USER MOD reduce.3.24.130724 H: found=0, std=0, add=466, rem=0, adj=10 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 170 SER OG : rot -84:sc= 1.09 USER MOD Set 1.2: A 171 GLN : amide:sc= -6.12! C(o=-5!,f=-11!) USER MOD Single : A 131 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 139 THR OG1 : rot 180:sc= 0 USER MOD Single : A 141 GLN : amide:sc= 0 K(o=0,f=-1.4!) 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 81:sc= -2.08! USER MOD Single : A 154 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 156 THR OG1 : rot 180:sc= 0 USER MOD Single : A 159 TYR OH : rot 180:sc= 0 USER MOD Single : A 160 MET CE :methyl -147:sc= -0.0503 (180deg=-0.968) USER MOD Single : A 162 THR OG1 : rot 180:sc= 0 USER MOD Single : A 164 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 172 HIS : no HD1:sc= -0.219 K(o=-0.22,f=-1.1) USER MOD Single : A 191 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 58 N GLY A 123 -0.711 -10.389 -21.408 1.00 0.00 N ATOM 59 CA GLY A 123 0.482 -11.227 -21.454 1.00 0.00 C ATOM 60 C GLY A 123 0.780 -11.823 -20.083 1.00 0.00 C ATOM 61 O GLY A 123 0.124 -11.490 -19.095 1.00 0.00 O ATOM 0 HA2 GLY A 123 0.341 -12.027 -22.180 1.00 0.00 H new ATOM 0 HA3 GLY A 123 1.334 -10.636 -21.791 1.00 0.00 H new ATOM 65 N PRO A 124 1.753 -12.691 -20.011 1.00 0.00 N ATOM 66 CA PRO A 124 2.152 -13.353 -18.732 1.00 0.00 C ATOM 67 C PRO A 124 2.576 -12.331 -17.676 1.00 0.00 C ATOM 68 O PRO A 124 2.403 -12.555 -16.477 1.00 0.00 O ATOM 69 CB PRO A 124 3.331 -14.264 -19.142 1.00 0.00 C ATOM 70 CG PRO A 124 3.810 -13.726 -20.454 1.00 0.00 C ATOM 71 CD PRO A 124 2.581 -13.141 -21.139 1.00 0.00 C ATOM 0 HA PRO A 124 1.332 -13.906 -18.275 1.00 0.00 H new ATOM 0 HB2 PRO A 124 4.124 -14.241 -18.395 1.00 0.00 H new ATOM 0 HB3 PRO A 124 3.012 -15.302 -19.236 1.00 0.00 H new ATOM 0 HG2 PRO A 124 4.575 -12.964 -20.308 1.00 0.00 H new ATOM 0 HG3 PRO A 124 4.257 -14.514 -21.060 1.00 0.00 H new ATOM 0 HD2 PRO A 124 2.843 -12.316 -21.801 1.00 0.00 H new ATOM 0 HD3 PRO A 124 2.065 -13.885 -21.746 1.00 0.00 H new ATOM 79 N GLU A 125 3.123 -11.212 -18.131 1.00 0.00 N ATOM 80 CA GLU A 125 3.558 -10.165 -17.216 1.00 0.00 C ATOM 81 C GLU A 125 2.357 -9.546 -16.514 1.00 0.00 C ATOM 82 O GLU A 125 2.379 -9.316 -15.305 1.00 0.00 O ATOM 83 CB GLU A 125 4.322 -9.086 -17.987 1.00 0.00 C ATOM 84 CG GLU A 125 5.614 -9.680 -18.560 1.00 0.00 C ATOM 85 CD GLU A 125 6.566 -10.049 -17.428 1.00 0.00 C ATOM 86 OE1 GLU A 125 6.398 -9.521 -16.341 1.00 0.00 O ATOM 87 OE2 GLU A 125 7.452 -10.854 -17.666 1.00 0.00 O ATOM 0 H GLU A 125 3.275 -11.007 -19.118 1.00 0.00 H new ATOM 0 HA GLU A 125 4.216 -10.604 -16.466 1.00 0.00 H new ATOM 0 HB2 GLU A 125 3.702 -8.693 -18.793 1.00 0.00 H new ATOM 0 HB3 GLU A 125 4.555 -8.250 -17.328 1.00 0.00 H new ATOM 0 HG2 GLU A 125 5.385 -10.564 -19.156 1.00 0.00 H new ATOM 0 HG3 GLU A 125 6.090 -8.961 -19.227 1.00 0.00 H new ATOM 94 N GLU A 126 1.307 -9.284 -17.282 1.00 0.00 N ATOM 95 CA GLU A 126 0.098 -8.696 -16.723 1.00 0.00 C ATOM 96 C GLU A 126 -0.580 -9.689 -15.793 1.00 0.00 C ATOM 97 O GLU A 126 -0.959 -9.350 -14.672 1.00 0.00 O ATOM 98 CB GLU A 126 -0.865 -8.298 -17.846 1.00 0.00 C ATOM 99 CG GLU A 126 -0.212 -7.222 -18.717 1.00 0.00 C ATOM 100 CD GLU A 126 -0.013 -5.944 -17.910 1.00 0.00 C ATOM 101 OE1 GLU A 126 -0.673 -5.800 -16.895 1.00 0.00 O ATOM 102 OE2 GLU A 126 0.794 -5.127 -18.321 1.00 0.00 O ATOM 0 H GLU A 126 1.268 -9.468 -18.285 1.00 0.00 H new ATOM 0 HA GLU A 126 0.371 -7.805 -16.158 1.00 0.00 H new ATOM 0 HB2 GLU A 126 -1.115 -9.169 -18.451 1.00 0.00 H new ATOM 0 HB3 GLU A 126 -1.798 -7.924 -17.425 1.00 0.00 H new ATOM 0 HG2 GLU A 126 0.748 -7.579 -19.090 1.00 0.00 H new ATOM 0 HG3 GLU A 126 -0.837 -7.019 -19.587 1.00 0.00 H new ATOM 109 N LEU A 127 -0.752 -10.911 -16.273 1.00 0.00 N ATOM 110 CA LEU A 127 -1.414 -11.933 -15.479 1.00 0.00 C ATOM 111 C LEU A 127 -0.684 -12.102 -14.153 1.00 0.00 C ATOM 112 O LEU A 127 -1.300 -12.160 -13.090 1.00 0.00 O ATOM 113 CB LEU A 127 -1.416 -13.270 -16.253 1.00 0.00 C ATOM 114 CG LEU A 127 -2.633 -14.122 -15.851 1.00 0.00 C ATOM 115 CD1 LEU A 127 -2.648 -14.322 -14.329 1.00 0.00 C ATOM 116 CD2 LEU A 127 -3.942 -13.425 -16.309 1.00 0.00 C ATOM 0 H LEU A 127 -0.446 -11.216 -17.197 1.00 0.00 H new ATOM 0 HA LEU A 127 -2.443 -11.632 -15.284 1.00 0.00 H new ATOM 0 HB2 LEU A 127 -1.438 -13.076 -17.325 1.00 0.00 H new ATOM 0 HB3 LEU A 127 -0.497 -13.818 -16.047 1.00 0.00 H new ATOM 0 HG LEU A 127 -2.563 -15.095 -16.337 1.00 0.00 H new ATOM 0 HD11 LEU A 127 -3.512 -14.926 -14.050 1.00 0.00 H new ATOM 0 HD12 LEU A 127 -1.735 -14.830 -14.020 1.00 0.00 H new ATOM 0 HD13 LEU A 127 -2.708 -13.352 -13.835 1.00 0.00 H new ATOM 0 HD21 LEU A 127 -4.799 -14.034 -16.021 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -4.018 -12.446 -15.836 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -3.930 -13.305 -17.392 1.00 0.00 H new ATOM 128 N GLU A 128 0.634 -12.168 -14.219 1.00 0.00 N ATOM 129 CA GLU A 128 1.432 -12.323 -13.016 1.00 0.00 C ATOM 130 C GLU A 128 1.307 -11.086 -12.136 1.00 0.00 C ATOM 131 O GLU A 128 1.315 -11.180 -10.909 1.00 0.00 O ATOM 132 CB GLU A 128 2.896 -12.550 -13.389 1.00 0.00 C ATOM 133 CG GLU A 128 3.702 -12.847 -12.125 1.00 0.00 C ATOM 134 CD GLU A 128 5.145 -13.169 -12.493 1.00 0.00 C ATOM 135 OE1 GLU A 128 5.509 -12.940 -13.634 1.00 0.00 O ATOM 136 OE2 GLU A 128 5.866 -13.641 -11.628 1.00 0.00 O ATOM 0 H GLU A 128 1.171 -12.117 -15.085 1.00 0.00 H new ATOM 0 HA GLU A 128 1.066 -13.187 -12.461 1.00 0.00 H new ATOM 0 HB2 GLU A 128 2.979 -13.380 -14.090 1.00 0.00 H new ATOM 0 HB3 GLU A 128 3.296 -11.668 -13.890 1.00 0.00 H new ATOM 0 HG2 GLU A 128 3.672 -11.989 -11.454 1.00 0.00 H new ATOM 0 HG3 GLU A 128 3.258 -13.686 -11.589 1.00 0.00 H new ATOM 143 N GLU A 129 1.190 -9.925 -12.773 1.00 0.00 N ATOM 144 CA GLU A 129 1.065 -8.673 -12.038 1.00 0.00 C ATOM 145 C GLU A 129 -0.181 -8.704 -11.160 1.00 0.00 C ATOM 146 O GLU A 129 -0.179 -8.186 -10.043 1.00 0.00 O ATOM 147 CB GLU A 129 0.976 -7.498 -13.016 1.00 0.00 C ATOM 148 CG GLU A 129 1.074 -6.175 -12.248 1.00 0.00 C ATOM 149 CD GLU A 129 2.494 -5.982 -11.730 1.00 0.00 C ATOM 150 OE1 GLU A 129 3.351 -6.769 -12.099 1.00 0.00 O ATOM 151 OE2 GLU A 129 2.706 -5.049 -10.972 1.00 0.00 O ATOM 0 H GLU A 129 1.179 -9.826 -13.788 1.00 0.00 H new ATOM 0 HA GLU A 129 1.944 -8.548 -11.406 1.00 0.00 H new ATOM 0 HB2 GLU A 129 1.778 -7.563 -13.751 1.00 0.00 H new ATOM 0 HB3 GLU A 129 0.036 -7.541 -13.566 1.00 0.00 H new ATOM 0 HG2 GLU A 129 0.799 -5.345 -12.899 1.00 0.00 H new ATOM 0 HG3 GLU A 129 0.370 -6.174 -11.416 1.00 0.00 H new ATOM 158 N LEU A 130 -1.241 -9.318 -11.671 1.00 0.00 N ATOM 159 CA LEU A 130 -2.488 -9.415 -10.922 1.00 0.00 C ATOM 160 C LEU A 130 -2.282 -10.222 -9.648 1.00 0.00 C ATOM 161 O LEU A 130 -2.792 -9.865 -8.586 1.00 0.00 O ATOM 162 CB LEU A 130 -3.563 -10.081 -11.783 1.00 0.00 C ATOM 163 CG LEU A 130 -3.976 -9.136 -12.922 1.00 0.00 C ATOM 164 CD1 LEU A 130 -4.859 -9.896 -13.918 1.00 0.00 C ATOM 165 CD2 LEU A 130 -4.750 -7.923 -12.361 1.00 0.00 C ATOM 0 H LEU A 130 -1.263 -9.753 -12.593 1.00 0.00 H new ATOM 0 HA LEU A 130 -2.810 -8.409 -10.654 1.00 0.00 H new ATOM 0 HB2 LEU A 130 -3.185 -11.017 -12.194 1.00 0.00 H new ATOM 0 HB3 LEU A 130 -4.430 -10.329 -11.171 1.00 0.00 H new ATOM 0 HG LEU A 130 -3.080 -8.775 -13.426 1.00 0.00 H new ATOM 0 HD11 LEU A 130 -5.153 -9.228 -14.727 1.00 0.00 H new ATOM 0 HD12 LEU A 130 -4.303 -10.739 -14.328 1.00 0.00 H new ATOM 0 HD13 LEU A 130 -5.750 -10.263 -13.408 1.00 0.00 H new ATOM 0 HD21 LEU A 130 -5.036 -7.263 -13.180 1.00 0.00 H new ATOM 0 HD22 LEU A 130 -5.646 -8.270 -11.845 1.00 0.00 H new ATOM 0 HD23 LEU A 130 -4.116 -7.379 -11.661 1.00 0.00 H new ATOM 177 N GLN A 131 -1.531 -11.310 -9.761 1.00 0.00 N ATOM 178 CA GLN A 131 -1.263 -12.158 -8.607 1.00 0.00 C ATOM 179 C GLN A 131 -0.485 -11.385 -7.552 1.00 0.00 C ATOM 180 O GLN A 131 -0.783 -11.468 -6.360 1.00 0.00 O ATOM 181 CB GLN A 131 -0.465 -13.391 -9.039 1.00 0.00 C ATOM 182 CG GLN A 131 -0.267 -14.322 -7.843 1.00 0.00 C ATOM 183 CD GLN A 131 0.497 -15.568 -8.272 1.00 0.00 C ATOM 184 OE1 GLN A 131 1.625 -15.472 -8.754 1.00 0.00 O ATOM 185 NE2 GLN A 131 -0.055 -16.741 -8.120 1.00 0.00 N ATOM 0 H GLN A 131 -1.100 -11.624 -10.631 1.00 0.00 H new ATOM 0 HA GLN A 131 -2.214 -12.477 -8.180 1.00 0.00 H new ATOM 0 HB2 GLN A 131 -0.991 -13.915 -9.837 1.00 0.00 H new ATOM 0 HB3 GLN A 131 0.502 -13.088 -9.440 1.00 0.00 H new ATOM 0 HG2 GLN A 131 0.280 -13.804 -7.055 1.00 0.00 H new ATOM 0 HG3 GLN A 131 -1.234 -14.604 -7.427 1.00 0.00 H new ATOM 0 HE21 GLN A 131 -0.990 -16.817 -7.720 1.00 0.00 H new ATOM 0 HE22 GLN A 131 0.449 -17.582 -8.401 1.00 0.00 H new ATOM 194 N ALA A 132 0.511 -10.634 -7.996 1.00 0.00 N ATOM 195 CA ALA A 132 1.327 -9.848 -7.081 1.00 0.00 C ATOM 196 C ALA A 132 0.468 -8.815 -6.368 1.00 0.00 C ATOM 197 O ALA A 132 0.677 -8.523 -5.192 1.00 0.00 O ATOM 198 CB ALA A 132 2.450 -9.146 -7.847 1.00 0.00 C ATOM 0 H ALA A 132 0.773 -10.552 -8.978 1.00 0.00 H new ATOM 0 HA ALA A 132 1.765 -10.518 -6.341 1.00 0.00 H new ATOM 0 HB1 ALA A 132 3.054 -8.561 -7.153 1.00 0.00 H new ATOM 0 HB2 ALA A 132 3.078 -9.891 -8.336 1.00 0.00 H new ATOM 0 HB3 ALA A 132 2.019 -8.485 -8.599 1.00 0.00 H new ATOM 204 N ALA A 133 -0.505 -8.267 -7.084 1.00 0.00 N ATOM 205 CA ALA A 133 -1.395 -7.273 -6.501 1.00 0.00 C ATOM 206 C ALA A 133 -2.288 -7.910 -5.445 1.00 0.00 C ATOM 207 O ALA A 133 -2.452 -7.374 -4.350 1.00 0.00 O ATOM 208 CB ALA A 133 -2.262 -6.647 -7.594 1.00 0.00 C ATOM 0 H ALA A 133 -0.697 -8.491 -8.060 1.00 0.00 H new ATOM 0 HA ALA A 133 -0.789 -6.500 -6.030 1.00 0.00 H new ATOM 0 HB1 ALA A 133 -2.926 -5.904 -7.151 1.00 0.00 H new ATOM 0 HB2 ALA A 133 -1.623 -6.167 -8.335 1.00 0.00 H new ATOM 0 HB3 ALA A 133 -2.856 -7.423 -8.076 1.00 0.00 H new ATOM 214 N PHE A 134 -2.858 -9.062 -5.781 1.00 0.00 N ATOM 215 CA PHE A 134 -3.734 -9.764 -4.852 1.00 0.00 C ATOM 216 C PHE A 134 -2.998 -10.069 -3.554 1.00 0.00 C ATOM 217 O PHE A 134 -3.614 -10.231 -2.500 1.00 0.00 O ATOM 218 CB PHE A 134 -4.227 -11.071 -5.483 1.00 0.00 C ATOM 219 CG PHE A 134 -5.446 -11.571 -4.739 1.00 0.00 C ATOM 220 CD1 PHE A 134 -6.708 -11.048 -5.042 1.00 0.00 C ATOM 221 CD2 PHE A 134 -5.314 -12.553 -3.750 1.00 0.00 C ATOM 222 CE1 PHE A 134 -7.839 -11.505 -4.357 1.00 0.00 C ATOM 223 CE2 PHE A 134 -6.445 -13.011 -3.064 1.00 0.00 C ATOM 224 CZ PHE A 134 -7.709 -12.487 -3.369 1.00 0.00 C ATOM 0 H PHE A 134 -2.731 -9.525 -6.681 1.00 0.00 H new ATOM 0 HA PHE A 134 -4.588 -9.124 -4.631 1.00 0.00 H new ATOM 0 HB2 PHE A 134 -4.471 -10.909 -6.533 1.00 0.00 H new ATOM 0 HB3 PHE A 134 -3.437 -11.821 -5.451 1.00 0.00 H new ATOM 0 HD1 PHE A 134 -6.809 -10.291 -5.805 1.00 0.00 H new ATOM 0 HD2 PHE A 134 -4.340 -12.957 -3.516 1.00 0.00 H new ATOM 0 HE1 PHE A 134 -8.812 -11.100 -4.591 1.00 0.00 H new ATOM 0 HE2 PHE A 134 -6.344 -13.768 -2.300 1.00 0.00 H new ATOM 0 HZ PHE A 134 -8.582 -12.841 -2.841 1.00 0.00 H new ATOM 234 N GLU A 135 -1.675 -10.146 -3.639 1.00 0.00 N ATOM 235 CA GLU A 135 -0.863 -10.433 -2.465 1.00 0.00 C ATOM 236 C GLU A 135 -0.949 -9.284 -1.468 1.00 0.00 C ATOM 237 O GLU A 135 -1.014 -9.503 -0.258 1.00 0.00 O ATOM 238 CB GLU A 135 0.596 -10.644 -2.879 1.00 0.00 C ATOM 239 CG GLU A 135 1.402 -11.174 -1.688 1.00 0.00 C ATOM 240 CD GLU A 135 0.998 -12.613 -1.388 1.00 0.00 C ATOM 241 OE1 GLU A 135 0.237 -13.168 -2.165 1.00 0.00 O ATOM 242 OE2 GLU A 135 1.454 -13.139 -0.387 1.00 0.00 O ATOM 0 H GLU A 135 -1.146 -10.015 -4.501 1.00 0.00 H new ATOM 0 HA GLU A 135 -1.241 -11.340 -1.994 1.00 0.00 H new ATOM 0 HB2 GLU A 135 0.650 -11.349 -3.709 1.00 0.00 H new ATOM 0 HB3 GLU A 135 1.023 -9.705 -3.230 1.00 0.00 H new ATOM 0 HG2 GLU A 135 2.468 -11.125 -1.908 1.00 0.00 H new ATOM 0 HG3 GLU A 135 1.228 -10.548 -0.813 1.00 0.00 H new ATOM 249 N GLU A 136 -0.954 -8.056 -1.980 1.00 0.00 N ATOM 250 CA GLU A 136 -1.039 -6.882 -1.122 1.00 0.00 C ATOM 251 C GLU A 136 -2.439 -6.749 -0.534 1.00 0.00 C ATOM 252 O GLU A 136 -2.606 -6.464 0.652 1.00 0.00 O ATOM 253 CB GLU A 136 -0.691 -5.626 -1.925 1.00 0.00 C ATOM 254 CG GLU A 136 0.763 -5.707 -2.399 1.00 0.00 C ATOM 255 CD GLU A 136 1.709 -5.675 -1.204 1.00 0.00 C ATOM 256 OE1 GLU A 136 1.292 -5.205 -0.157 1.00 0.00 O ATOM 257 OE2 GLU A 136 2.836 -6.117 -1.353 1.00 0.00 O ATOM 0 H GLU A 136 -0.901 -7.851 -2.978 1.00 0.00 H new ATOM 0 HA GLU A 136 -0.328 -6.996 -0.304 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -1.359 -5.533 -2.781 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -0.835 -4.737 -1.310 1.00 0.00 H new ATOM 0 HG2 GLU A 136 0.917 -6.623 -2.969 1.00 0.00 H new ATOM 0 HG3 GLU A 136 0.982 -4.875 -3.068 1.00 0.00 H new ATOM 264 N PHE A 137 -3.443 -6.966 -1.376 1.00 0.00 N ATOM 265 CA PHE A 137 -4.830 -6.882 -0.939 1.00 0.00 C ATOM 266 C PHE A 137 -5.167 -8.040 -0.010 1.00 0.00 C ATOM 267 O PHE A 137 -5.929 -7.881 0.944 1.00 0.00 O ATOM 268 CB PHE A 137 -5.776 -6.891 -2.146 1.00 0.00 C ATOM 269 CG PHE A 137 -5.717 -5.548 -2.842 1.00 0.00 C ATOM 270 CD1 PHE A 137 -6.391 -4.449 -2.293 1.00 0.00 C ATOM 271 CD2 PHE A 137 -4.989 -5.399 -4.027 1.00 0.00 C ATOM 272 CE1 PHE A 137 -6.338 -3.204 -2.930 1.00 0.00 C ATOM 273 CE2 PHE A 137 -4.936 -4.153 -4.665 1.00 0.00 C ATOM 274 CZ PHE A 137 -5.610 -3.057 -4.118 1.00 0.00 C ATOM 0 H PHE A 137 -3.323 -7.201 -2.361 1.00 0.00 H new ATOM 0 HA PHE A 137 -4.960 -5.945 -0.397 1.00 0.00 H new ATOM 0 HB2 PHE A 137 -5.493 -7.684 -2.838 1.00 0.00 H new ATOM 0 HB3 PHE A 137 -6.795 -7.100 -1.821 1.00 0.00 H new ATOM 0 HD1 PHE A 137 -6.952 -4.563 -1.377 1.00 0.00 H new ATOM 0 HD2 PHE A 137 -4.468 -6.245 -4.450 1.00 0.00 H new ATOM 0 HE1 PHE A 137 -6.858 -2.357 -2.506 1.00 0.00 H new ATOM 0 HE2 PHE A 137 -4.374 -4.039 -5.580 1.00 0.00 H new ATOM 0 HZ PHE A 137 -5.569 -2.097 -4.611 1.00 0.00 H new ATOM 284 N ASP A 138 -4.604 -9.211 -0.297 1.00 0.00 N ATOM 285 CA ASP A 138 -4.857 -10.396 0.518 1.00 0.00 C ATOM 286 C ASP A 138 -3.836 -10.502 1.642 1.00 0.00 C ATOM 287 O ASP A 138 -3.106 -11.487 1.746 1.00 0.00 O ATOM 288 CB ASP A 138 -4.787 -11.647 -0.358 1.00 0.00 C ATOM 289 CG ASP A 138 -5.377 -12.838 0.388 1.00 0.00 C ATOM 290 OD1 ASP A 138 -6.033 -12.620 1.394 1.00 0.00 O ATOM 291 OD2 ASP A 138 -5.166 -13.954 -0.058 1.00 0.00 O ATOM 0 H ASP A 138 -3.973 -9.365 -1.083 1.00 0.00 H new ATOM 0 HA ASP A 138 -5.851 -10.311 0.957 1.00 0.00 H new ATOM 0 HB2 ASP A 138 -5.333 -11.482 -1.287 1.00 0.00 H new ATOM 0 HB3 ASP A 138 -3.752 -11.854 -0.629 1.00 0.00 H new ATOM 296 N THR A 139 -3.788 -9.476 2.485 1.00 0.00 N ATOM 297 CA THR A 139 -2.851 -9.458 3.603 1.00 0.00 C ATOM 298 C THR A 139 -3.114 -10.617 4.550 1.00 0.00 C ATOM 299 O THR A 139 -2.191 -11.270 5.033 1.00 0.00 O ATOM 300 CB THR A 139 -2.974 -8.131 4.357 1.00 0.00 C ATOM 301 OG1 THR A 139 -1.870 -7.984 5.238 1.00 0.00 O ATOM 302 CG2 THR A 139 -4.278 -8.095 5.156 1.00 0.00 C ATOM 0 H THR A 139 -4.383 -8.650 2.417 1.00 0.00 H new ATOM 0 HA THR A 139 -1.840 -9.561 3.209 1.00 0.00 H new ATOM 0 HB THR A 139 -2.980 -7.312 3.637 1.00 0.00 H new ATOM 0 HG1 THR A 139 -1.947 -7.134 5.720 1.00 0.00 H new ATOM 0 HG21 THR A 139 -4.353 -7.146 5.687 1.00 0.00 H new ATOM 0 HG22 THR A 139 -5.124 -8.198 4.477 1.00 0.00 H new ATOM 0 HG23 THR A 139 -4.287 -8.915 5.874 1.00 0.00 H new ATOM 310 N ASP A 140 -4.384 -10.850 4.811 1.00 0.00 N ATOM 311 CA ASP A 140 -4.788 -11.926 5.714 1.00 0.00 C ATOM 312 C ASP A 140 -4.578 -13.287 5.059 1.00 0.00 C ATOM 313 O ASP A 140 -4.749 -14.327 5.694 1.00 0.00 O ATOM 314 CB ASP A 140 -6.260 -11.773 6.105 1.00 0.00 C ATOM 315 CG ASP A 140 -7.135 -11.747 4.858 1.00 0.00 C ATOM 316 OD1 ASP A 140 -6.624 -12.053 3.794 1.00 0.00 O ATOM 317 OD2 ASP A 140 -8.305 -11.424 4.986 1.00 0.00 O ATOM 0 H ASP A 140 -5.157 -10.315 4.416 1.00 0.00 H new ATOM 0 HA ASP A 140 -4.169 -11.862 6.609 1.00 0.00 H new ATOM 0 HB2 ASP A 140 -6.560 -12.598 6.752 1.00 0.00 H new ATOM 0 HB3 ASP A 140 -6.399 -10.854 6.675 1.00 0.00 H new ATOM 322 N GLN A 141 -4.205 -13.273 3.784 1.00 0.00 N ATOM 323 CA GLN A 141 -3.970 -14.508 3.047 1.00 0.00 C ATOM 324 C GLN A 141 -5.087 -15.512 3.319 1.00 0.00 C ATOM 325 O GLN A 141 -4.834 -16.697 3.538 1.00 0.00 O ATOM 326 CB GLN A 141 -2.622 -15.111 3.456 1.00 0.00 C ATOM 327 CG GLN A 141 -2.161 -16.111 2.393 1.00 0.00 C ATOM 328 CD GLN A 141 -0.811 -16.702 2.777 1.00 0.00 C ATOM 329 OE1 GLN A 141 -0.103 -16.139 3.613 1.00 0.00 O ATOM 330 NE2 GLN A 141 -0.412 -17.809 2.216 1.00 0.00 N ATOM 0 H GLN A 141 -4.059 -12.422 3.241 1.00 0.00 H new ATOM 0 HA GLN A 141 -3.955 -14.280 1.981 1.00 0.00 H new ATOM 0 HB2 GLN A 141 -1.880 -14.321 3.573 1.00 0.00 H new ATOM 0 HB3 GLN A 141 -2.713 -15.608 4.422 1.00 0.00 H new ATOM 0 HG2 GLN A 141 -2.898 -16.907 2.288 1.00 0.00 H new ATOM 0 HG3 GLN A 141 -2.087 -15.616 1.425 1.00 0.00 H new ATOM 0 HE21 GLN A 141 -1.002 -18.272 1.524 1.00 0.00 H new ATOM 0 HE22 GLN A 141 0.490 -18.213 2.469 1.00 0.00 H new ATOM 339 N ASP A 142 -6.325 -15.031 3.308 1.00 0.00 N ATOM 340 CA ASP A 142 -7.475 -15.898 3.558 1.00 0.00 C ATOM 341 C ASP A 142 -8.010 -16.464 2.246 1.00 0.00 C ATOM 342 O ASP A 142 -8.956 -17.249 2.239 1.00 0.00 O ATOM 343 CB ASP A 142 -8.579 -15.110 4.263 1.00 0.00 C ATOM 344 CG ASP A 142 -8.919 -13.858 3.462 1.00 0.00 C ATOM 345 OD1 ASP A 142 -8.189 -13.558 2.531 1.00 0.00 O ATOM 346 OD2 ASP A 142 -9.901 -13.216 3.793 1.00 0.00 O ATOM 0 H ASP A 142 -6.559 -14.054 3.130 1.00 0.00 H new ATOM 0 HA ASP A 142 -7.155 -16.723 4.195 1.00 0.00 H new ATOM 0 HB2 ASP A 142 -9.467 -15.732 4.375 1.00 0.00 H new ATOM 0 HB3 ASP A 142 -8.256 -14.833 5.266 1.00 0.00 H new ATOM 351 N GLY A 143 -7.393 -16.063 1.139 1.00 0.00 N ATOM 352 CA GLY A 143 -7.813 -16.537 -0.175 1.00 0.00 C ATOM 353 C GLY A 143 -9.017 -15.751 -0.680 1.00 0.00 C ATOM 354 O GLY A 143 -9.641 -16.124 -1.672 1.00 0.00 O ATOM 0 H GLY A 143 -6.605 -15.415 1.125 1.00 0.00 H new ATOM 0 HA2 GLY A 143 -6.988 -16.440 -0.881 1.00 0.00 H new ATOM 0 HA3 GLY A 143 -8.063 -17.597 -0.121 1.00 0.00 H new ATOM 358 N TYR A 144 -9.344 -14.665 0.016 1.00 0.00 N ATOM 359 CA TYR A 144 -10.479 -13.830 -0.366 1.00 0.00 C ATOM 360 C TYR A 144 -10.251 -12.389 0.075 1.00 0.00 C ATOM 361 O TYR A 144 -9.470 -12.125 0.990 1.00 0.00 O ATOM 362 CB TYR A 144 -11.762 -14.367 0.269 1.00 0.00 C ATOM 363 CG TYR A 144 -11.949 -15.812 -0.128 1.00 0.00 C ATOM 364 CD1 TYR A 144 -12.498 -16.132 -1.374 1.00 0.00 C ATOM 365 CD2 TYR A 144 -11.576 -16.832 0.755 1.00 0.00 C ATOM 366 CE1 TYR A 144 -12.672 -17.473 -1.739 1.00 0.00 C ATOM 367 CE2 TYR A 144 -11.749 -18.172 0.392 1.00 0.00 C ATOM 368 CZ TYR A 144 -12.297 -18.493 -0.856 1.00 0.00 C ATOM 369 OH TYR A 144 -12.469 -19.814 -1.214 1.00 0.00 O ATOM 0 H TYR A 144 -8.842 -14.344 0.844 1.00 0.00 H new ATOM 0 HA TYR A 144 -10.578 -13.855 -1.451 1.00 0.00 H new ATOM 0 HB2 TYR A 144 -11.708 -14.280 1.354 1.00 0.00 H new ATOM 0 HB3 TYR A 144 -12.618 -13.775 -0.056 1.00 0.00 H new ATOM 0 HD1 TYR A 144 -12.788 -15.345 -2.055 1.00 0.00 H new ATOM 0 HD2 TYR A 144 -11.154 -16.584 1.718 1.00 0.00 H new ATOM 0 HE1 TYR A 144 -13.095 -17.720 -2.701 1.00 0.00 H new ATOM 0 HE2 TYR A 144 -11.460 -18.958 1.074 1.00 0.00 H new ATOM 0 HH TYR A 144 -12.156 -20.393 -0.488 1.00 0.00 H new ATOM 379 N ILE A 145 -10.944 -11.461 -0.578 1.00 0.00 N ATOM 380 CA ILE A 145 -10.822 -10.037 -0.250 1.00 0.00 C ATOM 381 C ILE A 145 -12.188 -9.360 -0.273 1.00 0.00 C ATOM 382 O ILE A 145 -13.161 -9.919 -0.779 1.00 0.00 O ATOM 383 CB ILE A 145 -9.885 -9.352 -1.246 1.00 0.00 C ATOM 384 CG1 ILE A 145 -10.413 -9.550 -2.670 1.00 0.00 C ATOM 385 CG2 ILE A 145 -8.484 -9.958 -1.130 1.00 0.00 C ATOM 386 CD1 ILE A 145 -9.573 -8.727 -3.645 1.00 0.00 C ATOM 0 H ILE A 145 -11.595 -11.665 -1.336 1.00 0.00 H new ATOM 0 HA ILE A 145 -10.408 -9.948 0.755 1.00 0.00 H new ATOM 0 HB ILE A 145 -9.839 -8.286 -1.024 1.00 0.00 H new ATOM 0 HG12 ILE A 145 -10.373 -10.605 -2.940 1.00 0.00 H new ATOM 0 HG13 ILE A 145 -11.458 -9.245 -2.727 1.00 0.00 H new ATOM 0 HG21 ILE A 145 -7.816 -9.470 -1.840 1.00 0.00 H new ATOM 0 HG22 ILE A 145 -8.107 -9.812 -0.118 1.00 0.00 H new ATOM 0 HG23 ILE A 145 -8.530 -11.025 -1.350 1.00 0.00 H new ATOM 0 HD11 ILE A 145 -9.949 -8.868 -4.658 1.00 0.00 H new ATOM 0 HD12 ILE A 145 -9.636 -7.672 -3.378 1.00 0.00 H new ATOM 0 HD13 ILE A 145 -8.534 -9.053 -3.595 1.00 0.00 H new ATOM 398 N GLY A 146 -12.250 -8.152 0.274 1.00 0.00 N ATOM 399 CA GLY A 146 -13.502 -7.403 0.304 1.00 0.00 C ATOM 400 C GLY A 146 -13.774 -6.751 -1.047 1.00 0.00 C ATOM 401 O GLY A 146 -12.939 -6.014 -1.572 1.00 0.00 O ATOM 0 H GLY A 146 -11.456 -7.673 0.699 1.00 0.00 H new ATOM 0 HA2 GLY A 146 -14.324 -8.070 0.563 1.00 0.00 H new ATOM 0 HA3 GLY A 146 -13.455 -6.638 1.079 1.00 0.00 H new ATOM 405 N TYR A 147 -14.946 -7.031 -1.607 1.00 0.00 N ATOM 406 CA TYR A 147 -15.312 -6.474 -2.903 1.00 0.00 C ATOM 407 C TYR A 147 -15.113 -4.959 -2.899 1.00 0.00 C ATOM 408 O TYR A 147 -15.006 -4.336 -3.953 1.00 0.00 O ATOM 409 CB TYR A 147 -16.787 -6.820 -3.224 1.00 0.00 C ATOM 410 CG TYR A 147 -16.910 -7.298 -4.651 1.00 0.00 C ATOM 411 CD1 TYR A 147 -17.122 -6.378 -5.682 1.00 0.00 C ATOM 412 CD2 TYR A 147 -16.801 -8.661 -4.939 1.00 0.00 C ATOM 413 CE1 TYR A 147 -17.226 -6.822 -7.004 1.00 0.00 C ATOM 414 CE2 TYR A 147 -16.905 -9.108 -6.258 1.00 0.00 C ATOM 415 CZ TYR A 147 -17.118 -8.188 -7.292 1.00 0.00 C ATOM 416 OH TYR A 147 -17.218 -8.628 -8.596 1.00 0.00 O ATOM 0 H TYR A 147 -15.653 -7.635 -1.188 1.00 0.00 H new ATOM 0 HA TYR A 147 -14.671 -6.907 -3.671 1.00 0.00 H new ATOM 0 HB2 TYR A 147 -17.144 -7.592 -2.542 1.00 0.00 H new ATOM 0 HB3 TYR A 147 -17.416 -5.943 -3.071 1.00 0.00 H new ATOM 0 HD1 TYR A 147 -17.205 -5.325 -5.458 1.00 0.00 H new ATOM 0 HD2 TYR A 147 -16.636 -9.370 -4.141 1.00 0.00 H new ATOM 0 HE1 TYR A 147 -17.389 -6.112 -7.802 1.00 0.00 H new ATOM 0 HE2 TYR A 147 -16.821 -10.162 -6.480 1.00 0.00 H new ATOM 0 HH TYR A 147 -17.120 -9.603 -8.621 1.00 0.00 H new ATOM 426 N ARG A 148 -15.069 -4.375 -1.714 1.00 0.00 N ATOM 427 CA ARG A 148 -14.885 -2.938 -1.598 1.00 0.00 C ATOM 428 C ARG A 148 -13.509 -2.531 -2.116 1.00 0.00 C ATOM 429 O ARG A 148 -13.355 -1.486 -2.747 1.00 0.00 O ATOM 430 CB ARG A 148 -15.033 -2.509 -0.140 1.00 0.00 C ATOM 431 CG ARG A 148 -16.501 -2.627 0.279 1.00 0.00 C ATOM 432 CD ARG A 148 -16.647 -2.214 1.743 1.00 0.00 C ATOM 433 NE ARG A 148 -18.033 -2.361 2.173 1.00 0.00 N ATOM 434 CZ ARG A 148 -18.396 -2.098 3.424 1.00 0.00 C ATOM 435 NH1 ARG A 148 -17.507 -1.694 4.290 1.00 0.00 N ATOM 436 NH2 ARG A 148 -19.642 -2.244 3.787 1.00 0.00 N ATOM 0 H ARG A 148 -15.157 -4.868 -0.825 1.00 0.00 H new ATOM 0 HA ARG A 148 -15.647 -2.443 -2.200 1.00 0.00 H new ATOM 0 HB2 ARG A 148 -14.410 -3.134 0.499 1.00 0.00 H new ATOM 0 HB3 ARG A 148 -14.689 -1.482 -0.015 1.00 0.00 H new ATOM 0 HG2 ARG A 148 -17.123 -1.993 -0.353 1.00 0.00 H new ATOM 0 HG3 ARG A 148 -16.848 -3.651 0.142 1.00 0.00 H new ATOM 0 HD2 ARG A 148 -15.998 -2.828 2.368 1.00 0.00 H new ATOM 0 HD3 ARG A 148 -16.327 -1.180 1.870 1.00 0.00 H new ATOM 0 HE ARG A 148 -18.736 -2.671 1.502 1.00 0.00 H new ATOM 0 HH11 ARG A 148 -16.534 -1.580 4.007 1.00 0.00 H new ATOM 0 HH12 ARG A 148 -17.785 -1.492 5.250 1.00 0.00 H new ATOM 0 HH21 ARG A 148 -20.337 -2.560 3.110 1.00 0.00 H new ATOM 0 HH22 ARG A 148 -19.920 -2.042 4.747 1.00 0.00 H new ATOM 450 N GLU A 149 -12.510 -3.364 -1.839 1.00 0.00 N ATOM 451 CA GLU A 149 -11.147 -3.082 -2.277 1.00 0.00 C ATOM 452 C GLU A 149 -10.982 -3.408 -3.755 1.00 0.00 C ATOM 453 O GLU A 149 -9.978 -3.053 -4.370 1.00 0.00 O ATOM 454 CB GLU A 149 -10.156 -3.912 -1.460 1.00 0.00 C ATOM 455 CG GLU A 149 -10.167 -3.428 -0.009 1.00 0.00 C ATOM 456 CD GLU A 149 -9.277 -4.326 0.843 1.00 0.00 C ATOM 457 OE1 GLU A 149 -8.665 -5.222 0.286 1.00 0.00 O ATOM 458 OE2 GLU A 149 -9.224 -4.107 2.041 1.00 0.00 O ATOM 0 H GLU A 149 -12.617 -4.234 -1.317 1.00 0.00 H new ATOM 0 HA GLU A 149 -10.949 -2.021 -2.125 1.00 0.00 H new ATOM 0 HB2 GLU A 149 -10.424 -4.968 -1.505 1.00 0.00 H new ATOM 0 HB3 GLU A 149 -9.154 -3.819 -1.879 1.00 0.00 H new ATOM 0 HG2 GLU A 149 -9.815 -2.398 0.043 1.00 0.00 H new ATOM 0 HG3 GLU A 149 -11.186 -3.437 0.379 1.00 0.00 H new ATOM 465 N LEU A 150 -11.966 -4.097 -4.313 1.00 0.00 N ATOM 466 CA LEU A 150 -11.909 -4.479 -5.713 1.00 0.00 C ATOM 467 C LEU A 150 -11.798 -3.244 -6.594 1.00 0.00 C ATOM 468 O LEU A 150 -11.064 -3.242 -7.582 1.00 0.00 O ATOM 469 CB LEU A 150 -13.166 -5.267 -6.095 1.00 0.00 C ATOM 470 CG LEU A 150 -13.059 -5.792 -7.551 1.00 0.00 C ATOM 471 CD1 LEU A 150 -13.625 -7.213 -7.634 1.00 0.00 C ATOM 472 CD2 LEU A 150 -13.856 -4.886 -8.503 1.00 0.00 C ATOM 0 H LEU A 150 -12.807 -4.400 -3.821 1.00 0.00 H new ATOM 0 HA LEU A 150 -11.030 -5.105 -5.864 1.00 0.00 H new ATOM 0 HB2 LEU A 150 -13.299 -6.104 -5.410 1.00 0.00 H new ATOM 0 HB3 LEU A 150 -14.045 -4.630 -5.996 1.00 0.00 H new ATOM 0 HG LEU A 150 -12.009 -5.792 -7.842 1.00 0.00 H new ATOM 0 HD11 LEU A 150 -13.547 -7.576 -8.659 1.00 0.00 H new ATOM 0 HD12 LEU A 150 -13.059 -7.869 -6.972 1.00 0.00 H new ATOM 0 HD13 LEU A 150 -14.672 -7.206 -7.330 1.00 0.00 H new ATOM 0 HD21 LEU A 150 -13.773 -5.265 -9.521 1.00 0.00 H new ATOM 0 HD22 LEU A 150 -14.904 -4.877 -8.204 1.00 0.00 H new ATOM 0 HD23 LEU A 150 -13.457 -3.872 -8.460 1.00 0.00 H new ATOM 484 N GLY A 151 -12.531 -2.197 -6.239 1.00 0.00 N ATOM 485 CA GLY A 151 -12.503 -0.969 -7.019 1.00 0.00 C ATOM 486 C GLY A 151 -11.072 -0.467 -7.186 1.00 0.00 C ATOM 487 O GLY A 151 -10.623 -0.211 -8.303 1.00 0.00 O ATOM 0 H GLY A 151 -13.145 -2.173 -5.425 1.00 0.00 H new ATOM 0 HA2 GLY A 151 -12.948 -1.144 -7.998 1.00 0.00 H new ATOM 0 HA3 GLY A 151 -13.106 -0.206 -6.527 1.00 0.00 H new ATOM 491 N ASP A 152 -10.360 -0.330 -6.071 1.00 0.00 N ATOM 492 CA ASP A 152 -8.981 0.144 -6.119 1.00 0.00 C ATOM 493 C ASP A 152 -8.094 -0.869 -6.832 1.00 0.00 C ATOM 494 O ASP A 152 -7.445 -0.546 -7.829 1.00 0.00 O ATOM 495 CB ASP A 152 -8.458 0.371 -4.702 1.00 0.00 C ATOM 496 CG ASP A 152 -7.028 0.898 -4.751 1.00 0.00 C ATOM 497 OD1 ASP A 152 -6.473 0.948 -5.836 1.00 0.00 O ATOM 498 OD2 ASP A 152 -6.509 1.241 -3.701 1.00 0.00 O ATOM 0 H ASP A 152 -10.709 -0.537 -5.135 1.00 0.00 H new ATOM 0 HA ASP A 152 -8.958 1.084 -6.670 1.00 0.00 H new ATOM 0 HB2 ASP A 152 -9.098 1.081 -4.179 1.00 0.00 H new ATOM 0 HB3 ASP A 152 -8.491 -0.562 -4.140 1.00 0.00 H new ATOM 503 N CYS A 153 -8.068 -2.094 -6.318 1.00 0.00 N ATOM 504 CA CYS A 153 -7.254 -3.148 -6.915 1.00 0.00 C ATOM 505 C CYS A 153 -7.409 -3.153 -8.429 1.00 0.00 C ATOM 506 O CYS A 153 -6.458 -3.419 -9.158 1.00 0.00 O ATOM 507 CB CYS A 153 -7.671 -4.509 -6.356 1.00 0.00 C ATOM 508 SG CYS A 153 -6.375 -5.727 -6.704 1.00 0.00 S ATOM 0 H CYS A 153 -8.597 -2.381 -5.495 1.00 0.00 H new ATOM 0 HA CYS A 153 -6.210 -2.956 -6.668 1.00 0.00 H new ATOM 0 HB2 CYS A 153 -7.838 -4.437 -5.281 1.00 0.00 H new ATOM 0 HB3 CYS A 153 -8.613 -4.826 -6.805 1.00 0.00 H new ATOM 0 HG CYS A 153 -5.430 -5.621 -5.818 1.00 0.00 H new ATOM 514 N MET A 154 -8.612 -2.859 -8.895 1.00 0.00 N ATOM 515 CA MET A 154 -8.882 -2.832 -10.326 1.00 0.00 C ATOM 516 C MET A 154 -8.102 -1.713 -11.003 1.00 0.00 C ATOM 517 O MET A 154 -7.611 -1.880 -12.116 1.00 0.00 O ATOM 518 CB MET A 154 -10.377 -2.637 -10.575 1.00 0.00 C ATOM 519 CG MET A 154 -10.651 -2.656 -12.081 1.00 0.00 C ATOM 520 SD MET A 154 -12.439 -2.589 -12.364 1.00 0.00 S ATOM 521 CE MET A 154 -12.729 -4.372 -12.452 1.00 0.00 C ATOM 0 H MET A 154 -9.415 -2.636 -8.307 1.00 0.00 H new ATOM 0 HA MET A 154 -8.565 -3.785 -10.749 1.00 0.00 H new ATOM 0 HB2 MET A 154 -10.945 -3.426 -10.081 1.00 0.00 H new ATOM 0 HB3 MET A 154 -10.707 -1.691 -10.146 1.00 0.00 H new ATOM 0 HG2 MET A 154 -10.163 -1.808 -12.562 1.00 0.00 H new ATOM 0 HG3 MET A 154 -10.234 -3.559 -12.527 1.00 0.00 H new ATOM 0 HE1 MET A 154 -13.789 -4.560 -12.625 1.00 0.00 H new ATOM 0 HE2 MET A 154 -12.147 -4.795 -13.271 1.00 0.00 H new ATOM 0 HE3 MET A 154 -12.427 -4.837 -11.513 1.00 0.00 H new ATOM 531 N ARG A 155 -8.008 -0.569 -10.337 1.00 0.00 N ATOM 532 CA ARG A 155 -7.300 0.577 -10.894 1.00 0.00 C ATOM 533 C ARG A 155 -5.790 0.427 -10.719 1.00 0.00 C ATOM 534 O ARG A 155 -5.011 1.172 -11.311 1.00 0.00 O ATOM 535 CB ARG A 155 -7.768 1.860 -10.204 1.00 0.00 C ATOM 536 CG ARG A 155 -9.228 2.129 -10.570 1.00 0.00 C ATOM 537 CD ARG A 155 -9.742 3.331 -9.775 1.00 0.00 C ATOM 538 NE ARG A 155 -8.982 4.528 -10.127 1.00 0.00 N ATOM 539 CZ ARG A 155 -9.325 5.285 -11.167 1.00 0.00 C ATOM 540 NH1 ARG A 155 -10.357 4.961 -11.897 1.00 0.00 N ATOM 541 NH2 ARG A 155 -8.628 6.349 -11.456 1.00 0.00 N ATOM 0 H ARG A 155 -8.411 -0.410 -9.414 1.00 0.00 H new ATOM 0 HA ARG A 155 -7.522 0.629 -11.960 1.00 0.00 H new ATOM 0 HB2 ARG A 155 -7.664 1.764 -9.123 1.00 0.00 H new ATOM 0 HB3 ARG A 155 -7.144 2.699 -10.511 1.00 0.00 H new ATOM 0 HG2 ARG A 155 -9.316 2.322 -11.639 1.00 0.00 H new ATOM 0 HG3 ARG A 155 -9.836 1.250 -10.354 1.00 0.00 H new ATOM 0 HD2 ARG A 155 -10.800 3.489 -9.983 1.00 0.00 H new ATOM 0 HD3 ARG A 155 -9.653 3.135 -8.706 1.00 0.00 H new ATOM 0 HE ARG A 155 -8.172 4.789 -9.565 1.00 0.00 H new ATOM 0 HH11 ARG A 155 -10.900 4.128 -11.671 1.00 0.00 H new ATOM 0 HH12 ARG A 155 -10.620 5.541 -12.694 1.00 0.00 H new ATOM 0 HH21 ARG A 155 -7.821 6.600 -10.885 1.00 0.00 H new ATOM 0 HH22 ARG A 155 -8.890 6.930 -12.253 1.00 0.00 H new ATOM 555 N THR A 156 -5.386 -0.532 -9.898 1.00 0.00 N ATOM 556 CA THR A 156 -3.969 -0.760 -9.643 1.00 0.00 C ATOM 557 C THR A 156 -3.222 -1.086 -10.927 1.00 0.00 C ATOM 558 O THR A 156 -2.003 -1.260 -10.927 1.00 0.00 O ATOM 559 CB THR A 156 -3.799 -1.904 -8.625 1.00 0.00 C ATOM 560 OG1 THR A 156 -2.613 -1.690 -7.878 1.00 0.00 O ATOM 561 CG2 THR A 156 -3.718 -3.263 -9.340 1.00 0.00 C ATOM 0 H THR A 156 -6.014 -1.162 -9.399 1.00 0.00 H new ATOM 0 HA THR A 156 -3.545 0.156 -9.233 1.00 0.00 H new ATOM 0 HB THR A 156 -4.663 -1.915 -7.961 1.00 0.00 H new ATOM 0 HG1 THR A 156 -2.501 -2.414 -7.228 1.00 0.00 H new ATOM 0 HG21 THR A 156 -3.598 -4.056 -8.602 1.00 0.00 H new ATOM 0 HG22 THR A 156 -4.633 -3.431 -9.907 1.00 0.00 H new ATOM 0 HG23 THR A 156 -2.865 -3.267 -10.018 1.00 0.00 H new ATOM 569 N LEU A 157 -3.972 -1.196 -12.006 1.00 0.00 N ATOM 570 CA LEU A 157 -3.400 -1.538 -13.311 1.00 0.00 C ATOM 571 C LEU A 157 -3.815 -0.529 -14.369 1.00 0.00 C ATOM 572 O LEU A 157 -3.743 -0.801 -15.567 1.00 0.00 O ATOM 573 CB LEU A 157 -3.851 -2.944 -13.728 1.00 0.00 C ATOM 574 CG LEU A 157 -5.345 -3.132 -13.425 1.00 0.00 C ATOM 575 CD1 LEU A 157 -6.183 -2.182 -14.298 1.00 0.00 C ATOM 576 CD2 LEU A 157 -5.740 -4.584 -13.716 1.00 0.00 C ATOM 0 H LEU A 157 -4.982 -1.055 -12.013 1.00 0.00 H new ATOM 0 HA LEU A 157 -2.314 -1.516 -13.223 1.00 0.00 H new ATOM 0 HB2 LEU A 157 -3.666 -3.093 -14.792 1.00 0.00 H new ATOM 0 HB3 LEU A 157 -3.267 -3.694 -13.195 1.00 0.00 H new ATOM 0 HG LEU A 157 -5.532 -2.904 -12.376 1.00 0.00 H new ATOM 0 HD11 LEU A 157 -7.241 -2.322 -14.076 1.00 0.00 H new ATOM 0 HD12 LEU A 157 -5.902 -1.150 -14.087 1.00 0.00 H new ATOM 0 HD13 LEU A 157 -6.001 -2.399 -15.350 1.00 0.00 H new ATOM 0 HD21 LEU A 157 -6.800 -4.723 -13.502 1.00 0.00 H new ATOM 0 HD22 LEU A 157 -5.549 -4.810 -14.765 1.00 0.00 H new ATOM 0 HD23 LEU A 157 -5.153 -5.254 -13.088 1.00 0.00 H new ATOM 588 N GLY A 158 -4.251 0.635 -13.914 1.00 0.00 N ATOM 589 CA GLY A 158 -4.683 1.702 -14.819 1.00 0.00 C ATOM 590 C GLY A 158 -6.189 1.911 -14.733 1.00 0.00 C ATOM 591 O GLY A 158 -6.910 1.087 -14.172 1.00 0.00 O ATOM 0 H GLY A 158 -4.317 0.870 -12.924 1.00 0.00 H new ATOM 0 HA2 GLY A 158 -4.168 2.629 -14.567 1.00 0.00 H new ATOM 0 HA3 GLY A 158 -4.404 1.451 -15.843 1.00 0.00 H new ATOM 595 N TYR A 159 -6.655 3.021 -15.295 1.00 0.00 N ATOM 596 CA TYR A 159 -8.078 3.336 -15.283 1.00 0.00 C ATOM 597 C TYR A 159 -8.780 2.699 -16.480 1.00 0.00 C ATOM 598 O TYR A 159 -8.931 3.316 -17.531 1.00 0.00 O ATOM 599 CB TYR A 159 -8.278 4.853 -15.327 1.00 0.00 C ATOM 600 CG TYR A 159 -7.441 5.437 -16.440 1.00 0.00 C ATOM 601 CD1 TYR A 159 -6.069 5.639 -16.249 1.00 0.00 C ATOM 602 CD2 TYR A 159 -8.035 5.776 -17.663 1.00 0.00 C ATOM 603 CE1 TYR A 159 -5.290 6.177 -17.278 1.00 0.00 C ATOM 604 CE2 TYR A 159 -7.254 6.315 -18.693 1.00 0.00 C ATOM 605 CZ TYR A 159 -5.883 6.514 -18.500 1.00 0.00 C ATOM 606 OH TYR A 159 -5.113 7.045 -19.515 1.00 0.00 O ATOM 0 H TYR A 159 -6.071 3.714 -15.762 1.00 0.00 H new ATOM 0 HA TYR A 159 -8.509 2.936 -14.365 1.00 0.00 H new ATOM 0 HB2 TYR A 159 -9.330 5.088 -15.487 1.00 0.00 H new ATOM 0 HB3 TYR A 159 -7.994 5.296 -14.373 1.00 0.00 H new ATOM 0 HD1 TYR A 159 -5.612 5.379 -15.306 1.00 0.00 H new ATOM 0 HD2 TYR A 159 -9.094 5.622 -17.811 1.00 0.00 H new ATOM 0 HE1 TYR A 159 -4.232 6.332 -17.130 1.00 0.00 H new ATOM 0 HE2 TYR A 159 -7.710 6.577 -19.636 1.00 0.00 H new ATOM 0 HH TYR A 159 -5.678 7.222 -20.296 1.00 0.00 H new ATOM 616 N MET A 160 -9.221 1.461 -16.297 1.00 0.00 N ATOM 617 CA MET A 160 -9.931 0.734 -17.344 1.00 0.00 C ATOM 618 C MET A 160 -11.447 0.954 -17.220 1.00 0.00 C ATOM 619 O MET A 160 -12.146 1.043 -18.230 1.00 0.00 O ATOM 620 CB MET A 160 -9.616 -0.771 -17.244 1.00 0.00 C ATOM 621 CG MET A 160 -8.223 -0.969 -16.648 1.00 0.00 C ATOM 622 SD MET A 160 -7.617 -2.617 -17.084 1.00 0.00 S ATOM 623 CE MET A 160 -8.950 -3.558 -16.304 1.00 0.00 C ATOM 0 H MET A 160 -9.099 0.937 -15.430 1.00 0.00 H new ATOM 0 HA MET A 160 -9.600 1.110 -18.312 1.00 0.00 H new ATOM 0 HB2 MET A 160 -10.361 -1.268 -16.623 1.00 0.00 H new ATOM 0 HB3 MET A 160 -9.668 -1.229 -18.232 1.00 0.00 H new ATOM 0 HG2 MET A 160 -7.541 -0.206 -17.025 1.00 0.00 H new ATOM 0 HG3 MET A 160 -8.259 -0.857 -15.564 1.00 0.00 H new ATOM 0 HE1 MET A 160 -8.556 -4.501 -15.925 1.00 0.00 H new ATOM 0 HE2 MET A 160 -9.367 -2.982 -15.478 1.00 0.00 H new ATOM 0 HE3 MET A 160 -9.731 -3.759 -17.037 1.00 0.00 H new ATOM 633 N PRO A 161 -11.964 1.033 -16.011 1.00 0.00 N ATOM 634 CA PRO A 161 -13.415 1.230 -15.773 1.00 0.00 C ATOM 635 C PRO A 161 -13.814 2.698 -15.858 1.00 0.00 C ATOM 636 O PRO A 161 -12.986 3.590 -15.682 1.00 0.00 O ATOM 637 CB PRO A 161 -13.622 0.660 -14.363 1.00 0.00 C ATOM 638 CG PRO A 161 -12.308 0.838 -13.655 1.00 0.00 C ATOM 639 CD PRO A 161 -11.219 0.957 -14.736 1.00 0.00 C ATOM 0 HA PRO A 161 -14.036 0.740 -16.523 1.00 0.00 H new ATOM 0 HB2 PRO A 161 -14.422 1.186 -13.842 1.00 0.00 H new ATOM 0 HB3 PRO A 161 -13.905 -0.392 -14.404 1.00 0.00 H new ATOM 0 HG2 PRO A 161 -12.327 1.730 -13.028 1.00 0.00 H new ATOM 0 HG3 PRO A 161 -12.107 -0.009 -12.999 1.00 0.00 H new ATOM 0 HD2 PRO A 161 -10.604 1.844 -14.583 1.00 0.00 H new ATOM 0 HD3 PRO A 161 -10.549 0.098 -14.719 1.00 0.00 H new ATOM 647 N THR A 162 -15.091 2.940 -16.125 1.00 0.00 N ATOM 648 CA THR A 162 -15.589 4.301 -16.227 1.00 0.00 C ATOM 649 C THR A 162 -15.580 4.979 -14.861 1.00 0.00 C ATOM 650 O THR A 162 -14.596 5.611 -14.479 1.00 0.00 O ATOM 651 CB THR A 162 -17.012 4.295 -16.792 1.00 0.00 C ATOM 652 OG1 THR A 162 -16.992 3.780 -18.115 1.00 0.00 O ATOM 653 CG2 THR A 162 -17.570 5.719 -16.803 1.00 0.00 C ATOM 0 H THR A 162 -15.794 2.216 -16.273 1.00 0.00 H new ATOM 0 HA THR A 162 -14.936 4.859 -16.898 1.00 0.00 H new ATOM 0 HB THR A 162 -17.647 3.667 -16.167 1.00 0.00 H new ATOM 0 HG1 THR A 162 -17.902 3.774 -18.477 1.00 0.00 H new ATOM 0 HG21 THR A 162 -18.583 5.710 -17.206 1.00 0.00 H new ATOM 0 HG22 THR A 162 -17.588 6.111 -15.786 1.00 0.00 H new ATOM 0 HG23 THR A 162 -16.938 6.353 -17.425 1.00 0.00 H new ATOM 661 N GLU A 163 -16.683 4.841 -14.131 1.00 0.00 N ATOM 662 CA GLU A 163 -16.797 5.447 -12.807 1.00 0.00 C ATOM 663 C GLU A 163 -18.103 5.036 -12.139 1.00 0.00 C ATOM 664 O GLU A 163 -18.151 4.816 -10.928 1.00 0.00 O ATOM 665 CB GLU A 163 -16.744 6.972 -12.925 1.00 0.00 C ATOM 666 CG GLU A 163 -16.786 7.594 -11.528 1.00 0.00 C ATOM 667 CD GLU A 163 -16.618 9.106 -11.627 1.00 0.00 C ATOM 668 OE1 GLU A 163 -16.690 9.619 -12.731 1.00 0.00 O ATOM 669 OE2 GLU A 163 -16.413 9.728 -10.597 1.00 0.00 O ATOM 0 H GLU A 163 -17.506 4.318 -14.431 1.00 0.00 H new ATOM 0 HA GLU A 163 -15.964 5.098 -12.197 1.00 0.00 H new ATOM 0 HB2 GLU A 163 -15.834 7.276 -13.443 1.00 0.00 H new ATOM 0 HB3 GLU A 163 -17.584 7.331 -13.520 1.00 0.00 H new ATOM 0 HG2 GLU A 163 -17.733 7.356 -11.043 1.00 0.00 H new ATOM 0 HG3 GLU A 163 -15.995 7.171 -10.908 1.00 0.00 H new ATOM 676 N MET A 164 -19.166 4.939 -12.935 1.00 0.00 N ATOM 677 CA MET A 164 -20.479 4.557 -12.416 1.00 0.00 C ATOM 678 C MET A 164 -20.811 3.117 -12.801 1.00 0.00 C ATOM 679 O MET A 164 -21.578 2.445 -12.118 1.00 0.00 O ATOM 680 CB MET A 164 -21.553 5.493 -12.963 1.00 0.00 C ATOM 681 CG MET A 164 -21.333 6.902 -12.403 1.00 0.00 C ATOM 682 SD MET A 164 -22.601 8.019 -13.049 1.00 0.00 S ATOM 683 CE MET A 164 -23.855 7.706 -11.780 1.00 0.00 C ATOM 0 H MET A 164 -19.145 5.119 -13.939 1.00 0.00 H new ATOM 0 HA MET A 164 -20.453 4.634 -11.329 1.00 0.00 H new ATOM 0 HB2 MET A 164 -21.514 5.512 -14.052 1.00 0.00 H new ATOM 0 HB3 MET A 164 -22.543 5.130 -12.686 1.00 0.00 H new ATOM 0 HG2 MET A 164 -21.373 6.881 -11.314 1.00 0.00 H new ATOM 0 HG3 MET A 164 -20.342 7.263 -12.679 1.00 0.00 H new ATOM 0 HE1 MET A 164 -24.741 8.306 -11.988 1.00 0.00 H new ATOM 0 HE2 MET A 164 -24.123 6.649 -11.786 1.00 0.00 H new ATOM 0 HE3 MET A 164 -23.457 7.974 -10.801 1.00 0.00 H new ATOM 693 N GLU A 165 -20.234 2.656 -13.902 1.00 0.00 N ATOM 694 CA GLU A 165 -20.483 1.298 -14.370 1.00 0.00 C ATOM 695 C GLU A 165 -19.964 0.277 -13.361 1.00 0.00 C ATOM 696 O GLU A 165 -20.582 -0.764 -13.141 1.00 0.00 O ATOM 697 CB GLU A 165 -19.797 1.079 -15.720 1.00 0.00 C ATOM 698 CG GLU A 165 -20.122 -0.324 -16.240 1.00 0.00 C ATOM 699 CD GLU A 165 -19.508 -0.523 -17.619 1.00 0.00 C ATOM 700 OE1 GLU A 165 -18.693 0.297 -18.008 1.00 0.00 O ATOM 701 OE2 GLU A 165 -19.862 -1.493 -18.270 1.00 0.00 O ATOM 0 H GLU A 165 -19.595 3.197 -14.485 1.00 0.00 H new ATOM 0 HA GLU A 165 -21.559 1.164 -14.482 1.00 0.00 H new ATOM 0 HB2 GLU A 165 -20.132 1.830 -16.436 1.00 0.00 H new ATOM 0 HB3 GLU A 165 -18.719 1.198 -15.615 1.00 0.00 H new ATOM 0 HG2 GLU A 165 -19.737 -1.075 -15.550 1.00 0.00 H new ATOM 0 HG3 GLU A 165 -21.202 -0.461 -16.291 1.00 0.00 H new ATOM 708 N LEU A 166 -18.827 0.583 -12.750 1.00 0.00 N ATOM 709 CA LEU A 166 -18.234 -0.317 -11.769 1.00 0.00 C ATOM 710 C LEU A 166 -19.161 -0.483 -10.567 1.00 0.00 C ATOM 711 O LEU A 166 -19.224 -1.552 -9.962 1.00 0.00 O ATOM 712 CB LEU A 166 -16.884 0.245 -11.317 1.00 0.00 C ATOM 713 CG LEU A 166 -17.077 1.629 -10.642 1.00 0.00 C ATOM 714 CD1 LEU A 166 -17.017 1.492 -9.117 1.00 0.00 C ATOM 715 CD2 LEU A 166 -15.970 2.586 -11.098 1.00 0.00 C ATOM 0 H LEU A 166 -18.300 1.441 -12.914 1.00 0.00 H new ATOM 0 HA LEU A 166 -18.087 -1.295 -12.226 1.00 0.00 H new ATOM 0 HB2 LEU A 166 -16.410 -0.445 -10.619 1.00 0.00 H new ATOM 0 HB3 LEU A 166 -16.217 0.340 -12.173 1.00 0.00 H new ATOM 0 HG LEU A 166 -18.052 2.022 -10.931 1.00 0.00 H new ATOM 0 HD11 LEU A 166 -17.154 2.471 -8.658 1.00 0.00 H new ATOM 0 HD12 LEU A 166 -17.807 0.820 -8.781 1.00 0.00 H new ATOM 0 HD13 LEU A 166 -16.048 1.087 -8.826 1.00 0.00 H new ATOM 0 HD21 LEU A 166 -16.109 3.557 -10.622 1.00 0.00 H new ATOM 0 HD22 LEU A 166 -14.999 2.179 -10.816 1.00 0.00 H new ATOM 0 HD23 LEU A 166 -16.014 2.703 -12.181 1.00 0.00 H new ATOM 727 N LEU A 167 -19.868 0.587 -10.223 1.00 0.00 N ATOM 728 CA LEU A 167 -20.778 0.559 -9.082 1.00 0.00 C ATOM 729 C LEU A 167 -21.834 -0.520 -9.285 1.00 0.00 C ATOM 730 O LEU A 167 -22.236 -1.197 -8.339 1.00 0.00 O ATOM 731 CB LEU A 167 -21.464 1.916 -8.916 1.00 0.00 C ATOM 732 CG LEU A 167 -20.424 2.985 -8.548 1.00 0.00 C ATOM 733 CD1 LEU A 167 -21.085 4.371 -8.555 1.00 0.00 C ATOM 734 CD2 LEU A 167 -19.841 2.703 -7.149 1.00 0.00 C ATOM 0 H LEU A 167 -19.830 1.480 -10.714 1.00 0.00 H new ATOM 0 HA LEU A 167 -20.201 0.338 -8.184 1.00 0.00 H new ATOM 0 HB2 LEU A 167 -21.971 2.192 -9.840 1.00 0.00 H new ATOM 0 HB3 LEU A 167 -22.227 1.855 -8.140 1.00 0.00 H new ATOM 0 HG LEU A 167 -19.618 2.959 -9.281 1.00 0.00 H new ATOM 0 HD11 LEU A 167 -20.346 5.128 -8.294 1.00 0.00 H new ATOM 0 HD12 LEU A 167 -21.482 4.580 -9.548 1.00 0.00 H new ATOM 0 HD13 LEU A 167 -21.897 4.391 -7.828 1.00 0.00 H new ATOM 0 HD21 LEU A 167 -19.105 3.468 -6.900 1.00 0.00 H new ATOM 0 HD22 LEU A 167 -20.643 2.717 -6.411 1.00 0.00 H new ATOM 0 HD23 LEU A 167 -19.362 1.724 -7.145 1.00 0.00 H new ATOM 746 N GLU A 168 -22.276 -0.681 -10.525 1.00 0.00 N ATOM 747 CA GLU A 168 -23.279 -1.690 -10.840 1.00 0.00 C ATOM 748 C GLU A 168 -22.717 -3.091 -10.617 1.00 0.00 C ATOM 749 O GLU A 168 -23.402 -3.968 -10.095 1.00 0.00 O ATOM 750 CB GLU A 168 -23.729 -1.540 -12.294 1.00 0.00 C ATOM 751 CG GLU A 168 -24.518 -0.240 -12.449 1.00 0.00 C ATOM 752 CD GLU A 168 -24.892 -0.031 -13.912 1.00 0.00 C ATOM 753 OE1 GLU A 168 -24.512 -0.857 -14.725 1.00 0.00 O ATOM 754 OE2 GLU A 168 -25.552 0.954 -14.199 1.00 0.00 O ATOM 0 H GLU A 168 -21.959 -0.131 -11.324 1.00 0.00 H new ATOM 0 HA GLU A 168 -24.134 -1.547 -10.180 1.00 0.00 H new ATOM 0 HB2 GLU A 168 -22.863 -1.534 -12.956 1.00 0.00 H new ATOM 0 HB3 GLU A 168 -24.346 -2.390 -12.585 1.00 0.00 H new ATOM 0 HG2 GLU A 168 -25.419 -0.276 -11.836 1.00 0.00 H new ATOM 0 HG3 GLU A 168 -23.923 0.601 -12.093 1.00 0.00 H new ATOM 761 N VAL A 169 -21.467 -3.292 -11.016 1.00 0.00 N ATOM 762 CA VAL A 169 -20.820 -4.591 -10.855 1.00 0.00 C ATOM 763 C VAL A 169 -20.642 -4.926 -9.376 1.00 0.00 C ATOM 764 O VAL A 169 -20.902 -6.047 -8.944 1.00 0.00 O ATOM 765 CB VAL A 169 -19.459 -4.591 -11.551 1.00 0.00 C ATOM 766 CG1 VAL A 169 -18.724 -5.903 -11.252 1.00 0.00 C ATOM 767 CG2 VAL A 169 -19.659 -4.452 -13.061 1.00 0.00 C ATOM 0 H VAL A 169 -20.883 -2.578 -11.451 1.00 0.00 H new ATOM 0 HA VAL A 169 -21.457 -5.349 -11.311 1.00 0.00 H new ATOM 0 HB VAL A 169 -18.866 -3.754 -11.182 1.00 0.00 H new ATOM 0 HG11 VAL A 169 -17.754 -5.899 -11.750 1.00 0.00 H new ATOM 0 HG12 VAL A 169 -18.579 -6.002 -10.176 1.00 0.00 H new ATOM 0 HG13 VAL A 169 -19.315 -6.743 -11.617 1.00 0.00 H new ATOM 0 HG21 VAL A 169 -18.689 -4.452 -13.558 1.00 0.00 H new ATOM 0 HG22 VAL A 169 -20.254 -5.288 -13.428 1.00 0.00 H new ATOM 0 HG23 VAL A 169 -20.176 -3.517 -13.275 1.00 0.00 H new ATOM 777 N SER A 170 -20.192 -3.943 -8.609 1.00 0.00 N ATOM 778 CA SER A 170 -19.976 -4.138 -7.180 1.00 0.00 C ATOM 779 C SER A 170 -21.295 -4.449 -6.475 1.00 0.00 C ATOM 780 O SER A 170 -21.361 -5.335 -5.624 1.00 0.00 O ATOM 781 CB SER A 170 -19.348 -2.886 -6.569 1.00 0.00 C ATOM 782 OG SER A 170 -19.449 -2.952 -5.153 1.00 0.00 O ATOM 0 H SER A 170 -19.970 -3.007 -8.948 1.00 0.00 H new ATOM 0 HA SER A 170 -19.299 -4.982 -7.046 1.00 0.00 H new ATOM 0 HB2 SER A 170 -18.302 -2.807 -6.867 1.00 0.00 H new ATOM 0 HB3 SER A 170 -19.853 -1.994 -6.940 1.00 0.00 H new ATOM 0 HG SER A 170 -20.326 -2.618 -4.872 1.00 0.00 H new ATOM 788 N GLN A 171 -22.339 -3.709 -6.834 1.00 0.00 N ATOM 789 CA GLN A 171 -23.653 -3.906 -6.228 1.00 0.00 C ATOM 790 C GLN A 171 -24.267 -5.224 -6.692 1.00 0.00 C ATOM 791 O GLN A 171 -25.109 -5.801 -6.006 1.00 0.00 O ATOM 792 CB GLN A 171 -24.578 -2.735 -6.596 1.00 0.00 C ATOM 793 CG GLN A 171 -24.312 -1.549 -5.663 1.00 0.00 C ATOM 794 CD GLN A 171 -22.829 -1.193 -5.677 1.00 0.00 C ATOM 795 OE1 GLN A 171 -21.998 -1.972 -5.206 1.00 0.00 O ATOM 796 NE2 GLN A 171 -22.446 -0.056 -6.188 1.00 0.00 N ATOM 0 H GLN A 171 -22.303 -2.971 -7.537 1.00 0.00 H new ATOM 0 HA GLN A 171 -23.535 -3.944 -5.145 1.00 0.00 H new ATOM 0 HB2 GLN A 171 -24.411 -2.439 -7.632 1.00 0.00 H new ATOM 0 HB3 GLN A 171 -25.620 -3.044 -6.517 1.00 0.00 H new ATOM 0 HG2 GLN A 171 -24.903 -0.689 -5.978 1.00 0.00 H new ATOM 0 HG3 GLN A 171 -24.625 -1.797 -4.649 1.00 0.00 H new ATOM 0 HE21 GLN A 171 -23.136 0.587 -6.577 1.00 0.00 H new ATOM 0 HE22 GLN A 171 -21.456 0.191 -6.199 1.00 0.00 H new ATOM 805 N HIS A 172 -23.844 -5.687 -7.860 1.00 0.00 N ATOM 806 CA HIS A 172 -24.360 -6.934 -8.412 1.00 0.00 C ATOM 807 C HIS A 172 -24.015 -8.106 -7.502 1.00 0.00 C ATOM 808 O HIS A 172 -24.778 -9.065 -7.389 1.00 0.00 O ATOM 809 CB HIS A 172 -23.775 -7.174 -9.804 1.00 0.00 C ATOM 810 CG HIS A 172 -24.386 -8.414 -10.395 1.00 0.00 C ATOM 811 ND1 HIS A 172 -23.883 -9.678 -10.135 1.00 0.00 N ATOM 812 CD2 HIS A 172 -25.454 -8.600 -11.234 1.00 0.00 C ATOM 813 CE1 HIS A 172 -24.643 -10.563 -10.807 1.00 0.00 C ATOM 814 NE2 HIS A 172 -25.615 -9.957 -11.494 1.00 0.00 N ATOM 0 H HIS A 172 -23.148 -5.221 -8.442 1.00 0.00 H new ATOM 0 HA HIS A 172 -25.445 -6.854 -8.486 1.00 0.00 H new ATOM 0 HB2 HIS A 172 -23.973 -6.316 -10.447 1.00 0.00 H new ATOM 0 HB3 HIS A 172 -22.692 -7.283 -9.742 1.00 0.00 H new ATOM 0 HD2 HIS A 172 -26.076 -7.812 -11.633 1.00 0.00 H new ATOM 0 HE1 HIS A 172 -24.486 -11.631 -10.792 1.00 0.00 H new ATOM 0 HE2 HIS A 172 -26.323 -10.395 -12.083 1.00 0.00 H new ATOM 822 N VAL A 173 -22.856 -8.025 -6.856 1.00 0.00 N ATOM 823 CA VAL A 173 -22.414 -9.083 -5.952 1.00 0.00 C ATOM 824 C VAL A 173 -22.932 -8.838 -4.540 1.00 0.00 C ATOM 825 O VAL A 173 -23.103 -9.774 -3.760 1.00 0.00 O ATOM 826 CB VAL A 173 -20.891 -9.151 -5.934 1.00 0.00 C ATOM 827 CG1 VAL A 173 -20.437 -10.200 -4.917 1.00 0.00 C ATOM 828 CG2 VAL A 173 -20.386 -9.534 -7.327 1.00 0.00 C ATOM 0 H VAL A 173 -22.208 -7.242 -6.940 1.00 0.00 H new ATOM 0 HA VAL A 173 -22.815 -10.030 -6.312 1.00 0.00 H new ATOM 0 HB VAL A 173 -20.485 -8.179 -5.653 1.00 0.00 H new ATOM 0 HG11 VAL A 173 -19.348 -10.248 -4.905 1.00 0.00 H new ATOM 0 HG12 VAL A 173 -20.799 -9.927 -3.926 1.00 0.00 H new ATOM 0 HG13 VAL A 173 -20.840 -11.174 -5.195 1.00 0.00 H new ATOM 0 HG21 VAL A 173 -19.297 -9.584 -7.318 1.00 0.00 H new ATOM 0 HG22 VAL A 173 -20.791 -10.506 -7.606 1.00 0.00 H new ATOM 0 HG23 VAL A 173 -20.709 -8.785 -8.050 1.00 0.00 H new ATOM 925 N GLY A 179 -20.634 -11.155 -1.186 1.00 0.00 N ATOM 926 CA GLY A 179 -20.098 -12.408 -1.726 1.00 0.00 C ATOM 927 C GLY A 179 -18.568 -12.392 -1.735 1.00 0.00 C ATOM 928 O GLY A 179 -17.955 -11.325 -1.755 1.00 0.00 O ATOM 0 HA2 GLY A 179 -20.453 -13.247 -1.128 1.00 0.00 H new ATOM 0 HA3 GLY A 179 -20.469 -12.560 -2.739 1.00 0.00 H new ATOM 932 N PHE A 180 -17.949 -13.583 -1.715 1.00 0.00 N ATOM 933 CA PHE A 180 -16.491 -13.682 -1.716 1.00 0.00 C ATOM 934 C PHE A 180 -16.004 -14.264 -3.038 1.00 0.00 C ATOM 935 O PHE A 180 -16.704 -15.052 -3.675 1.00 0.00 O ATOM 936 CB PHE A 180 -16.033 -14.575 -0.562 1.00 0.00 C ATOM 937 CG PHE A 180 -16.685 -15.931 -0.686 1.00 0.00 C ATOM 938 CD1 PHE A 180 -16.112 -16.912 -1.504 1.00 0.00 C ATOM 939 CD2 PHE A 180 -17.863 -16.207 0.020 1.00 0.00 C ATOM 940 CE1 PHE A 180 -16.715 -18.169 -1.617 1.00 0.00 C ATOM 941 CE2 PHE A 180 -18.466 -17.467 -0.092 1.00 0.00 C ATOM 942 CZ PHE A 180 -17.893 -18.447 -0.911 1.00 0.00 C ATOM 0 H PHE A 180 -18.435 -14.480 -1.698 1.00 0.00 H new ATOM 0 HA PHE A 180 -16.070 -12.684 -1.592 1.00 0.00 H new ATOM 0 HB2 PHE A 180 -14.948 -14.679 -0.577 1.00 0.00 H new ATOM 0 HB3 PHE A 180 -16.297 -14.119 0.392 1.00 0.00 H new ATOM 0 HD1 PHE A 180 -15.204 -16.698 -2.048 1.00 0.00 H new ATOM 0 HD2 PHE A 180 -18.306 -15.450 0.650 1.00 0.00 H new ATOM 0 HE1 PHE A 180 -16.273 -18.925 -2.248 1.00 0.00 H new ATOM 0 HE2 PHE A 180 -19.373 -17.682 0.454 1.00 0.00 H new ATOM 0 HZ PHE A 180 -18.359 -19.417 -0.999 1.00 0.00 H new ATOM 952 N VAL A 181 -14.799 -13.873 -3.443 1.00 0.00 N ATOM 953 CA VAL A 181 -14.220 -14.363 -4.694 1.00 0.00 C ATOM 954 C VAL A 181 -12.703 -14.506 -4.569 1.00 0.00 C ATOM 955 O VAL A 181 -12.004 -13.548 -4.245 1.00 0.00 O ATOM 956 CB VAL A 181 -14.562 -13.395 -5.841 1.00 0.00 C ATOM 957 CG1 VAL A 181 -15.962 -13.703 -6.381 1.00 0.00 C ATOM 958 CG2 VAL A 181 -14.528 -11.958 -5.312 1.00 0.00 C ATOM 0 H VAL A 181 -14.206 -13.222 -2.928 1.00 0.00 H new ATOM 0 HA VAL A 181 -14.642 -15.344 -4.910 1.00 0.00 H new ATOM 0 HB VAL A 181 -13.834 -13.513 -6.644 1.00 0.00 H new ATOM 0 HG11 VAL A 181 -16.199 -13.015 -7.192 1.00 0.00 H new ATOM 0 HG12 VAL A 181 -15.991 -14.727 -6.754 1.00 0.00 H new ATOM 0 HG13 VAL A 181 -16.694 -13.587 -5.582 1.00 0.00 H new ATOM 0 HG21 VAL A 181 -14.769 -11.267 -6.120 1.00 0.00 H new ATOM 0 HG22 VAL A 181 -15.258 -11.848 -4.510 1.00 0.00 H new ATOM 0 HG23 VAL A 181 -13.532 -11.735 -4.929 1.00 0.00 H new ATOM 968 N ASP A 182 -12.213 -15.711 -4.832 1.00 0.00 N ATOM 969 CA ASP A 182 -10.786 -15.976 -4.755 1.00 0.00 C ATOM 970 C ASP A 182 -10.062 -15.262 -5.886 1.00 0.00 C ATOM 971 O ASP A 182 -10.685 -14.572 -6.691 1.00 0.00 O ATOM 972 CB ASP A 182 -10.522 -17.478 -4.837 1.00 0.00 C ATOM 973 CG ASP A 182 -9.075 -17.773 -4.462 1.00 0.00 C ATOM 974 OD1 ASP A 182 -8.451 -16.911 -3.862 1.00 0.00 O ATOM 975 OD2 ASP A 182 -8.608 -18.854 -4.777 1.00 0.00 O ATOM 0 H ASP A 182 -12.781 -16.515 -5.099 1.00 0.00 H new ATOM 0 HA ASP A 182 -10.412 -15.604 -3.801 1.00 0.00 H new ATOM 0 HB2 ASP A 182 -11.196 -18.011 -4.167 1.00 0.00 H new ATOM 0 HB3 ASP A 182 -10.725 -17.837 -5.846 1.00 0.00 H new ATOM 980 N PHE A 183 -8.749 -15.432 -5.946 1.00 0.00 N ATOM 981 CA PHE A 183 -7.956 -14.797 -6.989 1.00 0.00 C ATOM 982 C PHE A 183 -8.428 -15.247 -8.367 1.00 0.00 C ATOM 983 O PHE A 183 -8.559 -14.437 -9.284 1.00 0.00 O ATOM 984 CB PHE A 183 -6.477 -15.151 -6.807 1.00 0.00 C ATOM 985 CG PHE A 183 -5.656 -14.443 -7.861 1.00 0.00 C ATOM 986 CD1 PHE A 183 -5.578 -13.045 -7.857 1.00 0.00 C ATOM 987 CD2 PHE A 183 -4.968 -15.176 -8.836 1.00 0.00 C ATOM 988 CE1 PHE A 183 -4.817 -12.381 -8.823 1.00 0.00 C ATOM 989 CE2 PHE A 183 -4.207 -14.512 -9.806 1.00 0.00 C ATOM 990 CZ PHE A 183 -4.133 -13.113 -9.798 1.00 0.00 C ATOM 0 H PHE A 183 -8.213 -16.000 -5.290 1.00 0.00 H new ATOM 0 HA PHE A 183 -8.081 -13.717 -6.912 1.00 0.00 H new ATOM 0 HB2 PHE A 183 -6.142 -14.858 -5.812 1.00 0.00 H new ATOM 0 HB3 PHE A 183 -6.338 -16.229 -6.886 1.00 0.00 H new ATOM 0 HD1 PHE A 183 -6.107 -12.478 -7.105 1.00 0.00 H new ATOM 0 HD2 PHE A 183 -5.024 -16.255 -8.840 1.00 0.00 H new ATOM 0 HE1 PHE A 183 -4.757 -11.303 -8.816 1.00 0.00 H new ATOM 0 HE2 PHE A 183 -3.678 -15.077 -10.559 1.00 0.00 H new ATOM 0 HZ PHE A 183 -3.547 -12.600 -10.546 1.00 0.00 H new ATOM 1000 N GLU A 184 -8.676 -16.540 -8.504 1.00 0.00 N ATOM 1001 CA GLU A 184 -9.131 -17.087 -9.775 1.00 0.00 C ATOM 1002 C GLU A 184 -10.571 -16.671 -10.062 1.00 0.00 C ATOM 1003 O GLU A 184 -10.944 -16.454 -11.216 1.00 0.00 O ATOM 1004 CB GLU A 184 -9.026 -18.619 -9.758 1.00 0.00 C ATOM 1005 CG GLU A 184 -9.488 -19.146 -8.396 1.00 0.00 C ATOM 1006 CD GLU A 184 -9.735 -20.649 -8.470 1.00 0.00 C ATOM 1007 OE1 GLU A 184 -8.912 -21.338 -9.049 1.00 0.00 O ATOM 1008 OE2 GLU A 184 -10.742 -21.089 -7.940 1.00 0.00 O ATOM 0 H GLU A 184 -8.571 -17.227 -7.757 1.00 0.00 H new ATOM 0 HA GLU A 184 -8.492 -16.690 -10.564 1.00 0.00 H new ATOM 0 HB2 GLU A 184 -9.639 -19.045 -10.552 1.00 0.00 H new ATOM 0 HB3 GLU A 184 -7.998 -18.926 -9.949 1.00 0.00 H new ATOM 0 HG2 GLU A 184 -8.733 -18.931 -7.639 1.00 0.00 H new ATOM 0 HG3 GLU A 184 -10.401 -18.635 -8.090 1.00 0.00 H new ATOM 1015 N GLU A 185 -11.376 -16.567 -9.013 1.00 0.00 N ATOM 1016 CA GLU A 185 -12.770 -16.183 -9.171 1.00 0.00 C ATOM 1017 C GLU A 185 -12.877 -14.698 -9.471 1.00 0.00 C ATOM 1018 O GLU A 185 -13.696 -14.281 -10.286 1.00 0.00 O ATOM 1019 CB GLU A 185 -13.556 -16.523 -7.905 1.00 0.00 C ATOM 1020 CG GLU A 185 -13.665 -18.045 -7.765 1.00 0.00 C ATOM 1021 CD GLU A 185 -14.383 -18.403 -6.471 1.00 0.00 C ATOM 1022 OE1 GLU A 185 -14.816 -17.493 -5.785 1.00 0.00 O ATOM 1023 OE2 GLU A 185 -14.493 -19.585 -6.183 1.00 0.00 O ATOM 0 H GLU A 185 -11.089 -16.742 -8.050 1.00 0.00 H new ATOM 0 HA GLU A 185 -13.193 -16.739 -10.008 1.00 0.00 H new ATOM 0 HB2 GLU A 185 -13.059 -16.101 -7.031 1.00 0.00 H new ATOM 0 HB3 GLU A 185 -14.550 -16.079 -7.951 1.00 0.00 H new ATOM 0 HG2 GLU A 185 -14.206 -18.458 -8.616 1.00 0.00 H new ATOM 0 HG3 GLU A 185 -12.670 -18.491 -7.773 1.00 0.00 H new ATOM 1030 N PHE A 186 -12.038 -13.910 -8.810 1.00 0.00 N ATOM 1031 CA PHE A 186 -12.026 -12.471 -9.020 1.00 0.00 C ATOM 1032 C PHE A 186 -11.541 -12.139 -10.433 1.00 0.00 C ATOM 1033 O PHE A 186 -12.111 -11.284 -11.113 1.00 0.00 O ATOM 1034 CB PHE A 186 -11.126 -11.798 -7.961 1.00 0.00 C ATOM 1035 CG PHE A 186 -10.523 -10.528 -8.527 1.00 0.00 C ATOM 1036 CD1 PHE A 186 -11.345 -9.438 -8.825 1.00 0.00 C ATOM 1037 CD2 PHE A 186 -9.149 -10.460 -8.779 1.00 0.00 C ATOM 1038 CE1 PHE A 186 -10.792 -8.273 -9.372 1.00 0.00 C ATOM 1039 CE2 PHE A 186 -8.593 -9.296 -9.323 1.00 0.00 C ATOM 1040 CZ PHE A 186 -9.417 -8.202 -9.622 1.00 0.00 C ATOM 0 H PHE A 186 -11.359 -14.244 -8.126 1.00 0.00 H new ATOM 0 HA PHE A 186 -13.041 -12.088 -8.914 1.00 0.00 H new ATOM 0 HB2 PHE A 186 -11.709 -11.568 -7.069 1.00 0.00 H new ATOM 0 HB3 PHE A 186 -10.334 -12.482 -7.656 1.00 0.00 H new ATOM 0 HD1 PHE A 186 -12.406 -9.494 -8.634 1.00 0.00 H new ATOM 0 HD2 PHE A 186 -8.517 -11.306 -8.554 1.00 0.00 H new ATOM 0 HE1 PHE A 186 -11.427 -7.430 -9.601 1.00 0.00 H new ATOM 0 HE2 PHE A 186 -7.531 -9.241 -9.512 1.00 0.00 H new ATOM 0 HZ PHE A 186 -8.991 -7.305 -10.045 1.00 0.00 H new ATOM 1050 N VAL A 187 -10.468 -12.798 -10.844 1.00 0.00 N ATOM 1051 CA VAL A 187 -9.893 -12.545 -12.158 1.00 0.00 C ATOM 1052 C VAL A 187 -10.889 -12.898 -13.250 1.00 0.00 C ATOM 1053 O VAL A 187 -11.041 -12.156 -14.220 1.00 0.00 O ATOM 1054 CB VAL A 187 -8.604 -13.355 -12.337 1.00 0.00 C ATOM 1055 CG1 VAL A 187 -8.151 -13.294 -13.801 1.00 0.00 C ATOM 1056 CG2 VAL A 187 -7.507 -12.771 -11.441 1.00 0.00 C ATOM 0 H VAL A 187 -9.981 -13.505 -10.293 1.00 0.00 H new ATOM 0 HA VAL A 187 -9.655 -11.484 -12.234 1.00 0.00 H new ATOM 0 HB VAL A 187 -8.790 -14.393 -12.060 1.00 0.00 H new ATOM 0 HG11 VAL A 187 -7.234 -13.871 -13.923 1.00 0.00 H new ATOM 0 HG12 VAL A 187 -8.930 -13.710 -14.440 1.00 0.00 H new ATOM 0 HG13 VAL A 187 -7.967 -12.257 -14.082 1.00 0.00 H new ATOM 0 HG21 VAL A 187 -6.590 -13.346 -11.567 1.00 0.00 H new ATOM 0 HG22 VAL A 187 -7.325 -11.733 -11.718 1.00 0.00 H new ATOM 0 HG23 VAL A 187 -7.824 -12.818 -10.399 1.00 0.00 H new ATOM 1066 N GLU A 188 -11.552 -14.036 -13.095 1.00 0.00 N ATOM 1067 CA GLU A 188 -12.521 -14.493 -14.084 1.00 0.00 C ATOM 1068 C GLU A 188 -13.323 -13.320 -14.640 1.00 0.00 C ATOM 1069 O GLU A 188 -13.654 -13.284 -15.826 1.00 0.00 O ATOM 1070 CB GLU A 188 -13.473 -15.510 -13.447 1.00 0.00 C ATOM 1071 CG GLU A 188 -14.430 -16.052 -14.510 1.00 0.00 C ATOM 1072 CD GLU A 188 -15.320 -17.137 -13.908 1.00 0.00 C ATOM 1073 OE1 GLU A 188 -15.001 -17.606 -12.829 1.00 0.00 O ATOM 1074 OE2 GLU A 188 -16.305 -17.482 -14.539 1.00 0.00 O ATOM 0 H GLU A 188 -11.438 -14.659 -12.296 1.00 0.00 H new ATOM 0 HA GLU A 188 -11.979 -14.963 -14.904 1.00 0.00 H new ATOM 0 HB2 GLU A 188 -12.904 -16.328 -13.004 1.00 0.00 H new ATOM 0 HB3 GLU A 188 -14.037 -15.040 -12.641 1.00 0.00 H new ATOM 0 HG2 GLU A 188 -15.045 -15.243 -14.904 1.00 0.00 H new ATOM 0 HG3 GLU A 188 -13.863 -16.458 -15.348 1.00 0.00 H new ATOM 1081 N LEU A 189 -13.635 -12.369 -13.774 1.00 0.00 N ATOM 1082 CA LEU A 189 -14.405 -11.199 -14.180 1.00 0.00 C ATOM 1083 C LEU A 189 -13.619 -10.345 -15.160 1.00 0.00 C ATOM 1084 O LEU A 189 -14.157 -9.877 -16.163 1.00 0.00 O ATOM 1085 CB LEU A 189 -14.780 -10.360 -12.951 1.00 0.00 C ATOM 1086 CG LEU A 189 -15.855 -11.081 -12.122 1.00 0.00 C ATOM 1087 CD1 LEU A 189 -17.157 -11.230 -12.936 1.00 0.00 C ATOM 1088 CD2 LEU A 189 -15.330 -12.461 -11.706 1.00 0.00 C ATOM 0 H LEU A 189 -13.369 -12.382 -12.789 1.00 0.00 H new ATOM 0 HA LEU A 189 -15.313 -11.547 -14.672 1.00 0.00 H new ATOM 0 HB2 LEU A 189 -13.896 -10.184 -12.338 1.00 0.00 H new ATOM 0 HB3 LEU A 189 -15.148 -9.384 -13.267 1.00 0.00 H new ATOM 0 HG LEU A 189 -16.076 -10.492 -11.232 1.00 0.00 H new ATOM 0 HD11 LEU A 189 -17.906 -11.743 -12.333 1.00 0.00 H new ATOM 0 HD12 LEU A 189 -17.528 -10.243 -13.214 1.00 0.00 H new ATOM 0 HD13 LEU A 189 -16.958 -11.810 -13.837 1.00 0.00 H new ATOM 0 HD21 LEU A 189 -16.089 -12.977 -11.118 1.00 0.00 H new ATOM 0 HD22 LEU A 189 -15.101 -13.047 -12.596 1.00 0.00 H new ATOM 0 HD23 LEU A 189 -14.426 -12.341 -11.108 1.00 0.00 H new ATOM 1100 N ILE A 190 -12.345 -10.139 -14.861 1.00 0.00 N ATOM 1101 CA ILE A 190 -11.493 -9.333 -15.723 1.00 0.00 C ATOM 1102 C ILE A 190 -10.982 -10.159 -16.900 1.00 0.00 C ATOM 1103 O ILE A 190 -10.734 -9.627 -17.983 1.00 0.00 O ATOM 1104 CB ILE A 190 -10.314 -8.793 -14.919 1.00 0.00 C ATOM 1105 CG1 ILE A 190 -10.831 -7.856 -13.823 1.00 0.00 C ATOM 1106 CG2 ILE A 190 -9.390 -8.015 -15.848 1.00 0.00 C ATOM 1107 CD1 ILE A 190 -9.694 -7.526 -12.855 1.00 0.00 C ATOM 0 H ILE A 190 -11.881 -10.516 -14.034 1.00 0.00 H new ATOM 0 HA ILE A 190 -12.079 -8.501 -16.113 1.00 0.00 H new ATOM 0 HB ILE A 190 -9.771 -9.622 -14.465 1.00 0.00 H new ATOM 0 HG12 ILE A 190 -11.222 -6.941 -14.267 1.00 0.00 H new ATOM 0 HG13 ILE A 190 -11.655 -8.327 -13.286 1.00 0.00 H new ATOM 0 HG21 ILE A 190 -8.545 -7.626 -15.279 1.00 0.00 H new ATOM 0 HG22 ILE A 190 -9.025 -8.675 -16.635 1.00 0.00 H new ATOM 0 HG23 ILE A 190 -9.938 -7.186 -16.296 1.00 0.00 H new ATOM 0 HD11 ILE A 190 -10.062 -6.859 -12.075 1.00 0.00 H new ATOM 0 HD12 ILE A 190 -9.324 -8.445 -12.401 1.00 0.00 H new ATOM 0 HD13 ILE A 190 -8.884 -7.038 -13.398 1.00 0.00 H new ATOM 1119 N SER A 191 -10.827 -11.461 -16.682 1.00 0.00 N ATOM 1120 CA SER A 191 -10.342 -12.352 -17.728 1.00 0.00 C ATOM 1121 C SER A 191 -11.477 -12.739 -18.670 1.00 0.00 C ATOM 1122 O SER A 191 -11.792 -11.948 -19.542 1.00 0.00 O ATOM 1123 CB SER A 191 -9.742 -13.613 -17.102 1.00 0.00 C ATOM 1124 OG SER A 191 -9.633 -14.623 -18.096 1.00 0.00 O ATOM 0 H SER A 191 -11.029 -11.920 -15.794 1.00 0.00 H new ATOM 0 HA SER A 191 -9.574 -11.829 -18.299 1.00 0.00 H new ATOM 0 HB2 SER A 191 -8.761 -13.393 -16.681 1.00 0.00 H new ATOM 0 HB3 SER A 191 -10.370 -13.960 -16.281 1.00 0.00 H new ATOM 0 HG SER A 191 -9.247 -15.432 -17.699 1.00 0.00 H new