USER MOD reduce.3.24.130724 H: found=0, std=0, add=466, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 467 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 162 THR OG1 : rot 98:sc= 0.814 USER MOD Set 1.2: A 164 MET CE :methyl -173:sc= -0.121 (180deg=-0.274) USER MOD Single : A 131 GLN : amide:sc= -4.19! C(o=-4.2!,f=-4.5!) USER MOD Single : A 139 THR OG1 : rot 180:sc= 0.0149 USER MOD Single : A 141 GLN : amide:sc= -2.48! C(o=-2.5!,f=-2.7!) USER MOD Single : A 144 TYR OH : rot 180:sc= 0 USER MOD Single : A 147 TYR OH : rot 180:sc= 0 USER MOD Single : A 153 CYS SG : rot -129:sc= 0.872 USER MOD Single : A 154 MET CE :methyl 142:sc= -0.31 (180deg=-2.24!) USER MOD Single : A 156 THR OG1 : rot -130:sc= -0.552 USER MOD Single : A 159 TYR OH : rot 180:sc= 0 USER MOD Single : A 160 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 170 SER OG : rot 76:sc= 0.286 USER MOD Single : A 171 GLN : amide:sc= -1.28! K(o=-1.3!,f=-0.35) USER MOD Single : A 172 HIS : no HD1:sc= -0.0492 X(o=-0.049,f=-0.42) USER MOD Single : A 191 SER OG : rot -160:sc= -1.36 USER MOD ----------------------------------------------------------------- ATOM 58 N GLY A 123 1.208 -12.525 -22.406 1.00 0.00 N ATOM 59 CA GLY A 123 2.109 -13.405 -21.674 1.00 0.00 C ATOM 60 C GLY A 123 1.692 -13.514 -20.212 1.00 0.00 C ATOM 61 O GLY A 123 0.788 -12.811 -19.759 1.00 0.00 O ATOM 0 HA2 GLY A 123 2.109 -14.394 -22.131 1.00 0.00 H new ATOM 0 HA3 GLY A 123 3.128 -13.024 -21.738 1.00 0.00 H new ATOM 65 N PRO A 124 2.335 -14.377 -19.474 1.00 0.00 N ATOM 66 CA PRO A 124 2.036 -14.584 -18.028 1.00 0.00 C ATOM 67 C PRO A 124 2.581 -13.449 -17.165 1.00 0.00 C ATOM 68 O PRO A 124 2.284 -13.362 -15.974 1.00 0.00 O ATOM 69 CB PRO A 124 2.734 -15.905 -17.696 1.00 0.00 C ATOM 70 CG PRO A 124 3.855 -16.022 -18.676 1.00 0.00 C ATOM 71 CD PRO A 124 3.422 -15.249 -19.942 1.00 0.00 C ATOM 0 HA PRO A 124 0.964 -14.604 -17.830 1.00 0.00 H new ATOM 0 HB2 PRO A 124 3.107 -15.905 -16.672 1.00 0.00 H new ATOM 0 HB3 PRO A 124 2.046 -16.746 -17.785 1.00 0.00 H new ATOM 0 HG2 PRO A 124 4.774 -15.605 -18.264 1.00 0.00 H new ATOM 0 HG3 PRO A 124 4.056 -17.067 -18.911 1.00 0.00 H new ATOM 0 HD2 PRO A 124 4.247 -14.670 -20.357 1.00 0.00 H new ATOM 0 HD3 PRO A 124 3.081 -15.926 -20.725 1.00 0.00 H new ATOM 79 N GLU A 125 3.381 -12.581 -17.777 1.00 0.00 N ATOM 80 CA GLU A 125 3.970 -11.460 -17.057 1.00 0.00 C ATOM 81 C GLU A 125 2.879 -10.563 -16.484 1.00 0.00 C ATOM 82 O GLU A 125 2.937 -10.165 -15.321 1.00 0.00 O ATOM 83 CB GLU A 125 4.863 -10.647 -17.997 1.00 0.00 C ATOM 84 CG GLU A 125 3.999 -9.965 -19.059 1.00 0.00 C ATOM 85 CD GLU A 125 4.873 -9.480 -20.209 1.00 0.00 C ATOM 86 OE1 GLU A 125 5.727 -10.238 -20.639 1.00 0.00 O ATOM 87 OE2 GLU A 125 4.679 -8.355 -20.642 1.00 0.00 O ATOM 0 H GLU A 125 3.634 -12.633 -18.764 1.00 0.00 H new ATOM 0 HA GLU A 125 4.571 -11.852 -16.237 1.00 0.00 H new ATOM 0 HB2 GLU A 125 5.420 -9.900 -17.431 1.00 0.00 H new ATOM 0 HB3 GLU A 125 5.596 -11.298 -18.473 1.00 0.00 H new ATOM 0 HG2 GLU A 125 3.248 -10.662 -19.431 1.00 0.00 H new ATOM 0 HG3 GLU A 125 3.463 -9.124 -18.619 1.00 0.00 H new ATOM 94 N GLU A 126 1.885 -10.249 -17.308 1.00 0.00 N ATOM 95 CA GLU A 126 0.784 -9.398 -16.873 1.00 0.00 C ATOM 96 C GLU A 126 -0.093 -10.137 -15.868 1.00 0.00 C ATOM 97 O GLU A 126 -0.431 -9.601 -14.812 1.00 0.00 O ATOM 98 CB GLU A 126 -0.059 -8.975 -18.078 1.00 0.00 C ATOM 99 CG GLU A 126 -0.809 -10.189 -18.626 1.00 0.00 C ATOM 100 CD GLU A 126 -1.323 -9.893 -20.032 1.00 0.00 C ATOM 101 OE1 GLU A 126 -0.534 -9.973 -20.958 1.00 0.00 O ATOM 102 OE2 GLU A 126 -2.497 -9.588 -20.160 1.00 0.00 O ATOM 0 H GLU A 126 1.819 -10.569 -18.274 1.00 0.00 H new ATOM 0 HA GLU A 126 1.199 -8.511 -16.395 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -0.766 -8.199 -17.786 1.00 0.00 H new ATOM 0 HB3 GLU A 126 0.580 -8.549 -18.851 1.00 0.00 H new ATOM 0 HG2 GLU A 126 -0.149 -11.056 -18.646 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -1.643 -10.438 -17.970 1.00 0.00 H new ATOM 109 N LEU A 127 -0.458 -11.371 -16.203 1.00 0.00 N ATOM 110 CA LEU A 127 -1.281 -12.181 -15.313 1.00 0.00 C ATOM 111 C LEU A 127 -0.612 -12.313 -13.949 1.00 0.00 C ATOM 112 O LEU A 127 -1.258 -12.161 -12.913 1.00 0.00 O ATOM 113 CB LEU A 127 -1.495 -13.570 -15.916 1.00 0.00 C ATOM 114 CG LEU A 127 -2.860 -14.109 -15.486 1.00 0.00 C ATOM 115 CD1 LEU A 127 -2.966 -14.068 -13.958 1.00 0.00 C ATOM 116 CD2 LEU A 127 -3.965 -13.241 -16.094 1.00 0.00 C ATOM 0 H LEU A 127 -0.199 -11.828 -17.077 1.00 0.00 H new ATOM 0 HA LEU A 127 -2.246 -11.690 -15.190 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -1.439 -13.518 -17.003 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -0.706 -14.246 -15.588 1.00 0.00 H new ATOM 0 HG LEU A 127 -2.970 -15.137 -15.832 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -3.939 -14.452 -13.650 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -2.179 -14.683 -13.522 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -2.856 -13.040 -13.613 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -4.938 -13.624 -15.788 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -3.854 -12.214 -15.746 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -3.891 -13.266 -17.181 1.00 0.00 H new ATOM 128 N GLU A 128 0.688 -12.595 -13.959 1.00 0.00 N ATOM 129 CA GLU A 128 1.436 -12.746 -12.717 1.00 0.00 C ATOM 130 C GLU A 128 1.429 -11.440 -11.931 1.00 0.00 C ATOM 131 O GLU A 128 1.382 -11.443 -10.701 1.00 0.00 O ATOM 132 CB GLU A 128 2.878 -13.156 -13.022 1.00 0.00 C ATOM 133 CG GLU A 128 3.615 -13.441 -11.712 1.00 0.00 C ATOM 134 CD GLU A 128 5.038 -13.904 -12.003 1.00 0.00 C ATOM 135 OE1 GLU A 128 5.309 -14.233 -13.147 1.00 0.00 O ATOM 136 OE2 GLU A 128 5.836 -13.923 -11.081 1.00 0.00 O ATOM 0 H GLU A 128 1.241 -12.723 -14.807 1.00 0.00 H new ATOM 0 HA GLU A 128 0.960 -13.522 -12.117 1.00 0.00 H new ATOM 0 HB2 GLU A 128 2.889 -14.041 -13.658 1.00 0.00 H new ATOM 0 HB3 GLU A 128 3.385 -12.363 -13.572 1.00 0.00 H new ATOM 0 HG2 GLU A 128 3.635 -12.543 -11.094 1.00 0.00 H new ATOM 0 HG3 GLU A 128 3.084 -14.206 -11.146 1.00 0.00 H new ATOM 143 N GLU A 129 1.471 -10.322 -12.651 1.00 0.00 N ATOM 144 CA GLU A 129 1.466 -9.014 -12.011 1.00 0.00 C ATOM 145 C GLU A 129 0.210 -8.844 -11.163 1.00 0.00 C ATOM 146 O GLU A 129 0.248 -8.235 -10.095 1.00 0.00 O ATOM 147 CB GLU A 129 1.522 -7.912 -13.071 1.00 0.00 C ATOM 148 CG GLU A 129 1.773 -6.564 -12.393 1.00 0.00 C ATOM 149 CD GLU A 129 3.198 -6.510 -11.853 1.00 0.00 C ATOM 150 OE1 GLU A 129 3.949 -7.431 -12.125 1.00 0.00 O ATOM 151 OE2 GLU A 129 3.516 -5.546 -11.175 1.00 0.00 O ATOM 0 H GLU A 129 1.509 -10.297 -13.670 1.00 0.00 H new ATOM 0 HA GLU A 129 2.342 -8.940 -11.367 1.00 0.00 H new ATOM 0 HB2 GLU A 129 2.315 -8.123 -13.789 1.00 0.00 H new ATOM 0 HB3 GLU A 129 0.586 -7.882 -13.629 1.00 0.00 H new ATOM 0 HG2 GLU A 129 1.614 -5.754 -13.105 1.00 0.00 H new ATOM 0 HG3 GLU A 129 1.061 -6.418 -11.580 1.00 0.00 H new ATOM 158 N LEU A 130 -0.901 -9.394 -11.645 1.00 0.00 N ATOM 159 CA LEU A 130 -2.162 -9.300 -10.921 1.00 0.00 C ATOM 160 C LEU A 130 -2.074 -10.058 -9.603 1.00 0.00 C ATOM 161 O LEU A 130 -2.621 -9.627 -8.587 1.00 0.00 O ATOM 162 CB LEU A 130 -3.296 -9.877 -11.771 1.00 0.00 C ATOM 163 CG LEU A 130 -3.407 -9.091 -13.079 1.00 0.00 C ATOM 164 CD1 LEU A 130 -4.528 -9.681 -13.936 1.00 0.00 C ATOM 165 CD2 LEU A 130 -3.720 -7.626 -12.766 1.00 0.00 C ATOM 0 H LEU A 130 -0.953 -9.905 -12.526 1.00 0.00 H new ATOM 0 HA LEU A 130 -2.366 -8.250 -10.712 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -3.107 -10.929 -11.982 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -4.237 -9.826 -11.223 1.00 0.00 H new ATOM 0 HG LEU A 130 -2.464 -9.154 -13.623 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -4.607 -9.121 -14.868 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -4.306 -10.725 -14.158 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -5.472 -9.618 -13.394 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -3.800 -7.064 -13.697 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -4.663 -7.563 -12.223 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -2.921 -7.206 -12.155 1.00 0.00 H new ATOM 177 N GLN A 131 -1.377 -11.191 -9.624 1.00 0.00 N ATOM 178 CA GLN A 131 -1.225 -12.004 -8.422 1.00 0.00 C ATOM 179 C GLN A 131 -0.493 -11.219 -7.339 1.00 0.00 C ATOM 180 O GLN A 131 -0.879 -11.244 -6.172 1.00 0.00 O ATOM 181 CB GLN A 131 -0.445 -13.278 -8.748 1.00 0.00 C ATOM 182 CG GLN A 131 -0.323 -14.139 -7.488 1.00 0.00 C ATOM 183 CD GLN A 131 0.828 -13.636 -6.624 1.00 0.00 C ATOM 184 OE1 GLN A 131 0.603 -13.014 -5.587 1.00 0.00 O ATOM 185 NE2 GLN A 131 2.059 -13.872 -6.993 1.00 0.00 N ATOM 0 H GLN A 131 -0.913 -11.564 -10.452 1.00 0.00 H new ATOM 0 HA GLN A 131 -2.216 -12.271 -8.056 1.00 0.00 H new ATOM 0 HB2 GLN A 131 -0.952 -13.836 -9.535 1.00 0.00 H new ATOM 0 HB3 GLN A 131 0.546 -13.024 -9.125 1.00 0.00 H new ATOM 0 HG2 GLN A 131 -1.255 -14.106 -6.923 1.00 0.00 H new ATOM 0 HG3 GLN A 131 -0.154 -15.180 -7.764 1.00 0.00 H new ATOM 0 HE21 GLN A 131 2.244 -14.388 -7.853 1.00 0.00 H new ATOM 0 HE22 GLN A 131 2.835 -13.540 -6.421 1.00 0.00 H new ATOM 194 N ALA A 132 0.562 -10.515 -7.739 1.00 0.00 N ATOM 195 CA ALA A 132 1.343 -9.727 -6.793 1.00 0.00 C ATOM 196 C ALA A 132 0.441 -8.734 -6.065 1.00 0.00 C ATOM 197 O ALA A 132 0.619 -8.478 -4.874 1.00 0.00 O ATOM 198 CB ALA A 132 2.449 -8.970 -7.531 1.00 0.00 C ATOM 0 H ALA A 132 0.893 -10.474 -8.703 1.00 0.00 H new ATOM 0 HA ALA A 132 1.793 -10.401 -6.064 1.00 0.00 H new ATOM 0 HB1 ALA A 132 3.028 -8.384 -6.817 1.00 0.00 H new ATOM 0 HB2 ALA A 132 3.105 -9.682 -8.032 1.00 0.00 H new ATOM 0 HB3 ALA A 132 2.003 -8.304 -8.270 1.00 0.00 H new ATOM 204 N ALA A 133 -0.527 -8.184 -6.789 1.00 0.00 N ATOM 205 CA ALA A 133 -1.455 -7.225 -6.200 1.00 0.00 C ATOM 206 C ALA A 133 -2.331 -7.908 -5.157 1.00 0.00 C ATOM 207 O ALA A 133 -2.551 -7.376 -4.069 1.00 0.00 O ATOM 208 CB ALA A 133 -2.337 -6.613 -7.291 1.00 0.00 C ATOM 0 H ALA A 133 -0.689 -8.383 -7.776 1.00 0.00 H new ATOM 0 HA ALA A 133 -0.879 -6.436 -5.717 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -3.027 -5.898 -6.843 1.00 0.00 H new ATOM 0 HB2 ALA A 133 -1.710 -6.103 -8.022 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -2.903 -7.402 -7.786 1.00 0.00 H new ATOM 214 N PHE A 134 -2.829 -9.094 -5.495 1.00 0.00 N ATOM 215 CA PHE A 134 -3.672 -9.849 -4.576 1.00 0.00 C ATOM 216 C PHE A 134 -2.953 -10.052 -3.247 1.00 0.00 C ATOM 217 O PHE A 134 -3.551 -9.912 -2.179 1.00 0.00 O ATOM 218 CB PHE A 134 -4.022 -11.209 -5.184 1.00 0.00 C ATOM 219 CG PHE A 134 -5.082 -11.879 -4.344 1.00 0.00 C ATOM 220 CD1 PHE A 134 -6.426 -11.527 -4.505 1.00 0.00 C ATOM 221 CD2 PHE A 134 -4.719 -12.851 -3.405 1.00 0.00 C ATOM 222 CE1 PHE A 134 -7.411 -12.149 -3.725 1.00 0.00 C ATOM 223 CE2 PHE A 134 -5.702 -13.472 -2.626 1.00 0.00 C ATOM 224 CZ PHE A 134 -7.048 -13.122 -2.786 1.00 0.00 C ATOM 0 H PHE A 134 -2.664 -9.550 -6.393 1.00 0.00 H new ATOM 0 HA PHE A 134 -4.589 -9.286 -4.402 1.00 0.00 H new ATOM 0 HB2 PHE A 134 -4.380 -11.081 -6.206 1.00 0.00 H new ATOM 0 HB3 PHE A 134 -3.132 -11.837 -5.234 1.00 0.00 H new ATOM 0 HD1 PHE A 134 -6.705 -10.776 -5.230 1.00 0.00 H new ATOM 0 HD2 PHE A 134 -3.681 -13.122 -3.282 1.00 0.00 H new ATOM 0 HE1 PHE A 134 -8.449 -11.878 -3.848 1.00 0.00 H new ATOM 0 HE2 PHE A 134 -5.422 -14.222 -1.901 1.00 0.00 H new ATOM 0 HZ PHE A 134 -7.806 -13.602 -2.185 1.00 0.00 H new ATOM 234 N GLU A 135 -1.666 -10.379 -3.321 1.00 0.00 N ATOM 235 CA GLU A 135 -0.872 -10.588 -2.116 1.00 0.00 C ATOM 236 C GLU A 135 -0.841 -9.317 -1.275 1.00 0.00 C ATOM 237 O GLU A 135 -0.910 -9.372 -0.046 1.00 0.00 O ATOM 238 CB GLU A 135 0.556 -10.989 -2.496 1.00 0.00 C ATOM 239 CG GLU A 135 1.318 -11.414 -1.240 1.00 0.00 C ATOM 240 CD GLU A 135 0.794 -12.756 -0.742 1.00 0.00 C ATOM 241 OE1 GLU A 135 -0.008 -13.354 -1.441 1.00 0.00 O ATOM 242 OE2 GLU A 135 1.202 -13.168 0.332 1.00 0.00 O ATOM 0 H GLU A 135 -1.155 -10.504 -4.195 1.00 0.00 H new ATOM 0 HA GLU A 135 -1.328 -11.387 -1.532 1.00 0.00 H new ATOM 0 HB2 GLU A 135 0.536 -11.807 -3.216 1.00 0.00 H new ATOM 0 HB3 GLU A 135 1.064 -10.153 -2.977 1.00 0.00 H new ATOM 0 HG2 GLU A 135 2.383 -11.489 -1.459 1.00 0.00 H new ATOM 0 HG3 GLU A 135 1.204 -10.659 -0.462 1.00 0.00 H new ATOM 249 N GLU A 136 -0.738 -8.174 -1.945 1.00 0.00 N ATOM 250 CA GLU A 136 -0.706 -6.892 -1.250 1.00 0.00 C ATOM 251 C GLU A 136 -2.084 -6.557 -0.690 1.00 0.00 C ATOM 252 O GLU A 136 -2.201 -5.960 0.379 1.00 0.00 O ATOM 253 CB GLU A 136 -0.262 -5.789 -2.213 1.00 0.00 C ATOM 254 CG GLU A 136 -0.024 -4.495 -1.432 1.00 0.00 C ATOM 255 CD GLU A 136 1.223 -4.629 -0.566 1.00 0.00 C ATOM 256 OE1 GLU A 136 1.915 -5.624 -0.709 1.00 0.00 O ATOM 257 OE2 GLU A 136 1.470 -3.735 0.227 1.00 0.00 O ATOM 0 H GLU A 136 -0.676 -8.109 -2.961 1.00 0.00 H new ATOM 0 HA GLU A 136 0.004 -6.961 -0.425 1.00 0.00 H new ATOM 0 HB2 GLU A 136 0.650 -6.088 -2.729 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -1.023 -5.630 -2.977 1.00 0.00 H new ATOM 0 HG2 GLU A 136 0.091 -3.660 -2.123 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -0.889 -4.274 -0.806 1.00 0.00 H new ATOM 264 N PHE A 137 -3.124 -6.951 -1.418 1.00 0.00 N ATOM 265 CA PHE A 137 -4.491 -6.688 -0.987 1.00 0.00 C ATOM 266 C PHE A 137 -4.998 -7.821 -0.103 1.00 0.00 C ATOM 267 O PHE A 137 -6.119 -7.774 0.403 1.00 0.00 O ATOM 268 CB PHE A 137 -5.404 -6.539 -2.204 1.00 0.00 C ATOM 269 CG PHE A 137 -5.171 -5.194 -2.849 1.00 0.00 C ATOM 270 CD1 PHE A 137 -5.496 -4.021 -2.159 1.00 0.00 C ATOM 271 CD2 PHE A 137 -4.628 -5.120 -4.138 1.00 0.00 C ATOM 272 CE1 PHE A 137 -5.281 -2.773 -2.755 1.00 0.00 C ATOM 273 CE2 PHE A 137 -4.413 -3.871 -4.736 1.00 0.00 C ATOM 274 CZ PHE A 137 -4.740 -2.699 -4.044 1.00 0.00 C ATOM 0 H PHE A 137 -3.047 -7.451 -2.304 1.00 0.00 H new ATOM 0 HA PHE A 137 -4.500 -5.761 -0.413 1.00 0.00 H new ATOM 0 HB2 PHE A 137 -5.206 -7.336 -2.920 1.00 0.00 H new ATOM 0 HB3 PHE A 137 -6.447 -6.633 -1.903 1.00 0.00 H new ATOM 0 HD1 PHE A 137 -5.914 -4.079 -1.165 1.00 0.00 H new ATOM 0 HD2 PHE A 137 -4.375 -6.025 -4.671 1.00 0.00 H new ATOM 0 HE1 PHE A 137 -5.532 -1.868 -2.221 1.00 0.00 H new ATOM 0 HE2 PHE A 137 -3.995 -3.813 -5.730 1.00 0.00 H new ATOM 0 HZ PHE A 137 -4.575 -1.736 -4.505 1.00 0.00 H new ATOM 284 N ASP A 138 -4.164 -8.841 0.080 1.00 0.00 N ATOM 285 CA ASP A 138 -4.537 -9.982 0.906 1.00 0.00 C ATOM 286 C ASP A 138 -3.465 -10.255 1.954 1.00 0.00 C ATOM 287 O ASP A 138 -2.621 -11.136 1.778 1.00 0.00 O ATOM 288 CB ASP A 138 -4.727 -11.221 0.030 1.00 0.00 C ATOM 289 CG ASP A 138 -5.344 -12.349 0.848 1.00 0.00 C ATOM 290 OD1 ASP A 138 -5.268 -12.283 2.064 1.00 0.00 O ATOM 291 OD2 ASP A 138 -5.883 -13.264 0.247 1.00 0.00 O ATOM 0 H ASP A 138 -3.232 -8.900 -0.330 1.00 0.00 H new ATOM 0 HA ASP A 138 -5.474 -9.751 1.413 1.00 0.00 H new ATOM 0 HB2 ASP A 138 -5.369 -10.982 -0.818 1.00 0.00 H new ATOM 0 HB3 ASP A 138 -3.767 -11.539 -0.377 1.00 0.00 H new ATOM 296 N THR A 139 -3.501 -9.496 3.045 1.00 0.00 N ATOM 297 CA THR A 139 -2.524 -9.661 4.114 1.00 0.00 C ATOM 298 C THR A 139 -2.705 -11.009 4.803 1.00 0.00 C ATOM 299 O THR A 139 -1.730 -11.663 5.177 1.00 0.00 O ATOM 300 CB THR A 139 -2.678 -8.537 5.139 1.00 0.00 C ATOM 301 OG1 THR A 139 -4.047 -8.409 5.497 1.00 0.00 O ATOM 302 CG2 THR A 139 -2.181 -7.222 4.538 1.00 0.00 C ATOM 0 H THR A 139 -4.192 -8.765 3.211 1.00 0.00 H new ATOM 0 HA THR A 139 -1.526 -9.621 3.678 1.00 0.00 H new ATOM 0 HB THR A 139 -2.090 -8.772 6.026 1.00 0.00 H new ATOM 0 HG1 THR A 139 -4.147 -7.690 6.155 1.00 0.00 H new ATOM 0 HG21 THR A 139 -2.292 -6.422 5.270 1.00 0.00 H new ATOM 0 HG22 THR A 139 -1.130 -7.321 4.265 1.00 0.00 H new ATOM 0 HG23 THR A 139 -2.766 -6.984 3.650 1.00 0.00 H new ATOM 310 N ASP A 140 -3.958 -11.419 4.972 1.00 0.00 N ATOM 311 CA ASP A 140 -4.252 -12.694 5.616 1.00 0.00 C ATOM 312 C ASP A 140 -3.973 -13.855 4.666 1.00 0.00 C ATOM 313 O ASP A 140 -4.006 -15.018 5.066 1.00 0.00 O ATOM 314 CB ASP A 140 -5.720 -12.731 6.052 1.00 0.00 C ATOM 315 CG ASP A 140 -6.620 -12.344 4.883 1.00 0.00 C ATOM 316 OD1 ASP A 140 -6.212 -11.501 4.102 1.00 0.00 O ATOM 317 OD2 ASP A 140 -7.703 -12.897 4.788 1.00 0.00 O ATOM 0 H ASP A 140 -4.779 -10.892 4.675 1.00 0.00 H new ATOM 0 HA ASP A 140 -3.609 -12.794 6.490 1.00 0.00 H new ATOM 0 HB2 ASP A 140 -5.978 -13.729 6.406 1.00 0.00 H new ATOM 0 HB3 ASP A 140 -5.878 -12.047 6.886 1.00 0.00 H new ATOM 322 N GLN A 141 -3.700 -13.531 3.406 1.00 0.00 N ATOM 323 CA GLN A 141 -3.413 -14.557 2.410 1.00 0.00 C ATOM 324 C GLN A 141 -4.389 -15.721 2.543 1.00 0.00 C ATOM 325 O GLN A 141 -3.990 -16.884 2.506 1.00 0.00 O ATOM 326 CB GLN A 141 -1.982 -15.067 2.584 1.00 0.00 C ATOM 327 CG GLN A 141 -0.994 -13.949 2.243 1.00 0.00 C ATOM 328 CD GLN A 141 0.434 -14.423 2.491 1.00 0.00 C ATOM 329 OE1 GLN A 141 0.794 -15.537 2.113 1.00 0.00 O ATOM 330 NE2 GLN A 141 1.275 -13.635 3.106 1.00 0.00 N ATOM 0 H GLN A 141 -3.672 -12.575 3.053 1.00 0.00 H new ATOM 0 HA GLN A 141 -3.524 -14.116 1.419 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -1.827 -15.403 3.609 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -1.811 -15.927 1.937 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -1.112 -13.653 1.201 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -1.204 -13.068 2.850 1.00 0.00 H new ATOM 0 HE21 GLN A 141 0.974 -12.712 3.418 1.00 0.00 H new ATOM 0 HE22 GLN A 141 2.233 -13.943 3.274 1.00 0.00 H new ATOM 339 N ASP A 142 -5.670 -15.399 2.699 1.00 0.00 N ATOM 340 CA ASP A 142 -6.693 -16.429 2.835 1.00 0.00 C ATOM 341 C ASP A 142 -7.140 -16.924 1.464 1.00 0.00 C ATOM 342 O ASP A 142 -7.957 -17.839 1.360 1.00 0.00 O ATOM 343 CB ASP A 142 -7.896 -15.869 3.595 1.00 0.00 C ATOM 344 CG ASP A 142 -8.428 -14.627 2.888 1.00 0.00 C ATOM 345 OD1 ASP A 142 -7.955 -14.341 1.800 1.00 0.00 O ATOM 346 OD2 ASP A 142 -9.301 -13.982 3.444 1.00 0.00 O ATOM 0 H ASP A 142 -6.021 -14.442 2.734 1.00 0.00 H new ATOM 0 HA ASP A 142 -6.270 -17.266 3.390 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -8.679 -16.624 3.660 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -7.608 -15.621 4.616 1.00 0.00 H new ATOM 351 N GLY A 143 -6.601 -16.311 0.414 1.00 0.00 N ATOM 352 CA GLY A 143 -6.955 -16.697 -0.947 1.00 0.00 C ATOM 353 C GLY A 143 -8.277 -16.063 -1.367 1.00 0.00 C ATOM 354 O GLY A 143 -8.789 -16.333 -2.453 1.00 0.00 O ATOM 0 H GLY A 143 -5.923 -15.551 0.479 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -6.166 -16.390 -1.633 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -7.030 -17.782 -1.013 1.00 0.00 H new ATOM 358 N TYR A 144 -8.826 -15.219 -0.499 1.00 0.00 N ATOM 359 CA TYR A 144 -10.090 -14.552 -0.791 1.00 0.00 C ATOM 360 C TYR A 144 -10.080 -13.127 -0.250 1.00 0.00 C ATOM 361 O TYR A 144 -9.465 -12.847 0.780 1.00 0.00 O ATOM 362 CB TYR A 144 -11.249 -15.331 -0.164 1.00 0.00 C ATOM 363 CG TYR A 144 -11.136 -16.789 -0.535 1.00 0.00 C ATOM 364 CD1 TYR A 144 -11.589 -17.230 -1.785 1.00 0.00 C ATOM 365 CD2 TYR A 144 -10.580 -17.702 0.369 1.00 0.00 C ATOM 366 CE1 TYR A 144 -11.486 -18.582 -2.130 1.00 0.00 C ATOM 367 CE2 TYR A 144 -10.476 -19.055 0.024 1.00 0.00 C ATOM 368 CZ TYR A 144 -10.929 -19.495 -1.225 1.00 0.00 C ATOM 369 OH TYR A 144 -10.827 -20.829 -1.566 1.00 0.00 O ATOM 0 H TYR A 144 -8.419 -14.982 0.406 1.00 0.00 H new ATOM 0 HA TYR A 144 -10.220 -14.517 -1.873 1.00 0.00 H new ATOM 0 HB2 TYR A 144 -11.232 -15.219 0.920 1.00 0.00 H new ATOM 0 HB3 TYR A 144 -12.201 -14.929 -0.511 1.00 0.00 H new ATOM 0 HD1 TYR A 144 -12.018 -16.526 -2.483 1.00 0.00 H new ATOM 0 HD2 TYR A 144 -10.231 -17.363 1.333 1.00 0.00 H new ATOM 0 HE1 TYR A 144 -11.836 -18.922 -3.094 1.00 0.00 H new ATOM 0 HE2 TYR A 144 -10.046 -19.759 0.721 1.00 0.00 H new ATOM 0 HH TYR A 144 -10.417 -21.325 -0.827 1.00 0.00 H new ATOM 379 N ILE A 145 -10.768 -12.229 -0.949 1.00 0.00 N ATOM 380 CA ILE A 145 -10.847 -10.839 -0.518 1.00 0.00 C ATOM 381 C ILE A 145 -12.301 -10.394 -0.413 1.00 0.00 C ATOM 382 O ILE A 145 -13.206 -11.074 -0.895 1.00 0.00 O ATOM 383 CB ILE A 145 -10.109 -9.940 -1.513 1.00 0.00 C ATOM 384 CG1 ILE A 145 -10.469 -10.356 -2.940 1.00 0.00 C ATOM 385 CG2 ILE A 145 -8.599 -10.085 -1.307 1.00 0.00 C ATOM 386 CD1 ILE A 145 -11.834 -9.772 -3.312 1.00 0.00 C ATOM 0 H ILE A 145 -11.275 -12.437 -1.809 1.00 0.00 H new ATOM 0 HA ILE A 145 -10.380 -10.756 0.463 1.00 0.00 H new ATOM 0 HB ILE A 145 -10.401 -8.902 -1.352 1.00 0.00 H new ATOM 0 HG12 ILE A 145 -9.708 -10.003 -3.636 1.00 0.00 H new ATOM 0 HG13 ILE A 145 -10.493 -11.443 -3.018 1.00 0.00 H new ATOM 0 HG21 ILE A 145 -8.072 -9.445 -2.015 1.00 0.00 H new ATOM 0 HG22 ILE A 145 -8.341 -9.790 -0.290 1.00 0.00 H new ATOM 0 HG23 ILE A 145 -8.308 -11.123 -1.469 1.00 0.00 H new ATOM 0 HD11 ILE A 145 -12.091 -10.068 -4.329 1.00 0.00 H new ATOM 0 HD12 ILE A 145 -12.590 -10.147 -2.622 1.00 0.00 H new ATOM 0 HD13 ILE A 145 -11.794 -8.685 -3.250 1.00 0.00 H new ATOM 398 N GLY A 146 -12.520 -9.247 0.223 1.00 0.00 N ATOM 399 CA GLY A 146 -13.870 -8.725 0.394 1.00 0.00 C ATOM 400 C GLY A 146 -14.261 -7.830 -0.777 1.00 0.00 C ATOM 401 O GLY A 146 -13.894 -8.096 -1.922 1.00 0.00 O ATOM 0 H GLY A 146 -11.785 -8.665 0.626 1.00 0.00 H new ATOM 0 HA2 GLY A 146 -14.576 -9.552 0.476 1.00 0.00 H new ATOM 0 HA3 GLY A 146 -13.930 -8.160 1.324 1.00 0.00 H new ATOM 405 N TYR A 147 -15.006 -6.769 -0.484 1.00 0.00 N ATOM 406 CA TYR A 147 -15.440 -5.844 -1.523 1.00 0.00 C ATOM 407 C TYR A 147 -14.593 -4.576 -1.498 1.00 0.00 C ATOM 408 O TYR A 147 -13.496 -4.562 -0.941 1.00 0.00 O ATOM 409 CB TYR A 147 -16.912 -5.479 -1.316 1.00 0.00 C ATOM 410 CG TYR A 147 -17.645 -6.663 -0.731 1.00 0.00 C ATOM 411 CD1 TYR A 147 -17.427 -7.946 -1.246 1.00 0.00 C ATOM 412 CD2 TYR A 147 -18.543 -6.475 0.326 1.00 0.00 C ATOM 413 CE1 TYR A 147 -18.108 -9.043 -0.704 1.00 0.00 C ATOM 414 CE2 TYR A 147 -19.223 -7.572 0.869 1.00 0.00 C ATOM 415 CZ TYR A 147 -19.005 -8.856 0.354 1.00 0.00 C ATOM 416 OH TYR A 147 -19.675 -9.937 0.890 1.00 0.00 O ATOM 0 H TYR A 147 -15.319 -6.530 0.457 1.00 0.00 H new ATOM 0 HA TYR A 147 -15.319 -6.331 -2.491 1.00 0.00 H new ATOM 0 HB2 TYR A 147 -16.995 -4.620 -0.650 1.00 0.00 H new ATOM 0 HB3 TYR A 147 -17.364 -5.191 -2.265 1.00 0.00 H new ATOM 0 HD1 TYR A 147 -16.734 -8.090 -2.061 1.00 0.00 H new ATOM 0 HD2 TYR A 147 -18.711 -5.485 0.722 1.00 0.00 H new ATOM 0 HE1 TYR A 147 -17.941 -10.033 -1.102 1.00 0.00 H new ATOM 0 HE2 TYR A 147 -19.916 -7.428 1.685 1.00 0.00 H new ATOM 0 HH TYR A 147 -20.258 -9.633 1.617 1.00 0.00 H new ATOM 426 N ARG A 148 -15.108 -3.512 -2.104 1.00 0.00 N ATOM 427 CA ARG A 148 -14.388 -2.246 -2.148 1.00 0.00 C ATOM 428 C ARG A 148 -13.032 -2.425 -2.824 1.00 0.00 C ATOM 429 O ARG A 148 -12.828 -1.987 -3.956 1.00 0.00 O ATOM 430 CB ARG A 148 -14.188 -1.709 -0.730 1.00 0.00 C ATOM 431 CG ARG A 148 -15.548 -1.565 -0.042 1.00 0.00 C ATOM 432 CD ARG A 148 -16.245 -0.303 -0.550 1.00 0.00 C ATOM 433 NE ARG A 148 -17.409 -0.005 0.277 1.00 0.00 N ATOM 434 CZ ARG A 148 -18.356 0.828 -0.145 1.00 0.00 C ATOM 435 NH1 ARG A 148 -18.253 1.393 -1.317 1.00 0.00 N ATOM 436 NH2 ARG A 148 -19.389 1.078 0.612 1.00 0.00 N ATOM 0 H ARG A 148 -16.016 -3.501 -2.569 1.00 0.00 H new ATOM 0 HA ARG A 148 -14.977 -1.533 -2.725 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -13.550 -2.385 -0.160 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -13.681 -0.745 -0.763 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -16.165 -2.441 -0.245 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -15.417 -1.511 1.039 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -15.551 0.537 -0.531 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -16.552 -0.440 -1.587 1.00 0.00 H new ATOM 0 HE ARG A 148 -17.498 -0.443 1.194 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -17.446 1.196 -1.909 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -18.979 2.032 -1.641 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -19.470 0.635 1.527 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -20.116 1.717 0.289 1.00 0.00 H new ATOM 450 N GLU A 149 -12.108 -3.073 -2.121 1.00 0.00 N ATOM 451 CA GLU A 149 -10.774 -3.302 -2.663 1.00 0.00 C ATOM 452 C GLU A 149 -10.857 -3.757 -4.116 1.00 0.00 C ATOM 453 O GLU A 149 -9.884 -3.659 -4.866 1.00 0.00 O ATOM 454 CB GLU A 149 -10.048 -4.364 -1.835 1.00 0.00 C ATOM 455 CG GLU A 149 -9.871 -3.861 -0.400 1.00 0.00 C ATOM 456 CD GLU A 149 -8.917 -2.671 -0.381 1.00 0.00 C ATOM 457 OE1 GLU A 149 -8.179 -2.512 -1.339 1.00 0.00 O ATOM 458 OE2 GLU A 149 -8.939 -1.936 0.591 1.00 0.00 O ATOM 0 H GLU A 149 -12.257 -3.446 -1.183 1.00 0.00 H new ATOM 0 HA GLU A 149 -10.219 -2.365 -2.618 1.00 0.00 H new ATOM 0 HB2 GLU A 149 -10.617 -5.294 -1.838 1.00 0.00 H new ATOM 0 HB3 GLU A 149 -9.076 -4.583 -2.277 1.00 0.00 H new ATOM 0 HG2 GLU A 149 -10.836 -3.571 0.015 1.00 0.00 H new ATOM 0 HG3 GLU A 149 -9.481 -4.661 0.230 1.00 0.00 H new ATOM 465 N LEU A 150 -12.027 -4.253 -4.510 1.00 0.00 N ATOM 466 CA LEU A 150 -12.225 -4.723 -5.874 1.00 0.00 C ATOM 467 C LEU A 150 -11.906 -3.616 -6.874 1.00 0.00 C ATOM 468 O LEU A 150 -11.142 -3.820 -7.819 1.00 0.00 O ATOM 469 CB LEU A 150 -13.672 -5.182 -6.063 1.00 0.00 C ATOM 470 CG LEU A 150 -13.943 -6.396 -5.173 1.00 0.00 C ATOM 471 CD1 LEU A 150 -15.440 -6.708 -5.174 1.00 0.00 C ATOM 472 CD2 LEU A 150 -13.171 -7.604 -5.708 1.00 0.00 C ATOM 0 H LEU A 150 -12.846 -4.339 -3.908 1.00 0.00 H new ATOM 0 HA LEU A 150 -11.552 -5.562 -6.051 1.00 0.00 H new ATOM 0 HB2 LEU A 150 -14.357 -4.373 -5.811 1.00 0.00 H new ATOM 0 HB3 LEU A 150 -13.850 -5.437 -7.108 1.00 0.00 H new ATOM 0 HG LEU A 150 -13.619 -6.178 -4.156 1.00 0.00 H new ATOM 0 HD11 LEU A 150 -15.632 -7.573 -4.539 1.00 0.00 H new ATOM 0 HD12 LEU A 150 -15.991 -5.849 -4.792 1.00 0.00 H new ATOM 0 HD13 LEU A 150 -15.766 -6.925 -6.191 1.00 0.00 H new ATOM 0 HD21 LEU A 150 -13.364 -8.469 -5.074 1.00 0.00 H new ATOM 0 HD22 LEU A 150 -13.495 -7.821 -6.726 1.00 0.00 H new ATOM 0 HD23 LEU A 150 -12.104 -7.384 -5.706 1.00 0.00 H new ATOM 484 N GLY A 151 -12.496 -2.444 -6.660 1.00 0.00 N ATOM 485 CA GLY A 151 -12.263 -1.311 -7.545 1.00 0.00 C ATOM 486 C GLY A 151 -10.813 -0.846 -7.463 1.00 0.00 C ATOM 487 O GLY A 151 -10.190 -0.542 -8.481 1.00 0.00 O ATOM 0 H GLY A 151 -13.134 -2.256 -5.887 1.00 0.00 H new ATOM 0 HA2 GLY A 151 -12.502 -1.591 -8.571 1.00 0.00 H new ATOM 0 HA3 GLY A 151 -12.928 -0.491 -7.275 1.00 0.00 H new ATOM 491 N ASP A 152 -10.282 -0.789 -6.246 1.00 0.00 N ATOM 492 CA ASP A 152 -8.903 -0.360 -6.045 1.00 0.00 C ATOM 493 C ASP A 152 -7.945 -1.248 -6.831 1.00 0.00 C ATOM 494 O ASP A 152 -7.003 -0.760 -7.456 1.00 0.00 O ATOM 495 CB ASP A 152 -8.551 -0.417 -4.557 1.00 0.00 C ATOM 496 CG ASP A 152 -7.212 0.272 -4.312 1.00 0.00 C ATOM 497 OD1 ASP A 152 -6.418 0.328 -5.238 1.00 0.00 O ATOM 498 OD2 ASP A 152 -6.999 0.732 -3.203 1.00 0.00 O ATOM 0 H ASP A 152 -10.781 -1.032 -5.390 1.00 0.00 H new ATOM 0 HA ASP A 152 -8.805 0.665 -6.403 1.00 0.00 H new ATOM 0 HB2 ASP A 152 -9.332 0.068 -3.971 1.00 0.00 H new ATOM 0 HB3 ASP A 152 -8.502 -1.454 -4.226 1.00 0.00 H new ATOM 503 N CYS A 153 -8.191 -2.553 -6.798 1.00 0.00 N ATOM 504 CA CYS A 153 -7.341 -3.499 -7.508 1.00 0.00 C ATOM 505 C CYS A 153 -7.387 -3.237 -9.011 1.00 0.00 C ATOM 506 O CYS A 153 -6.390 -3.410 -9.711 1.00 0.00 O ATOM 507 CB CYS A 153 -7.801 -4.931 -7.224 1.00 0.00 C ATOM 508 SG CYS A 153 -6.455 -6.082 -7.594 1.00 0.00 S ATOM 0 H CYS A 153 -8.967 -2.977 -6.290 1.00 0.00 H new ATOM 0 HA CYS A 153 -6.316 -3.371 -7.159 1.00 0.00 H new ATOM 0 HB2 CYS A 153 -8.100 -5.028 -6.180 1.00 0.00 H new ATOM 0 HB3 CYS A 153 -8.675 -5.170 -7.830 1.00 0.00 H new ATOM 0 HG CYS A 153 -6.895 -7.031 -8.366 1.00 0.00 H new ATOM 514 N MET A 154 -8.550 -2.818 -9.498 1.00 0.00 N ATOM 515 CA MET A 154 -8.714 -2.537 -10.919 1.00 0.00 C ATOM 516 C MET A 154 -7.776 -1.416 -11.356 1.00 0.00 C ATOM 517 O MET A 154 -7.170 -1.481 -12.424 1.00 0.00 O ATOM 518 CB MET A 154 -10.161 -2.138 -11.210 1.00 0.00 C ATOM 519 CG MET A 154 -10.381 -2.074 -12.722 1.00 0.00 C ATOM 520 SD MET A 154 -10.380 -3.752 -13.402 1.00 0.00 S ATOM 521 CE MET A 154 -11.912 -4.314 -12.621 1.00 0.00 C ATOM 0 H MET A 154 -9.387 -2.666 -8.935 1.00 0.00 H new ATOM 0 HA MET A 154 -8.468 -3.439 -11.479 1.00 0.00 H new ATOM 0 HB2 MET A 154 -10.845 -2.860 -10.763 1.00 0.00 H new ATOM 0 HB3 MET A 154 -10.380 -1.170 -10.759 1.00 0.00 H new ATOM 0 HG2 MET A 154 -11.328 -1.581 -12.942 1.00 0.00 H new ATOM 0 HG3 MET A 154 -9.596 -1.480 -13.190 1.00 0.00 H new ATOM 0 HE1 MET A 154 -12.463 -4.949 -13.315 1.00 0.00 H new ATOM 0 HE2 MET A 154 -11.675 -4.881 -11.721 1.00 0.00 H new ATOM 0 HE3 MET A 154 -12.523 -3.451 -12.356 1.00 0.00 H new ATOM 531 N ARG A 155 -7.664 -0.389 -10.520 1.00 0.00 N ATOM 532 CA ARG A 155 -6.796 0.743 -10.830 1.00 0.00 C ATOM 533 C ARG A 155 -5.336 0.306 -10.860 1.00 0.00 C ATOM 534 O ARG A 155 -4.488 0.980 -11.444 1.00 0.00 O ATOM 535 CB ARG A 155 -6.979 1.844 -9.783 1.00 0.00 C ATOM 536 CG ARG A 155 -8.342 2.513 -9.977 1.00 0.00 C ATOM 537 CD ARG A 155 -8.482 3.679 -9.000 1.00 0.00 C ATOM 538 NE ARG A 155 -8.584 3.181 -7.632 1.00 0.00 N ATOM 539 CZ ARG A 155 -8.635 4.017 -6.598 1.00 0.00 C ATOM 540 NH1 ARG A 155 -8.599 5.306 -6.800 1.00 0.00 N ATOM 541 NH2 ARG A 155 -8.725 3.548 -5.384 1.00 0.00 N ATOM 0 H ARG A 155 -8.158 -0.316 -9.631 1.00 0.00 H new ATOM 0 HA ARG A 155 -7.069 1.127 -11.813 1.00 0.00 H new ATOM 0 HB2 ARG A 155 -6.909 1.422 -8.780 1.00 0.00 H new ATOM 0 HB3 ARG A 155 -6.183 2.583 -9.874 1.00 0.00 H new ATOM 0 HG2 ARG A 155 -8.441 2.870 -11.002 1.00 0.00 H new ATOM 0 HG3 ARG A 155 -9.141 1.790 -9.813 1.00 0.00 H new ATOM 0 HD2 ARG A 155 -7.622 4.343 -9.090 1.00 0.00 H new ATOM 0 HD3 ARG A 155 -9.366 4.266 -9.248 1.00 0.00 H new ATOM 0 HE ARG A 155 -8.617 2.175 -7.466 1.00 0.00 H new ATOM 0 HH11 ARG A 155 -8.532 5.672 -7.750 1.00 0.00 H new ATOM 0 HH12 ARG A 155 -8.638 5.948 -6.008 1.00 0.00 H new ATOM 0 HH21 ARG A 155 -8.756 2.541 -5.227 1.00 0.00 H new ATOM 0 HH22 ARG A 155 -8.764 4.189 -4.591 1.00 0.00 H new ATOM 555 N THR A 156 -5.050 -0.828 -10.229 1.00 0.00 N ATOM 556 CA THR A 156 -3.689 -1.349 -10.189 1.00 0.00 C ATOM 557 C THR A 156 -3.209 -1.698 -11.594 1.00 0.00 C ATOM 558 O THR A 156 -2.063 -2.101 -11.788 1.00 0.00 O ATOM 559 CB THR A 156 -3.630 -2.595 -9.303 1.00 0.00 C ATOM 560 OG1 THR A 156 -4.439 -2.394 -8.152 1.00 0.00 O ATOM 561 CG2 THR A 156 -2.183 -2.849 -8.874 1.00 0.00 C ATOM 0 H THR A 156 -5.738 -1.401 -9.741 1.00 0.00 H new ATOM 0 HA THR A 156 -3.038 -0.579 -9.774 1.00 0.00 H new ATOM 0 HB THR A 156 -3.998 -3.456 -9.860 1.00 0.00 H new ATOM 0 HG1 THR A 156 -3.926 -2.621 -7.348 1.00 0.00 H new ATOM 0 HG21 THR A 156 -2.141 -3.737 -8.243 1.00 0.00 H new ATOM 0 HG22 THR A 156 -1.563 -3.002 -9.757 1.00 0.00 H new ATOM 0 HG23 THR A 156 -1.813 -1.989 -8.316 1.00 0.00 H new ATOM 569 N LEU A 157 -4.096 -1.539 -12.572 1.00 0.00 N ATOM 570 CA LEU A 157 -3.752 -1.835 -13.958 1.00 0.00 C ATOM 571 C LEU A 157 -4.585 -0.983 -14.908 1.00 0.00 C ATOM 572 O LEU A 157 -4.958 -1.430 -15.995 1.00 0.00 O ATOM 573 CB LEU A 157 -3.993 -3.318 -14.252 1.00 0.00 C ATOM 574 CG LEU A 157 -5.442 -3.675 -13.914 1.00 0.00 C ATOM 575 CD1 LEU A 157 -5.939 -4.756 -14.876 1.00 0.00 C ATOM 576 CD2 LEU A 157 -5.513 -4.202 -12.478 1.00 0.00 C ATOM 0 H LEU A 157 -5.051 -1.209 -12.432 1.00 0.00 H new ATOM 0 HA LEU A 157 -2.698 -1.603 -14.109 1.00 0.00 H new ATOM 0 HB2 LEU A 157 -3.790 -3.529 -15.302 1.00 0.00 H new ATOM 0 HB3 LEU A 157 -3.309 -3.932 -13.666 1.00 0.00 H new ATOM 0 HG LEU A 157 -6.067 -2.787 -14.010 1.00 0.00 H new ATOM 0 HD11 LEU A 157 -6.971 -5.011 -14.635 1.00 0.00 H new ATOM 0 HD12 LEU A 157 -5.886 -4.385 -15.899 1.00 0.00 H new ATOM 0 HD13 LEU A 157 -5.314 -5.644 -14.779 1.00 0.00 H new ATOM 0 HD21 LEU A 157 -6.544 -4.457 -12.235 1.00 0.00 H new ATOM 0 HD22 LEU A 157 -4.888 -5.090 -12.385 1.00 0.00 H new ATOM 0 HD23 LEU A 157 -5.157 -3.434 -11.791 1.00 0.00 H new ATOM 588 N GLY A 158 -4.870 0.248 -14.497 1.00 0.00 N ATOM 589 CA GLY A 158 -5.662 1.154 -15.319 1.00 0.00 C ATOM 590 C GLY A 158 -7.152 0.867 -15.165 1.00 0.00 C ATOM 591 O GLY A 158 -7.564 0.149 -14.254 1.00 0.00 O ATOM 0 H GLY A 158 -4.566 0.639 -13.605 1.00 0.00 H new ATOM 0 HA2 GLY A 158 -5.455 2.185 -15.034 1.00 0.00 H new ATOM 0 HA3 GLY A 158 -5.373 1.049 -16.365 1.00 0.00 H new ATOM 595 N TYR A 159 -7.954 1.430 -16.061 1.00 0.00 N ATOM 596 CA TYR A 159 -9.397 1.226 -16.015 1.00 0.00 C ATOM 597 C TYR A 159 -10.003 1.363 -17.408 1.00 0.00 C ATOM 598 O TYR A 159 -9.327 1.770 -18.353 1.00 0.00 O ATOM 599 CB TYR A 159 -10.039 2.251 -15.076 1.00 0.00 C ATOM 600 CG TYR A 159 -9.808 3.642 -15.616 1.00 0.00 C ATOM 601 CD1 TYR A 159 -8.645 4.343 -15.273 1.00 0.00 C ATOM 602 CD2 TYR A 159 -10.759 4.231 -16.458 1.00 0.00 C ATOM 603 CE1 TYR A 159 -8.433 5.633 -15.773 1.00 0.00 C ATOM 604 CE2 TYR A 159 -10.546 5.522 -16.958 1.00 0.00 C ATOM 605 CZ TYR A 159 -9.382 6.223 -16.616 1.00 0.00 C ATOM 606 OH TYR A 159 -9.173 7.495 -17.109 1.00 0.00 O ATOM 0 H TYR A 159 -7.633 2.027 -16.823 1.00 0.00 H new ATOM 0 HA TYR A 159 -9.591 0.220 -15.644 1.00 0.00 H new ATOM 0 HB2 TYR A 159 -11.108 2.057 -14.985 1.00 0.00 H new ATOM 0 HB3 TYR A 159 -9.613 2.162 -14.077 1.00 0.00 H new ATOM 0 HD1 TYR A 159 -7.912 3.888 -14.623 1.00 0.00 H new ATOM 0 HD2 TYR A 159 -11.656 3.690 -16.722 1.00 0.00 H new ATOM 0 HE1 TYR A 159 -7.536 6.174 -15.508 1.00 0.00 H new ATOM 0 HE2 TYR A 159 -11.279 5.977 -17.607 1.00 0.00 H new ATOM 0 HH TYR A 159 -9.928 7.753 -17.679 1.00 0.00 H new ATOM 616 N MET A 160 -11.281 1.018 -17.527 1.00 0.00 N ATOM 617 CA MET A 160 -11.966 1.101 -18.812 1.00 0.00 C ATOM 618 C MET A 160 -13.456 1.356 -18.609 1.00 0.00 C ATOM 619 O MET A 160 -13.987 2.380 -19.040 1.00 0.00 O ATOM 620 CB MET A 160 -11.773 -0.200 -19.594 1.00 0.00 C ATOM 621 CG MET A 160 -10.726 0.015 -20.689 1.00 0.00 C ATOM 622 SD MET A 160 -11.389 1.133 -21.948 1.00 0.00 S ATOM 623 CE MET A 160 -10.007 1.013 -23.108 1.00 0.00 C ATOM 0 H MET A 160 -11.859 0.681 -16.757 1.00 0.00 H new ATOM 0 HA MET A 160 -11.539 1.930 -19.376 1.00 0.00 H new ATOM 0 HB2 MET A 160 -11.454 -0.997 -18.922 1.00 0.00 H new ATOM 0 HB3 MET A 160 -12.718 -0.515 -20.036 1.00 0.00 H new ATOM 0 HG2 MET A 160 -9.816 0.433 -20.259 1.00 0.00 H new ATOM 0 HG3 MET A 160 -10.456 -0.939 -21.141 1.00 0.00 H new ATOM 0 HE1 MET A 160 -10.208 1.637 -23.979 1.00 0.00 H new ATOM 0 HE2 MET A 160 -9.093 1.352 -22.621 1.00 0.00 H new ATOM 0 HE3 MET A 160 -9.887 -0.023 -23.424 1.00 0.00 H new ATOM 633 N PRO A 161 -14.132 0.446 -17.960 1.00 0.00 N ATOM 634 CA PRO A 161 -15.589 0.577 -17.673 1.00 0.00 C ATOM 635 C PRO A 161 -15.898 1.814 -16.838 1.00 0.00 C ATOM 636 O PRO A 161 -15.130 2.184 -15.949 1.00 0.00 O ATOM 637 CB PRO A 161 -15.923 -0.702 -16.902 1.00 0.00 C ATOM 638 CG PRO A 161 -14.614 -1.215 -16.397 1.00 0.00 C ATOM 639 CD PRO A 161 -13.577 -0.809 -17.433 1.00 0.00 C ATOM 0 HA PRO A 161 -16.178 0.696 -18.582 1.00 0.00 H new ATOM 0 HB2 PRO A 161 -16.608 -0.497 -16.079 1.00 0.00 H new ATOM 0 HB3 PRO A 161 -16.409 -1.434 -17.547 1.00 0.00 H new ATOM 0 HG2 PRO A 161 -14.378 -0.790 -15.422 1.00 0.00 H new ATOM 0 HG3 PRO A 161 -14.640 -2.298 -16.275 1.00 0.00 H new ATOM 0 HD2 PRO A 161 -12.593 -0.663 -16.987 1.00 0.00 H new ATOM 0 HD3 PRO A 161 -13.465 -1.563 -18.213 1.00 0.00 H new ATOM 647 N THR A 162 -17.027 2.454 -17.131 1.00 0.00 N ATOM 648 CA THR A 162 -17.430 3.648 -16.399 1.00 0.00 C ATOM 649 C THR A 162 -17.654 3.322 -14.927 1.00 0.00 C ATOM 650 O THR A 162 -18.053 2.209 -14.582 1.00 0.00 O ATOM 651 CB THR A 162 -18.715 4.220 -17.001 1.00 0.00 C ATOM 652 OG1 THR A 162 -19.514 4.776 -15.965 1.00 0.00 O ATOM 653 CG2 THR A 162 -19.493 3.109 -17.705 1.00 0.00 C ATOM 0 H THR A 162 -17.674 2.167 -17.865 1.00 0.00 H new ATOM 0 HA THR A 162 -16.633 4.388 -16.478 1.00 0.00 H new ATOM 0 HB THR A 162 -18.462 4.996 -17.724 1.00 0.00 H new ATOM 0 HG1 THR A 162 -19.372 5.745 -15.927 1.00 0.00 H new ATOM 0 HG21 THR A 162 -20.408 3.520 -18.133 1.00 0.00 H new ATOM 0 HG22 THR A 162 -18.880 2.683 -18.500 1.00 0.00 H new ATOM 0 HG23 THR A 162 -19.747 2.330 -16.986 1.00 0.00 H new ATOM 661 N GLU A 163 -17.394 4.295 -14.061 1.00 0.00 N ATOM 662 CA GLU A 163 -17.593 4.103 -12.630 1.00 0.00 C ATOM 663 C GLU A 163 -19.036 3.707 -12.339 1.00 0.00 C ATOM 664 O GLU A 163 -19.344 3.189 -11.265 1.00 0.00 O ATOM 665 CB GLU A 163 -17.252 5.391 -11.876 1.00 0.00 C ATOM 666 CG GLU A 163 -18.036 6.558 -12.482 1.00 0.00 C ATOM 667 CD GLU A 163 -17.741 7.839 -11.710 1.00 0.00 C ATOM 668 OE1 GLU A 163 -17.091 7.753 -10.681 1.00 0.00 O ATOM 669 OE2 GLU A 163 -18.171 8.890 -12.158 1.00 0.00 O ATOM 0 H GLU A 163 -17.048 5.218 -14.322 1.00 0.00 H new ATOM 0 HA GLU A 163 -16.934 3.302 -12.295 1.00 0.00 H new ATOM 0 HB2 GLU A 163 -17.498 5.283 -10.820 1.00 0.00 H new ATOM 0 HB3 GLU A 163 -16.182 5.588 -11.936 1.00 0.00 H new ATOM 0 HG2 GLU A 163 -17.765 6.684 -13.530 1.00 0.00 H new ATOM 0 HG3 GLU A 163 -19.104 6.344 -12.453 1.00 0.00 H new ATOM 676 N MET A 164 -19.917 3.953 -13.302 1.00 0.00 N ATOM 677 CA MET A 164 -21.327 3.619 -13.137 1.00 0.00 C ATOM 678 C MET A 164 -21.541 2.116 -13.282 1.00 0.00 C ATOM 679 O MET A 164 -22.400 1.534 -12.619 1.00 0.00 O ATOM 680 CB MET A 164 -22.166 4.359 -14.182 1.00 0.00 C ATOM 681 CG MET A 164 -22.146 5.858 -13.882 1.00 0.00 C ATOM 682 SD MET A 164 -23.163 6.730 -15.101 1.00 0.00 S ATOM 683 CE MET A 164 -21.957 6.723 -16.448 1.00 0.00 C ATOM 0 H MET A 164 -19.683 4.379 -14.199 1.00 0.00 H new ATOM 0 HA MET A 164 -21.639 3.925 -12.139 1.00 0.00 H new ATOM 0 HB2 MET A 164 -21.771 4.172 -15.180 1.00 0.00 H new ATOM 0 HB3 MET A 164 -23.191 3.988 -14.170 1.00 0.00 H new ATOM 0 HG2 MET A 164 -22.524 6.044 -12.877 1.00 0.00 H new ATOM 0 HG3 MET A 164 -21.123 6.232 -13.912 1.00 0.00 H new ATOM 0 HE1 MET A 164 -22.332 7.326 -17.275 1.00 0.00 H new ATOM 0 HE2 MET A 164 -21.014 7.138 -16.094 1.00 0.00 H new ATOM 0 HE3 MET A 164 -21.798 5.700 -16.789 1.00 0.00 H new ATOM 693 N GLU A 165 -20.752 1.493 -14.152 1.00 0.00 N ATOM 694 CA GLU A 165 -20.855 0.055 -14.368 1.00 0.00 C ATOM 695 C GLU A 165 -20.277 -0.706 -13.179 1.00 0.00 C ATOM 696 O GLU A 165 -20.794 -1.753 -12.787 1.00 0.00 O ATOM 697 CB GLU A 165 -20.103 -0.337 -15.641 1.00 0.00 C ATOM 698 CG GLU A 165 -20.294 -1.832 -15.909 1.00 0.00 C ATOM 699 CD GLU A 165 -19.612 -2.218 -17.217 1.00 0.00 C ATOM 700 OE1 GLU A 165 -18.890 -1.392 -17.753 1.00 0.00 O ATOM 701 OE2 GLU A 165 -19.824 -3.331 -17.667 1.00 0.00 O ATOM 0 H GLU A 165 -20.039 1.958 -14.715 1.00 0.00 H new ATOM 0 HA GLU A 165 -21.908 -0.204 -14.475 1.00 0.00 H new ATOM 0 HB2 GLU A 165 -20.471 0.244 -16.487 1.00 0.00 H new ATOM 0 HB3 GLU A 165 -19.043 -0.109 -15.534 1.00 0.00 H new ATOM 0 HG2 GLU A 165 -19.877 -2.414 -15.087 1.00 0.00 H new ATOM 0 HG3 GLU A 165 -21.357 -2.068 -15.960 1.00 0.00 H new ATOM 708 N LEU A 166 -19.200 -0.175 -12.609 1.00 0.00 N ATOM 709 CA LEU A 166 -18.561 -0.811 -11.462 1.00 0.00 C ATOM 710 C LEU A 166 -19.508 -0.832 -10.265 1.00 0.00 C ATOM 711 O LEU A 166 -19.576 -1.821 -9.533 1.00 0.00 O ATOM 712 CB LEU A 166 -17.282 -0.058 -11.091 1.00 0.00 C ATOM 713 CG LEU A 166 -16.512 -0.851 -10.035 1.00 0.00 C ATOM 714 CD1 LEU A 166 -16.055 -2.185 -10.628 1.00 0.00 C ATOM 715 CD2 LEU A 166 -15.286 -0.047 -9.591 1.00 0.00 C ATOM 0 H LEU A 166 -18.754 0.688 -12.920 1.00 0.00 H new ATOM 0 HA LEU A 166 -18.311 -1.837 -11.732 1.00 0.00 H new ATOM 0 HB2 LEU A 166 -16.663 0.086 -11.976 1.00 0.00 H new ATOM 0 HB3 LEU A 166 -17.528 0.933 -10.709 1.00 0.00 H new ATOM 0 HG LEU A 166 -17.159 -1.037 -9.178 1.00 0.00 H new ATOM 0 HD11 LEU A 166 -15.506 -2.749 -9.874 1.00 0.00 H new ATOM 0 HD12 LEU A 166 -16.925 -2.758 -10.948 1.00 0.00 H new ATOM 0 HD13 LEU A 166 -15.408 -1.999 -11.485 1.00 0.00 H new ATOM 0 HD21 LEU A 166 -14.735 -0.610 -8.838 1.00 0.00 H new ATOM 0 HD22 LEU A 166 -14.641 0.137 -10.450 1.00 0.00 H new ATOM 0 HD23 LEU A 166 -15.608 0.905 -9.169 1.00 0.00 H new ATOM 727 N LEU A 167 -20.234 0.263 -10.070 1.00 0.00 N ATOM 728 CA LEU A 167 -21.172 0.357 -8.956 1.00 0.00 C ATOM 729 C LEU A 167 -22.204 -0.764 -9.031 1.00 0.00 C ATOM 730 O LEU A 167 -22.663 -1.266 -8.005 1.00 0.00 O ATOM 731 CB LEU A 167 -21.884 1.711 -8.985 1.00 0.00 C ATOM 732 CG LEU A 167 -22.878 1.791 -7.825 1.00 0.00 C ATOM 733 CD1 LEU A 167 -22.132 1.615 -6.500 1.00 0.00 C ATOM 734 CD2 LEU A 167 -23.569 3.156 -7.841 1.00 0.00 C ATOM 0 H LEU A 167 -20.193 1.092 -10.663 1.00 0.00 H new ATOM 0 HA LEU A 167 -20.613 0.261 -8.025 1.00 0.00 H new ATOM 0 HB2 LEU A 167 -21.156 2.518 -8.910 1.00 0.00 H new ATOM 0 HB3 LEU A 167 -22.405 1.839 -9.934 1.00 0.00 H new ATOM 0 HG LEU A 167 -23.623 1.003 -7.930 1.00 0.00 H new ATOM 0 HD11 LEU A 167 -22.840 1.672 -5.673 1.00 0.00 H new ATOM 0 HD12 LEU A 167 -21.637 0.644 -6.487 1.00 0.00 H new ATOM 0 HD13 LEU A 167 -21.387 2.404 -6.394 1.00 0.00 H new ATOM 0 HD21 LEU A 167 -24.278 3.215 -7.015 1.00 0.00 H new ATOM 0 HD22 LEU A 167 -22.822 3.943 -7.735 1.00 0.00 H new ATOM 0 HD23 LEU A 167 -24.100 3.284 -8.784 1.00 0.00 H new ATOM 746 N GLU A 168 -22.560 -1.152 -10.250 1.00 0.00 N ATOM 747 CA GLU A 168 -23.537 -2.217 -10.446 1.00 0.00 C ATOM 748 C GLU A 168 -22.959 -3.559 -10.013 1.00 0.00 C ATOM 749 O GLU A 168 -23.646 -4.370 -9.390 1.00 0.00 O ATOM 750 CB GLU A 168 -23.944 -2.286 -11.921 1.00 0.00 C ATOM 751 CG GLU A 168 -24.675 -0.999 -12.310 1.00 0.00 C ATOM 752 CD GLU A 168 -26.018 -0.927 -11.592 1.00 0.00 C ATOM 753 OE1 GLU A 168 -26.498 -1.963 -11.164 1.00 0.00 O ATOM 754 OE2 GLU A 168 -26.549 0.166 -11.481 1.00 0.00 O ATOM 0 H GLU A 168 -22.191 -0.749 -11.111 1.00 0.00 H new ATOM 0 HA GLU A 168 -24.414 -1.998 -9.837 1.00 0.00 H new ATOM 0 HB2 GLU A 168 -23.062 -2.419 -12.547 1.00 0.00 H new ATOM 0 HB3 GLU A 168 -24.588 -3.148 -12.091 1.00 0.00 H new ATOM 0 HG2 GLU A 168 -24.067 -0.132 -12.050 1.00 0.00 H new ATOM 0 HG3 GLU A 168 -24.828 -0.969 -13.389 1.00 0.00 H new ATOM 761 N VAL A 169 -21.694 -3.787 -10.346 1.00 0.00 N ATOM 762 CA VAL A 169 -21.032 -5.037 -9.987 1.00 0.00 C ATOM 763 C VAL A 169 -20.893 -5.154 -8.473 1.00 0.00 C ATOM 764 O VAL A 169 -21.095 -6.225 -7.903 1.00 0.00 O ATOM 765 CB VAL A 169 -19.649 -5.099 -10.637 1.00 0.00 C ATOM 766 CG1 VAL A 169 -18.918 -6.356 -10.161 1.00 0.00 C ATOM 767 CG2 VAL A 169 -19.801 -5.145 -12.158 1.00 0.00 C ATOM 0 H VAL A 169 -21.109 -3.128 -10.860 1.00 0.00 H new ATOM 0 HA VAL A 169 -21.640 -5.867 -10.348 1.00 0.00 H new ATOM 0 HB VAL A 169 -19.076 -4.215 -10.355 1.00 0.00 H new ATOM 0 HG11 VAL A 169 -17.932 -6.401 -10.624 1.00 0.00 H new ATOM 0 HG12 VAL A 169 -18.809 -6.325 -9.077 1.00 0.00 H new ATOM 0 HG13 VAL A 169 -19.492 -7.239 -10.443 1.00 0.00 H new ATOM 0 HG21 VAL A 169 -18.815 -5.189 -12.621 1.00 0.00 H new ATOM 0 HG22 VAL A 169 -20.374 -6.028 -12.440 1.00 0.00 H new ATOM 0 HG23 VAL A 169 -20.322 -4.250 -12.499 1.00 0.00 H new ATOM 777 N SER A 170 -20.547 -4.046 -7.828 1.00 0.00 N ATOM 778 CA SER A 170 -20.372 -4.039 -6.380 1.00 0.00 C ATOM 779 C SER A 170 -21.658 -4.472 -5.683 1.00 0.00 C ATOM 780 O SER A 170 -21.627 -5.247 -4.726 1.00 0.00 O ATOM 781 CB SER A 170 -19.979 -2.640 -5.907 1.00 0.00 C ATOM 782 OG SER A 170 -18.805 -2.224 -6.592 1.00 0.00 O ATOM 0 H SER A 170 -20.383 -3.147 -8.281 1.00 0.00 H new ATOM 0 HA SER A 170 -19.579 -4.743 -6.126 1.00 0.00 H new ATOM 0 HB2 SER A 170 -20.792 -1.938 -6.096 1.00 0.00 H new ATOM 0 HB3 SER A 170 -19.804 -2.643 -4.831 1.00 0.00 H new ATOM 0 HG SER A 170 -19.036 -1.963 -7.508 1.00 0.00 H new ATOM 788 N GLN A 171 -22.787 -3.966 -6.168 1.00 0.00 N ATOM 789 CA GLN A 171 -24.078 -4.309 -5.584 1.00 0.00 C ATOM 790 C GLN A 171 -24.421 -5.767 -5.861 1.00 0.00 C ATOM 791 O GLN A 171 -25.030 -6.442 -5.031 1.00 0.00 O ATOM 792 CB GLN A 171 -25.170 -3.407 -6.162 1.00 0.00 C ATOM 793 CG GLN A 171 -24.968 -1.973 -5.662 1.00 0.00 C ATOM 794 CD GLN A 171 -26.047 -1.062 -6.237 1.00 0.00 C ATOM 795 OE1 GLN A 171 -27.224 -1.422 -6.246 1.00 0.00 O ATOM 796 NE2 GLN A 171 -25.714 0.102 -6.723 1.00 0.00 N ATOM 0 H GLN A 171 -22.835 -3.322 -6.958 1.00 0.00 H new ATOM 0 HA GLN A 171 -24.018 -4.160 -4.506 1.00 0.00 H new ATOM 0 HB2 GLN A 171 -25.137 -3.431 -7.251 1.00 0.00 H new ATOM 0 HB3 GLN A 171 -26.153 -3.772 -5.864 1.00 0.00 H new ATOM 0 HG2 GLN A 171 -25.004 -1.951 -4.573 1.00 0.00 H new ATOM 0 HG3 GLN A 171 -23.982 -1.613 -5.955 1.00 0.00 H new ATOM 0 HE21 GLN A 171 -24.738 0.398 -6.714 1.00 0.00 H new ATOM 0 HE22 GLN A 171 -26.430 0.716 -7.112 1.00 0.00 H new ATOM 805 N HIS A 172 -24.026 -6.249 -7.034 1.00 0.00 N ATOM 806 CA HIS A 172 -24.296 -7.632 -7.413 1.00 0.00 C ATOM 807 C HIS A 172 -23.696 -8.593 -6.393 1.00 0.00 C ATOM 808 O HIS A 172 -24.323 -9.579 -6.008 1.00 0.00 O ATOM 809 CB HIS A 172 -23.708 -7.922 -8.796 1.00 0.00 C ATOM 810 CG HIS A 172 -24.010 -9.341 -9.183 1.00 0.00 C ATOM 811 ND1 HIS A 172 -23.136 -10.383 -8.917 1.00 0.00 N ATOM 812 CD2 HIS A 172 -25.087 -9.909 -9.819 1.00 0.00 C ATOM 813 CE1 HIS A 172 -23.695 -11.513 -9.386 1.00 0.00 C ATOM 814 NE2 HIS A 172 -24.886 -11.281 -9.946 1.00 0.00 N ATOM 0 H HIS A 172 -23.521 -5.707 -7.735 1.00 0.00 H new ATOM 0 HA HIS A 172 -25.376 -7.776 -7.441 1.00 0.00 H new ATOM 0 HB2 HIS A 172 -24.128 -7.236 -9.532 1.00 0.00 H new ATOM 0 HB3 HIS A 172 -22.630 -7.758 -8.786 1.00 0.00 H new ATOM 0 HD2 HIS A 172 -25.957 -9.373 -10.168 1.00 0.00 H new ATOM 0 HE1 HIS A 172 -23.237 -12.489 -9.318 1.00 0.00 H new ATOM 0 HE2 HIS A 172 -25.513 -11.962 -10.374 1.00 0.00 H new ATOM 822 N VAL A 173 -22.477 -8.295 -5.956 1.00 0.00 N ATOM 823 CA VAL A 173 -21.799 -9.136 -4.974 1.00 0.00 C ATOM 824 C VAL A 173 -22.553 -9.121 -3.648 1.00 0.00 C ATOM 825 O VAL A 173 -22.735 -10.163 -3.017 1.00 0.00 O ATOM 826 CB VAL A 173 -20.369 -8.637 -4.758 1.00 0.00 C ATOM 827 CG1 VAL A 173 -19.697 -9.474 -3.669 1.00 0.00 C ATOM 828 CG2 VAL A 173 -19.583 -8.770 -6.063 1.00 0.00 C ATOM 0 H VAL A 173 -21.941 -7.484 -6.263 1.00 0.00 H new ATOM 0 HA VAL A 173 -21.772 -10.158 -5.352 1.00 0.00 H new ATOM 0 HB VAL A 173 -20.389 -7.591 -4.451 1.00 0.00 H new ATOM 0 HG11 VAL A 173 -18.678 -9.119 -3.514 1.00 0.00 H new ATOM 0 HG12 VAL A 173 -20.259 -9.381 -2.740 1.00 0.00 H new ATOM 0 HG13 VAL A 173 -19.675 -10.520 -3.976 1.00 0.00 H new ATOM 0 HG21 VAL A 173 -18.564 -8.415 -5.912 1.00 0.00 H new ATOM 0 HG22 VAL A 173 -19.561 -9.816 -6.370 1.00 0.00 H new ATOM 0 HG23 VAL A 173 -20.063 -8.174 -6.839 1.00 0.00 H new ATOM 925 N GLY A 179 -21.689 -12.901 -1.092 1.00 0.00 N ATOM 926 CA GLY A 179 -20.608 -13.830 -1.397 1.00 0.00 C ATOM 927 C GLY A 179 -19.284 -13.091 -1.563 1.00 0.00 C ATOM 928 O GLY A 179 -19.262 -11.883 -1.792 1.00 0.00 O ATOM 0 HA2 GLY A 179 -20.520 -14.566 -0.598 1.00 0.00 H new ATOM 0 HA3 GLY A 179 -20.840 -14.377 -2.311 1.00 0.00 H new ATOM 932 N PHE A 180 -18.183 -13.827 -1.447 1.00 0.00 N ATOM 933 CA PHE A 180 -16.860 -13.231 -1.590 1.00 0.00 C ATOM 934 C PHE A 180 -16.335 -13.429 -3.009 1.00 0.00 C ATOM 935 O PHE A 180 -17.026 -13.982 -3.865 1.00 0.00 O ATOM 936 CB PHE A 180 -15.889 -13.866 -0.592 1.00 0.00 C ATOM 937 CG PHE A 180 -15.944 -15.370 -0.725 1.00 0.00 C ATOM 938 CD1 PHE A 180 -16.884 -16.103 0.009 1.00 0.00 C ATOM 939 CD2 PHE A 180 -15.055 -16.029 -1.581 1.00 0.00 C ATOM 940 CE1 PHE A 180 -16.933 -17.498 -0.115 1.00 0.00 C ATOM 941 CE2 PHE A 180 -15.103 -17.423 -1.705 1.00 0.00 C ATOM 942 CZ PHE A 180 -16.044 -18.156 -0.972 1.00 0.00 C ATOM 0 H PHE A 180 -18.180 -14.829 -1.256 1.00 0.00 H new ATOM 0 HA PHE A 180 -16.940 -12.163 -1.389 1.00 0.00 H new ATOM 0 HB2 PHE A 180 -14.875 -13.510 -0.778 1.00 0.00 H new ATOM 0 HB3 PHE A 180 -16.150 -13.570 0.424 1.00 0.00 H new ATOM 0 HD1 PHE A 180 -17.570 -15.594 0.670 1.00 0.00 H new ATOM 0 HD2 PHE A 180 -14.331 -15.462 -2.147 1.00 0.00 H new ATOM 0 HE1 PHE A 180 -17.657 -18.065 0.451 1.00 0.00 H new ATOM 0 HE2 PHE A 180 -14.416 -17.932 -2.365 1.00 0.00 H new ATOM 0 HZ PHE A 180 -16.084 -19.231 -1.068 1.00 0.00 H new ATOM 952 N VAL A 181 -15.110 -12.974 -3.253 1.00 0.00 N ATOM 953 CA VAL A 181 -14.507 -13.105 -4.574 1.00 0.00 C ATOM 954 C VAL A 181 -13.052 -13.553 -4.458 1.00 0.00 C ATOM 955 O VAL A 181 -12.229 -12.867 -3.853 1.00 0.00 O ATOM 956 CB VAL A 181 -14.572 -11.767 -5.313 1.00 0.00 C ATOM 957 CG1 VAL A 181 -14.201 -11.976 -6.782 1.00 0.00 C ATOM 958 CG2 VAL A 181 -15.993 -11.204 -5.223 1.00 0.00 C ATOM 0 H VAL A 181 -14.520 -12.515 -2.559 1.00 0.00 H new ATOM 0 HA VAL A 181 -15.064 -13.857 -5.133 1.00 0.00 H new ATOM 0 HB VAL A 181 -13.872 -11.067 -4.857 1.00 0.00 H new ATOM 0 HG11 VAL A 181 -14.247 -11.023 -7.308 1.00 0.00 H new ATOM 0 HG12 VAL A 181 -13.190 -12.378 -6.848 1.00 0.00 H new ATOM 0 HG13 VAL A 181 -14.901 -12.676 -7.238 1.00 0.00 H new ATOM 0 HG21 VAL A 181 -16.041 -10.251 -5.749 1.00 0.00 H new ATOM 0 HG22 VAL A 181 -16.692 -11.905 -5.679 1.00 0.00 H new ATOM 0 HG23 VAL A 181 -16.260 -11.055 -4.177 1.00 0.00 H new ATOM 968 N ASP A 182 -12.746 -14.706 -5.044 1.00 0.00 N ATOM 969 CA ASP A 182 -11.386 -15.231 -5.012 1.00 0.00 C ATOM 970 C ASP A 182 -10.510 -14.507 -6.028 1.00 0.00 C ATOM 971 O ASP A 182 -11.000 -13.708 -6.828 1.00 0.00 O ATOM 972 CB ASP A 182 -11.395 -16.729 -5.319 1.00 0.00 C ATOM 973 CG ASP A 182 -10.008 -17.318 -5.088 1.00 0.00 C ATOM 974 OD1 ASP A 182 -9.205 -17.268 -6.006 1.00 0.00 O ATOM 975 OD2 ASP A 182 -9.770 -17.811 -3.999 1.00 0.00 O ATOM 0 H ASP A 182 -13.416 -15.291 -5.543 1.00 0.00 H new ATOM 0 HA ASP A 182 -10.978 -15.069 -4.014 1.00 0.00 H new ATOM 0 HB2 ASP A 182 -12.124 -17.234 -4.685 1.00 0.00 H new ATOM 0 HB3 ASP A 182 -11.702 -16.895 -6.352 1.00 0.00 H new ATOM 980 N PHE A 183 -9.211 -14.788 -5.993 1.00 0.00 N ATOM 981 CA PHE A 183 -8.278 -14.157 -6.917 1.00 0.00 C ATOM 982 C PHE A 183 -8.603 -14.549 -8.356 1.00 0.00 C ATOM 983 O PHE A 183 -8.312 -13.804 -9.293 1.00 0.00 O ATOM 984 CB PHE A 183 -6.844 -14.577 -6.584 1.00 0.00 C ATOM 985 CG PHE A 183 -5.903 -14.018 -7.624 1.00 0.00 C ATOM 986 CD1 PHE A 183 -5.781 -12.634 -7.787 1.00 0.00 C ATOM 987 CD2 PHE A 183 -5.153 -14.886 -8.427 1.00 0.00 C ATOM 988 CE1 PHE A 183 -4.909 -12.116 -8.751 1.00 0.00 C ATOM 989 CE2 PHE A 183 -4.279 -14.368 -9.390 1.00 0.00 C ATOM 990 CZ PHE A 183 -4.158 -12.984 -9.553 1.00 0.00 C ATOM 0 H PHE A 183 -8.784 -15.444 -5.339 1.00 0.00 H new ATOM 0 HA PHE A 183 -8.371 -13.076 -6.815 1.00 0.00 H new ATOM 0 HB2 PHE A 183 -6.567 -14.213 -5.594 1.00 0.00 H new ATOM 0 HB3 PHE A 183 -6.769 -15.664 -6.557 1.00 0.00 H new ATOM 0 HD1 PHE A 183 -6.360 -11.965 -7.168 1.00 0.00 H new ATOM 0 HD2 PHE A 183 -5.249 -15.955 -8.303 1.00 0.00 H new ATOM 0 HE1 PHE A 183 -4.815 -11.047 -8.876 1.00 0.00 H new ATOM 0 HE2 PHE A 183 -3.698 -15.037 -10.007 1.00 0.00 H new ATOM 0 HZ PHE A 183 -3.485 -12.585 -10.298 1.00 0.00 H new ATOM 1000 N GLU A 184 -9.204 -15.722 -8.525 1.00 0.00 N ATOM 1001 CA GLU A 184 -9.558 -16.204 -9.856 1.00 0.00 C ATOM 1002 C GLU A 184 -10.898 -15.621 -10.297 1.00 0.00 C ATOM 1003 O GLU A 184 -11.123 -15.389 -11.485 1.00 0.00 O ATOM 1004 CB GLU A 184 -9.638 -17.731 -9.854 1.00 0.00 C ATOM 1005 CG GLU A 184 -8.292 -18.312 -9.418 1.00 0.00 C ATOM 1006 CD GLU A 184 -7.220 -17.984 -10.451 1.00 0.00 C ATOM 1007 OE1 GLU A 184 -7.584 -17.668 -11.572 1.00 0.00 O ATOM 1008 OE2 GLU A 184 -6.052 -18.052 -10.106 1.00 0.00 O ATOM 0 H GLU A 184 -9.455 -16.353 -7.764 1.00 0.00 H new ATOM 0 HA GLU A 184 -8.787 -15.883 -10.556 1.00 0.00 H new ATOM 0 HB2 GLU A 184 -10.426 -18.064 -9.178 1.00 0.00 H new ATOM 0 HB3 GLU A 184 -9.897 -18.093 -10.849 1.00 0.00 H new ATOM 0 HG2 GLU A 184 -8.009 -17.905 -8.447 1.00 0.00 H new ATOM 0 HG3 GLU A 184 -8.375 -19.392 -9.299 1.00 0.00 H new ATOM 1015 N GLU A 185 -11.782 -15.388 -9.333 1.00 0.00 N ATOM 1016 CA GLU A 185 -13.096 -14.828 -9.634 1.00 0.00 C ATOM 1017 C GLU A 185 -12.982 -13.346 -9.970 1.00 0.00 C ATOM 1018 O GLU A 185 -13.611 -12.862 -10.910 1.00 0.00 O ATOM 1019 CB GLU A 185 -14.028 -15.013 -8.435 1.00 0.00 C ATOM 1020 CG GLU A 185 -14.254 -16.505 -8.187 1.00 0.00 C ATOM 1021 CD GLU A 185 -15.082 -17.103 -9.318 1.00 0.00 C ATOM 1022 OE1 GLU A 185 -15.582 -16.339 -10.128 1.00 0.00 O ATOM 1023 OE2 GLU A 185 -15.204 -18.316 -9.359 1.00 0.00 O ATOM 0 H GLU A 185 -11.616 -15.576 -8.344 1.00 0.00 H new ATOM 0 HA GLU A 185 -13.506 -15.353 -10.497 1.00 0.00 H new ATOM 0 HB2 GLU A 185 -13.595 -14.548 -7.549 1.00 0.00 H new ATOM 0 HB3 GLU A 185 -14.980 -14.517 -8.622 1.00 0.00 H new ATOM 0 HG2 GLU A 185 -13.296 -17.019 -8.116 1.00 0.00 H new ATOM 0 HG3 GLU A 185 -14.765 -16.650 -7.235 1.00 0.00 H new ATOM 1030 N PHE A 186 -12.177 -12.629 -9.193 1.00 0.00 N ATOM 1031 CA PHE A 186 -11.972 -11.205 -9.427 1.00 0.00 C ATOM 1032 C PHE A 186 -11.322 -10.970 -10.788 1.00 0.00 C ATOM 1033 O PHE A 186 -11.726 -10.080 -11.535 1.00 0.00 O ATOM 1034 CB PHE A 186 -11.086 -10.617 -8.327 1.00 0.00 C ATOM 1035 CG PHE A 186 -10.385 -9.385 -8.849 1.00 0.00 C ATOM 1036 CD1 PHE A 186 -11.113 -8.215 -9.095 1.00 0.00 C ATOM 1037 CD2 PHE A 186 -9.005 -9.414 -9.087 1.00 0.00 C ATOM 1038 CE1 PHE A 186 -10.462 -7.074 -9.579 1.00 0.00 C ATOM 1039 CE2 PHE A 186 -8.353 -8.273 -9.570 1.00 0.00 C ATOM 1040 CZ PHE A 186 -9.083 -7.102 -9.816 1.00 0.00 C ATOM 0 H PHE A 186 -11.659 -13.008 -8.400 1.00 0.00 H new ATOM 0 HA PHE A 186 -12.944 -10.712 -9.413 1.00 0.00 H new ATOM 0 HB2 PHE A 186 -11.690 -10.363 -7.456 1.00 0.00 H new ATOM 0 HB3 PHE A 186 -10.353 -11.355 -8.002 1.00 0.00 H new ATOM 0 HD1 PHE A 186 -12.177 -8.193 -8.911 1.00 0.00 H new ATOM 0 HD2 PHE A 186 -8.444 -10.317 -8.898 1.00 0.00 H new ATOM 0 HE1 PHE A 186 -11.024 -6.172 -9.770 1.00 0.00 H new ATOM 0 HE2 PHE A 186 -7.289 -8.295 -9.753 1.00 0.00 H new ATOM 0 HZ PHE A 186 -8.581 -6.221 -10.189 1.00 0.00 H new ATOM 1050 N VAL A 187 -10.310 -11.775 -11.100 1.00 0.00 N ATOM 1051 CA VAL A 187 -9.615 -11.650 -12.376 1.00 0.00 C ATOM 1052 C VAL A 187 -10.540 -12.024 -13.530 1.00 0.00 C ATOM 1053 O VAL A 187 -10.596 -11.327 -14.543 1.00 0.00 O ATOM 1054 CB VAL A 187 -8.385 -12.561 -12.391 1.00 0.00 C ATOM 1055 CG1 VAL A 187 -7.806 -12.613 -13.805 1.00 0.00 C ATOM 1056 CG2 VAL A 187 -7.331 -12.006 -11.428 1.00 0.00 C ATOM 0 H VAL A 187 -9.956 -12.514 -10.493 1.00 0.00 H new ATOM 0 HA VAL A 187 -9.302 -10.613 -12.498 1.00 0.00 H new ATOM 0 HB VAL A 187 -8.671 -13.566 -12.079 1.00 0.00 H new ATOM 0 HG11 VAL A 187 -6.930 -13.262 -13.816 1.00 0.00 H new ATOM 0 HG12 VAL A 187 -8.557 -13.005 -14.491 1.00 0.00 H new ATOM 0 HG13 VAL A 187 -7.518 -11.609 -14.117 1.00 0.00 H new ATOM 0 HG21 VAL A 187 -6.454 -12.653 -11.437 1.00 0.00 H new ATOM 0 HG22 VAL A 187 -7.045 -11.002 -11.741 1.00 0.00 H new ATOM 0 HG23 VAL A 187 -7.744 -11.968 -10.420 1.00 0.00 H new ATOM 1066 N GLU A 188 -11.260 -13.129 -13.371 1.00 0.00 N ATOM 1067 CA GLU A 188 -12.174 -13.590 -14.412 1.00 0.00 C ATOM 1068 C GLU A 188 -12.909 -12.414 -15.043 1.00 0.00 C ATOM 1069 O GLU A 188 -13.140 -12.391 -16.253 1.00 0.00 O ATOM 1070 CB GLU A 188 -13.189 -14.570 -13.818 1.00 0.00 C ATOM 1071 CG GLU A 188 -14.045 -15.159 -14.940 1.00 0.00 C ATOM 1072 CD GLU A 188 -13.211 -16.120 -15.782 1.00 0.00 C ATOM 1073 OE1 GLU A 188 -12.082 -16.382 -15.402 1.00 0.00 O ATOM 1074 OE2 GLU A 188 -13.714 -16.578 -16.795 1.00 0.00 O ATOM 0 H GLU A 188 -11.230 -13.718 -12.539 1.00 0.00 H new ATOM 0 HA GLU A 188 -11.591 -14.093 -15.183 1.00 0.00 H new ATOM 0 HB2 GLU A 188 -12.672 -15.367 -13.284 1.00 0.00 H new ATOM 0 HB3 GLU A 188 -13.822 -14.059 -13.093 1.00 0.00 H new ATOM 0 HG2 GLU A 188 -14.903 -15.683 -14.518 1.00 0.00 H new ATOM 0 HG3 GLU A 188 -14.437 -14.359 -15.568 1.00 0.00 H new ATOM 1081 N LEU A 189 -13.275 -11.438 -14.218 1.00 0.00 N ATOM 1082 CA LEU A 189 -13.988 -10.263 -14.709 1.00 0.00 C ATOM 1083 C LEU A 189 -13.138 -9.503 -15.722 1.00 0.00 C ATOM 1084 O LEU A 189 -13.637 -9.056 -16.755 1.00 0.00 O ATOM 1085 CB LEU A 189 -14.338 -9.340 -13.540 1.00 0.00 C ATOM 1086 CG LEU A 189 -15.687 -9.753 -12.951 1.00 0.00 C ATOM 1087 CD1 LEU A 189 -15.746 -9.349 -11.477 1.00 0.00 C ATOM 1088 CD2 LEU A 189 -16.814 -9.053 -13.717 1.00 0.00 C ATOM 0 H LEU A 189 -13.092 -11.436 -13.215 1.00 0.00 H new ATOM 0 HA LEU A 189 -14.904 -10.595 -15.198 1.00 0.00 H new ATOM 0 HB2 LEU A 189 -13.563 -9.394 -12.775 1.00 0.00 H new ATOM 0 HB3 LEU A 189 -14.379 -8.305 -13.879 1.00 0.00 H new ATOM 0 HG LEU A 189 -15.805 -10.833 -13.036 1.00 0.00 H new ATOM 0 HD11 LEU A 189 -16.708 -9.644 -11.057 1.00 0.00 H new ATOM 0 HD12 LEU A 189 -14.944 -9.846 -10.931 1.00 0.00 H new ATOM 0 HD13 LEU A 189 -15.628 -8.269 -11.391 1.00 0.00 H new ATOM 0 HD21 LEU A 189 -17.776 -9.347 -13.298 1.00 0.00 H new ATOM 0 HD22 LEU A 189 -16.696 -7.973 -13.632 1.00 0.00 H new ATOM 0 HD23 LEU A 189 -16.773 -9.340 -14.768 1.00 0.00 H new ATOM 1100 N ILE A 190 -11.852 -9.358 -15.419 1.00 0.00 N ATOM 1101 CA ILE A 190 -10.946 -8.634 -16.305 1.00 0.00 C ATOM 1102 C ILE A 190 -10.384 -9.562 -17.376 1.00 0.00 C ATOM 1103 O ILE A 190 -10.088 -9.132 -18.491 1.00 0.00 O ATOM 1104 CB ILE A 190 -9.796 -8.032 -15.495 1.00 0.00 C ATOM 1105 CG1 ILE A 190 -10.359 -7.038 -14.477 1.00 0.00 C ATOM 1106 CG2 ILE A 190 -8.835 -7.305 -16.438 1.00 0.00 C ATOM 1107 CD1 ILE A 190 -10.602 -7.753 -13.146 1.00 0.00 C ATOM 0 H ILE A 190 -11.416 -9.728 -14.574 1.00 0.00 H new ATOM 0 HA ILE A 190 -11.506 -7.836 -16.792 1.00 0.00 H new ATOM 0 HB ILE A 190 -9.262 -8.826 -14.973 1.00 0.00 H new ATOM 0 HG12 ILE A 190 -9.662 -6.212 -14.336 1.00 0.00 H new ATOM 0 HG13 ILE A 190 -11.291 -6.610 -14.847 1.00 0.00 H new ATOM 0 HG21 ILE A 190 -8.015 -6.876 -15.862 1.00 0.00 H new ATOM 0 HG22 ILE A 190 -8.436 -8.011 -17.166 1.00 0.00 H new ATOM 0 HG23 ILE A 190 -9.368 -6.510 -16.959 1.00 0.00 H new ATOM 0 HD11 ILE A 190 -11.003 -7.045 -12.421 1.00 0.00 H new ATOM 0 HD12 ILE A 190 -11.315 -8.564 -13.294 1.00 0.00 H new ATOM 0 HD13 ILE A 190 -9.661 -8.160 -12.774 1.00 0.00 H new ATOM 1119 N SER A 191 -10.241 -10.838 -17.032 1.00 0.00 N ATOM 1120 CA SER A 191 -9.710 -11.818 -17.972 1.00 0.00 C ATOM 1121 C SER A 191 -10.818 -12.342 -18.882 1.00 0.00 C ATOM 1122 O SER A 191 -10.904 -11.876 -20.007 1.00 0.00 O ATOM 1123 CB SER A 191 -9.077 -12.983 -17.212 1.00 0.00 C ATOM 1124 OG SER A 191 -7.866 -12.549 -16.612 1.00 0.00 O ATOM 0 H SER A 191 -10.484 -11.215 -16.116 1.00 0.00 H new ATOM 0 HA SER A 191 -8.951 -11.331 -18.585 1.00 0.00 H new ATOM 0 HB2 SER A 191 -9.763 -13.350 -16.449 1.00 0.00 H new ATOM 0 HB3 SER A 191 -8.883 -13.813 -17.892 1.00 0.00 H new ATOM 0 HG SER A 191 -7.307 -13.327 -16.403 1.00 0.00 H new