOM 5 CB ARG A 123 10.790 -13.229 24.761 1.00 0.00 C ATOM 6 CG ARG A 123 11.558 -14.405 24.151 1.00 0.00 C ATOM 7 CD ARG A 123 10.795 -14.938 22.936 1.00 0.00 C ATOM 8 NE ARG A 123 11.593 -14.691 21.703 1.00 0.00 N ATOM 9 CZ ARG A 123 11.057 -14.888 20.529 1.00 0.00 C ATOM 10 NH1 ARG A 123 10.304 -15.934 20.322 1.00 0.00 N ATOM 11 NH2 ARG A 123 11.273 -14.038 19.563 1.00 0.00 N ATOM 0 HA ARG A 123 12.042 -12.056 23.459 1.00 0.00 H new ATOM 0 HB2 ARG A 123 10.748 -13.332 25.845 1.00 0.00 H new ATOM 0 HB3 ARG A 123 9.761 -13.226 24.401 1.00 0.00 H new ATOM 0 HG2 ARG A 123 12.557 -14.086 23.855 1.00 0.00 H new ATOM 0 HG3 ARG A 123 11.682 -15.195 24.891 1.00 0.00 H new ATOM 0 HD2 ARG A 123 10.605 -16.005 23.052 1.00 0.00 H new ATOM 0 HD3 ARG A 123 9.825 -14.448 22.859 1.00 0.00 H new ATOM 0 HE ARG A 123 12.558 -14.368 21.776 1.00 0.00 H new ATOM 0 HH11 ARG A 123 10.134 -16.598 21.078 1.00 0.00 H new ATOM 0 HH12 ARG A 123 9.885 -16.088 19.405 1.00 0.00 H new ATOM 0 HH21 ARG A 123 11.860 -13.220 19.725 1.00 0.00 H new ATOM 0 HH22 ARG A 123 10.854 -14.191 18.646 1.00 0.00 H new ATOM 25 N PRO A 124 10.757 -9.810 23.372 1.00 0.00 N ATOM 26 CA PRO A 124 9.843 -8.694 23.092 1.00 0.00 C ATOM 27 C PRO A 124 8.502 -9.185 22.538 1.00 0.00 C ATOM 28 O PRO A 124 8.429 -10.191 21.862 1.00 0.00 O ATOM 29 CB PRO A 124 10.582 -7.884 22.028 1.00 0.00 C ATOM 30 CG PRO A 124 11.485 -8.869 21.365 1.00 0.00 C ATOM 31 CD PRO A 124 11.888 -9.852 22.428 1.00 0.00 C ATOM 0 HA PRO A 124 9.605 -8.125 23.990 1.00 0.00 H new ATOM 0 HB2 PRO A 124 9.888 -7.440 21.315 1.00 0.00 H new ATOM 0 HB3 PRO A 124 11.147 -7.066 22.474 1.00 0.00 H new ATOM 0 HG2 PRO A 124 10.976 -9.372 20.543 1.00 0.00 H new ATOM 0 HG3 PRO A 124 12.359 -8.373 20.943 1.00 0.00 H new ATOM 0 HD2 PRO A 124 12.033 -10.851 22.018 1.00 0.00 H new ATOM 0 HD3 PRO A 124 12.824 -9.565 22.908 1.00 0.00 H new ATOM 39 N LYS A 125 7.440 -8.480 22.820 1.00 0.00 N ATOM 40 CA LYS A 125 6.107 -8.906 22.311 1.00 0.00 C ATOM 41 C LYS A 125 5.900 -8.358 20.898 1.00 0.00 C ATOM 42 O LYS A 125 6.396 -7.302 20.553 1.00 0.00 O ATOM 43 CB LYS A 125 5.012 -8.366 23.232 1.00 0.00 C ATOM 44 CG LYS A 125 5.156 -8.995 24.620 1.00 0.00 C ATOM 45 CD LYS A 125 3.991 -8.549 25.506 1.00 0.00 C ATOM 46 CE LYS A 125 4.205 -9.070 26.928 1.00 0.00 C ATOM 47 NZ LYS A 125 3.157 -10.081 27.249 1.00 0.00 N ATOM 0 H LYS A 125 7.439 -7.628 23.381 1.00 0.00 H new ATOM 0 HA LYS A 125 6.059 -9.995 22.289 1.00 0.00 H new ATOM 0 HB2 LYS A 125 5.085 -7.281 23.304 1.00 0.00 H new ATOM 0 HB3 LYS A 125 4.029 -8.593 22.818 1.00 0.00 H new ATOM 0 HG2 LYS A 125 5.170 -10.082 24.539 1.00 0.00 H new ATOM 0 HG3 LYS A 125 6.103 -8.697 25.069 1.00 0.00 H new ATOM 0 HD2 LYS A 125 3.920 -7.461 25.512 1.00 0.00 H new ATOM 0 HD3 LYS A 125 3.050 -8.927 25.106 1.00 0.00 H new ATOM 0 HE2 LYS A 125 5.196 -9.516 27.018 1.00 0.00 H new ATOM 0 HE3 LYS A 125 4.160 -8.246 27.640 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 3.302 -10.436 28.216 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 2.217 -9.641 27.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 3.220 -10.872 26.577 1.00 0.00 H new ATOM 61 N THR A 126 5.173 -9.065 20.077 1.00 0.00 N ATOM 62 CA THR A 126 4.936 -8.582 18.688 1.00 0.00 C ATOM 63 C THR A 126 3.574 -7.890 18.614 1.00 0.00 C ATOM 64 O THR A 126 3.037 -7.668 17.547 1.00 0.00 O ATOM 65 CB THR A 126 4.957 -9.772 17.724 1.00 0.00 C ATOM 66 OG1 THR A 126 3.875 -10.643 18.026 1.00 0.00 O ATOM 67 CG2 THR A 126 6.278 -10.526 17.870 1.00 0.00 C ATOM 0 H THR A 126 4.733 -9.956 20.308 1.00 0.00 H new ATOM 0 HA THR A 126 5.718 -7.875 18.410 1.00 0.00 H new ATOM 0 HB THR A 126 4.859 -9.412 16.700 1.00 0.00 H new ATOM 0 HG1 THR A 126 3.886 -11.404 17.409 1.00 0.00 H new ATOM 0 HG21 THR A 126 6.292 -11.373 17.183 1.00 0.00 H new ATOM 0 HG22 THR A 126 7.106 -9.857 17.637 1.00 0.00 H new ATOM 0 HG23 THR A 126 6.380 -10.887 18.893 1.00 0.00 H new ATOM 75 N LEU A 127 3.011 -7.546 19.739 1.00 0.00 N ATOM 76 CA LEU A 127 1.684 -6.868 19.732 1.00 0.00 C ATOM 77 C LEU A 127 1.885 -5.356 19.618 1.00 0.00 C ATOM 78 O LEU A 127 2.148 -4.679 20.592 1.00 0.00 O ATOM 79 CB LEU A 127 0.941 -7.186 21.031 1.00 0.00 C ATOM 80 CG LEU A 127 0.801 -8.703 21.179 1.00 0.00 C ATOM 81 CD1 LEU A 127 -0.073 -9.018 22.395 1.00 0.00 C ATOM 82 CD2 LEU A 127 0.150 -9.280 19.921 1.00 0.00 C ATOM 0 H LEU A 127 3.412 -7.705 20.663 1.00 0.00 H new ATOM 0 HA LEU A 127 1.100 -7.223 18.883 1.00 0.00 H new ATOM 0 HB2 LEU A 127 1.483 -6.775 21.883 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -0.043 -6.718 21.024 1.00 0.00 H new ATOM 0 HG LEU A 127 1.787 -9.147 21.315 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -0.173 -10.098 22.501 1.00 0.00 H new ATOM 0 HD12 LEU A 127 0.390 -8.607 23.292 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -1.059 -8.574 22.259 1.00 0.00 H new ATOM 0 HD21 LEU A 127 0.050 -10.360 20.026 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -0.836 -8.836 19.785 1.00 0.00 H new ATOM 0 HD23 LEU A 127 0.771 -9.056 19.054 1.00 0.00 H new ATOM 94 N PHE A 128 1.764 -4.819 18.435 1.00 0.00 N ATOM 95 CA PHE A 128 1.948 -3.351 18.259 1.00 0.00 C ATOM 96 C PHE A 128 0.597 -2.700 17.958 1.00 0.00 C ATOM 97 O PHE A 128 -0.210 -3.233 17.222 1.00 0.00 O ATOM 98 CB PHE A 128 2.909 -3.093 17.096 1.00 0.00 C ATOM 99 CG PHE A 128 4.224 -3.784 17.366 1.00 0.00 C ATOM 100 CD1 PHE A 128 5.221 -3.128 18.099 1.00 0.00 C ATOM 101 CD2 PHE A 128 4.447 -5.080 16.883 1.00 0.00 C ATOM 102 CE1 PHE A 128 6.441 -3.769 18.348 1.00 0.00 C ATOM 103 CE2 PHE A 128 5.666 -5.719 17.134 1.00 0.00 C ATOM 104 CZ PHE A 128 6.664 -5.064 17.867 1.00 0.00 C ATOM 0 H PHE A 128 1.545 -5.334 17.582 1.00 0.00 H new ATOM 0 HA PHE A 128 2.361 -2.925 19.173 1.00 0.00 H new ATOM 0 HB2 PHE A 128 2.477 -3.461 16.165 1.00 0.00 H new ATOM 0 HB3 PHE A 128 3.068 -2.022 16.972 1.00 0.00 H new ATOM 0 HD1 PHE A 128 5.049 -2.129 18.472 1.00 0.00 H new ATOM 0 HD2 PHE A 128 3.678 -5.585 16.317 1.00 0.00 H new ATOM 0 HE1 PHE A 128 7.211 -3.263 18.912 1.00 0.00 H new ATOM 0 HE2 PHE A 128 5.838 -6.718 16.762 1.00 0.00 H new ATOM 0 HZ PHE A 128 7.605 -5.558 18.061 1.00 0.00 H new ATOM 114 N GLU A 129 0.344 -1.551 18.521 1.00 0.00 N ATOM 115 CA GLU A 129 -0.956 -0.867 18.267 1.00 0.00 C ATOM 116 C GLU A 129 -0.707 0.620 18.008 1.00 0.00 C ATOM 117 O GLU A 129 0.262 1.186 18.471 1.00 0.00 O ATOM 118 CB GLU A 129 -1.864 -1.027 19.488 1.00 0.00 C ATOM 119 CG GLU A 129 -3.011 -1.981 19.149 1.00 0.00 C ATOM 120 CD GLU A 129 -2.995 -3.165 20.117 1.00 0.00 C ATOM 121 OE1 GLU A 129 -1.920 -3.681 20.373 1.00 0.00 O ATOM 122 OE2 GLU A 129 -4.058 -3.536 20.587 1.00 0.00 O ATOM 0 H GLU A 129 0.981 -1.056 19.146 1.00 0.00 H new ATOM 0 HA GLU A 129 -1.437 -1.312 17.396 1.00 0.00 H new ATOM 0 HB2 GLU A 129 -1.292 -1.414 20.332 1.00 0.00 H new ATOM 0 HB3 GLU A 129 -2.260 -0.057 19.789 1.00 0.00 H new ATOM 0 HG2 GLU A 129 -3.965 -1.457 19.215 1.00 0.00 H new ATOM 0 HG3 GLU A 129 -2.912 -2.335 18.123 1.00 0.00 H new ATOM 129 N PRO A 130 -1.607 1.262 17.248 1.00 0.00 N ATOM 130 CA PRO A 130 -1.492 2.688 16.921 1.00 0.00 C ATOM 131 C PRO A 130 -1.179 3.532 18.160 1.00 0.00 C ATOM 132 O PRO A 130 -1.794 3.380 19.197 1.00 0.00 O ATOM 133 CB PRO A 130 -2.876 3.045 16.381 1.00 0.00 C ATOM 134 CG PRO A 130 -3.792 2.044 17.001 1.00 0.00 C ATOM 135 CD PRO A 130 -2.995 0.778 17.143 1.00 0.00 C ATOM 0 HA PRO A 130 -0.683 2.882 16.217 1.00 0.00 H new ATOM 0 HB2 PRO A 130 -3.158 4.062 16.654 1.00 0.00 H new ATOM 0 HB3 PRO A 130 -2.904 2.987 15.293 1.00 0.00 H new ATOM 0 HG2 PRO A 130 -4.148 2.391 17.971 1.00 0.00 H new ATOM 0 HG3 PRO A 130 -4.671 1.883 16.378 1.00 0.00 H new ATOM 0 HD2 PRO A 130 -3.292 0.213 18.026 1.00 0.00 H new ATOM 0 HD3 PRO A 130 -3.128 0.120 16.284 1.00 0.00 H new ATOM 143 N GLY A 131 -0.229 4.419 18.060 1.00 0.00 N ATOM 144 CA GLY A 131 0.122 5.270 19.233 1.00 0.00 C ATOM 145 C GLY A 131 1.143 4.540 20.109 1.00 0.00 C ATOM 146 O GLY A 131 1.532 5.021 21.154 1.00 0.00 O ATOM 0 H GLY A 131 0.320 4.592 17.218 1.00 0.00 H new ATOM 0 HA2 GLY A 131 0.532 6.222 18.895 1.00 0.00 H new ATOM 0 HA3 GLY A 131 -0.773 5.496 19.812 1.00 0.00 H new ATOM 150 N GLU A 132 1.579 3.382 19.694 1.00 0.00 N ATOM 151 CA GLU A 132 2.573 2.626 20.505 1.00 0.00 C ATOM 152 C GLU A 132 3.987 3.058 20.114 1.00 0.00 C ATOM 153 O GLU A 132 4.296 3.225 18.950 1.00 0.00 O ATOM 154 CB GLU A 132 2.408 1.127 20.245 1.00 0.00 C ATOM 155 CG GLU A 132 3.358 0.344 21.153 1.00 0.00 C ATOM 156 CD GLU A 132 2.920 0.504 22.610 1.00 0.00 C ATOM 157 OE1 GLU A 132 1.751 0.775 22.831 1.00 0.00 O ATOM 158 OE2 GLU A 132 3.761 0.354 23.481 1.00 0.00 O ATOM 0 H GLU A 132 1.289 2.927 18.828 1.00 0.00 H new ATOM 0 HA GLU A 132 2.410 2.832 21.563 1.00 0.00 H new ATOM 0 HB2 GLU A 132 1.377 0.826 20.433 1.00 0.00 H new ATOM 0 HB3 GLU A 132 2.620 0.903 19.200 1.00 0.00 H new ATOM 0 HG2 GLU A 132 3.357 -0.710 20.876 1.00 0.00 H new ATOM 0 HG3 GLU A 132 4.379 0.706 21.027 1.00 0.00 H new ATOM 165 N MET A 133 4.849 3.241 21.077 1.00 0.00 N ATOM 166 CA MET A 133 6.242 3.662 20.758 1.00 0.00 C ATOM 167 C MET A 133 7.050 2.445 20.300 1.00 0.00 C ATOM 168 O MET A 133 6.804 1.332 20.720 1.00 0.00 O ATOM 169 CB MET A 133 6.891 4.265 22.005 1.00 0.00 C ATOM 170 CG MET A 133 6.255 5.624 22.306 1.00 0.00 C ATOM 171 SD MET A 133 7.228 6.479 23.569 1.00 0.00 S ATOM 172 CE MET A 133 8.573 7.025 22.488 1.00 0.00 C ATOM 0 H MET A 133 4.649 3.117 22.069 1.00 0.00 H new ATOM 0 HA MET A 133 6.223 4.407 19.962 1.00 0.00 H new ATOM 0 HB2 MET A 133 6.762 3.595 22.855 1.00 0.00 H new ATOM 0 HB3 MET A 133 7.964 4.380 21.850 1.00 0.00 H new ATOM 0 HG2 MET A 133 6.209 6.225 21.398 1.00 0.00 H new ATOM 0 HG3 MET A 133 5.230 5.489 22.651 1.00 0.00 H new ATOM 0 HE1 MET A 133 9.522 6.650 22.871 1.00 0.00 H new ATOM 0 HE2 MET A 133 8.410 6.640 21.481 1.00 0.00 H new ATOM 0 HE3 MET A 133 8.598 8.114 22.460 1.00 0.00 H new ATOM 182 N VAL A 134 8.013 2.648 19.442 1.00 0.00 N ATOM 183 CA VAL A 134 8.832 1.502 18.960 1.00 0.00 C ATOM 184 C VAL A 134 10.301 1.927 18.881 1.00 0.00 C ATOM 185 O VAL A 134 10.646 3.055 19.168 1.00 0.00 O ATOM 186 CB VAL A 134 8.350 1.078 17.571 1.00 0.00 C ATOM 187 CG1 VAL A 134 8.803 -0.355 17.286 1.00 0.00 C ATOM 188 CG2 VAL A 134 6.822 1.149 17.519 1.00 0.00 C ATOM 0 H VAL A 134 8.267 3.557 19.055 1.00 0.00 H new ATOM 0 HA VAL A 134 8.730 0.665 19.651 1.00 0.00 H new ATOM 0 HB VAL A 134 8.772 1.747 16.821 1.00 0.00 H new ATOM 0 HG11 VAL A 134 8.459 -0.655 16.296 1.00 0.00 H new ATOM 0 HG12 VAL A 134 9.891 -0.407 17.323 1.00 0.00 H new ATOM 0 HG13 VAL A 134 8.382 -1.025 18.035 1.00 0.00 H new ATOM 0 HG21 VAL A 134 6.477 0.847 16.530 1.00 0.00 H new ATOM 0 HG22 VAL A 134 6.401 0.480 18.270 1.00 0.00 H new ATOM 0 HG23 VAL A 134 6.498 2.170 17.720 1.00 0.00 H new ATOM 198 N ARG A 135 11.168 1.032 18.493 1.00 0.00 N ATOM 199 CA ARG A 135 12.612 1.385 18.396 1.00 0.00 C ATOM 200 C ARG A 135 13.196 0.794 17.112 1.00 0.00 C ATOM 201 O ARG A 135 12.852 -0.298 16.708 1.00 0.00 O ATOM 202 CB ARG A 135 13.357 0.818 19.606 1.00 0.00 C ATOM 203 CG ARG A 135 12.947 1.587 20.864 1.00 0.00 C ATOM 204 CD ARG A 135 13.760 1.083 22.058 1.00 0.00 C ATOM 205 NE ARG A 135 15.133 1.662 22.003 1.00 0.00 N ATOM 206 CZ ARG A 135 16.092 1.013 21.401 1.00 0.00 C ATOM 207 NH1 ARG A 135 16.600 -0.057 21.949 1.00 0.00 N ATOM 208 NH2 ARG A 135 16.542 1.434 20.251 1.00 0.00 N ATOM 0 H ARG A 135 10.938 0.071 18.239 1.00 0.00 H new ATOM 0 HA ARG A 135 12.722 2.469 18.378 1.00 0.00 H new ATOM 0 HB2 ARG A 135 13.128 -0.241 19.724 1.00 0.00 H new ATOM 0 HB3 ARG A 135 14.433 0.897 19.453 1.00 0.00 H new ATOM 0 HG2 ARG A 135 13.114 2.655 20.721 1.00 0.00 H new ATOM 0 HG3 ARG A 135 11.882 1.454 21.054 1.00 0.00 H new ATOM 0 HD2 ARG A 135 13.271 1.366 22.990 1.00 0.00 H new ATOM 0 HD3 ARG A 135 13.812 -0.006 22.043 1.00 0.00 H new ATOM 0 HE ARG A 135 15.323 2.566 22.436 1.00 0.00 H new ATOM 0 HH11 ARG A 135 16.248 -0.386 22.848 1.00 0.00 H new ATOM 0 HH12 ARG A 135 17.349 -0.564 21.478 1.00 0.00 H new ATOM 0 HH21 ARG A 135 16.144 2.270 19.823 1.00 0.00 H new ATOM 0 HH22 ARG A 135 17.292 0.927 19.780 1.00 0.00 H new ATOM 222 N VAL A 136 14.079 1.507 16.467 1.00 0.00 N ATOM 223 CA VAL A 136 14.684 0.984 15.210 1.00 0.00 C ATOM 224 C VAL A 136 16.163 0.673 15.445 1.00 0.00 C ATOM 225 O VAL A 136 16.883 1.450 16.042 1.00 0.00 O ATOM 226 CB VAL A 136 14.551 2.034 14.105 1.00 0.00 C ATOM 227 CG1 VAL A 136 15.080 1.458 12.789 1.00 0.00 C ATOM 228 CG2 VAL A 136 13.079 2.417 13.939 1.00 0.00 C ATOM 0 H VAL A 136 14.407 2.428 16.756 1.00 0.00 H new ATOM 0 HA VAL A 136 14.166 0.073 14.909 1.00 0.00 H new ATOM 0 HB VAL A 136 15.128 2.919 14.373 1.00 0.00 H new ATOM 0 HG11 VAL A 136 14.986 2.205 12.001 1.00 0.00 H new ATOM 0 HG12 VAL A 136 16.129 1.185 12.907 1.00 0.00 H new ATOM 0 HG13 VAL A 136 14.503 0.573 12.521 1.00 0.00 H new ATOM 0 HG21 VAL A 136 12.984 3.165 13.152 1.00 0.00 H new ATOM 0 HG22 VAL A 136 12.501 1.533 13.671 1.00 0.00 H new ATOM 0 HG23 VAL A 136 12.702 2.827 14.876 1.00 0.00 H new ATOM 238 N ASN A 137 16.623 -0.456 14.980 1.00 0.00 N ATOM 239 CA ASN A 137 18.056 -0.814 15.176 1.00 0.00 C ATOM 240 C ASN A 137 18.684 -1.168 13.827 1.00 0.00 C ATOM 241 O ASN A 137 19.746 -1.753 13.761 1.00 0.00 O ATOM 242 CB ASN A 137 18.156 -2.017 16.117 1.00 0.00 C ATOM 243 CG ASN A 137 17.351 -3.183 15.540 1.00 0.00 C ATOM 244 OD1 ASN A 137 17.142 -3.259 14.345 1.00 0.00 O ATOM 245 ND2 ASN A 137 16.888 -4.102 16.343 1.00 0.00 N ATOM 0 H ASN A 137 16.069 -1.146 14.473 1.00 0.00 H new ATOM 0 HA ASN A 137 18.586 0.034 15.611 1.00 0.00 H new ATOM 0 HB2 ASN A 137 19.199 -2.308 16.243 1.00 0.00 H new ATOM 0 HB3 ASN A 137 17.777 -1.753 17.104 1.00 0.00 H new ATOM 0 HD21 ASN A 137 16.351 -4.884 15.968 1.00 0.00 H new ATOM 0 HD22 ASN A 137 17.063 -4.038 17.346 1.00 0.00 H new ATOM 252 N ASP A 138 18.035 -0.818 12.750 1.00 0.00 N ATOM 253 CA ASP A 138 18.596 -1.136 11.407 1.00 0.00 C ATOM 254 C ASP A 138 18.316 0.024 10.450 1.00 0.00 C ATOM 255 O ASP A 138 17.368 0.766 10.617 1.00 0.00 O ATOM 256 CB ASP A 138 17.941 -2.411 10.870 1.00 0.00 C ATOM 257 CG ASP A 138 18.639 -2.835 9.576 1.00 0.00 C ATOM 258 OD1 ASP A 138 19.629 -2.212 9.228 1.00 0.00 O ATOM 259 OD2 ASP A 138 18.172 -3.775 8.954 1.00 0.00 O ATOM 0 H ASP A 138 17.141 -0.326 12.742 1.00 0.00 H new ATOM 0 HA ASP A 138 19.672 -1.287 11.489 1.00 0.00 H new ATOM 0 HB2 ASP A 138 18.009 -3.208 11.611 1.00 0.00 H new ATOM 0 HB3 ASP A 138 16.881 -2.238 10.684 1.00 0.00 H new ATOM 264 N GLY A 139 19.134 0.188 9.446 1.00 0.00 N ATOM 265 CA GLY A 139 18.914 1.300 8.479 1.00 0.00 C ATOM 266 C GLY A 139 19.338 2.623 9.119 1.00 0.00 C ATOM 267 O GLY A 139 19.621 2.690 10.298 1.00 0.00 O ATOM 0 H GLY A 139 19.945 -0.400 9.254 1.00 0.00 H new ATOM 0 HA2 GLY A 139 19.487 1.124 7.569 1.00 0.00 H new ATOM 0 HA3 GLY A 139 17.864 1.343 8.191 1.00 0.00 H new ATOM 271 N PRO A 140 19.378 3.697 8.318 1.00 0.00 N ATOM 272 CA PRO A 140 19.766 5.029 8.800 1.00 0.00 C ATOM 273 C PRO A 140 18.913 5.473 9.993 1.00 0.00 C ATOM 274 O PRO A 140 19.278 6.365 10.731 1.00 0.00 O ATOM 275 CB PRO A 140 19.498 5.937 7.600 1.00 0.00 C ATOM 276 CG PRO A 140 18.452 5.222 6.813 1.00 0.00 C ATOM 277 CD PRO A 140 18.714 3.754 7.004 1.00 0.00 C ATOM 0 HA PRO A 140 20.799 5.053 9.147 1.00 0.00 H new ATOM 0 HB2 PRO A 140 19.152 6.921 7.917 1.00 0.00 H new ATOM 0 HB3 PRO A 140 20.402 6.091 7.010 1.00 0.00 H new ATOM 0 HG2 PRO A 140 17.454 5.488 7.161 1.00 0.00 H new ATOM 0 HG3 PRO A 140 18.505 5.493 5.759 1.00 0.00 H new ATOM 0 HD2 PRO A 140 17.790 3.176 6.995 1.00 0.00 H new ATOM 0 HD3 PRO A 140 19.349 3.353 6.214 1.00 0.00 H new ATOM 285 N PHE A 141 17.780 4.856 10.186 1.00 0.00 N ATOM 286 CA PHE A 141 16.907 5.243 11.331 1.00 0.00 C ATOM 287 C PHE A 141 17.230 4.361 12.539 1.00 0.00 C ATOM 288 O PHE A 141 16.480 4.301 13.493 1.00 0.00 O ATOM 289 CB PHE A 141 15.439 5.056 10.940 1.00 0.00 C ATOM 290 CG PHE A 141 15.124 5.914 9.737 1.00 0.00 C ATOM 291 CD1 PHE A 141 14.900 7.287 9.896 1.00 0.00 C ATOM 292 CD2 PHE A 141 15.053 5.335 8.464 1.00 0.00 C ATOM 293 CE1 PHE A 141 14.607 8.082 8.781 1.00 0.00 C ATOM 294 CE2 PHE A 141 14.760 6.130 7.350 1.00 0.00 C ATOM 295 CZ PHE A 141 14.537 7.503 7.508 1.00 0.00 C ATOM 0 H PHE A 141 17.421 4.101 9.601 1.00 0.00 H new ATOM 0 HA PHE A 141 17.084 6.288 11.586 1.00 0.00 H new ATOM 0 HB2 PHE A 141 15.243 4.008 10.714 1.00 0.00 H new ATOM 0 HB3 PHE A 141 14.792 5.329 11.774 1.00 0.00 H new ATOM 0 HD1 PHE A 141 14.953 7.733 10.878 1.00 0.00 H new ATOM 0 HD2 PHE A 141 15.224 4.276 8.342 1.00 0.00 H new ATOM 0 HE1 PHE A 141 14.435 9.141 8.903 1.00 0.00 H new ATOM 0 HE2 PHE A 141 14.706 5.684 6.368 1.00 0.00 H new ATOM 0 HZ PHE A 141 14.311 8.116 6.648 1.00 0.00 H new ATOM 305 N ALA A 142 18.339 3.676 12.505 1.00 0.00 N ATOM 306 CA ALA A 142 18.708 2.798 13.651 1.00 0.00 C ATOM 307 C ALA A 142 18.986 3.658 14.885 1.00 0.00 C ATOM 308 O ALA A 142 19.432 4.784 14.781 1.00 0.00 O ATOM 309 CB ALA A 142 19.962 1.996 13.296 1.00 0.00 C ATOM 0 H ALA A 142 19.006 3.686 11.733 1.00 0.00 H new ATOM 0 HA ALA A 142 17.886 2.114 13.863 1.00 0.00 H new ATOM 0 HB1 ALA A 142 20.232 1.354 14.134 1.00 0.00 H new ATOM 0 HB2 ALA A 142 19.765 1.382 12.417 1.00 0.00 H new ATOM 0 HB3 ALA A 142 20.783 2.680 13.084 1.00 0.00 H new ATOM 315 N ASP A 143 18.728 3.138 16.053 1.00 0.00 N ATOM 316 CA ASP A 143 18.978 3.927 17.293 1.00 0.00 C ATOM 317 C ASP A 143 18.062 5.153 17.311 1.00 0.00 C ATOM 318 O ASP A 143 18.492 6.257 17.580 1.00 0.00 O ATOM 319 CB ASP A 143 20.438 4.381 17.323 1.00 0.00 C ATOM 320 CG ASP A 143 21.354 3.160 17.211 1.00 0.00 C ATOM 321 OD1 ASP A 143 20.874 2.062 17.437 1.00 0.00 O ATOM 322 OD2 ASP A 143 22.520 3.345 16.902 1.00 0.00 O ATOM 0 H ASP A 143 18.355 2.201 16.203 1.00 0.00 H new ATOM 0 HA ASP A 143 18.772 3.307 18.166 1.00 0.00 H new ATOM 0 HB2 ASP A 143 20.632 5.071 16.502 1.00 0.00 H new ATOM 0 HB3 ASP A 143 20.644 4.920 18.248 1.00 0.00 H new ATOM 327 N PHE A 144 16.802 4.967 17.027 1.00 0.00 N ATOM 328 CA PHE A 144 15.859 6.121 17.029 1.00 0.00 C ATOM 329 C PHE A 144 14.521 5.687 17.630 1.00 0.00 C ATOM 330 O PHE A 144 14.060 4.585 17.410 1.00 0.00 O ATOM 331 CB PHE A 144 15.640 6.604 15.593 1.00 0.00 C ATOM 332 CG PHE A 144 16.770 7.521 15.191 1.00 0.00 C ATOM 333 CD1 PHE A 144 16.757 8.864 15.586 1.00 0.00 C ATOM 334 CD2 PHE A 144 17.832 7.028 14.423 1.00 0.00 C ATOM 335 CE1 PHE A 144 17.805 9.714 15.212 1.00 0.00 C ATOM 336 CE2 PHE A 144 18.881 7.878 14.050 1.00 0.00 C ATOM 337 CZ PHE A 144 18.867 9.221 14.444 1.00 0.00 C ATOM 0 H PHE A 144 16.385 4.066 16.794 1.00 0.00 H new ATOM 0 HA PHE A 144 16.279 6.931 17.625 1.00 0.00 H new ATOM 0 HB2 PHE A 144 15.591 5.752 14.915 1.00 0.00 H new ATOM 0 HB3 PHE A 144 14.687 7.128 15.516 1.00 0.00 H new ATOM 0 HD1 PHE A 144 15.939 9.244 16.179 1.00 0.00 H new ATOM 0 HD2 PHE A 144 17.842 5.992 14.118 1.00 0.00 H new ATOM 0 HE1 PHE A 144 17.794 10.750 15.516 1.00 0.00 H new ATOM 0 HE2 PHE A 144 19.700 7.497 13.459 1.00 0.00 H new ATOM 0 HZ PHE A 144 19.675 9.877 14.156 1.00 0.00 H new ATOM 347 N ASN A 145 13.894 6.544 18.389 1.00 0.00 N ATOM 348 CA ASN A 145 12.587 6.177 19.004 1.00 0.00 C ATOM 349 C ASN A 145 11.449 6.805 18.196 1.00 0.00 C ATOM 350 O ASN A 145 11.556 7.916 17.716 1.00 0.00 O ATOM 351 CB ASN A 145 12.537 6.693 20.443 1.00 0.00 C ATOM 352 CG ASN A 145 13.675 6.064 21.251 1.00 0.00 C ATOM 353 OD1 ASN A 145 14.185 5.023 20.892 1.00 0.00 O ATOM 354 ND2 ASN A 145 14.093 6.657 22.335 1.00 0.00 N ATOM 0 H ASN A 145 14.230 7.481 18.610 1.00 0.00 H new ATOM 0 HA ASN A 145 12.477 5.093 19.004 1.00 0.00 H new ATOM 0 HB2 ASN A 145 12.626 7.779 20.454 1.00 0.00 H new ATOM 0 HB3 ASN A 145 11.576 6.447 20.896 1.00 0.00 H new ATOM 0 HD21 ASN A 145 14.849 6.246 22.882 1.00 0.00 H new ATOM 0 HD22 ASN A 145 13.664 7.532 22.636 1.00 0.00 H new ATOM 361 N GLY A 146 10.359 6.104 18.043 1.00 0.00 N ATOM 362 CA GLY A 146 9.216 6.662 17.268 1.00 0.00 C ATOM 363 C GLY A 146 7.928 5.939 17.667 1.00 0.00 C ATOM 364 O GLY A 146 7.940 5.028 18.471 1.00 0.00 O ATOM 0 H GLY A 146 10.211 5.169 18.422 1.00 0.00 H new ATOM 0 HA2 GLY A 146 9.120 7.731 17.460 1.00 0.00 H new ATOM 0 HA3 GLY A 146 9.396 6.545 16.199 1.00 0.00 H new ATOM 368 N VAL A 147 6.816 6.334 17.110 1.00 0.00 N ATOM 369 CA VAL A 147 5.529 5.668 17.458 1.00 0.00 C ATOM 370 C VAL A 147 4.984 4.939 16.228 1.00 0.00 C ATOM 371 O VAL A 147 5.408 5.177 15.115 1.00 0.00 O ATOM 372 CB VAL A 147 4.518 6.718 17.920 1.00 0.00 C ATOM 373 CG1 VAL A 147 3.218 6.027 18.337 1.00 0.00 C ATOM 374 CG2 VAL A 147 5.091 7.488 19.111 1.00 0.00 C ATOM 0 H VAL A 147 6.743 7.090 16.429 1.00 0.00 H new ATOM 0 HA VAL A 147 5.697 4.950 18.261 1.00 0.00 H new ATOM 0 HB VAL A 147 4.315 7.410 17.103 1.00 0.00 H new ATOM 0 HG11 VAL A 147 2.497 6.776 18.666 1.00 0.00 H new ATOM 0 HG12 VAL A 147 2.809 5.478 17.488 1.00 0.00 H new ATOM 0 HG13 VAL A 147 3.420 5.334 19.154 1.00 0.00 H new ATOM 0 HG21 VAL A 147 4.371 8.237 19.441 1.00 0.00 H new ATOM 0 HG22 VAL A 147 5.295 6.796 19.928 1.00 0.00 H new ATOM 0 HG23 VAL A 147 6.017 7.981 18.814 1.00 0.00 H new ATOM 384 N VAL A 148 4.047 4.052 16.420 1.00 0.00 N ATOM 385 CA VAL A 148 3.476 3.309 15.261 1.00 0.00 C ATOM 386 C VAL A 148 2.231 4.036 14.750 1.00 0.00 C ATOM 387 O VAL A 148 1.141 3.852 15.255 1.00 0.00 O ATOM 388 CB VAL A 148 3.095 1.894 15.700 1.00 0.00 C ATOM 389 CG1 VAL A 148 2.426 1.161 14.535 1.00 0.00 C ATOM 390 CG2 VAL A 148 4.355 1.136 16.124 1.00 0.00 C ATOM 0 H VAL A 148 3.652 3.810 17.329 1.00 0.00 H new ATOM 0 HA VAL A 148 4.218 3.256 14.464 1.00 0.00 H new ATOM 0 HB VAL A 148 2.403 1.948 16.540 1.00 0.00 H new ATOM 0 HG11 VAL A 148 2.154 0.153 14.847 1.00 0.00 H new ATOM 0 HG12 VAL A 148 1.529 1.701 14.232 1.00 0.00 H new ATOM 0 HG13 VAL A 148 3.118 1.106 13.694 1.00 0.00 H new ATOM 0 HG21 VAL A 148 4.085 0.127 16.437 1.00 0.00 H new ATOM 0 HG22 VAL A 148 5.047 1.082 15.284 1.00 0.00 H new ATOM 0 HG23 VAL A 148 4.832 1.658 16.954 1.00 0.00 H new ATOM 400 N GLU A 149 2.382 4.862 13.751 1.00 0.00 N ATOM 401 CA GLU A 149 1.205 5.599 13.209 1.00 0.00 C ATOM 402 C GLU A 149 0.249 4.610 12.541 1.00 0.00 C ATOM 403 O GLU A 149 -0.955 4.772 12.581 1.00 0.00 O ATOM 404 CB GLU A 149 1.677 6.628 12.179 1.00 0.00 C ATOM 405 CG GLU A 149 2.615 7.631 12.853 1.00 0.00 C ATOM 406 CD GLU A 149 1.835 8.438 13.894 1.00 0.00 C ATOM 407 OE1 GLU A 149 0.616 8.380 13.868 1.00 0.00 O ATOM 408 OE2 GLU A 149 2.470 9.100 14.698 1.00 0.00 O ATOM 0 H GLU A 149 3.269 5.058 13.287 1.00 0.00 H new ATOM 0 HA GLU A 149 0.690 6.110 14.022 1.00 0.00 H new ATOM 0 HB2 GLU A 149 2.191 6.128 11.359 1.00 0.00 H new ATOM 0 HB3 GLU A 149 0.820 7.147 11.749 1.00 0.00 H new ATOM 0 HG2 GLU A 149 3.444 7.107 13.329 1.00 0.00 H new ATOM 0 HG3 GLU A 149 3.047 8.299 12.108 1.00 0.00 H new ATOM 415 N GLU A 150 0.774 3.584 11.928 1.00 0.00 N ATOM 416 CA GLU A 150 -0.104 2.585 11.258 1.00 0.00 C ATOM 417 C GLU A 150 0.587 1.220 11.262 1.00 0.00 C ATOM 418 O GLU A 150 1.783 1.120 11.447 1.00 0.00 O ATOM 419 CB GLU A 150 -0.366 3.021 9.815 1.00 0.00 C ATOM 420 CG GLU A 150 -1.114 4.356 9.814 1.00 0.00 C ATOM 421 CD GLU A 150 -1.502 4.722 8.380 1.00 0.00 C ATOM 422 OE1 GLU A 150 -1.058 4.038 7.474 1.00 0.00 O ATOM 423 OE2 GLU A 150 -2.237 5.682 8.214 1.00 0.00 O ATOM 0 H GLU A 150 1.774 3.395 11.863 1.00 0.00 H new ATOM 0 HA GLU A 150 -1.052 2.516 11.792 1.00 0.00 H new ATOM 0 HB2 GLU A 150 0.577 3.120 9.277 1.00 0.00 H new ATOM 0 HB3 GLU A 150 -0.952 2.263 9.295 1.00 0.00 H new ATOM 0 HG2 GLU A 150 -2.006 4.286 10.437 1.00 0.00 H new ATOM 0 HG3 GLU A 150 -0.486 5.137 10.243 1.00 0.00 H new ATOM 430 N VAL A 151 -0.157 0.166 11.062 1.00 0.00 N ATOM 431 CA VAL A 151 0.460 -1.190 11.057 1.00 0.00 C ATOM 432 C VAL A 151 0.133 -1.897 9.740 1.00 0.00 C ATOM 433 O VAL A 151 -0.885 -1.647 9.126 1.00 0.00 O ATOM 434 CB VAL A 151 -0.094 -2.007 12.226 1.00 0.00 C ATOM 435 CG1 VAL A 151 0.611 -3.363 12.279 1.00 0.00 C ATOM 436 CG2 VAL A 151 0.148 -1.253 13.534 1.00 0.00 C ATOM 0 H VAL A 151 -1.164 0.186 10.902 1.00 0.00 H new ATOM 0 HA VAL A 151 1.541 -1.096 11.159 1.00 0.00 H new ATOM 0 HB VAL A 151 -1.164 -2.160 12.089 1.00 0.00 H new ATOM 0 HG11 VAL A 151 0.217 -3.946 13.112 1.00 0.00 H new ATOM 0 HG12 VAL A 151 0.438 -3.900 11.346 1.00 0.00 H new ATOM 0 HG13 VAL A 151 1.682 -3.211 12.417 1.00 0.00 H new ATOM 0 HG21 VAL A 151 -0.246 -1.834 14.367 1.00 0.00 H new ATOM 0 HG22 VAL A 151 1.218 -1.100 13.673 1.00 0.00 H new ATOM 0 HG23 VAL A 151 -0.355 -0.287 13.495 1.00 0.00 H new ATOM 446 N ASP A 152 0.989 -2.780 9.301 1.00 0.00 N ATOM 447 CA ASP A 152 0.727 -3.503 8.026 1.00 0.00 C ATOM 448 C ASP A 152 0.793 -5.012 8.274 1.00 0.00 C ATOM 449 O ASP A 152 1.772 -5.659 7.964 1.00 0.00 O ATOM 450 CB ASP A 152 1.783 -3.110 6.991 1.00 0.00 C ATOM 451 CG ASP A 152 1.621 -1.632 6.633 1.00 0.00 C ATOM 452 OD1 ASP A 152 0.595 -1.068 6.977 1.00 0.00 O ATOM 453 OD2 ASP A 152 2.526 -1.088 6.022 1.00 0.00 O ATOM 0 H ASP A 152 1.859 -3.031 9.771 1.00 0.00 H new ATOM 0 HA ASP A 152 -0.263 -3.238 7.654 1.00 0.00 H new ATOM 0 HB2 ASP A 152 2.782 -3.292 7.388 1.00 0.00 H new ATOM 0 HB3 ASP A 152 1.678 -3.725 6.097 1.00 0.00 H new ATOM 458 N TYR A 153 -0.244 -5.575 8.832 1.00 0.00 N ATOM 459 CA TYR A 153 -0.241 -7.041 9.101 1.00 0.00 C ATOM 460 C TYR A 153 -0.164 -7.805 7.777 1.00 0.00 C ATOM 461 O TYR A 153 0.480 -8.830 7.678 1.00 0.00 O ATOM 462 CB TYR A 153 -1.526 -7.426 9.837 1.00 0.00 C ATOM 463 CG TYR A 153 -1.603 -6.671 11.143 1.00 0.00 C ATOM 464 CD1 TYR A 153 -0.790 -7.049 12.219 1.00 0.00 C ATOM 465 CD2 TYR A 153 -2.486 -5.593 11.277 1.00 0.00 C ATOM 466 CE1 TYR A 153 -0.862 -6.349 13.429 1.00 0.00 C ATOM 467 CE2 TYR A 153 -2.558 -4.893 12.487 1.00 0.00 C ATOM 468 CZ TYR A 153 -1.746 -5.271 13.563 1.00 0.00 C ATOM 469 OH TYR A 153 -1.815 -4.581 14.756 1.00 0.00 O ATOM 0 H TYR A 153 -1.092 -5.084 9.113 1.00 0.00 H new ATOM 0 HA TYR A 153 0.622 -7.295 9.717 1.00 0.00 H new ATOM 0 HB2 TYR A 153 -2.394 -7.196 9.220 1.00 0.00 H new ATOM 0 HB3 TYR A 153 -1.543 -8.500 10.024 1.00 0.00 H new ATOM 0 HD1 TYR A 153 -0.108 -7.880 12.115 1.00 0.00 H new ATOM 0 HD2 TYR A 153 -3.112 -5.301 10.447 1.00 0.00 H new ATOM 0 HE1 TYR A 153 -0.236 -6.640 14.259 1.00 0.00 H new ATOM 0 HE2 TYR A 153 -3.240 -4.062 12.590 1.00 0.00 H new ATOM 0 HH TYR A 153 -2.477 -3.862 14.680 1.00 0.00 H new ATOM 479 N GLU A 154 -0.815 -7.314 6.759 1.00 0.00 N ATOM 480 CA GLU A 154 -0.779 -8.013 5.444 1.00 0.00 C ATOM 481 C GLU A 154 0.665 -8.083 4.941 1.00 0.00 C ATOM 482 O GLU A 154 1.110 -9.095 4.439 1.00 0.00 O ATOM 483 CB GLU A 154 -1.634 -7.245 4.434 1.00 0.00 C ATOM 484 CG GLU A 154 -3.099 -7.288 4.870 1.00 0.00 C ATOM 485 CD GLU A 154 -3.969 -6.622 3.801 1.00 0.00 C ATOM 486 OE1 GLU A 154 -3.408 -6.043 2.885 1.00 0.00 O ATOM 487 OE2 GLU A 154 -5.181 -6.701 3.917 1.00 0.00 O ATOM 0 H GLU A 154 -1.370 -6.459 6.781 1.00 0.00 H new ATOM 0 HA GLU A 154 -1.172 -9.023 5.560 1.00 0.00 H new ATOM 0 HB2 GLU A 154 -1.294 -6.212 4.365 1.00 0.00 H new ATOM 0 HB3 GLU A 154 -1.526 -7.683 3.442 1.00 0.00 H new ATOM 0 HG2 GLU A 154 -3.415 -8.320 5.020 1.00 0.00 H new ATOM 0 HG3 GLU A 154 -3.221 -6.776 5.824 1.00 0.00 H new ATOM 494 N LYS A 155 1.400 -7.012 5.071 1.00 0.00 N ATOM 495 CA LYS A 155 2.813 -7.018 4.599 1.00 0.00 C ATOM 496 C LYS A 155 3.743 -7.361 5.766 1.00 0.00 C ATOM 497 O LYS A 155 4.950 -7.369 5.627 1.00 0.00 O ATOM 498 CB LYS A 155 3.171 -5.636 4.050 1.00 0.00 C ATOM 499 CG LYS A 155 2.292 -5.327 2.837 1.00 0.00 C ATOM 500 CD LYS A 155 2.702 -3.980 2.237 1.00 0.00 C ATOM 501 CE LYS A 155 1.740 -3.612 1.106 1.00 0.00 C ATOM 502 NZ LYS A 155 0.562 -2.893 1.670 1.00 0.00 N ATOM 0 H LYS A 155 1.083 -6.134 5.483 1.00 0.00 H new ATOM 0 HA LYS A 155 2.930 -7.764 3.813 1.00 0.00 H new ATOM 0 HB2 LYS A 155 3.026 -4.878 4.820 1.00 0.00 H new ATOM 0 HB3 LYS A 155 4.223 -5.606 3.767 1.00 0.00 H new ATOM 0 HG2 LYS A 155 2.394 -6.115 2.091 1.00 0.00 H new ATOM 0 HG3 LYS A 155 1.243 -5.301 3.132 1.00 0.00 H new ATOM 0 HD2 LYS A 155 2.688 -3.208 3.006 1.00 0.00 H new ATOM 0 HD3 LYS A 155 3.722 -4.034 1.858 1.00 0.00 H new ATOM 0 HE2 LYS A 155 2.246 -2.984 0.373 1.00 0.00 H new ATOM 0 HE3 LYS A 155 1.415 -4.512 0.584 1.00 0.00 H new ATOM 0 HZ1 LYS A 155 -0.092 -2.643 0.902 1.00 0.00 H new ATOM 0 HZ2 LYS A 155 0.075 -3.507 2.353 1.00 0.00 H new ATOM 0 HZ3 LYS A 155 0.881 -2.027 2.149 1.00 0.00 H new ATOM 516 N SER A 156 3.192 -7.643 6.915 1.00 0.00 N ATOM 517 CA SER A 156 4.047 -7.985 8.086 1.00 0.00 C ATOM 518 C SER A 156 5.034 -6.845 8.347 1.00 0.00 C ATOM 519 O SER A 156 6.227 -7.055 8.448 1.00 0.00 O ATOM 520 CB SER A 156 4.820 -9.273 7.795 1.00 0.00 C ATOM 521 OG SER A 156 4.240 -9.930 6.677 1.00 0.00 O ATOM 0 H SER A 156 2.188 -7.651 7.093 1.00 0.00 H new ATOM 0 HA SER A 156 3.419 -8.130 8.965 1.00 0.00 H new ATOM 0 HB2 SER A 156 5.866 -9.044 7.593 1.00 0.00 H new ATOM 0 HB3 SER A 156 4.799 -9.927 8.666 1.00 0.00 H new ATOM 0 HG SER A 156 4.735 -10.754 6.489 1.00 0.00 H new ATOM 527 N ARG A 157 4.547 -5.640 8.455 1.00 0.00 N ATOM 528 CA ARG A 157 5.456 -4.487 8.710 1.00 0.00 C ATOM 529 C ARG A 157 4.740 -3.455 9.581 1.00 0.00 C ATOM 530 O ARG A 157 3.528 -3.408 9.635 1.00 0.00 O ATOM 531 CB ARG A 157 5.850 -3.846 7.377 1.00 0.00 C ATOM 532 CG ARG A 157 6.630 -4.857 6.535 1.00 0.00 C ATOM 533 CD ARG A 157 7.358 -4.127 5.405 1.00 0.00 C ATOM 534 NE ARG A 157 7.965 -5.124 4.480 1.00 0.00 N ATOM 535 CZ ARG A 157 7.953 -4.911 3.192 1.00 0.00 C ATOM 536 NH1 ARG A 157 6.835 -5.007 2.525 1.00 0.00 N ATOM 537 NH2 ARG A 157 9.058 -4.604 2.571 1.00 0.00 N ATOM 0 H ARG A 157 3.558 -5.403 8.378 1.00 0.00 H new ATOM 0 HA ARG A 157 6.351 -4.836 9.225 1.00 0.00 H new ATOM 0 HB2 ARG A 157 4.959 -3.521 6.840 1.00 0.00 H new ATOM 0 HB3 ARG A 157 6.457 -2.958 7.554 1.00 0.00 H new ATOM 0 HG2 ARG A 157 7.347 -5.390 7.159 1.00 0.00 H new ATOM 0 HG3 ARG A 157 5.951 -5.603 6.122 1.00 0.00 H new ATOM 0 HD2 ARG A 157 6.661 -3.488 4.862 1.00 0.00 H new ATOM 0 HD3 ARG A 157 8.131 -3.478 5.816 1.00 0.00 H new ATOM 0 HE ARG A 157 8.390 -5.973 4.853 1.00 0.00 H new ATOM 0 HH11 ARG A 157 5.971 -5.248 3.010 1.00 0.00 H new ATOM 0 HH12 ARG A 157 6.826 -4.841 1.519 1.00 0.00 H new ATOM 0 HH21 ARG A 157 9.932 -4.530 3.092 1.00 0.00 H new ATOM 0 HH22 ARG A 157 9.048 -4.438 1.565 1.00 0.00 H new ATOM 551 N LEU A 158 5.480 -2.627 10.267 1.00 0.00 N ATOM 552 CA LEU A 158 4.840 -1.599 11.136 1.00 0.00 C ATOM 553 C LEU A 158 5.161 -0.204 10.596 1.00 0.00 C ATOM 554 O LEU A 158 6.284 0.092 10.240 1.00 0.00 O ATOM 555 CB LEU A 158 5.380 -1.729 12.562 1.00 0.00 C ATOM 556 CG LEU A 158 5.428 -3.207 12.957 1.00 0.00 C ATOM 557 CD1 LEU A 158 6.009 -3.338 14.367 1.00 0.00 C ATOM 558 CD2 LEU A 158 4.012 -3.786 12.931 1.00 0.00 C ATOM 0 H LEU A 158 6.500 -2.618 10.263 1.00 0.00 H new ATOM 0 HA LEU A 158 3.760 -1.748 11.141 1.00 0.00 H new ATOM 0 HB2 LEU A 158 6.376 -1.292 12.626 1.00 0.00 H new ATOM 0 HB3 LEU A 158 4.745 -1.177 13.255 1.00 0.00 H new ATOM 0 HG LEU A 158 6.056 -3.753 12.254 1.00 0.00 H new ATOM 0 HD11 LEU A 158 6.044 -4.390 14.650 1.00 0.00 H new ATOM 0 HD12 LEU A 158 7.017 -2.924 14.385 1.00 0.00 H new ATOM 0 HD13 LEU A 158 5.380 -2.794 15.072 1.00 0.00 H new ATOM 0 HD21 LEU A 158 4.044 -4.839 13.212 1.00 0.00 H new ATOM 0 HD22 LEU A 158 3.383 -3.241 13.635 1.00 0.00 H new ATOM 0 HD23 LEU A 158 3.598 -3.691 11.927 1.00 0.00 H new ATOM 570 N LYS A 159 4.182 0.658 10.537 1.00 0.00 N ATOM 571 CA LYS A 159 4.431 2.033 10.024 1.00 0.00 C ATOM 572 C LYS A 159 4.874 2.932 11.180 1.00 0.00 C ATOM 573 O LYS A 159 4.083 3.318 12.017 1.00 0.00 O ATOM 574 CB LYS A 159 3.145 2.590 9.409 1.00 0.00 C ATOM 575 CG LYS A 159 3.448 3.915 8.707 1.00 0.00 C ATOM 576 CD LYS A 159 2.141 4.541 8.214 1.00 0.00 C ATOM 577 CE LYS A 159 2.457 5.725 7.298 1.00 0.00 C ATOM 578 NZ LYS A 159 2.622 5.241 5.899 1.00 0.00 N ATOM 0 H LYS A 159 3.221 0.468 10.822 1.00 0.00 H new ATOM 0 HA LYS A 159 5.212 2.003 9.264 1.00 0.00 H new ATOM 0 HB2 LYS A 159 2.730 1.876 8.698 1.00 0.00 H new ATOM 0 HB3 LYS A 159 2.394 2.740 10.184 1.00 0.00 H new ATOM 0 HG2 LYS A 159 3.954 4.595 9.393 1.00 0.00 H new ATOM 0 HG3 LYS A 159 4.123 3.748 7.868 1.00 0.00 H new ATOM 0 HD2 LYS A 159 1.550 3.799 7.677 1.00 0.00 H new ATOM 0 HD3 LYS A 159 1.542 4.873 9.062 1.00 0.00 H new ATOM 0 HE2 LYS A 159 1.654 6.461 7.347 1.00 0.00 H new ATOM 0 HE3 LYS A 159 3.367 6.223 7.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 159 2.837 6.046 5.276 1.00 0.00 H new ATOM 0 HZ2 LYS A 159 3.402 4.554 5.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 159 1.742 4.784 5.584 1.00 0.00 H new ATOM 592 N VAL A 160 6.135 3.265 11.236 1.00 0.00 N ATOM 593 CA VAL A 160 6.627 4.135 12.340 1.00 0.00 C ATOM 594 C VAL A 160 7.271 5.393 11.755 1.00 0.00 C ATOM 595 O VAL A 160 7.918 5.351 10.727 1.00 0.00 O ATOM 596 CB VAL A 160 7.662 3.369 13.168 1.00 0.00 C ATOM 597 CG1 VAL A 160 8.077 4.214 14.374 1.00 0.00 C ATOM 598 CG2 VAL A 160 7.053 2.052 13.652 1.00 0.00 C ATOM 0 H VAL A 160 6.845 2.972 10.565 1.00 0.00 H new ATOM 0 HA VAL A 160 5.790 4.421 12.977 1.00 0.00 H new ATOM 0 HB VAL A 160 8.538 3.160 12.553 1.00 0.00 H new ATOM 0 HG11 VAL A 160 8.814 3.669 14.964 1.00 0.00 H new ATOM 0 HG12 VAL A 160 8.511 5.152 14.029 1.00 0.00 H new ATOM 0 HG13 VAL A 160 7.202 4.423 14.990 1.00 0.00 H new ATOM 0 HG21 VAL A 160 7.789 1.506 14.242 1.00 0.00 H new ATOM 0 HG22 VAL A 160 6.178 2.260 14.267 1.00 0.00 H new ATOM 0 HG23 VAL A 160 6.758 1.450 12.793 1.00 0.00 H new ATOM 608 N SER A 161 7.101 6.513 12.403 1.00 0.00 N ATOM 609 CA SER A 161 7.705 7.773 11.885 1.00 0.00 C ATOM 610 C SER A 161 8.841 8.211 12.812 1.00 0.00 C ATOM 611 O SER A 161 8.782 8.027 14.011 1.00 0.00 O ATOM 612 CB SER A 161 6.638 8.868 11.836 1.00 0.00 C ATOM 613 OG SER A 161 6.242 9.203 13.157 1.00 0.00 O ATOM 0 H SER A 161 6.570 6.610 13.269 1.00 0.00 H new ATOM 0 HA SER A 161 8.097 7.603 10.882 1.00 0.00 H new ATOM 0 HB2 SER A 161 7.029 9.749 11.328 1.00 0.00 H new ATOM 0 HB3 SER A 161 5.777 8.526 11.263 1.00 0.00 H new ATOM 0 HG SER A 161 5.560 9.906 13.126 1.00 0.00 H new ATOM 619 N VAL A 162 9.877 8.788 12.266 1.00 0.00 N ATOM 620 CA VAL A 162 11.015 9.234 13.118 1.00 0.00 C ATOM 621 C VAL A 162 11.140 10.758 13.048 1.00 0.00 C ATOM 622 O VAL A 162 11.005 11.355 11.998 1.00 0.00 O ATOM 623 CB VAL A 162 12.307 8.589 12.622 1.00 0.00 C ATOM 624 CG1 VAL A 162 12.703 9.224 11.294 1.00 0.00 C ATOM 625 CG2 VAL A 162 13.419 8.814 13.649 1.00 0.00 C ATOM 0 H VAL A 162 9.984 8.969 11.268 1.00 0.00 H new ATOM 0 HA VAL A 162 10.835 8.934 14.150 1.00 0.00 H new ATOM 0 HB VAL A 162 12.155 7.518 12.487 1.00 0.00 H new ATOM 0 HG11 VAL A 162 13.625 8.768 10.933 1.00 0.00 H new ATOM 0 HG12 VAL A 162 11.910 9.065 10.564 1.00 0.00 H new ATOM 0 HG13 VAL A 162 12.858 10.294 11.434 1.00 0.00 H new ATOM 0 HG21 VAL A 162 14.341 8.353 13.294 1.00 0.00 H new ATOM 0 HG22 VAL A 162 13.577 9.884 13.785 1.00 0.00 H new ATOM 0 HG23 VAL A 162 13.132 8.365 14.600 1.00 0.00 H new ATOM 635 N SER A 163 11.400 11.392 14.159 1.00 0.00 N ATOM 636 CA SER A 163 11.536 12.875 14.156 1.00 0.00 C ATOM 637 C SER A 163 13.019 13.250 14.220 1.00 0.00 C ATOM 638 O SER A 163 13.617 13.275 15.278 1.00 0.00 O ATOM 639 CB SER A 163 10.810 13.458 15.369 1.00 0.00 C ATOM 640 OG SER A 163 10.900 14.875 15.341 1.00 0.00 O ATOM 0 H SER A 163 11.524 10.946 15.068 1.00 0.00 H new ATOM 0 HA SER A 163 11.097 13.278 13.243 1.00 0.00 H new ATOM 0 HB2 SER A 163 9.765 13.150 15.363 1.00 0.00 H new ATOM 0 HB3 SER A 163 11.250 13.073 16.289 1.00 0.00 H new ATOM 0 HG SER A 163 10.433 15.248 16.118 1.00 0.00 H new ATOM 646 N ILE A 164 13.617 13.538 13.097 1.00 0.00 N ATOM 647 CA ILE A 164 15.061 13.907 13.097 1.00 0.00 C ATOM 648 C ILE A 164 15.219 15.352 12.618 1.00 0.00 C ATOM 649 O ILE A 164 14.604 15.769 11.656 1.00 0.00 O ATOM 650 CB ILE A 164 15.824 12.972 12.157 1.00 0.00 C ATOM 651 CG1 ILE A 164 15.517 11.519 12.524 1.00 0.00 C ATOM 652 CG2 ILE A 164 17.327 13.227 12.294 1.00 0.00 C ATOM 653 CD1 ILE A 164 15.879 10.607 11.350 1.00 0.00 C ATOM 0 H ILE A 164 13.169 13.534 12.181 1.00 0.00 H new ATOM 0 HA ILE A 164 15.460 13.814 14.107 1.00 0.00 H new ATOM 0 HB ILE A 164 15.516 13.159 11.128 1.00 0.00 H new ATOM 0 HG12 ILE A 164 16.082 11.230 13.410 1.00 0.00 H new ATOM 0 HG13 ILE A 164 14.461 11.411 12.770 1.00 0.00 H new ATOM 0 HG21 ILE A 164 17.872 12.561 11.625 1.00 0.00 H new ATOM 0 HG22 ILE A 164 17.546 14.262 12.033 1.00 0.00 H new ATOM 0 HG23 ILE A 164 17.636 13.039 13.322 1.00 0.00 H new ATOM 0 HD11 ILE A 164 15.660 9.572 11.612 1.00 0.00 H new ATOM 0 HD12 ILE A 164 15.294 10.891 10.475 1.00 0.00 H new ATOM 0 HD13 ILE A 164 16.941 10.707 11.125 1.00 0.00 H new ATOM 665 N PHE A 165 16.039 16.121 13.282 1.00 0.00 N ATOM 666 CA PHE A 165 16.236 17.538 12.865 1.00 0.00 C ATOM 667 C PHE A 165 14.892 18.266 12.881 1.00 0.00 C ATOM 668 O PHE A 165 14.678 19.210 12.147 1.00 0.00 O ATOM 669 CB PHE A 165 16.821 17.575 11.451 1.00 0.00 C ATOM 670 CG PHE A 165 18.029 16.671 11.381 1.00 0.00 C ATOM 671 CD1 PHE A 165 18.802 16.444 12.526 1.00 0.00 C ATOM 672 CD2 PHE A 165 18.375 16.060 10.170 1.00 0.00 C ATOM 673 CE1 PHE A 165 19.922 15.605 12.460 1.00 0.00 C ATOM 674 CE2 PHE A 165 19.495 15.222 10.104 1.00 0.00 C ATOM 675 CZ PHE A 165 20.268 14.995 11.249 1.00 0.00 C ATOM 0 H PHE A 165 16.581 15.829 14.095 1.00 0.00 H new ATOM 0 HA PHE A 165 16.922 18.029 13.555 1.00 0.00 H new ATOM 0 HB2 PHE A 165 16.071 17.254 10.728 1.00 0.00 H new ATOM 0 HB3 PHE A 165 17.101 18.595 11.189 1.00 0.00 H new ATOM 0 HD1 PHE A 165 18.535 16.916 13.460 1.00 0.00 H new ATOM 0 HD2 PHE A 165 17.778 16.235 9.287 1.00 0.00 H new ATOM 0 HE1 PHE A 165 20.518 15.429 13.343 1.00 0.00 H new ATOM 0 HE2 PHE A 165 19.762 14.751 9.170 1.00 0.00 H new ATOM 0 HZ PHE A 165 21.132 14.349 11.198 1.00 0.00 H new ATOM 685 N GLY A 166 13.983 17.837 13.715 1.00 0.00 N ATOM 686 CA GLY A 166 12.653 18.507 13.778 1.00 0.00 C ATOM 687 C GLY A 166 11.849 18.164 12.521 1.00 0.00 C ATOM 688 O GLY A 166 10.925 18.862 12.155 1.00 0.00 O ATOM 0 H GLY A 166 14.104 17.052 14.355 1.00 0.00 H new ATOM 0 HA2 GLY A 166 12.113 18.184 14.668 1.00 0.00 H new ATOM 0 HA3 GLY A 166 12.781 19.587 13.858 1.00 0.00 H new ATOM 692 N ARG A 167 12.194 17.094 11.858 1.00 0.00 N ATOM 693 CA ARG A 167 11.449 16.709 10.627 1.00 0.00 C ATOM 694 C ARG A 167 10.817 15.329 10.824 1.00 0.00 C ATOM 695 O ARG A 167 11.386 14.460 11.454 1.00 0.00 O ATOM 696 CB ARG A 167 12.413 16.664 9.440 1.00 0.00 C ATOM 697 CG ARG A 167 12.969 18.066 9.181 1.00 0.00 C ATOM 698 CD ARG A 167 13.826 18.049 7.914 1.00 0.00 C ATOM 699 NE ARG A 167 14.575 19.333 7.805 1.00 0.00 N ATOM 700 CZ ARG A 167 13.927 20.462 7.713 1.00 0.00 C ATOM 701 NH1 ARG A 167 12.812 20.519 7.039 1.00 0.00 N ATOM 702 NH2 ARG A 167 14.395 21.532 8.294 1.00 0.00 N ATOM 0 H ARG A 167 12.959 16.471 12.116 1.00 0.00 H new ATOM 0 HA ARG A 167 10.667 17.442 10.432 1.00 0.00 H new ATOM 0 HB2 ARG A 167 13.228 15.970 9.646 1.00 0.00 H new ATOM 0 HB3 ARG A 167 11.898 16.296 8.553 1.00 0.00 H new ATOM 0 HG2 ARG A 167 12.151 18.778 9.070 1.00 0.00 H new ATOM 0 HG3 ARG A 167 13.565 18.395 10.032 1.00 0.00 H new ATOM 0 HD2 ARG A 167 14.522 17.211 7.944 1.00 0.00 H new ATOM 0 HD3 ARG A 167 13.195 17.908 7.037 1.00 0.00 H new ATOM 0 HE ARG A 167 15.595 19.329 7.802 1.00 0.00 H new ATOM 0 HH11 ARG A 167 12.447 19.682 6.585 1.00 0.00 H new ATOM 0 HH12 ARG A 167 12.305 21.401 6.966 1.00 0.00 H new ATOM 0 HH21 ARG A 167 15.268 21.486 8.820 1.00 0.00 H new ATOM 0 HH22 ARG A 167 13.888 22.414 8.222 1.00 0.00 H new ATOM 716 N ALA A 168 9.644 15.121 10.290 1.00 0.00 N ATOM 717 CA ALA A 168 8.978 13.798 10.448 1.00 0.00 C ATOM 718 C ALA A 168 9.354 12.892 9.273 1.00 0.00 C ATOM 719 O ALA A 168 9.331 13.302 8.130 1.00 0.00 O ATOM 720 CB ALA A 168 7.460 13.991 10.477 1.00 0.00 C ATOM 0 H ALA A 168 9.119 15.810 9.752 1.00 0.00 H new ATOM 0 HA ALA A 168 9.304 13.337 11.380 1.00 0.00 H new ATOM 0 HB1 ALA A 168 6.972 13.023 10.593 1.00 0.00 H new ATOM 0 HB2 ALA A 168 7.191 14.635 11.314 1.00 0.00 H new ATOM 0 HB3 ALA A 168 7.134 14.452 9.545 1.00 0.00 H new ATOM 726 N THR A 169 9.701 11.665 9.546 1.00 0.00 N ATOM 727 CA THR A 169 10.079 10.734 8.445 1.00 0.00 C ATOM 728 C THR A 169 9.272 9.440 8.572 1.00 0.00 C ATOM 729 O THR A 169 9.787 8.414 8.970 1.00 0.00 O ATOM 730 CB THR A 169 11.572 10.416 8.537 1.00 0.00 C ATOM 731 OG1 THR A 169 12.233 11.448 9.255 1.00 0.00 O ATOM 732 CG2 THR A 169 12.162 10.313 7.130 1.00 0.00 C ATOM 0 H THR A 169 9.739 11.266 10.484 1.00 0.00 H new ATOM 0 HA THR A 169 9.866 11.202 7.484 1.00 0.00 H new ATOM 0 HB THR A 169 11.709 9.467 9.056 1.00 0.00 H new ATOM 0 HG1 THR A 169 13.190 11.243 9.316 1.00 0.00 H new ATOM 0 HG21 THR A 169 13.226 10.086 7.197 1.00 0.00 H new ATOM 0 HG22 THR A 169 11.656 9.519 6.580 1.00 0.00 H new ATOM 0 HG23 THR A 169 12.025 11.260 6.608 1.00 0.00 H new ATOM 740 N PRO A 170 7.978 9.496 8.225 1.00 0.00 N ATOM 741 CA PRO A 170 7.089 8.330 8.296 1.00 0.00 C ATOM 742 C PRO A 170 7.612 7.164 7.453 1.00 0.00 C ATOM 743 O PRO A 170 7.521 7.171 6.242 1.00 0.00 O ATOM 744 CB PRO A 170 5.773 8.845 7.715 1.00 0.00 C ATOM 745 CG PRO A 170 6.172 9.976 6.828 1.00 0.00 C ATOM 746 CD PRO A 170 7.375 10.608 7.468 1.00 0.00 C ATOM 0 HA PRO A 170 7.000 7.946 9.312 1.00 0.00 H new ATOM 0 HB2 PRO A 170 5.255 8.066 7.156 1.00 0.00 H new ATOM 0 HB3 PRO A 170 5.095 9.178 8.501 1.00 0.00 H new ATOM 0 HG2 PRO A 170 6.407 9.620 5.825 1.00 0.00 H new ATOM 0 HG3 PRO A 170 5.361 10.697 6.728 1.00 0.00 H new ATOM 0 HD2 PRO A 170 8.063 11.008 6.724 1.00 0.00 H new ATOM 0 HD3 PRO A 170 7.096 11.435 8.121 1.00 0.00 H new ATOM 754 N VAL A 171 8.159 6.162 8.085 1.00 0.00 N ATOM 755 CA VAL A 171 8.687 4.997 7.321 1.00 0.00 C ATOM 756 C VAL A 171 8.150 3.701 7.929 1.00 0.00 C ATOM 757 O VAL A 171 7.790 3.651 9.089 1.00 0.00 O ATOM 758 CB VAL A 171 10.216 4.996 7.384 1.00 0.00 C ATOM 759 CG1 VAL A 171 10.749 6.332 6.865 1.00 0.00 C ATOM 760 CG2 VAL A 171 10.666 4.795 8.833 1.00 0.00 C ATOM 0 H VAL A 171 8.263 6.100 9.098 1.00 0.00 H new ATOM 0 HA VAL A 171 8.366 5.069 6.282 1.00 0.00 H new ATOM 0 HB VAL A 171 10.605 4.186 6.767 1.00 0.00 H new ATOM 0 HG11 VAL A 171 11.838 6.331 6.910 1.00 0.00 H new ATOM 0 HG12 VAL A 171 10.428 6.476 5.833 1.00 0.00 H new ATOM 0 HG13 VAL A 171 10.361 7.143 7.482 1.00 0.00 H new ATOM 0 HG21 VAL A 171 11.755 4.794 8.879 1.00 0.00 H new ATOM 0 HG22 VAL A 171 10.277 5.605 9.450 1.00 0.00 H new ATOM 0 HG23 VAL A 171 10.286 3.843 9.203 1.00 0.00 H new ATOM 770 N GLU A 172 8.094 2.650 7.157 1.00 0.00 N ATOM 771 CA GLU A 172 7.581 1.358 7.694 1.00 0.00 C ATOM 772 C GLU A 172 8.755 0.412 7.954 1.00 0.00 C ATOM 773 O GLU A 172 9.589 0.193 7.098 1.00 0.00 O ATOM 774 CB GLU A 172 6.629 0.725 6.677 1.00 0.00 C ATOM 775 CG GLU A 172 5.428 1.647 6.459 1.00 0.00 C ATOM 776 CD GLU A 172 4.426 0.968 5.524 1.00 0.00 C ATOM 777 OE1 GLU A 172 4.764 -0.069 4.977 1.00 0.00 O ATOM 778 OE2 GLU A 172 3.338 1.497 5.370 1.00 0.00 O ATOM 0 H GLU A 172 8.381 2.630 6.178 1.00 0.00 H new ATOM 0 HA GLU A 172 7.047 1.538 8.627 1.00 0.00 H new ATOM 0 HB2 GLU A 172 7.148 0.557 5.733 1.00 0.00 H new ATOM 0 HB3 GLU A 172 6.293 -0.249 7.034 1.00 0.00 H new ATOM 0 HG2 GLU A 172 4.954 1.876 7.413 1.00 0.00 H new ATOM 0 HG3 GLU A 172 5.756 2.594 6.031 1.00 0.00 H new ATOM 785 N LEU A 173 8.827 -0.151 9.129 1.00 0.00 N ATOM 786 CA LEU A 173 9.948 -1.081 9.442 1.00 0.00 C ATOM 787 C LEU A 173 9.382 -2.450 9.824 1.00 0.00 C ATOM 788 O LEU A 173 8.333 -2.552 10.429 1.00 0.00 O ATOM 789 CB LEU A 173 10.762 -0.523 10.612 1.00 0.00 C ATOM 790 CG LEU A 173 11.331 0.846 10.233 1.00 0.00 C ATOM 791 CD1 LEU A 173 11.988 0.762 8.854 1.00 0.00 C ATOM 792 CD2 LEU A 173 10.200 1.876 10.196 1.00 0.00 C ATOM 0 H LEU A 173 8.158 -0.007 9.885 1.00 0.00 H new ATOM 0 HA LEU A 173 10.590 -1.183 8.567 1.00 0.00 H new ATOM 0 HB2 LEU A 173 10.132 -0.434 11.497 1.00 0.00 H new ATOM 0 HB3 LEU A 173 11.572 -1.208 10.864 1.00 0.00 H new ATOM 0 HG LEU A 173 12.074 1.147 10.972 1.00 0.00 H new ATOM 0 HD11 LEU A 173 12.393 1.737 8.584 1.00 0.00 H new ATOM 0 HD12 LEU A 173 12.794 0.028 8.879 1.00 0.00 H new ATOM 0 HD13 LEU A 173 11.246 0.460 8.115 1.00 0.00 H new ATOM 0 HD21 LEU A 173 10.605 2.851 9.926 1.00 0.00 H new ATOM 0 HD22 LEU A 173 9.457 1.574 9.457 1.00 0.00 H new ATOM 0 HD23 LEU A 173 9.731 1.937 11.178 1.00 0.00 H new ATOM 804 N ASP A 174 10.069 -3.504 9.477 1.00 0.00 N ATOM 805 CA ASP A 174 9.569 -4.864 9.821 1.00 0.00 C ATOM 806 C ASP A 174 9.573 -5.037 11.342 1.00 0.00 C ATOM 807 O ASP A 174 10.050 -4.190 12.070 1.00 0.00 O ATOM 808 CB ASP A 174 10.477 -5.919 9.186 1.00 0.00 C ATOM 809 CG ASP A 174 10.444 -5.771 7.664 1.00 0.00 C ATOM 810 OD1 ASP A 174 9.610 -5.022 7.180 1.00 0.00 O ATOM 811 OD2 ASP A 174 11.251 -6.408 7.008 1.00 0.00 O ATOM 0 H ASP A 174 10.954 -3.482 8.971 1.00 0.00 H new ATOM 0 HA ASP A 174 8.554 -4.984 9.442 1.00 0.00 H new ATOM 0 HB2 ASP A 174 11.497 -5.803 9.551 1.00 0.00 H new ATOM 0 HB3 ASP A 174 10.147 -6.918 9.472 1.00 0.00 H new ATOM 816 N PHE A 175 9.042 -6.125 11.827 1.00 0.00 N ATOM 817 CA PHE A 175 9.016 -6.347 13.301 1.00 0.00 C ATOM 818 C PHE A 175 10.446 -6.527 13.815 1.00 0.00 C ATOM 819 O PHE A 175 10.828 -5.968 14.824 1.00 0.00 O ATOM 820 CB PHE A 175 8.198 -7.603 13.614 1.00 0.00 C ATOM 821 CG PHE A 175 6.884 -7.559 12.867 1.00 0.00 C ATOM 822 CD1 PHE A 175 6.373 -6.337 12.409 1.00 0.00 C ATOM 823 CD2 PHE A 175 6.175 -8.744 12.631 1.00 0.00 C ATOM 824 CE1 PHE A 175 5.156 -6.300 11.717 1.00 0.00 C ATOM 825 CE2 PHE A 175 4.958 -8.706 11.939 1.00 0.00 C ATOM 826 CZ PHE A 175 4.449 -7.486 11.483 1.00 0.00 C ATOM 0 H PHE A 175 8.625 -6.869 11.268 1.00 0.00 H new ATOM 0 HA PHE A 175 8.560 -5.486 13.790 1.00 0.00 H new ATOM 0 HB2 PHE A 175 8.759 -8.493 13.329 1.00 0.00 H new ATOM 0 HB3 PHE A 175 8.015 -7.671 14.686 1.00 0.00 H new ATOM 0 HD1 PHE A 175 6.918 -5.423 12.590 1.00 0.00 H new ATOM 0 HD2 PHE A 175 6.567 -9.687 12.983 1.00 0.00 H new ATOM 0 HE1 PHE A 175 4.763 -5.358 11.364 1.00 0.00 H new ATOM 0 HE2 PHE A 175 4.412 -9.620 11.757 1.00 0.00 H new ATOM 0 HZ PHE A 175 3.510 -7.458 10.950 1.00 0.00 H new ATOM 836 N SER A 176 11.241 -7.301 13.129 1.00 0.00 N ATOM 837 CA SER A 176 12.645 -7.514 13.581 1.00 0.00 C ATOM 838 C SER A 176 13.463 -6.249 13.311 1.00 0.00 C ATOM 839 O SER A 176 14.471 -6.004 13.944 1.00 0.00 O ATOM 840 CB SER A 176 13.255 -8.689 12.815 1.00 0.00 C ATOM 841 OG SER A 176 12.411 -9.824 12.938 1.00 0.00 O ATOM 0 H SER A 176 10.980 -7.795 12.276 1.00 0.00 H new ATOM 0 HA SER A 176 12.655 -7.733 14.649 1.00 0.00 H new ATOM 0 HB2 SER A 176 13.379 -8.427 11.764 1.00 0.00 H new ATOM 0 HB3 SER A 176 14.247 -8.916 13.206 1.00 0.00 H new ATOM 0 HG SER A 176 12.801 -10.576 12.446 1.00 0.00 H new ATOM 847 N GLN A 177 13.036 -5.443 12.377 1.00 0.00 N ATOM 848 CA GLN A 177 13.790 -4.194 12.070 1.00 0.00 C ATOM 849 C GLN A 177 13.622 -3.203 13.223 1.00 0.00 C ATOM 850 O GLN A 177 14.439 -2.325 13.424 1.00 0.00 O ATOM 851 CB GLN A 177 13.247 -3.576 10.781 1.00 0.00 C ATOM 852 CG GLN A 177 13.751 -4.378 9.579 1.00 0.00 C ATOM 853 CD GLN A 177 13.228 -3.746 8.288 1.00 0.00 C ATOM 854 OE1 GLN A 177 12.386 -2.871 8.324 1.00 0.00 O ATOM 855 NE2 GLN A 177 13.695 -4.155 7.140 1.00 0.00 N ATOM 0 H GLN A 177 12.199 -5.595 11.814 1.00 0.00 H new ATOM 0 HA GLN A 177 14.847 -4.427 11.943 1.00 0.00 H new ATOM 0 HB2 GLN A 177 12.157 -3.572 10.798 1.00 0.00 H new ATOM 0 HB3 GLN A 177 13.568 -2.538 10.699 1.00 0.00 H new ATOM 0 HG2 GLN A 177 14.841 -4.396 9.572 1.00 0.00 H new ATOM 0 HG3 GLN A 177 13.415 -5.412 9.652 1.00 0.00 H new ATOM 0 HE21 GLN A 177 14.402 -4.890 7.110 1.00 0.00 H new ATOM 0 HE22 GLN A 177 13.353 -3.740 6.273 1.00 0.00 H new ATOM 864 N VAL A 178 12.568 -3.335 13.981 1.00 0.00 N ATOM 865 CA VAL A 178 12.348 -2.400 15.120 1.00 0.00 C ATOM 866 C VAL A 178 12.016 -3.203 16.379 1.00 0.00 C ATOM 867 O VAL A 178 11.673 -4.367 16.312 1.00 0.00 O ATOM 868 CB VAL A 178 11.185 -1.461 14.793 1.00 0.00 C ATOM 869 CG1 VAL A 178 11.403 -0.845 13.410 1.00 0.00 C ATOM 870 CG2 VAL A 178 9.875 -2.252 14.800 1.00 0.00 C ATOM 0 H VAL A 178 11.850 -4.050 13.861 1.00 0.00 H new ATOM 0 HA VAL A 178 13.251 -1.813 15.289 1.00 0.00 H new ATOM 0 HB VAL A 178 11.134 -0.669 15.540 1.00 0.00 H new ATOM 0 HG11 VAL A 178 10.575 -0.176 13.175 1.00 0.00 H new ATOM 0 HG12 VAL A 178 12.337 -0.283 13.405 1.00 0.00 H new ATOM 0 HG13 VAL A 178 11.452 -1.637 12.663 1.00 0.00 H new ATOM 0 HG21 VAL A 178 9.046 -1.584 14.567 1.00 0.00 H new ATOM 0 HG22 VAL A 178 9.924 -3.044 14.053 1.00 0.00 H new ATOM 0 HG23 VAL A 178 9.721 -2.692 15.785 1.00 0.00 H new ATOM 880 N GLU A 179 12.117 -2.594 17.528 1.00 0.00 N ATOM 881 CA GLU A 179 11.809 -3.325 18.789 1.00 0.00 C ATOM 882 C GLU A 179 10.644 -2.639 19.505 1.00 0.00 C ATOM 883 O GLU A 179 10.501 -1.433 19.465 1.00 0.00 O ATOM 884 CB GLU A 179 13.039 -3.318 19.697 1.00 0.00 C ATOM 885 CG GLU A 179 14.196 -4.031 18.993 1.00 0.00 C ATOM 886 CD GLU A 179 13.765 -5.449 18.612 1.00 0.00 C ATOM 887 OE1 GLU A 179 13.219 -6.130 19.464 1.00 0.00 O ATOM 888 OE2 GLU A 179 13.988 -5.828 17.474 1.00 0.00 O ATOM 0 H GLU A 179 12.400 -1.621 17.648 1.00 0.00 H new ATOM 0 HA GLU A 179 11.537 -4.354 18.554 1.00 0.00 H new ATOM 0 HB2 GLU A 179 13.321 -2.293 19.937 1.00 0.00 H new ATOM 0 HB3 GLU A 179 12.811 -3.815 20.640 1.00 0.00 H new ATOM 0 HG2 GLU A 179 14.490 -3.477 18.102 1.00 0.00 H new ATOM 0 HG3 GLU A 179 15.067 -4.068 19.647 1.00 0.00 H new ATOM 895 N LYS A 180 9.808 -3.398 20.161 1.00 0.00 N ATOM 896 CA LYS A 180 8.654 -2.789 20.879 1.00 0.00 C ATOM 897 C LYS A 180 9.170 -1.903 22.014 1.00 0.00 C ATOM 898 O LYS A 180 10.114 -2.242 22.700 1.00 0.00 O ATOM 899 CB LYS A 180 7.771 -3.896 21.458 1.00 0.00 C ATOM 900 CG LYS A 180 6.448 -3.296 21.937 1.00 0.00 C ATOM 901 CD LYS A 180 5.552 -4.408 22.486 1.00 0.00 C ATOM 902 CE LYS A 180 4.171 -3.836 22.810 1.00 0.00 C ATOM 903 NZ LYS A 180 3.926 -3.930 24.278 1.00 0.00 N ATOM 0 H LYS A 180 9.875 -4.413 20.230 1.00 0.00 H new ATOM 0 HA LYS A 180 8.071 -2.186 20.183 1.00 0.00 H new ATOM 0 HB2 LYS A 180 7.584 -4.659 20.702 1.00 0.00 H new ATOM 0 HB3 LYS A 180 8.281 -4.387 22.287 1.00 0.00 H new ATOM 0 HG2 LYS A 180 6.634 -2.549 22.709 1.00 0.00 H new ATOM 0 HG3 LYS A 180 5.949 -2.785 21.113 1.00 0.00 H new ATOM 0 HD2 LYS A 180 5.462 -5.212 21.755 1.00 0.00 H new ATOM 0 HD3 LYS A 180 5.998 -4.840 23.382 1.00 0.00 H new ATOM 0 HE2 LYS A 180 4.111 -2.797 22.486 1.00 0.00 H new ATOM 0 HE3 LYS A 180 3.402 -4.384 22.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 180 2.987 -3.541 24.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 180 3.966 -4.926 24.574 1.00 0.00 H new ATOM 0 HZ3 LYS A 180 4.653 -3.388 24.787 1.00 0.00 H new ATOM 917 N ALA A 181 8.558 -0.769 22.219 1.00 0.00 N ATOM 918 CA ALA A 181 9.015 0.138 23.309 1.00 0.00 C ATOM 919 C ALA A 181 8.711 -0.502 24.665 1.00 0.00 C ATOM 920 O ALA A 181 7.577 -0.557 25.097 1.00 0.00 O ATOM 921 CB ALA A 181 8.280 1.476 23.201 1.00 0.00 C ATOM 0 H ALA A 181 7.761 -0.432 21.679 1.00 0.00 H new ATOM 0 HA ALA A 181 10.088 0.304 23.217 1.00 0.00 H new ATOM 0 HB1 ALA A 181 8.614 2.140 23.998 1.00 0.00 H new ATOM 0 HB2 ALA A 181 8.495 1.932 22.235 1.00 0.00 H new ATOM 0 HB3 ALA A 181 7.207 1.310 23.293 1.00 0.00 H new TER 927 ALA A 181