Browse entries in the PDBbind-CN Database
HEADER 5C83_COMPLEX COMPND 5C83_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 107 MET ASN PHE PRO ASN SER THR ASN LEU PRO ARG ASN PRO SEQRES 2 A 107 SER MET ALA ASP TYR GLU ALA ARG ILE PHE THR PHE GLY SEQRES 3 A 107 THR TRP ILE TYR SER VAL ASN LYS GLU GLN LEU ALA ARG SEQRES 4 A 107 ALA GLY PHE TYR ALA LEU GLY GLU GLY ASP LYS VAL LYS SEQRES 5 A 107 CYS PHE HIS CYS GLY GLY GLY LEU THR ASP TRP LYS PRO SEQRES 6 A 107 SER GLU ASP PRO TRP GLU GLN HIS ALA LYS TRP TYR PRO SEQRES 7 A 107 GLY CYS LYS TYR LEU LEU GLU GLN LYS GLY GLN GLU TYR SEQRES 8 A 107 ILE ASN ASN ILE HIS LEU THR HIS SER LEU GLU GLU CYS SEQRES 9 A 107 LEU VAL ARG HET ZN A 1 1 HET UNN A 252 67 ATOM 1 N MET A 248 -12.146 -18.114 -17.506 1.00 71.42 N ATOM 2 CA MET A 248 -12.555 -18.981 -16.359 1.00 71.22 C ATOM 3 C MET A 248 -12.715 -20.468 -16.720 1.00 68.85 C ATOM 4 O MET A 248 -12.464 -21.336 -15.870 1.00 74.60 O ATOM 5 CB MET A 248 -13.846 -18.450 -15.733 1.00 73.02 C ATOM 6 CG MET A 248 -14.152 -18.992 -14.344 1.00 70.80 C ATOM 7 SD MET A 248 -15.753 -18.444 -13.721 1.00 84.49 S ATOM 8 CE MET A 248 -16.863 -19.647 -14.455 1.00 69.31 C ATOM 9 HN3 MET A 248 -12.864 -18.172 -18.256 1.00 0.00 H ATOM 10 HN2 MET A 248 -11.230 -18.440 -17.876 1.00 0.00 H ATOM 11 HN1 MET A 248 -12.060 -17.130 -17.182 1.00 0.00 H ATOM 12 N ASN A 249 -13.127 -20.743 -17.964 1.00 57.09 N ATOM 13 CA ASN A 249 -13.448 -22.103 -18.490 1.00 58.34 C ATOM 14 C ASN A 249 -14.809 -22.614 -18.064 1.00 45.68 C ATOM 15 O ASN A 249 -15.148 -22.566 -16.892 1.00 40.78 O ATOM 16 CB ASN A 249 -12.378 -23.171 -18.207 1.00 61.19 C ATOM 17 CG ASN A 249 -11.853 -23.815 -19.484 1.00 77.59 C ATOM 18 OD1 ASN A 249 -12.624 -24.315 -20.322 1.00 79.33 O ATOM 19 ND2 ASN A 249 -10.527 -23.807 -19.640 1.00 73.08 N ATOM 20 HD22 ASN A 249 -9.920 -23.377 -18.913 1.00 0.00 H ATOM 21 HD21 ASN A 249 -10.101 -24.230 -20.489 1.00 0.00 H ATOM 22 H ASN A 249 -13.232 -19.942 -18.619 1.00 0.00 H ATOM 23 N PHE A 250 -15.582 -23.102 -19.030 1.00 42.24 N ATOM 24 CA PHE A 250 -16.963 -23.488 -18.762 1.00 38.47 C ATOM 25 C PHE A 250 -17.037 -24.729 -17.866 1.00 33.76 C ATOM 26 O PHE A 250 -16.129 -25.571 -17.899 1.00 33.16 O ATOM 27 CB PHE A 250 -17.796 -23.600 -20.053 1.00 40.24 C ATOM 28 CG PHE A 250 -17.503 -24.818 -20.883 1.00 42.71 C ATOM 29 CD1 PHE A 250 -18.299 -25.969 -20.768 1.00 41.56 C ATOM 30 CD2 PHE A 250 -16.432 -24.828 -21.786 1.00 45.04 C ATOM 31 CE1 PHE A 250 -18.032 -27.102 -21.535 1.00 42.38 C ATOM 32 CE2 PHE A 250 -16.162 -25.958 -22.554 1.00 45.72 C ATOM 33 CZ PHE A 250 -16.962 -27.093 -22.427 1.00 44.61 C ATOM 34 H PHE A 250 -15.197 -23.210 -19.990 1.00 0.00 H ATOM 35 N PRO A 251 -18.115 -24.844 -17.065 1.00 30.32 N ATOM 36 CA PRO A 251 -18.257 -26.034 -16.219 1.00 29.07 C ATOM 37 C PRO A 251 -18.713 -27.273 -17.027 1.00 28.01 C ATOM 38 O PRO A 251 -19.554 -27.166 -17.933 1.00 29.65 O ATOM 39 CB PRO A 251 -19.315 -25.610 -15.201 1.00 27.56 C ATOM 40 CG PRO A 251 -20.160 -24.607 -15.936 1.00 30.60 C ATOM 41 CD PRO A 251 -19.245 -23.902 -16.896 1.00 30.96 C ATOM 42 N ASN A 252 -18.157 -28.431 -16.694 1.00 27.20 N ATOM 43 CA ASN A 252 -18.602 -29.685 -17.289 1.00 27.01 C ATOM 44 C ASN A 252 -19.943 -30.121 -16.705 1.00 27.60 C ATOM 45 O ASN A 252 -20.058 -30.400 -15.484 1.00 26.37 O ATOM 46 CB ASN A 252 -17.560 -30.801 -17.124 1.00 25.48 C ATOM 47 CG ASN A 252 -18.085 -32.153 -17.589 1.00 25.68 C ATOM 48 OD1 ASN A 252 -18.717 -32.270 -18.648 1.00 27.71 O ATOM 49 ND2 ASN A 252 -17.829 -33.180 -16.798 1.00 25.18 N ATOM 50 HD22 ASN A 252 -17.295 -33.037 -15.917 1.00 0.00 H ATOM 51 HD21 ASN A 252 -18.162 -34.131 -17.056 1.00 0.00 H ATOM 52 H ASN A 252 -17.388 -28.444 -15.994 1.00 0.00 H ATOM 53 N SER A 253 -20.946 -30.179 -17.574 1.00 27.84 N ATOM 54 CA SER A 253 -22.268 -30.676 -17.176 1.00 30.56 C ATOM 55 C SER A 253 -22.621 -32.037 -17.759 1.00 30.98 C ATOM 56 O SER A 253 -23.784 -32.420 -17.702 1.00 31.94 O ATOM 57 CB SER A 253 -23.369 -29.679 -17.516 1.00 29.27 C ATOM 58 OG SER A 253 -23.128 -28.462 -16.868 1.00 34.16 O ATOM 59 HG SER A 253 -22.256 -28.099 -17.164 1.00 0.00 H ATOM 60 H SER A 253 -20.792 -29.867 -18.554 1.00 0.00 H ATOM 61 N THR A 254 -21.642 -32.761 -18.313 1.00 31.05 N ATOM 62 CA THR A 254 -21.912 -34.139 -18.787 1.00 33.67 C ATOM 63 C THR A 254 -21.755 -35.124 -17.638 1.00 33.20 C ATOM 64 O THR A 254 -21.247 -34.758 -16.569 1.00 31.20 O ATOM 65 CB THR A 254 -20.982 -34.574 -19.943 1.00 34.29 C ATOM 66 OG1 THR A 254 -19.643 -34.747 -19.441 1.00 35.59 O ATOM 67 CG2 THR A 254 -20.995 -33.547 -21.064 1.00 33.53 C ATOM 68 HG1 THR A 254 -19.321 -33.891 -19.061 1.00 0.00 H ATOM 69 H THR A 254 -20.689 -32.356 -18.411 1.00 0.00 H ATOM 70 N ASN A 255 -22.190 -36.367 -17.862 1.00 36.35 N ATOM 71 CA ASN A 255 -22.042 -37.456 -16.881 1.00 35.86 C ATOM 72 C ASN A 255 -20.637 -38.048 -16.819 1.00 35.73 C ATOM 73 O ASN A 255 -20.391 -38.977 -16.057 1.00 40.97 O ATOM 74 CB ASN A 255 -23.089 -38.547 -17.120 1.00 38.81 C ATOM 75 CG ASN A 255 -24.500 -38.089 -16.767 1.00 41.60 C ATOM 76 OD1 ASN A 255 -24.867 -38.012 -15.589 1.00 45.49 O ATOM 77 ND2 ASN A 255 -25.299 -37.780 -17.789 1.00 41.56 N ATOM 78 HD22 ASN A 255 -24.949 -37.859 -18.765 1.00 0.00 H ATOM 79 HD21 ASN A 255 -26.272 -37.460 -17.610 1.00 0.00 H ATOM 80 H ASN A 255 -22.654 -36.575 -18.769 1.00 0.00 H ATOM 81 N LEU A 256 -19.725 -37.508 -17.617 1.00 35.60 N ATOM 82 CA LEU A 256 -18.340 -37.968 -17.658 1.00 37.39 C ATOM 83 C LEU A 256 -17.397 -36.955 -16.998 1.00 35.43 C ATOM 84 O LEU A 256 -17.411 -35.769 -17.341 1.00 35.10 O ATOM 85 CB LEU A 256 -17.890 -38.284 -19.091 1.00 40.53 C ATOM 86 CG LEU A 256 -18.818 -39.186 -19.921 1.00 44.62 C ATOM 87 CD1 LEU A 256 -19.705 -38.334 -20.806 1.00 47.29 C ATOM 88 CD2 LEU A 256 -18.036 -40.151 -20.788 1.00 46.60 C ATOM 89 H LEU A 256 -20.008 -36.724 -18.239 1.00 0.00 H ATOM 90 N PRO A 257 -16.575 -37.426 -16.047 1.00 35.66 N ATOM 91 CA PRO A 257 -15.696 -36.508 -15.312 1.00 35.21 C ATOM 92 C PRO A 257 -14.648 -35.870 -16.212 1.00 35.79 C ATOM 93 O PRO A 257 -14.117 -36.518 -17.106 1.00 38.19 O ATOM 94 CB PRO A 257 -15.026 -37.408 -14.263 1.00 33.87 C ATOM 95 CG PRO A 257 -15.129 -38.791 -14.815 1.00 36.63 C ATOM 96 CD PRO A 257 -16.409 -38.829 -15.605 1.00 36.01 C ATOM 97 N ARG A 258 -14.370 -34.599 -15.954 1.00 36.04 N ATOM 98 CA ARG A 258 -13.350 -33.863 -16.668 1.00 36.76 C ATOM 99 C ARG A 258 -11.933 -34.329 -16.292 1.00 36.26 C ATOM 100 O ARG A 258 -11.052 -34.367 -17.136 1.00 38.26 O ATOM 101 CB ARG A 258 -13.530 -32.360 -16.420 1.00 39.25 C ATOM 102 CG ARG A 258 -12.703 -31.520 -17.373 1.00 44.94 C ATOM 103 CD ARG A 258 -13.077 -30.069 -17.317 1.00 44.24 C ATOM 104 NE ARG A 258 -14.024 -29.739 -18.374 1.00 40.08 N ATOM 105 CZ ARG A 258 -14.727 -28.611 -18.395 1.00 40.24 C ATOM 106 NH1 ARG A 258 -14.584 -27.710 -17.415 1.00 35.14 N ATOM 107 NH2 ARG A 258 -15.569 -28.385 -19.391 1.00 39.29 N ATOM 108 HE ARG A 258 -14.156 -30.419 -19.150 1.00 0.00 H ATOM 109 HH12 ARG A 258 -15.136 -26.829 -17.435 1.00 0.00 H ATOM 110 HH11 ARG A 258 -13.921 -27.892 -16.634 1.00 0.00 H ATOM 111 HH22 ARG A 258 -16.123 -27.505 -19.414 1.00 0.00 H ATOM 112 HH21 ARG A 258 -15.677 -29.088 -20.150 1.00 0.00 H ATOM 113 H ARG A 258 -14.907 -34.112 -15.208 1.00 0.00 H ATOM 114 N ASN A 259 -11.728 -34.678 -15.027 1.00 33.53 N ATOM 115 CA ASN A 259 -10.458 -35.217 -14.575 1.00 33.53 C ATOM 116 C ASN A 259 -10.592 -36.647 -14.018 1.00 33.57 C ATOM 117 O ASN A 259 -10.679 -36.815 -12.800 1.00 35.61 O ATOM 118 CB ASN A 259 -9.831 -34.270 -13.542 1.00 33.62 C ATOM 119 CG ASN A 259 -8.362 -34.592 -13.244 1.00 36.18 C ATOM 120 OD1 ASN A 259 -7.799 -35.580 -13.723 1.00 37.27 O ATOM 121 ND2 ASN A 259 -7.739 -33.742 -12.438 1.00 37.58 N ATOM 122 HD22 ASN A 259 -8.249 -32.921 -12.054 1.00 0.00 H ATOM 123 HD21 ASN A 259 -6.741 -33.897 -12.190 1.00 0.00 H ATOM 124 H ASN A 259 -12.500 -34.562 -14.340 1.00 0.00 H ATOM 125 N PRO A 260 -10.607 -37.678 -14.899 1.00 36.14 N ATOM 126 CA PRO A 260 -10.748 -39.073 -14.430 1.00 37.45 C ATOM 127 C PRO A 260 -9.623 -39.575 -13.509 1.00 39.15 C ATOM 128 O PRO A 260 -9.884 -40.466 -12.704 1.00 40.02 O ATOM 129 CB PRO A 260 -10.768 -39.915 -15.720 1.00 39.77 C ATOM 130 CG PRO A 260 -10.801 -38.971 -16.861 1.00 38.97 C ATOM 131 CD PRO A 260 -10.482 -37.591 -16.370 1.00 38.21 C ATOM 132 N SER A 261 -8.405 -39.023 -13.621 1.00 38.15 N ATOM 133 CA SER A 261 -7.297 -39.397 -12.730 1.00 39.85 C ATOM 134 C SER A 261 -7.582 -39.073 -11.253 1.00 39.79 C ATOM 135 O SER A 261 -6.981 -39.660 -10.353 1.00 41.04 O ATOM 136 CB SER A 261 -5.971 -38.765 -13.178 1.00 41.29 C ATOM 137 OG SER A 261 -5.896 -37.390 -12.826 1.00 40.37 O ATOM 138 HG SER A 261 -6.638 -36.898 -13.260 1.00 0.00 H ATOM 139 H SER A 261 -8.240 -38.310 -14.360 1.00 0.00 H ATOM 140 N MET A 262 -8.502 -38.137 -11.036 1.00 38.40 N ATOM 141 CA MET A 262 -8.974 -37.744 -9.713 1.00 36.79 C ATOM 142 C MET A 262 -10.360 -38.313 -9.355 1.00 37.67 C ATOM 143 O MET A 262 -10.996 -37.833 -8.411 1.00 36.50 O ATOM 144 CB MET A 262 -8.986 -36.207 -9.608 1.00 34.17 C ATOM 145 CG MET A 262 -7.607 -35.580 -9.654 1.00 35.28 C ATOM 146 SD MET A 262 -6.650 -35.966 -8.170 1.00 36.69 S ATOM 147 CE MET A 262 -5.125 -36.614 -8.874 1.00 37.59 C ATOM 148 H MET A 262 -8.911 -37.655 -11.862 1.00 0.00 H ATOM 149 N ALA A 263 -10.827 -39.327 -10.097 1.00 37.04 N ATOM 150 CA ALA A 263 -12.130 -39.960 -9.805 1.00 36.31 C ATOM 151 C ALA A 263 -12.177 -40.720 -8.474 1.00 35.73 C ATOM 152 O ALA A 263 -13.252 -40.846 -7.889 1.00 33.94 O ATOM 153 CB ALA A 263 -12.609 -40.853 -10.962 1.00 35.00 C ATOM 154 H ALA A 263 -10.260 -39.676 -10.896 1.00 0.00 H ATOM 155 N ASP A 264 -11.032 -41.219 -8.003 1.00 37.15 N ATOM 156 CA ASP A 264 -11.010 -41.989 -6.754 1.00 41.88 C ATOM 157 C ASP A 264 -10.793 -41.089 -5.563 1.00 40.03 C ATOM 158 O ASP A 264 -9.982 -40.160 -5.618 1.00 41.57 O ATOM 159 CB ASP A 264 -9.949 -43.109 -6.760 1.00 47.27 C ATOM 160 CG ASP A 264 -10.286 -44.247 -7.706 1.00 50.17 C ATOM 161 OD1 ASP A 264 -11.483 -44.507 -7.967 1.00 52.18 O ATOM 162 OD2 ASP A 264 -9.338 -44.891 -8.195 1.00 57.93 O ATOM 163 H ASP A 264 -10.147 -41.061 -8.526 1.00 0.00 H ATOM 164 N TYR A 265 -11.522 -41.368 -4.488 1.00 40.35 N ATOM 165 CA TYR A 265 -11.370 -40.629 -3.234 1.00 39.68 C ATOM 166 C TYR A 265 -9.890 -40.564 -2.792 1.00 41.26 C ATOM 167 O TYR A 265 -9.393 -39.483 -2.445 1.00 38.85 O ATOM 168 CB TYR A 265 -12.277 -41.212 -2.139 1.00 39.94 C ATOM 169 CG TYR A 265 -12.004 -40.648 -0.762 1.00 43.16 C ATOM 170 CD1 TYR A 265 -12.546 -39.417 -0.371 1.00 38.95 C ATOM 171 CD2 TYR A 265 -11.200 -41.345 0.155 1.00 43.83 C ATOM 172 CE1 TYR A 265 -12.299 -38.899 0.883 1.00 39.72 C ATOM 173 CE2 TYR A 265 -10.947 -40.829 1.419 1.00 46.34 C ATOM 174 CZ TYR A 265 -11.499 -39.605 1.778 1.00 44.39 C ATOM 175 OH TYR A 265 -11.257 -39.079 3.030 1.00 44.03 O ATOM 176 HH TYR A 265 -11.592 -39.705 3.720 1.00 0.00 H ATOM 177 H TYR A 265 -12.222 -42.135 -4.539 1.00 0.00 H ATOM 178 N GLU A 266 -9.204 -41.707 -2.809 1.00 45.30 N ATOM 179 CA GLU A 266 -7.800 -41.776 -2.376 1.00 51.16 C ATOM 180 C GLU A 266 -6.860 -40.896 -3.200 1.00 46.95 C ATOM 181 O GLU A 266 -5.976 -40.248 -2.638 1.00 47.25 O ATOM 182 CB GLU A 266 -7.286 -43.222 -2.316 1.00 58.13 C ATOM 183 CG GLU A 266 -7.910 -44.084 -1.214 1.00 71.30 C ATOM 184 CD GLU A 266 -7.705 -43.553 0.213 1.00 80.94 C ATOM 185 OE1 GLU A 266 -6.704 -42.839 0.480 1.00 86.43 O ATOM 186 OE2 GLU A 266 -8.559 -43.855 1.084 1.00 78.55 O ATOM 187 H GLU A 266 -9.675 -42.574 -3.138 1.00 0.00 H ATOM 188 N ALA A 267 -7.050 -40.873 -4.520 1.00 43.61 N ATOM 189 CA ALA A 267 -6.262 -40.002 -5.389 1.00 41.79 C ATOM 190 C ALA A 267 -6.420 -38.523 -4.995 1.00 38.80 C ATOM 191 O ALA A 267 -5.429 -37.799 -4.896 1.00 42.48 O ATOM 192 CB ALA A 267 -6.596 -40.237 -6.870 1.00 39.92 C ATOM 193 H ALA A 267 -7.775 -41.489 -4.940 1.00 0.00 H ATOM 194 N ARG A 268 -7.656 -38.084 -4.773 1.00 36.32 N ATOM 195 CA ARG A 268 -7.934 -36.698 -4.350 1.00 34.78 C ATOM 196 C ARG A 268 -7.266 -36.388 -3.009 1.00 37.33 C ATOM 197 O ARG A 268 -6.671 -35.307 -2.840 1.00 37.00 O ATOM 198 CB ARG A 268 -9.444 -36.418 -4.274 1.00 30.83 C ATOM 199 CG ARG A 268 -10.168 -36.640 -5.592 1.00 30.53 C ATOM 200 CD ARG A 268 -11.539 -35.969 -5.658 1.00 30.20 C ATOM 201 NE ARG A 268 -12.581 -36.620 -4.842 1.00 29.50 N ATOM 202 CZ ARG A 268 -13.227 -37.744 -5.148 1.00 29.02 C ATOM 203 NH1 ARG A 268 -12.971 -38.407 -6.274 1.00 28.71 N ATOM 204 NH2 ARG A 268 -14.148 -38.216 -4.312 1.00 28.90 N ATOM 205 HE ARG A 268 -12.835 -36.159 -3.945 1.00 0.00 H ATOM 206 HH12 ARG A 268 -13.489 -39.283 -6.491 1.00 0.00 H ATOM 207 HH11 ARG A 268 -12.253 -38.049 -6.936 1.00 0.00 H ATOM 208 HH22 ARG A 268 -14.658 -39.093 -4.541 1.00 0.00 H ATOM 209 HH21 ARG A 268 -14.358 -37.708 -3.429 1.00 0.00 H ATOM 210 H ARG A 268 -8.453 -38.740 -4.902 1.00 0.00 H ATOM 211 N ILE A 269 -7.367 -37.335 -2.070 1.00 37.88 N ATOM 212 CA ILE A 269 -6.827 -37.144 -0.728 1.00 42.13 C ATOM 213 C ILE A 269 -5.316 -36.833 -0.746 1.00 42.36 C ATOM 214 O ILE A 269 -4.900 -35.937 -0.034 1.00 42.30 O ATOM 215 CB ILE A 269 -7.294 -38.231 0.294 1.00 46.16 C ATOM 216 CG1 ILE A 269 -7.478 -37.614 1.679 1.00 50.91 C ATOM 217 CG2 ILE A 269 -6.353 -39.430 0.396 1.00 49.91 C ATOM 218 CD1 ILE A 269 -8.843 -37.001 1.895 1.00 47.84 C ATOM 219 H ILE A 269 -7.843 -38.230 -2.302 1.00 0.00 H ATOM 220 N PHE A 270 -4.527 -37.561 -1.549 1.00 43.93 N ATOM 221 CA PHE A 270 -3.081 -37.302 -1.711 1.00 47.11 C ATOM 222 C PHE A 270 -2.710 -35.875 -2.137 1.00 42.04 C ATOM 223 O PHE A 270 -1.642 -35.395 -1.797 1.00 43.25 O ATOM 224 CB PHE A 270 -2.427 -38.288 -2.696 1.00 52.25 C ATOM 225 CG PHE A 270 -2.387 -39.718 -2.218 1.00 60.28 C ATOM 226 CD1 PHE A 270 -1.916 -40.045 -0.942 1.00 65.72 C ATOM 227 CD2 PHE A 270 -2.824 -40.752 -3.055 1.00 65.18 C ATOM 228 CE1 PHE A 270 -1.885 -41.374 -0.513 1.00 72.74 C ATOM 229 CE2 PHE A 270 -2.795 -42.080 -2.632 1.00 68.84 C ATOM 230 CZ PHE A 270 -2.325 -42.390 -1.360 1.00 70.49 C ATOM 231 H PHE A 270 -4.953 -38.345 -2.083 1.00 0.00 H ATOM 232 N THR A 271 -3.583 -35.203 -2.876 1.00 38.69 N ATOM 233 CA THR A 271 -3.249 -33.878 -3.420 1.00 37.34 C ATOM 234 C THR A 271 -3.064 -32.820 -2.323 1.00 36.26 C ATOM 235 O THR A 271 -2.349 -31.849 -2.530 1.00 37.01 O ATOM 236 CB THR A 271 -4.282 -33.380 -4.464 1.00 34.24 C ATOM 237 OG1 THR A 271 -5.564 -33.228 -3.840 1.00 31.75 O ATOM 238 CG2 THR A 271 -4.372 -34.348 -5.665 1.00 32.71 C ATOM 239 HG1 THR A 271 -5.858 -34.101 -3.476 1.00 0.00 H ATOM 240 H THR A 271 -4.516 -35.619 -3.073 1.00 0.00 H ATOM 241 N PHE A 272 -3.707 -33.020 -1.172 1.00 34.42 N ATOM 242 CA PHE A 272 -3.710 -32.029 -0.089 1.00 35.76 C ATOM 243 C PHE A 272 -2.386 -31.937 0.663 1.00 37.68 C ATOM 244 O PHE A 272 -1.863 -30.834 0.850 1.00 39.52 O ATOM 245 CB PHE A 272 -4.888 -32.248 0.879 1.00 34.95 C ATOM 246 CG PHE A 272 -6.243 -32.084 0.234 1.00 34.66 C ATOM 247 CD1 PHE A 272 -6.867 -33.161 -0.413 1.00 33.98 C ATOM 248 CD2 PHE A 272 -6.910 -30.851 0.267 1.00 35.29 C ATOM 249 CE1 PHE A 272 -8.115 -33.019 -1.009 1.00 30.84 C ATOM 250 CE2 PHE A 272 -8.171 -30.707 -0.336 1.00 32.53 C ATOM 251 CZ PHE A 272 -8.765 -31.795 -0.971 1.00 29.79 C ATOM 252 H PHE A 272 -4.226 -33.911 -1.037 1.00 0.00 H ATOM 253 N GLY A 273 -1.852 -33.083 1.087 1.00 37.87 N ATOM 254 CA GLY A 273 -0.695 -33.112 1.977 1.00 41.75 C ATOM 255 C GLY A 273 -1.112 -32.564 3.329 1.00 42.48 C ATOM 256 O GLY A 273 -2.288 -32.673 3.707 1.00 42.30 O ATOM 257 H GLY A 273 -2.272 -33.982 0.775 1.00 0.00 H ATOM 258 N THR A 274 -0.165 -31.978 4.055 1.00 43.71 N ATOM 259 CA THR A 274 -0.480 -31.247 5.275 1.00 45.24 C ATOM 260 C THR A 274 -1.321 -30.021 4.915 1.00 44.52 C ATOM 261 O THR A 274 -0.903 -29.166 4.135 1.00 45.03 O ATOM 262 CB THR A 274 0.788 -30.881 6.074 1.00 47.54 C ATOM 263 OG1 THR A 274 1.512 -32.082 6.343 1.00 48.53 O ATOM 264 CG2 THR A 274 0.441 -30.210 7.411 1.00 47.53 C ATOM 265 HG1 THR A 274 0.944 -32.697 6.871 1.00 0.00 H ATOM 266 H THR A 274 0.825 -32.043 3.744 1.00 0.00 H ATOM 267 N TRP A 275 -2.512 -29.966 5.507 1.00 44.56 N ATOM 268 CA TRP A 275 -3.538 -28.996 5.163 1.00 42.64 C ATOM 269 C TRP A 275 -3.818 -28.131 6.393 1.00 45.47 C ATOM 270 O TRP A 275 -4.343 -28.623 7.396 1.00 47.10 O ATOM 271 CB TRP A 275 -4.752 -29.790 4.719 1.00 41.28 C ATOM 272 CG TRP A 275 -5.883 -29.058 4.125 1.00 38.97 C ATOM 273 CD1 TRP A 275 -7.102 -28.845 4.706 1.00 38.95 C ATOM 274 CD2 TRP A 275 -5.933 -28.434 2.836 1.00 38.31 C ATOM 275 NE1 TRP A 275 -7.907 -28.128 3.864 1.00 37.84 N ATOM 276 CE2 TRP A 275 -7.224 -27.859 2.707 1.00 36.49 C ATOM 277 CE3 TRP A 275 -5.015 -28.302 1.773 1.00 38.56 C ATOM 278 CZ2 TRP A 275 -7.630 -27.158 1.556 1.00 35.18 C ATOM 279 CZ3 TRP A 275 -5.414 -27.604 0.623 1.00 37.52 C ATOM 280 CH2 TRP A 275 -6.717 -27.039 0.525 1.00 36.09 C ATOM 281 HE1 TRP A 275 -8.883 -27.834 4.069 1.00 0.00 H ATOM 282 H TRP A 275 -2.720 -30.655 6.257 1.00 0.00 H ATOM 283 N ILE A 276 -3.463 -26.846 6.313 1.00 46.05 N ATOM 284 CA ILE A 276 -3.571 -25.934 7.470 1.00 49.78 C ATOM 285 C ILE A 276 -4.927 -25.218 7.563 1.00 48.14 C ATOM 286 O ILE A 276 -5.241 -24.603 8.576 1.00 50.55 O ATOM 287 CB ILE A 276 -2.428 -24.875 7.524 1.00 51.97 C ATOM 288 CG1 ILE A 276 -2.453 -23.950 6.280 1.00 51.73 C ATOM 289 CG2 ILE A 276 -1.080 -25.549 7.744 1.00 52.88 C ATOM 290 CD1 ILE A 276 -1.794 -22.591 6.486 1.00 54.02 C ATOM 291 H ILE A 276 -3.100 -26.477 5.411 1.00 0.00 H ATOM 292 N TYR A 277 -5.714 -25.308 6.503 1.00 45.50 N ATOM 293 CA TYR A 277 -6.920 -24.504 6.351 1.00 47.11 C ATOM 294 C TYR A 277 -8.108 -24.977 7.197 1.00 50.36 C ATOM 295 O TYR A 277 -8.184 -26.157 7.599 1.00 47.66 O ATOM 296 CB TYR A 277 -7.258 -24.352 4.866 1.00 42.52 C ATOM 297 CG TYR A 277 -6.072 -23.794 4.105 1.00 41.33 C ATOM 298 CD1 TYR A 277 -5.332 -24.605 3.228 1.00 38.84 C ATOM 299 CD2 TYR A 277 -5.683 -22.450 4.262 1.00 41.71 C ATOM 300 CE1 TYR A 277 -4.243 -24.090 2.532 1.00 38.25 C ATOM 301 CE2 TYR A 277 -4.597 -21.935 3.569 1.00 41.60 C ATOM 302 CZ TYR A 277 -3.887 -22.758 2.711 1.00 39.72 C ATOM 303 OH TYR A 277 -2.823 -22.255 2.031 1.00 41.55 O ATOM 304 HH TYR A 277 -2.428 -22.965 1.466 1.00 0.00 H ATOM 305 H TYR A 277 -5.462 -25.979 5.749 1.00 0.00 H ATOM 306 N SER A 278 -9.019 -24.032 7.452 1.00 55.55 N ATOM 307 CA SER A 278 -10.201 -24.233 8.315 1.00 62.00 C ATOM 308 C SER A 278 -11.124 -25.343 7.786 1.00 55.68 C ATOM 309 O SER A 278 -11.750 -26.072 8.554 1.00 58.98 O ATOM 310 CB SER A 278 -10.982 -22.914 8.484 1.00 67.57 C ATOM 311 OG SER A 278 -11.496 -22.445 7.239 1.00 67.18 O ATOM 312 HG SER A 278 -11.990 -21.599 7.385 1.00 0.00 H ATOM 313 H SER A 278 -8.887 -23.097 7.016 1.00 0.00 H ATOM 314 N VAL A 279 -11.192 -25.454 6.469 1.00 48.13 N ATOM 315 CA VAL A 279 -11.984 -26.478 5.821 1.00 46.64 C ATOM 316 C VAL A 279 -11.288 -27.857 5.857 1.00 45.97 C ATOM 317 O VAL A 279 -10.090 -27.981 5.590 1.00 44.45 O ATOM 318 CB VAL A 279 -12.348 -26.025 4.397 1.00 43.58 C ATOM 319 CG1 VAL A 279 -11.090 -25.843 3.543 1.00 42.10 C ATOM 320 CG2 VAL A 279 -13.374 -26.950 3.769 1.00 40.38 C ATOM 321 H VAL A 279 -10.659 -24.783 5.880 1.00 0.00 H ATOM 322 N ASN A 280 -12.080 -28.871 6.194 1.00 45.68 N ATOM 323 CA ASN A 280 -11.658 -30.249 6.388 1.00 46.51 C ATOM 324 C ASN A 280 -11.364 -30.970 5.050 1.00 44.59 C ATOM 325 O ASN A 280 -12.231 -31.036 4.162 1.00 40.96 O ATOM 326 CB ASN A 280 -12.777 -30.936 7.177 1.00 51.78 C ATOM 327 CG ASN A 280 -12.487 -32.385 7.493 1.00 54.43 C ATOM 328 OD1 ASN A 280 -12.609 -33.250 6.629 1.00 55.88 O ATOM 329 ND2 ASN A 280 -12.104 -32.658 8.734 1.00 55.91 N ATOM 330 HD22 ASN A 280 -12.015 -31.891 9.431 1.00 0.00 H ATOM 331 HD21 ASN A 280 -11.893 -33.638 9.009 1.00 0.00 H ATOM 332 H ASN A 280 -13.089 -28.660 6.331 1.00 0.00 H ATOM 333 N LYS A 281 -10.147 -31.506 4.913 1.00 42.65 N ATOM 334 CA LYS A 281 -9.700 -32.115 3.653 1.00 40.76 C ATOM 335 C LYS A 281 -10.427 -33.403 3.257 1.00 39.97 C ATOM 336 O LYS A 281 -10.657 -33.627 2.066 1.00 36.36 O ATOM 337 CB LYS A 281 -8.167 -32.278 3.580 1.00 40.01 C ATOM 338 CG LYS A 281 -7.562 -33.347 4.471 1.00 44.26 C ATOM 339 CD LYS A 281 -6.201 -33.755 3.929 1.00 46.53 C ATOM 340 CE LYS A 281 -5.407 -34.565 4.932 1.00 49.79 C ATOM 341 NZ LYS A 281 -3.986 -34.688 4.502 1.00 55.23 N ATOM 342 HZ1 LYS A 281 -3.945 -35.163 3.578 1.00 0.00 H ATOM 343 HZ2 LYS A 281 -3.565 -33.740 4.426 1.00 0.00 H ATOM 344 HZ3 LYS A 281 -3.460 -35.247 5.204 1.00 0.00 H ATOM 345 H LYS A 281 -9.496 -31.491 5.724 1.00 0.00 H ATOM 346 N GLU A 282 -10.784 -34.238 4.237 1.00 44.05 N ATOM 347 CA GLU A 282 -11.578 -35.436 3.944 1.00 47.00 C ATOM 348 C GLU A 282 -12.989 -35.072 3.451 1.00 43.62 C ATOM 349 O GLU A 282 -13.474 -35.659 2.488 1.00 41.22 O ATOM 350 CB GLU A 282 -11.567 -36.499 5.067 1.00 52.59 C ATOM 351 CG GLU A 282 -11.199 -36.069 6.485 1.00 67.37 C ATOM 352 CD GLU A 282 -9.707 -35.860 6.722 1.00 67.22 C ATOM 353 OE1 GLU A 282 -8.906 -36.781 6.453 1.00 67.79 O ATOM 354 OE2 GLU A 282 -9.337 -34.758 7.185 1.00 70.83 O ATOM 355 H GLU A 282 -10.496 -34.037 5.216 1.00 0.00 H ATOM 356 N GLN A 283 -13.618 -34.106 4.122 1.00 44.67 N ATOM 357 CA GLN A 283 -14.890 -33.498 3.719 1.00 43.01 C ATOM 358 C GLN A 283 -14.814 -32.988 2.274 1.00 38.77 C ATOM 359 O GLN A 283 -15.727 -33.226 1.481 1.00 35.74 O ATOM 360 CB GLN A 283 -15.199 -32.334 4.665 1.00 49.49 C ATOM 361 CG GLN A 283 -16.636 -32.183 5.153 1.00 58.72 C ATOM 362 CD GLN A 283 -16.713 -31.380 6.459 1.00 63.65 C ATOM 363 OE1 GLN A 283 -16.943 -31.949 7.537 1.00 67.51 O ATOM 364 NE2 GLN A 283 -16.519 -30.054 6.368 1.00 55.16 N ATOM 365 HE22 GLN A 283 -16.329 -29.619 5.443 1.00 0.00 H ATOM 366 HE21 GLN A 283 -16.559 -29.463 7.223 1.00 0.00 H ATOM 367 H GLN A 283 -13.173 -33.758 4.996 1.00 0.00 H ATOM 368 N LEU A 284 -13.720 -32.292 1.949 1.00 36.03 N ATOM 369 CA LEU A 284 -13.471 -31.776 0.601 1.00 32.77 C ATOM 370 C LEU A 284 -13.333 -32.895 -0.425 1.00 33.11 C ATOM 371 O LEU A 284 -13.945 -32.843 -1.490 1.00 28.44 O ATOM 372 CB LEU A 284 -12.230 -30.878 0.566 1.00 31.90 C ATOM 373 CG LEU A 284 -12.407 -29.437 1.054 1.00 33.93 C ATOM 374 CD1 LEU A 284 -11.056 -28.827 1.392 1.00 35.61 C ATOM 375 CD2 LEU A 284 -13.163 -28.575 0.054 1.00 30.49 C ATOM 376 H LEU A 284 -13.012 -32.108 2.688 1.00 0.00 H ATOM 377 N ALA A 285 -12.527 -33.905 -0.101 1.00 34.87 N ATOM 378 CA ALA A 285 -12.319 -35.009 -1.023 1.00 34.46 C ATOM 379 C ALA A 285 -13.631 -35.731 -1.276 1.00 33.46 C ATOM 380 O ALA A 285 -13.902 -36.105 -2.422 1.00 34.55 O ATOM 381 CB ALA A 285 -11.228 -35.945 -0.539 1.00 34.38 C ATOM 382 H ALA A 285 -12.043 -33.903 0.819 1.00 0.00 H ATOM 383 N ARG A 286 -14.427 -35.919 -0.218 1.00 33.35 N ATOM 384 CA ARG A 286 -15.778 -36.512 -0.307 1.00 34.48 C ATOM 385 C ARG A 286 -16.721 -35.735 -1.232 1.00 34.22 C ATOM 386 O ARG A 286 -17.499 -36.346 -1.971 1.00 35.72 O ATOM 387 CB ARG A 286 -16.411 -36.669 1.083 1.00 36.82 C ATOM 388 CG ARG A 286 -16.147 -38.011 1.749 1.00 40.35 C ATOM 389 CD ARG A 286 -16.987 -38.174 3.013 1.00 43.83 C ATOM 390 NE ARG A 286 -16.236 -37.801 4.210 1.00 50.45 N ATOM 391 CZ ARG A 286 -16.436 -36.710 4.947 1.00 52.40 C ATOM 392 NH1 ARG A 286 -17.384 -35.831 4.635 1.00 58.82 N ATOM 393 NH2 ARG A 286 -15.677 -36.498 6.009 1.00 52.99 N ATOM 394 HE ARG A 286 -15.478 -38.445 4.513 1.00 0.00 H ATOM 395 HH12 ARG A 286 -17.523 -34.985 5.224 1.00 0.00 H ATOM 396 HH11 ARG A 286 -17.986 -35.989 3.802 1.00 0.00 H ATOM 397 HH22 ARG A 286 -15.824 -35.649 6.592 1.00 0.00 H ATOM 398 HH21 ARG A 286 -14.933 -37.180 6.261 1.00 0.00 H ATOM 399 H ARG A 286 -14.076 -35.632 0.718 1.00 0.00 H ATOM 400 N ALA A 287 -16.640 -34.399 -1.182 1.00 30.85 N ATOM 401 CA ALA A 287 -17.435 -33.524 -2.038 1.00 28.42 C ATOM 402 C ALA A 287 -16.863 -33.399 -3.472 1.00 29.47 C ATOM 403 O ALA A 287 -17.336 -32.578 -4.265 1.00 30.23 O ATOM 404 CB ALA A 287 -17.604 -32.157 -1.395 1.00 24.84 C ATOM 405 H ALA A 287 -15.982 -33.966 -0.503 1.00 0.00 H ATOM 406 N GLY A 288 -15.854 -34.214 -3.780 1.00 29.69 N ATOM 407 CA GLY A 288 -15.299 -34.359 -5.128 1.00 30.15 C ATOM 408 C GLY A 288 -14.101 -33.479 -5.418 1.00 29.75 C ATOM 409 O GLY A 288 -13.634 -33.439 -6.562 1.00 30.51 O ATOM 410 H GLY A 288 -15.435 -34.782 -3.016 1.00 0.00 H ATOM 411 N PHE A 289 -13.608 -32.780 -4.395 1.00 25.45 N ATOM 412 CA PHE A 289 -12.544 -31.810 -4.574 1.00 26.23 C ATOM 413 C PHE A 289 -11.137 -32.385 -4.345 1.00 26.82 C ATOM 414 O PHE A 289 -10.919 -33.231 -3.470 1.00 28.72 O ATOM 415 CB PHE A 289 -12.788 -30.575 -3.692 1.00 26.12 C ATOM 416 CG PHE A 289 -14.009 -29.780 -4.078 1.00 26.97 C ATOM 417 CD1 PHE A 289 -14.027 -29.008 -5.259 1.00 25.29 C ATOM 418 CD2 PHE A 289 -15.148 -29.797 -3.268 1.00 26.62 C ATOM 419 CE1 PHE A 289 -15.148 -28.279 -5.613 1.00 24.28 C ATOM 420 CE2 PHE A 289 -16.274 -29.069 -3.617 1.00 25.68 C ATOM 421 CZ PHE A 289 -16.274 -28.308 -4.792 1.00 25.82 C ATOM 422 H PHE A 289 -13.997 -32.934 -3.443 1.00 0.00 H ATOM 423 N TYR A 290 -10.187 -31.915 -5.143 1.00 26.98 N ATOM 424 CA TYR A 290 -8.759 -32.183 -4.918 1.00 29.27 C ATOM 425 C TYR A 290 -8.047 -30.834 -4.888 1.00 30.09 C ATOM 426 O TYR A 290 -8.527 -29.876 -5.511 1.00 30.86 O ATOM 427 CB TYR A 290 -8.184 -33.127 -5.994 1.00 30.92 C ATOM 428 CG TYR A 290 -8.264 -32.578 -7.409 1.00 33.01 C ATOM 429 CD1 TYR A 290 -7.160 -31.944 -8.011 1.00 34.49 C ATOM 430 CD2 TYR A 290 -9.442 -32.689 -8.149 1.00 32.88 C ATOM 431 CE1 TYR A 290 -7.242 -31.441 -9.313 1.00 35.72 C ATOM 432 CE2 TYR A 290 -9.530 -32.192 -9.442 1.00 35.60 C ATOM 433 CZ TYR A 290 -8.439 -31.573 -10.019 1.00 34.53 C ATOM 434 OH TYR A 290 -8.569 -31.095 -11.302 1.00 34.20 O ATOM 435 HH TYR A 290 -9.292 -30.419 -11.330 1.00 0.00 H ATOM 436 H TYR A 290 -10.463 -31.334 -5.960 1.00 0.00 H ATOM 437 N ALA A 291 -6.920 -30.767 -4.173 1.00 31.14 N ATOM 438 CA ALA A 291 -6.119 -29.543 -4.020 1.00 33.89 C ATOM 439 C ALA A 291 -5.207 -29.241 -5.208 1.00 36.17 C ATOM 440 O ALA A 291 -4.640 -30.159 -5.830 1.00 34.60 O ATOM 441 CB ALA A 291 -5.274 -29.620 -2.757 1.00 33.97 C ATOM 442 H ALA A 291 -6.590 -31.631 -3.697 1.00 0.00 H ATOM 443 N LEU A 292 -5.069 -27.950 -5.515 1.00 35.94 N ATOM 444 CA LEU A 292 -4.147 -27.505 -6.569 1.00 37.28 C ATOM 445 C LEU A 292 -2.736 -27.161 -6.060 1.00 38.73 C ATOM 446 O LEU A 292 -1.814 -26.990 -6.864 1.00 38.37 O ATOM 447 CB LEU A 292 -4.742 -26.336 -7.362 1.00 37.92 C ATOM 448 CG LEU A 292 -6.081 -26.525 -8.092 1.00 39.97 C ATOM 449 CD1 LEU A 292 -6.350 -25.266 -8.891 1.00 42.59 C ATOM 450 CD2 LEU A 292 -6.087 -27.740 -9.006 1.00 38.25 C ATOM 451 H LEU A 292 -5.627 -27.242 -4.996 1.00 0.00 H ATOM 452 N GLY A 293 -2.581 -27.064 -4.737 1.00 38.27 N ATOM 453 CA GLY A 293 -1.321 -26.679 -4.117 1.00 39.69 C ATOM 454 C GLY A 293 -1.069 -25.184 -4.129 1.00 41.95 C ATOM 455 O GLY A 293 0.072 -24.745 -4.009 1.00 45.30 O ATOM 456 H GLY A 293 -3.395 -27.272 -4.124 1.00 0.00 H ATOM 457 N GLU A 294 -2.132 -24.400 -4.272 1.00 42.05 N ATOM 458 CA GLU A 294 -2.035 -22.937 -4.291 1.00 46.83 C ATOM 459 C GLU A 294 -3.055 -22.374 -3.300 1.00 44.59 C ATOM 460 O GLU A 294 -4.251 -22.254 -3.614 1.00 42.43 O ATOM 461 CB GLU A 294 -2.288 -22.423 -5.713 1.00 52.90 C ATOM 462 CG GLU A 294 -1.850 -20.979 -5.949 1.00 66.31 C ATOM 463 CD GLU A 294 -2.182 -20.472 -7.350 1.00 73.02 C ATOM 464 OE1 GLU A 294 -1.949 -19.275 -7.597 1.00 74.48 O ATOM 465 OE2 GLU A 294 -2.672 -21.254 -8.206 1.00 71.65 O ATOM 466 H GLU A 294 -3.068 -24.841 -4.374 1.00 0.00 H ATOM 467 N GLY A 295 -2.586 -22.032 -2.104 1.00 43.76 N ATOM 468 CA GLY A 295 -3.481 -21.730 -0.985 1.00 43.93 C ATOM 469 C GLY A 295 -4.522 -22.828 -0.791 1.00 42.41 C ATOM 470 O GLY A 295 -4.214 -24.021 -0.896 1.00 44.28 O ATOM 471 H GLY A 295 -1.558 -21.978 -1.959 1.00 0.00 H ATOM 472 N ASP A 296 -5.758 -22.433 -0.507 1.00 40.42 N ATOM 473 CA ASP A 296 -6.853 -23.401 -0.375 1.00 38.34 C ATOM 474 C ASP A 296 -7.680 -23.588 -1.676 1.00 33.84 C ATOM 475 O ASP A 296 -8.856 -23.946 -1.619 1.00 31.96 O ATOM 476 CB ASP A 296 -7.750 -23.051 0.835 1.00 38.59 C ATOM 477 CG ASP A 296 -8.400 -21.665 0.725 1.00 41.09 C ATOM 478 OD1 ASP A 296 -8.305 -20.991 -0.331 1.00 41.60 O ATOM 479 OD2 ASP A 296 -9.019 -21.240 1.715 1.00 44.34 O ATOM 480 H ASP A 296 -5.953 -21.420 -0.376 1.00 0.00 H ATOM 481 N LYS A 297 -7.064 -23.347 -2.833 1.00 35.38 N ATOM 482 CA LYS A 297 -7.719 -23.587 -4.141 1.00 35.27 C ATOM 483 C LYS A 297 -7.953 -25.075 -4.379 1.00 34.61 C ATOM 484 O LYS A 297 -7.012 -25.875 -4.348 1.00 35.78 O ATOM 485 CB LYS A 297 -6.931 -22.973 -5.303 1.00 35.31 C ATOM 486 CG LYS A 297 -7.165 -21.474 -5.444 1.00 38.89 C ATOM 487 CD LYS A 297 -6.197 -20.750 -6.376 1.00 42.31 C ATOM 488 CE LYS A 297 -6.489 -21.028 -7.841 1.00 42.30 C ATOM 489 NZ LYS A 297 -5.784 -20.034 -8.708 1.00 48.24 N ATOM 490 HZ1 LYS A 297 -6.112 -19.076 -8.472 1.00 0.00 H ATOM 491 HZ2 LYS A 297 -4.759 -20.101 -8.547 1.00 0.00 H ATOM 492 HZ3 LYS A 297 -5.993 -20.237 -9.706 1.00 0.00 H ATOM 493 H LYS A 297 -6.092 -22.978 -2.818 1.00 0.00 H ATOM 494 N VAL A 298 -9.214 -25.432 -4.613 1.00 33.74 N ATOM 495 CA VAL A 298 -9.584 -26.796 -4.999 1.00 32.76 C ATOM 496 C VAL A 298 -10.357 -26.822 -6.325 1.00 32.15 C ATOM 497 O VAL A 298 -10.911 -25.804 -6.746 1.00 32.61 O ATOM 498 CB VAL A 298 -10.387 -27.513 -3.882 1.00 32.95 C ATOM 499 CG1 VAL A 298 -9.534 -27.632 -2.619 1.00 35.06 C ATOM 500 CG2 VAL A 298 -11.712 -26.805 -3.599 1.00 30.11 C ATOM 501 H VAL A 298 -9.963 -24.717 -4.518 1.00 0.00 H ATOM 502 N LYS A 299 -10.385 -27.985 -6.970 1.00 32.27 N ATOM 503 CA LYS A 299 -11.200 -28.228 -8.166 1.00 31.30 C ATOM 504 C LYS A 299 -11.951 -29.532 -7.999 1.00 30.32 C ATOM 505 O LYS A 299 -11.418 -30.495 -7.405 1.00 27.28 O ATOM 506 CB LYS A 299 -10.331 -28.391 -9.415 1.00 35.68 C ATOM 507 CG LYS A 299 -10.166 -27.179 -10.307 1.00 42.77 C ATOM 508 CD LYS A 299 -9.373 -27.571 -11.548 1.00 47.30 C ATOM 509 CE LYS A 299 -9.689 -26.677 -12.737 1.00 54.60 C ATOM 510 NZ LYS A 299 -9.115 -25.308 -12.556 1.00 69.95 N ATOM 511 HZ1 LYS A 299 -9.517 -24.875 -11.700 1.00 0.00 H ATOM 512 HZ2 LYS A 299 -8.082 -25.377 -12.459 1.00 0.00 H ATOM 513 HZ3 LYS A 299 -9.348 -24.723 -13.384 1.00 0.00 H ATOM 514 H LYS A 299 -9.798 -28.763 -6.607 1.00 0.00 H ATOM 515 N CYS A 300 -13.181 -29.563 -8.522 1.00 27.71 N ATOM 516 CA CYS A 300 -13.953 -30.797 -8.600 1.00 26.25 C ATOM 517 C CYS A 300 -13.436 -31.656 -9.741 1.00 26.45 C ATOM 518 O CYS A 300 -13.254 -31.151 -10.859 1.00 28.53 O ATOM 519 CB CYS A 300 -15.437 -30.478 -8.803 1.00 25.85 C ATOM 520 SG CYS A 300 -16.479 -31.929 -9.071 1.00 29.73 S ATOM 521 H CYS A 300 -13.599 -28.682 -8.883 1.00 0.00 H ATOM 522 N PHE A 301 -13.201 -32.945 -9.468 1.00 26.59 N ATOM 523 CA PHE A 301 -12.731 -33.901 -10.493 1.00 26.30 C ATOM 524 C PHE A 301 -13.685 -34.040 -11.669 1.00 25.66 C ATOM 525 O PHE A 301 -13.264 -34.316 -12.797 1.00 27.86 O ATOM 526 CB PHE A 301 -12.441 -35.284 -9.895 1.00 27.92 C ATOM 527 CG PHE A 301 -13.651 -36.179 -9.758 1.00 28.11 C ATOM 528 CD1 PHE A 301 -14.000 -37.077 -10.783 1.00 30.22 C ATOM 529 CD2 PHE A 301 -14.445 -36.132 -8.615 1.00 25.01 C ATOM 530 CE1 PHE A 301 -15.116 -37.903 -10.658 1.00 30.09 C ATOM 531 CE2 PHE A 301 -15.557 -36.954 -8.487 1.00 26.10 C ATOM 532 CZ PHE A 301 -15.897 -37.841 -9.507 1.00 27.62 C ATOM 533 H PHE A 301 -13.355 -33.287 -8.498 1.00 0.00 H ATOM 534 N HIS A 302 -14.969 -33.847 -11.392 1.00 26.38 N ATOM 535 CA HIS A 302 -16.015 -34.100 -12.356 1.00 26.08 C ATOM 536 C HIS A 302 -16.389 -32.878 -13.187 1.00 28.34 C ATOM 537 O HIS A 302 -16.224 -32.910 -14.411 1.00 28.83 O ATOM 538 CB HIS A 302 -17.231 -34.679 -11.679 1.00 25.14 C ATOM 539 CG HIS A 302 -18.130 -35.390 -12.631 1.00 28.93 C ATOM 540 ND1 HIS A 302 -19.003 -34.728 -13.465 1.00 29.72 N ATOM 541 CD2 HIS A 302 -18.288 -36.708 -12.885 1.00 29.70 C ATOM 542 CE1 HIS A 302 -19.663 -35.610 -14.192 1.00 32.39 C ATOM 543 NE2 HIS A 302 -19.246 -36.818 -13.857 1.00 34.42 N ATOM 544 H HIS A 302 -15.231 -33.501 -10.447 1.00 0.00 H ATOM 545 N CYS A 303 -16.884 -31.818 -12.528 1.00 29.18 N ATOM 546 CA CYS A 303 -17.277 -30.576 -13.221 1.00 29.23 C ATOM 547 C CYS A 303 -16.108 -29.647 -13.594 1.00 27.93 C ATOM 548 O CYS A 303 -16.252 -28.788 -14.470 1.00 28.06 O ATOM 549 CB CYS A 303 -18.392 -29.817 -12.475 1.00 26.35 C ATOM 550 SG CYS A 303 -18.000 -29.109 -10.848 1.00 27.13 S ATOM 551 H CYS A 303 -16.994 -31.874 -11.495 1.00 0.00 H ATOM 552 N GLY A 304 -14.964 -29.819 -12.937 1.00 28.10 N ATOM 553 CA GLY A 304 -13.803 -28.950 -13.154 1.00 27.52 C ATOM 554 C GLY A 304 -13.902 -27.656 -12.353 1.00 30.36 C ATOM 555 O GLY A 304 -13.006 -26.828 -12.410 1.00 31.15 O ATOM 556 H GLY A 304 -14.891 -30.594 -12.248 1.00 0.00 H ATOM 557 N GLY A 305 -14.995 -27.490 -11.607 1.00 29.90 N ATOM 558 CA GLY A 305 -15.275 -26.258 -10.893 1.00 29.95 C ATOM 559 C GLY A 305 -14.304 -25.935 -9.775 1.00 32.31 C ATOM 560 O GLY A 305 -14.044 -26.771 -8.906 1.00 29.70 O ATOM 561 H GLY A 305 -15.674 -28.275 -11.534 1.00 0.00 H ATOM 562 N GLY A 306 -13.777 -24.713 -9.811 1.00 32.34 N ATOM 563 CA GLY A 306 -12.770 -24.254 -8.871 1.00 31.48 C ATOM 564 C GLY A 306 -13.335 -23.380 -7.771 1.00 33.69 C ATOM 565 O GLY A 306 -14.238 -22.558 -8.006 1.00 34.74 O ATOM 566 H GLY A 306 -14.102 -24.055 -10.548 1.00 0.00 H ATOM 567 N LEU A 307 -12.798 -23.561 -6.566 1.00 31.89 N ATOM 568 CA LEU A 307 -13.184 -22.768 -5.401 1.00 32.88 C ATOM 569 C LEU A 307 -11.977 -22.400 -4.562 1.00 35.50 C ATOM 570 O LEU A 307 -10.981 -23.136 -4.544 1.00 34.26 O ATOM 571 CB LEU A 307 -14.222 -23.500 -4.543 1.00 31.78 C ATOM 572 CG LEU A 307 -15.582 -23.841 -5.160 1.00 31.64 C ATOM 573 CD1 LEU A 307 -16.326 -24.772 -4.221 1.00 32.84 C ATOM 574 CD2 LEU A 307 -16.396 -22.590 -5.457 1.00 33.33 C ATOM 575 H LEU A 307 -12.073 -24.298 -6.449 1.00 0.00 H ATOM 576 N THR A 308 -12.083 -21.259 -3.873 1.00 35.79 N ATOM 577 CA THR A 308 -10.997 -20.709 -3.061 1.00 38.02 C ATOM 578 C THR A 308 -11.503 -19.961 -1.808 1.00 38.55 C ATOM 579 O THR A 308 -12.707 -19.737 -1.657 1.00 38.55 O ATOM 580 CB THR A 308 -10.079 -19.799 -3.917 1.00 40.33 C ATOM 581 OG1 THR A 308 -8.804 -19.700 -3.284 1.00 44.85 O ATOM 582 CG2 THR A 308 -10.667 -18.385 -4.131 1.00 38.65 C ATOM 583 HG1 THR A 308 -8.915 -19.309 -2.381 1.00 0.00 H ATOM 584 H THR A 308 -12.981 -20.737 -3.916 1.00 0.00 H ATOM 585 N ASP A 309 -10.576 -19.584 -0.926 1.00 39.43 N ATOM 586 CA ASP A 309 -10.849 -18.694 0.221 1.00 43.37 C ATOM 587 C ASP A 309 -11.953 -19.220 1.138 1.00 41.88 C ATOM 588 O ASP A 309 -12.961 -18.551 1.387 1.00 43.29 O ATOM 589 CB ASP A 309 -11.142 -17.246 -0.230 1.00 49.26 C ATOM 590 CG ASP A 309 -9.977 -16.597 -0.965 1.00 55.74 C ATOM 591 OD1 ASP A 309 -10.134 -15.438 -1.394 1.00 61.53 O ATOM 592 OD2 ASP A 309 -8.904 -17.223 -1.123 1.00 60.32 O ATOM 593 H ASP A 309 -9.606 -19.937 -1.053 1.00 0.00 H ATOM 594 N TRP A 310 -11.735 -20.435 1.632 1.00 40.57 N ATOM 595 CA TRP A 310 -12.686 -21.143 2.474 1.00 39.80 C ATOM 596 C TRP A 310 -12.751 -20.502 3.857 1.00 43.51 C ATOM 597 O TRP A 310 -11.782 -20.561 4.601 1.00 44.79 O ATOM 598 CB TRP A 310 -12.261 -22.607 2.581 1.00 37.97 C ATOM 599 CG TRP A 310 -12.437 -23.352 1.289 1.00 36.37 C ATOM 600 CD1 TRP A 310 -11.524 -23.497 0.282 1.00 34.69 C ATOM 601 CD2 TRP A 310 -13.611 -24.053 0.874 1.00 34.32 C ATOM 602 NE1 TRP A 310 -12.060 -24.251 -0.743 1.00 33.75 N ATOM 603 CE2 TRP A 310 -13.341 -24.603 -0.400 1.00 31.94 C ATOM 604 CE3 TRP A 310 -14.871 -24.271 1.459 1.00 33.89 C ATOM 605 CZ2 TRP A 310 -14.281 -25.353 -1.096 1.00 30.79 C ATOM 606 CZ3 TRP A 310 -15.798 -25.012 0.769 1.00 31.11 C ATOM 607 CH2 TRP A 310 -15.502 -25.548 -0.498 1.00 30.74 C ATOM 608 HE1 TRP A 310 -11.575 -24.509 -1.626 1.00 0.00 H ATOM 609 H TRP A 310 -10.836 -20.905 1.404 1.00 0.00 H ATOM 610 N LYS A 311 -13.899 -19.895 4.176 1.00 46.35 N ATOM 611 CA LYS A 311 -14.238 -19.424 5.526 1.00 49.72 C ATOM 612 C LYS A 311 -14.645 -20.649 6.360 1.00 49.03 C ATOM 613 O LYS A 311 -15.093 -21.648 5.778 1.00 46.19 O ATOM 614 CB LYS A 311 -15.378 -18.402 5.482 1.00 52.27 C ATOM 615 CG LYS A 311 -14.946 -16.974 5.177 1.00 59.66 C ATOM 616 CD LYS A 311 -15.185 -16.611 3.720 1.00 64.10 C ATOM 617 CE LYS A 311 -14.013 -15.829 3.131 1.00 69.17 C ATOM 618 NZ LYS A 311 -13.869 -16.087 1.660 1.00 59.72 N ATOM 619 HZ1 LYS A 311 -13.703 -17.101 1.502 1.00 0.00 H ATOM 620 HZ2 LYS A 311 -14.740 -15.797 1.171 1.00 0.00 H ATOM 621 HZ3 LYS A 311 -13.064 -15.541 1.291 1.00 0.00 H ATOM 622 H LYS A 311 -14.597 -19.747 3.420 1.00 0.00 H ATOM 623 N PRO A 312 -14.494 -20.588 7.711 1.00 50.88 N ATOM 624 CA PRO A 312 -14.917 -21.725 8.557 1.00 51.23 C ATOM 625 C PRO A 312 -16.401 -22.108 8.424 1.00 50.22 C ATOM 626 O PRO A 312 -16.730 -23.295 8.549 1.00 47.69 O ATOM 627 CB PRO A 312 -14.593 -21.254 9.994 1.00 55.99 C ATOM 628 CG PRO A 312 -14.435 -19.770 9.910 1.00 57.60 C ATOM 629 CD PRO A 312 -13.920 -19.492 8.527 1.00 55.81 C ATOM 630 N SER A 313 -17.264 -21.114 8.176 1.00 51.05 N ATOM 631 CA SER A 313 -18.704 -21.314 7.950 1.00 51.65 C ATOM 632 C SER A 313 -19.139 -21.895 6.577 1.00 50.66 C ATOM 633 O SER A 313 -20.343 -22.134 6.370 1.00 52.44 O ATOM 634 CB SER A 313 -19.450 -20.003 8.194 1.00 56.54 C ATOM 635 OG SER A 313 -19.255 -19.095 7.126 1.00 55.09 O ATOM 636 HG SER A 313 -19.591 -19.498 6.286 1.00 0.00 H ATOM 637 H SER A 313 -16.894 -20.143 8.141 1.00 0.00 H ATOM 638 N GLU A 314 -18.184 -22.116 5.662 1.00 46.14 N ATOM 639 CA GLU A 314 -18.477 -22.561 4.287 1.00 43.24 C ATOM 640 C GLU A 314 -18.258 -24.066 4.136 1.00 42.71 C ATOM 641 O GLU A 314 -17.136 -24.555 4.279 1.00 44.55 O ATOM 642 CB GLU A 314 -17.642 -21.782 3.247 1.00 41.18 C ATOM 643 CG GLU A 314 -17.988 -20.302 3.166 1.00 43.94 C ATOM 644 CD GLU A 314 -17.080 -19.479 2.255 1.00 45.83 C ATOM 645 OE1 GLU A 314 -15.854 -19.771 2.116 1.00 42.99 O ATOM 646 OE2 GLU A 314 -17.613 -18.512 1.666 1.00 43.92 O ATOM 647 H GLU A 314 -17.191 -21.967 5.934 1.00 0.00 H ATOM 648 N ASP A 315 -19.347 -24.779 3.847 1.00 42.49 N ATOM 649 CA ASP A 315 -19.375 -26.243 3.693 1.00 42.47 C ATOM 650 C ASP A 315 -19.002 -26.669 2.255 1.00 37.36 C ATOM 651 O ASP A 315 -19.533 -26.107 1.291 1.00 33.87 O ATOM 652 CB ASP A 315 -20.787 -26.741 4.058 1.00 48.56 C ATOM 653 CG ASP A 315 -20.969 -28.249 3.877 1.00 49.93 C ATOM 654 OD1 ASP A 315 -21.729 -28.666 2.967 1.00 49.27 O ATOM 655 OD2 ASP A 315 -20.352 -29.015 4.646 1.00 52.90 O ATOM 656 H ASP A 315 -20.242 -24.264 3.721 1.00 0.00 H ATOM 657 N PRO A 316 -18.090 -27.659 2.103 1.00 36.81 N ATOM 658 CA PRO A 316 -17.741 -28.159 0.752 1.00 31.27 C ATOM 659 C PRO A 316 -18.931 -28.506 -0.167 1.00 30.31 C ATOM 660 O PRO A 316 -18.959 -28.066 -1.316 1.00 31.73 O ATOM 661 CB PRO A 316 -16.830 -29.367 1.032 1.00 30.86 C ATOM 662 CG PRO A 316 -16.230 -29.064 2.369 1.00 35.34 C ATOM 663 CD PRO A 316 -17.312 -28.348 3.158 1.00 35.98 C ATOM 664 N TRP A 317 -19.898 -29.275 0.315 1.00 30.95 N ATOM 665 CA TRP A 317 -21.046 -29.665 -0.531 1.00 28.86 C ATOM 666 C TRP A 317 -21.929 -28.491 -0.930 1.00 27.69 C ATOM 667 O TRP A 317 -22.320 -28.379 -2.102 1.00 28.55 O ATOM 668 CB TRP A 317 -21.887 -30.759 0.114 1.00 27.13 C ATOM 669 CG TRP A 317 -21.445 -32.215 -0.137 1.00 28.82 C ATOM 670 CD1 TRP A 317 -21.196 -33.174 0.822 1.00 30.28 C ATOM 671 CD2 TRP A 317 -21.208 -32.863 -1.407 1.00 26.20 C ATOM 672 NE1 TRP A 317 -20.823 -34.363 0.228 1.00 29.44 N ATOM 673 CE2 TRP A 317 -20.822 -34.202 -1.132 1.00 27.95 C ATOM 674 CE3 TRP A 317 -21.283 -32.444 -2.741 1.00 25.25 C ATOM 675 CZ2 TRP A 317 -20.511 -35.127 -2.153 1.00 28.62 C ATOM 676 CZ3 TRP A 317 -20.971 -33.372 -3.763 1.00 25.73 C ATOM 677 CH2 TRP A 317 -20.594 -34.686 -3.457 1.00 26.03 C ATOM 678 HE1 TRP A 317 -20.582 -35.240 0.732 1.00 0.00 H ATOM 679 H TRP A 317 -19.848 -29.607 1.299 1.00 0.00 H ATOM 680 N GLU A 318 -22.236 -27.630 0.036 1.00 29.79 N ATOM 681 CA GLU A 318 -23.030 -26.416 -0.182 1.00 30.56 C ATOM 682 C GLU A 318 -22.407 -25.476 -1.213 1.00 30.11 C ATOM 683 O GLU A 318 -23.122 -24.953 -2.090 1.00 29.23 O ATOM 684 CB GLU A 318 -23.248 -25.673 1.132 1.00 35.13 C ATOM 685 CG GLU A 318 -24.087 -26.445 2.129 1.00 41.78 C ATOM 686 CD GLU A 318 -24.527 -25.609 3.326 1.00 50.13 C ATOM 687 OE1 GLU A 318 -24.256 -24.382 3.351 1.00 52.97 O ATOM 688 OE2 GLU A 318 -25.150 -26.190 4.247 1.00 51.71 O ATOM 689 H GLU A 318 -21.895 -27.828 0.998 1.00 0.00 H ATOM 690 N GLN A 319 -21.087 -25.270 -1.100 1.00 27.97 N ATOM 691 CA GLN A 319 -20.341 -24.447 -2.045 1.00 28.47 C ATOM 692 C GLN A 319 -20.311 -25.067 -3.449 1.00 27.16 C ATOM 693 O GLN A 319 -20.413 -24.352 -4.465 1.00 26.97 O ATOM 694 CB GLN A 319 -18.930 -24.145 -1.523 1.00 28.00 C ATOM 695 CG GLN A 319 -18.895 -23.284 -0.256 1.00 31.14 C ATOM 696 CD GLN A 319 -19.521 -21.909 -0.424 1.00 32.39 C ATOM 697 OE1 GLN A 319 -19.099 -21.114 -1.271 1.00 33.90 O ATOM 698 NE2 GLN A 319 -20.535 -21.623 0.387 1.00 33.34 N ATOM 699 HE22 GLN A 319 -20.856 -22.324 1.085 1.00 0.00 H ATOM 700 HE21 GLN A 319 -21.007 -20.698 0.323 1.00 0.00 H ATOM 701 H GLN A 319 -20.577 -25.713 -0.310 1.00 0.00 H ATOM 702 N HIS A 320 -20.172 -26.395 -3.492 1.00 25.57 N ATOM 703 CA HIS A 320 -20.224 -27.156 -4.738 1.00 24.16 C ATOM 704 C HIS A 320 -21.562 -26.880 -5.432 1.00 25.30 C ATOM 705 O HIS A 320 -21.586 -26.580 -6.641 1.00 27.47 O ATOM 706 CB HIS A 320 -20.048 -28.648 -4.444 1.00 24.48 C ATOM 707 CG HIS A 320 -19.528 -29.456 -5.598 1.00 23.56 C ATOM 708 ND1 HIS A 320 -18.881 -30.661 -5.421 1.00 25.62 N ATOM 709 CD2 HIS A 320 -19.555 -29.240 -6.935 1.00 22.96 C ATOM 710 CE1 HIS A 320 -18.533 -31.151 -6.595 1.00 23.73 C ATOM 711 NE2 HIS A 320 -18.931 -30.309 -7.530 1.00 24.03 N ATOM 712 H HIS A 320 -20.020 -26.909 -2.601 1.00 0.00 H ATOM 713 N ALA A 321 -22.659 -26.979 -4.669 1.00 23.36 N ATOM 714 CA ALA A 321 -23.986 -26.677 -5.184 1.00 23.76 C ATOM 715 C ALA A 321 -24.196 -25.201 -5.554 1.00 25.24 C ATOM 716 O ALA A 321 -24.850 -24.902 -6.569 1.00 25.49 O ATOM 717 CB ALA A 321 -25.066 -27.183 -4.244 1.00 23.16 C ATOM 718 H ALA A 321 -22.559 -27.281 -3.679 1.00 0.00 H ATOM 719 N LYS A 322 -23.652 -24.287 -4.750 1.00 24.87 N ATOM 720 CA LYS A 322 -23.821 -22.843 -5.005 1.00 27.51 C ATOM 721 C LYS A 322 -23.271 -22.441 -6.386 1.00 27.21 C ATOM 722 O LYS A 322 -23.972 -21.849 -7.195 1.00 28.04 O ATOM 723 CB LYS A 322 -23.147 -22.036 -3.906 1.00 28.68 C ATOM 724 CG LYS A 322 -23.416 -20.547 -3.965 1.00 33.54 C ATOM 725 CD LYS A 322 -23.037 -19.932 -2.631 1.00 35.90 C ATOM 726 CE LYS A 322 -23.686 -18.581 -2.445 1.00 39.20 C ATOM 727 NZ LYS A 322 -23.074 -17.883 -1.288 1.00 41.12 N ATOM 728 HZ1 LYS A 322 -23.212 -18.452 -0.429 1.00 0.00 H ATOM 729 HZ2 LYS A 322 -22.056 -17.755 -1.461 1.00 0.00 H ATOM 730 HZ3 LYS A 322 -23.526 -16.954 -1.166 1.00 0.00 H ATOM 731 H LYS A 322 -23.098 -24.598 -3.927 1.00 0.00 H ATOM 732 N TRP A 323 -22.008 -22.784 -6.615 1.00 25.06 N ATOM 733 CA TRP A 323 -21.245 -22.320 -7.739 1.00 25.37 C ATOM 734 C TRP A 323 -21.282 -23.265 -8.940 1.00 26.47 C ATOM 735 O TRP A 323 -21.106 -22.817 -10.062 1.00 27.01 O ATOM 736 CB TRP A 323 -19.796 -22.029 -7.280 1.00 23.64 C ATOM 737 CG TRP A 323 -19.773 -20.903 -6.276 1.00 24.88 C ATOM 738 CD1 TRP A 323 -19.653 -21.017 -4.915 1.00 24.49 C ATOM 739 CD2 TRP A 323 -19.876 -19.495 -6.556 1.00 25.28 C ATOM 740 NE1 TRP A 323 -19.675 -19.769 -4.336 1.00 26.19 N ATOM 741 CE2 TRP A 323 -19.810 -18.818 -5.311 1.00 26.76 C ATOM 742 CE3 TRP A 323 -20.016 -18.747 -7.733 1.00 26.42 C ATOM 743 CZ2 TRP A 323 -19.879 -17.414 -5.202 1.00 28.80 C ATOM 744 CZ3 TRP A 323 -20.087 -17.341 -7.634 1.00 28.57 C ATOM 745 CH2 TRP A 323 -20.017 -16.695 -6.370 1.00 30.41 C ATOM 746 HE1 TRP A 323 -19.601 -19.578 -3.316 1.00 0.00 H ATOM 747 H TRP A 323 -21.545 -23.426 -5.941 1.00 0.00 H ATOM 748 N TYR A 324 -21.509 -24.565 -8.698 1.00 27.77 N ATOM 749 CA TYR A 324 -21.531 -25.577 -9.773 1.00 25.70 C ATOM 750 C TYR A 324 -22.796 -26.439 -9.800 1.00 24.99 C ATOM 751 O TYR A 324 -22.706 -27.661 -9.715 1.00 24.97 O ATOM 752 CB TYR A 324 -20.200 -26.377 -9.814 1.00 24.79 C ATOM 753 CG TYR A 324 -19.061 -25.385 -9.844 1.00 25.47 C ATOM 754 CD1 TYR A 324 -18.290 -25.132 -8.693 1.00 27.53 C ATOM 755 CD2 TYR A 324 -18.750 -24.685 -11.022 1.00 27.69 C ATOM 756 CE1 TYR A 324 -17.243 -24.211 -8.728 1.00 27.40 C ATOM 757 CE2 TYR A 324 -17.707 -23.763 -11.068 1.00 28.44 C ATOM 758 CZ TYR A 324 -16.957 -23.530 -9.918 1.00 28.27 C ATOM 759 OH TYR A 324 -15.925 -22.620 -9.961 1.00 32.63 O ATOM 760 HH TYR A 324 -15.494 -22.569 -9.071 1.00 0.00 H ATOM 761 H TYR A 324 -21.675 -24.871 -7.718 1.00 0.00 H ATOM 762 N PRO A 325 -23.984 -25.799 -9.923 1.00 23.80 N ATOM 763 CA PRO A 325 -25.246 -26.529 -9.826 1.00 24.24 C ATOM 764 C PRO A 325 -25.502 -27.582 -10.914 1.00 26.54 C ATOM 765 O PRO A 325 -26.347 -28.453 -10.703 1.00 27.84 O ATOM 766 CB PRO A 325 -26.300 -25.417 -9.933 1.00 24.72 C ATOM 767 CG PRO A 325 -25.634 -24.345 -10.710 1.00 24.30 C ATOM 768 CD PRO A 325 -24.234 -24.366 -10.172 1.00 24.22 C ATOM 769 N GLY A 326 -24.790 -27.501 -12.048 1.00 27.64 N ATOM 770 CA GLY A 326 -24.938 -28.468 -13.140 1.00 27.45 C ATOM 771 C GLY A 326 -24.061 -29.718 -13.033 1.00 29.11 C ATOM 772 O GLY A 326 -24.130 -30.594 -13.900 1.00 30.21 O ATOM 773 H GLY A 326 -24.108 -26.724 -12.157 1.00 0.00 H ATOM 774 N CYS A 327 -23.244 -29.802 -11.982 1.00 23.83 N ATOM 775 CA CYS A 327 -22.322 -30.906 -11.793 1.00 24.88 C ATOM 776 C CYS A 327 -23.024 -32.248 -11.591 1.00 24.63 C ATOM 777 O CYS A 327 -23.805 -32.412 -10.666 1.00 25.52 O ATOM 778 CB CYS A 327 -21.384 -30.638 -10.608 1.00 24.35 C ATOM 779 SG CYS A 327 -20.346 -32.079 -10.315 1.00 27.78 S ATOM 780 H CYS A 327 -23.269 -29.045 -11.269 1.00 0.00 H ATOM 781 N LYS A 328 -22.738 -33.203 -12.463 1.00 25.70 N ATOM 782 CA LYS A 328 -23.395 -34.503 -12.391 1.00 28.06 C ATOM 783 C LYS A 328 -22.988 -35.370 -11.209 1.00 26.98 C ATOM 784 O LYS A 328 -23.806 -36.105 -10.666 1.00 31.12 O ATOM 785 CB LYS A 328 -23.258 -35.262 -13.705 1.00 29.77 C ATOM 786 CG LYS A 328 -24.089 -34.646 -14.815 1.00 31.47 C ATOM 787 CD LYS A 328 -25.518 -34.358 -14.380 1.00 34.10 C ATOM 788 CE LYS A 328 -26.436 -34.166 -15.583 1.00 42.38 C ATOM 789 NZ LYS A 328 -26.015 -33.084 -16.517 1.00 45.29 N ATOM 790 HZ1 LYS A 328 -25.991 -32.178 -16.007 1.00 0.00 H ATOM 791 HZ2 LYS A 328 -25.068 -33.299 -16.890 1.00 0.00 H ATOM 792 HZ3 LYS A 328 -26.693 -33.023 -17.303 1.00 0.00 H ATOM 793 H LYS A 328 -22.036 -33.023 -13.209 1.00 0.00 H ATOM 794 N TYR A 329 -21.728 -35.281 -10.818 1.00 27.30 N ATOM 795 CA TYR A 329 -21.260 -35.916 -9.591 1.00 28.30 C ATOM 796 C TYR A 329 -22.059 -35.425 -8.367 1.00 26.24 C ATOM 797 O TYR A 329 -22.556 -36.237 -7.595 1.00 24.78 O ATOM 798 CB TYR A 329 -19.754 -35.706 -9.403 1.00 25.26 C ATOM 799 CG TYR A 329 -19.224 -36.281 -8.121 1.00 25.07 C ATOM 800 CD1 TYR A 329 -19.077 -37.675 -7.951 1.00 27.37 C ATOM 801 CD2 TYR A 329 -18.865 -35.439 -7.063 1.00 25.85 C ATOM 802 CE1 TYR A 329 -18.583 -38.208 -6.758 1.00 28.43 C ATOM 803 CE2 TYR A 329 -18.370 -35.960 -5.862 1.00 26.60 C ATOM 804 CZ TYR A 329 -18.231 -37.334 -5.714 1.00 28.99 C ATOM 805 OH TYR A 329 -17.741 -37.821 -4.522 1.00 35.59 O ATOM 806 HH TYR A 329 -18.340 -37.546 -3.783 1.00 0.00 H ATOM 807 H TYR A 329 -21.053 -34.745 -11.400 1.00 0.00 H ATOM 808 N LEU A 330 -22.166 -34.101 -8.218 1.00 24.66 N ATOM 809 CA LEU A 330 -22.998 -33.484 -7.178 1.00 24.85 C ATOM 810 C LEU A 330 -24.437 -34.019 -7.170 1.00 28.17 C ATOM 811 O LEU A 330 -24.947 -34.407 -6.092 1.00 29.60 O ATOM 812 CB LEU A 330 -22.981 -31.954 -7.332 1.00 23.07 C ATOM 813 CG LEU A 330 -24.057 -31.090 -6.665 1.00 23.66 C ATOM 814 CD1 LEU A 330 -23.870 -30.961 -5.152 1.00 23.08 C ATOM 815 CD2 LEU A 330 -24.031 -29.717 -7.314 1.00 24.54 C ATOM 816 H LEU A 330 -21.638 -33.482 -8.866 1.00 0.00 H ATOM 817 N LEU A 331 -25.079 -34.041 -8.350 1.00 26.58 N ATOM 818 CA LEU A 331 -26.431 -34.604 -8.494 1.00 31.74 C ATOM 819 C LEU A 331 -26.514 -36.073 -8.070 1.00 34.19 C ATOM 820 O LEU A 331 -27.502 -36.481 -7.450 1.00 39.80 O ATOM 821 CB LEU A 331 -26.982 -34.453 -9.928 1.00 31.35 C ATOM 822 CG LEU A 331 -28.379 -35.063 -10.188 1.00 38.82 C ATOM 823 CD1 LEU A 331 -29.472 -34.431 -9.312 1.00 38.82 C ATOM 824 CD2 LEU A 331 -28.787 -35.051 -11.667 1.00 36.57 C ATOM 825 H LEU A 331 -24.605 -33.648 -9.188 1.00 0.00 H ATOM 826 N GLU A 332 -25.484 -36.850 -8.406 1.00 32.94 N ATOM 827 CA GLU A 332 -25.458 -38.271 -8.094 1.00 37.41 C ATOM 828 C GLU A 332 -25.413 -38.469 -6.574 1.00 36.68 C ATOM 829 O GLU A 332 -26.148 -39.270 -6.049 1.00 38.88 O ATOM 830 CB GLU A 332 -24.289 -38.970 -8.818 1.00 40.84 C ATOM 831 CG GLU A 332 -24.027 -40.445 -8.484 1.00 47.76 C ATOM 832 CD GLU A 332 -25.164 -41.391 -8.868 1.00 62.49 C ATOM 833 OE1 GLU A 332 -26.084 -41.016 -9.648 1.00 67.38 O ATOM 834 OE2 GLU A 332 -25.141 -42.541 -8.379 1.00 76.57 O ATOM 835 H GLU A 332 -24.675 -36.428 -8.906 1.00 0.00 H ATOM 836 N GLN A 333 -24.547 -37.730 -5.890 1.00 35.93 N ATOM 837 CA GLN A 333 -24.243 -37.967 -4.480 1.00 36.32 C ATOM 838 C GLN A 333 -25.294 -37.414 -3.531 1.00 37.72 C ATOM 839 O GLN A 333 -25.597 -38.024 -2.505 1.00 38.69 O ATOM 840 CB GLN A 333 -22.869 -37.387 -4.148 1.00 34.28 C ATOM 841 CG GLN A 333 -21.707 -38.037 -4.894 1.00 34.42 C ATOM 842 CD GLN A 333 -21.634 -39.539 -4.659 1.00 43.34 C ATOM 843 OE1 GLN A 333 -21.663 -39.998 -3.520 1.00 46.25 O ATOM 844 NE2 GLN A 333 -21.540 -40.313 -5.739 1.00 43.95 N ATOM 845 HE22 GLN A 333 -21.519 -39.884 -6.686 1.00 0.00 H ATOM 846 HE21 GLN A 333 -21.488 -41.347 -5.635 1.00 0.00 H ATOM 847 H GLN A 333 -24.064 -36.949 -6.379 1.00 0.00 H ATOM 848 N LYS A 334 -25.846 -36.255 -3.885 1.00 39.33 N ATOM 849 CA LYS A 334 -26.732 -35.503 -3.000 1.00 38.81 C ATOM 850 C LYS A 334 -28.210 -35.526 -3.394 1.00 40.30 C ATOM 851 O LYS A 334 -29.078 -35.424 -2.523 1.00 43.04 O ATOM 852 CB LYS A 334 -26.223 -34.061 -2.840 1.00 35.04 C ATOM 853 CG LYS A 334 -24.777 -33.933 -2.353 1.00 36.71 C ATOM 854 CD LYS A 334 -24.483 -34.584 -0.990 1.00 37.41 C ATOM 855 CE LYS A 334 -25.038 -33.792 0.177 1.00 40.85 C ATOM 856 NZ LYS A 334 -24.770 -34.479 1.472 1.00 47.11 N ATOM 857 HZ1 LYS A 334 -25.218 -35.417 1.464 1.00 0.00 H ATOM 858 HZ2 LYS A 334 -23.743 -34.585 1.601 1.00 0.00 H ATOM 859 HZ3 LYS A 334 -25.162 -33.912 2.251 1.00 0.00 H ATOM 860 H LYS A 334 -25.638 -35.870 -4.829 1.00 0.00 H ATOM 861 N GLY A 335 -28.501 -35.659 -4.686 1.00 39.27 N ATOM 862 CA GLY A 335 -29.893 -35.645 -5.152 1.00 48.65 C ATOM 863 C GLY A 335 -30.374 -34.231 -5.419 1.00 57.48 C ATOM 864 O GLY A 335 -29.766 -33.273 -4.937 1.00 54.70 O ATOM 865 H GLY A 335 -27.731 -35.775 -5.375 1.00 0.00 H ATOM 866 N GLN A 336 -31.463 -34.087 -6.183 1.00 66.44 N ATOM 867 CA GLN A 336 -31.958 -32.747 -6.579 1.00 60.49 C ATOM 868 C GLN A 336 -32.696 -32.046 -5.407 1.00 61.23 C ATOM 869 O GLN A 336 -32.665 -30.816 -5.313 1.00 60.83 O ATOM 870 CB GLN A 336 -32.776 -32.797 -7.903 1.00 56.52 C ATOM 871 CG GLN A 336 -33.140 -31.448 -8.543 1.00 53.94 C ATOM 872 CD GLN A 336 -31.977 -30.734 -9.256 1.00 59.09 C ATOM 873 OE1 GLN A 336 -31.139 -31.372 -9.894 1.00 59.04 O ATOM 874 NE2 GLN A 336 -31.928 -29.395 -9.146 1.00 51.87 N ATOM 875 HE22 GLN A 336 -32.654 -28.891 -8.598 1.00 0.00 H ATOM 876 HE21 GLN A 336 -31.164 -28.863 -9.609 1.00 0.00 H ATOM 877 H GLN A 336 -31.973 -34.934 -6.506 1.00 0.00 H ATOM 878 N GLU A 337 -33.346 -32.818 -4.530 1.00 61.62 N ATOM 879 CA GLU A 337 -34.003 -32.258 -3.331 1.00 67.74 C ATOM 880 C GLU A 337 -33.037 -31.494 -2.404 1.00 69.26 C ATOM 881 O GLU A 337 -33.356 -30.384 -1.953 1.00 65.41 O ATOM 882 CB GLU A 337 -34.778 -33.333 -2.559 1.00 81.73 C ATOM 883 CG GLU A 337 -34.013 -34.634 -2.323 1.00 94.59 C ATOM 884 CD GLU A 337 -34.930 -35.811 -2.050 1.00101.79 C ATOM 885 OE1 GLU A 337 -35.691 -35.750 -1.059 1.00113.47 O ATOM 886 OE2 GLU A 337 -34.887 -36.794 -2.826 1.00 96.76 O ATOM 887 H GLU A 337 -33.390 -33.844 -4.697 1.00 0.00 H ATOM 888 N TYR A 338 -31.869 -32.090 -2.129 1.00 63.72 N ATOM 889 CA TYR A 338 -30.799 -31.420 -1.386 1.00 53.41 C ATOM 890 C TYR A 338 -30.339 -30.186 -2.135 1.00 48.81 C ATOM 891 O TYR A 338 -30.155 -29.123 -1.528 1.00 50.00 O ATOM 892 CB TYR A 338 -29.599 -32.348 -1.130 1.00 49.94 C ATOM 893 CG TYR A 338 -28.359 -31.627 -0.628 1.00 46.23 C ATOM 894 CD1 TYR A 338 -28.129 -31.468 0.747 1.00 48.32 C ATOM 895 CD2 TYR A 338 -27.416 -31.104 -1.522 1.00 40.39 C ATOM 896 CE1 TYR A 338 -26.999 -30.810 1.216 1.00 45.01 C ATOM 897 CE2 TYR A 338 -26.283 -30.445 -1.069 1.00 41.82 C ATOM 898 CZ TYR A 338 -26.082 -30.302 0.305 1.00 44.23 C ATOM 899 OH TYR A 338 -24.966 -29.653 0.764 1.00 40.86 O ATOM 900 HH TYR A 338 -24.977 -29.639 1.754 1.00 0.00 H ATOM 901 H TYR A 338 -31.716 -33.066 -2.455 1.00 0.00 H ATOM 902 N ILE A 339 -30.155 -30.331 -3.447 1.00 46.87 N ATOM 903 CA ILE A 339 -29.647 -29.246 -4.293 1.00 42.10 C ATOM 904 C ILE A 339 -30.606 -28.039 -4.279 1.00 41.56 C ATOM 905 O ILE A 339 -30.173 -26.895 -4.165 1.00 41.00 O ATOM 906 CB ILE A 339 -29.270 -29.747 -5.715 1.00 45.77 C ATOM 907 CG1 ILE A 339 -28.145 -30.795 -5.635 1.00 47.25 C ATOM 908 CG2 ILE A 339 -28.751 -28.606 -6.584 1.00 39.70 C ATOM 909 CD1 ILE A 339 -27.781 -31.426 -6.970 1.00 49.89 C ATOM 910 H ILE A 339 -30.380 -31.246 -3.887 1.00 0.00 H ATOM 911 N ASN A 340 -31.904 -28.297 -4.392 1.00 45.60 N ATOM 912 CA ASN A 340 -32.889 -27.228 -4.296 1.00 50.38 C ATOM 913 C ASN A 340 -32.862 -26.476 -2.963 1.00 50.57 C ATOM 914 O ASN A 340 -32.850 -25.239 -2.987 1.00 51.65 O ATOM 915 CB ASN A 340 -34.291 -27.722 -4.666 1.00 55.03 C ATOM 916 CG ASN A 340 -34.421 -28.047 -6.156 1.00 56.19 C ATOM 917 OD1 ASN A 340 -33.761 -27.428 -7.027 1.00 54.90 O ATOM 918 ND2 ASN A 340 -35.275 -29.023 -6.461 1.00 50.33 N ATOM 919 HD22 ASN A 340 -35.801 -29.509 -5.706 1.00 0.00 H ATOM 920 HD21 ASN A 340 -35.416 -29.299 -7.454 1.00 0.00 H ATOM 921 H ASN A 340 -32.221 -29.275 -4.551 1.00 0.00 H ATOM 922 N ASN A 341 -32.851 -27.207 -1.831 1.00 49.25 N ATOM 923 CA ASN A 341 -32.754 -26.599 -0.476 1.00 47.62 C ATOM 924 C ASN A 341 -31.577 -25.641 -0.407 1.00 42.71 C ATOM 925 O ASN A 341 -31.748 -24.491 -0.022 1.00 41.51 O ATOM 926 CB ASN A 341 -32.699 -27.667 0.660 1.00 51.50 C ATOM 927 CG ASN A 341 -32.320 -27.083 2.046 1.00 51.20 C ATOM 928 OD1 ASN A 341 -31.157 -26.711 2.313 1.00 45.84 O ATOM 929 ND2 ASN A 341 -33.310 -27.003 2.934 1.00 56.99 N ATOM 930 HD22 ASN A 341 -34.266 -27.322 2.677 1.00 0.00 H ATOM 931 HD21 ASN A 341 -33.127 -26.621 3.884 1.00 0.00 H ATOM 932 H ASN A 341 -32.913 -28.242 -1.908 1.00 0.00 H ATOM 933 N ILE A 342 -30.394 -26.118 -0.782 1.00 39.93 N ATOM 934 CA ILE A 342 -29.184 -25.288 -0.781 1.00 39.87 C ATOM 935 C ILE A 342 -29.402 -24.012 -1.610 1.00 40.69 C ATOM 936 O ILE A 342 -28.986 -22.928 -1.198 1.00 41.57 O ATOM 937 CB ILE A 342 -27.919 -26.121 -1.153 1.00 40.52 C ATOM 938 CG1 ILE A 342 -27.520 -27.024 0.013 1.00 47.57 C ATOM 939 CG2 ILE A 342 -26.687 -25.266 -1.425 1.00 42.20 C ATOM 940 CD1 ILE A 342 -27.530 -26.350 1.388 1.00 47.40 C ATOM 941 H ILE A 342 -30.324 -27.110 -1.085 1.00 0.00 H ATOM 942 N HIS A 343 -30.056 -24.154 -2.768 1.00 41.02 N ATOM 943 CA HIS A 343 -30.272 -23.032 -3.687 1.00 41.49 C ATOM 944 C HIS A 343 -31.226 -22.034 -3.086 1.00 41.43 C ATOM 945 O HIS A 343 -30.927 -20.846 -3.021 1.00 41.52 O ATOM 946 CB HIS A 343 -30.768 -23.524 -5.057 1.00 44.02 C ATOM 947 CG HIS A 343 -29.760 -24.345 -5.798 1.00 44.72 C ATOM 948 ND1 HIS A 343 -30.110 -25.442 -6.556 1.00 45.68 N ATOM 949 CD2 HIS A 343 -28.410 -24.231 -5.899 1.00 40.58 C ATOM 950 CE1 HIS A 343 -29.023 -25.968 -7.092 1.00 40.69 C ATOM 951 NE2 HIS A 343 -27.979 -25.252 -6.708 1.00 43.65 N ATOM 952 H HIS A 343 -30.424 -25.092 -3.025 1.00 0.00 H ATOM 953 N LEU A 344 -32.377 -22.527 -2.645 1.00 42.12 N ATOM 954 CA LEU A 344 -33.333 -21.703 -1.914 1.00 44.07 C ATOM 955 C LEU A 344 -32.740 -21.007 -0.688 1.00 45.95 C ATOM 956 O LEU A 344 -33.082 -19.863 -0.410 1.00 48.22 O ATOM 957 CB LEU A 344 -34.568 -22.521 -1.557 1.00 45.77 C ATOM 958 CG LEU A 344 -35.445 -22.895 -2.747 1.00 44.39 C ATOM 959 CD1 LEU A 344 -36.174 -24.178 -2.423 1.00 45.13 C ATOM 960 CD2 LEU A 344 -36.409 -21.775 -3.119 1.00 46.57 C ATOM 961 H LEU A 344 -32.603 -23.526 -2.825 1.00 0.00 H ATOM 962 N THR A 345 -31.857 -21.696 0.035 1.00 46.47 N ATOM 963 CA THR A 345 -31.211 -21.148 1.248 1.00 49.02 C ATOM 964 C THR A 345 -30.321 -19.954 0.904 1.00 50.84 C ATOM 965 O THR A 345 -30.375 -18.922 1.576 1.00 55.49 O ATOM 966 CB THR A 345 -30.394 -22.240 1.982 1.00 46.36 C ATOM 967 OG1 THR A 345 -31.290 -23.258 2.435 1.00 46.80 O ATOM 968 CG2 THR A 345 -29.615 -21.676 3.181 1.00 47.63 C ATOM 969 HG1 THR A 345 -31.758 -23.654 1.658 1.00 0.00 H ATOM 970 H THR A 345 -31.612 -22.661 -0.267 1.00 0.00 H ATOM 971 N HIS A 346 -29.512 -20.119 -0.144 1.00 52.46 N ATOM 972 CA HIS A 346 -28.572 -19.104 -0.605 1.00 56.37 C ATOM 973 C HIS A 346 -29.305 -17.927 -1.226 1.00 57.13 C ATOM 974 O HIS A 346 -29.000 -16.768 -0.917 1.00 59.51 O ATOM 975 CB HIS A 346 -27.592 -19.709 -1.612 1.00 60.01 C ATOM 976 CG HIS A 346 -26.671 -20.738 -1.025 1.00 68.37 C ATOM 977 ND1 HIS A 346 -26.126 -20.623 0.242 1.00 70.51 N ATOM 978 CD2 HIS A 346 -26.199 -21.902 -1.537 1.00 61.38 C ATOM 979 CE1 HIS A 346 -25.360 -21.672 0.484 1.00 72.41 C ATOM 980 NE2 HIS A 346 -25.387 -22.462 -0.579 1.00 74.14 N ATOM 981 H HIS A 346 -29.554 -21.021 -0.660 1.00 0.00 H ATOM 982 N SER A 347 -30.268 -18.238 -2.099 1.00 53.73 N ATOM 983 CA SER A 347 -31.102 -17.230 -2.732 1.00 55.14 C ATOM 984 C SER A 347 -31.969 -16.464 -1.738 1.00 62.82 C ATOM 985 O SER A 347 -32.296 -15.316 -2.005 1.00 73.50 O ATOM 986 CB SER A 347 -31.931 -17.843 -3.847 1.00 53.43 C ATOM 987 OG SER A 347 -31.084 -18.353 -4.870 1.00 50.83 O ATOM 988 HG SER A 347 -30.490 -19.047 -4.489 1.00 0.00 H ATOM 989 H SER A 347 -30.426 -19.239 -2.334 1.00 0.00 H ATOM 990 N LEU A 348 -32.335 -17.090 -0.608 1.00 65.81 N ATOM 991 CA LEU A 348 -33.005 -16.400 0.519 1.00 70.85 C ATOM 992 C LEU A 348 -32.015 -15.637 1.400 1.00 75.53 C ATOM 993 O LEU A 348 -32.407 -14.745 2.156 1.00 83.61 O ATOM 994 CB LEU A 348 -33.874 -17.363 1.370 1.00 69.06 C ATOM 995 CG LEU A 348 -34.656 -16.850 2.607 1.00 73.69 C ATOM 996 CD1 LEU A 348 -35.745 -15.855 2.236 1.00 75.38 C ATOM 997 CD2 LEU A 348 -35.243 -17.946 3.482 1.00 73.54 C ATOM 998 H LEU A 348 -32.139 -18.108 -0.520 1.00 0.00 H ATOM 999 N GLU A 349 -30.732 -15.974 1.316 1.00 77.71 N ATOM 1000 CA GLU A 349 -29.731 -15.161 2.003 1.00 82.90 C ATOM 1001 C GLU A 349 -29.520 -13.823 1.279 1.00 86.93 C ATOM 1002 O GLU A 349 -29.240 -12.810 1.918 1.00 85.54 O ATOM 1003 CB GLU A 349 -28.443 -15.939 2.249 1.00 79.47 C ATOM 1004 CG GLU A 349 -28.506 -16.744 3.541 1.00 83.52 C ATOM 1005 CD GLU A 349 -27.550 -17.930 3.590 1.00 82.46 C ATOM 1006 OE1 GLU A 349 -27.048 -18.238 4.691 1.00 88.05 O ATOM 1007 OE2 GLU A 349 -27.289 -18.561 2.546 1.00 77.22 O ATOM 1008 H GLU A 349 -30.443 -16.808 0.766 1.00 0.00 H ATOM 1009 N GLU A 350 -29.660 -13.840 -0.050 1.00 89.42 N ATOM 1010 CA GLU A 350 -29.766 -12.620 -0.874 1.00 95.56 C ATOM 1011 C GLU A 350 -30.858 -11.637 -0.397 1.00104.01 C ATOM 1012 O GLU A 350 -30.717 -10.426 -0.583 1.00114.25 O ATOM 1013 CB GLU A 350 -30.005 -12.986 -2.342 1.00 92.58 C ATOM 1014 CG GLU A 350 -28.832 -13.673 -3.040 1.00 84.79 C ATOM 1015 CD GLU A 350 -27.944 -12.708 -3.808 1.00 88.37 C ATOM 1016 OE1 GLU A 350 -28.479 -11.918 -4.619 1.00 96.11 O ATOM 1017 OE2 GLU A 350 -26.709 -12.736 -3.606 1.00 84.75 O ATOM 1018 H GLU A 350 -29.696 -14.762 -0.529 1.00 0.00 H ATOM 1019 N CYS A 351 -31.931 -12.163 0.208 1.00102.17 N ATOM 1020 CA CYS A 351 -33.002 -11.349 0.800 1.00100.97 C ATOM 1021 C CYS A 351 -32.496 -10.627 2.041 1.00105.80 C ATOM 1022 O CYS A 351 -32.323 -9.411 2.003 1.00115.13 O ATOM 1023 CB CYS A 351 -34.260 -12.192 1.108 1.00101.60 C ATOM 1024 SG CYS A 351 -35.621 -11.394 2.022 1.00 87.58 S ATOM 1025 H CYS A 351 -32.010 -13.199 0.261 1.00 0.00 H ATOM 1026 N LEU A 352 -32.262 -11.366 3.128 1.00108.19 N ATOM 1027 CA LEU A 352 -31.970 -10.768 4.452 1.00123.34 C ATOM 1028 C LEU A 352 -30.716 -9.874 4.547 1.00126.94 C ATOM 1029 O LEU A 352 -30.613 -9.061 5.476 1.00124.58 O ATOM 1030 CB LEU A 352 -31.962 -11.833 5.569 1.00122.50 C ATOM 1031 CG LEU A 352 -33.239 -12.588 5.969 1.00120.11 C ATOM 1032 CD1 LEU A 352 -32.880 -13.813 6.796 1.00114.06 C ATOM 1033 CD2 LEU A 352 -34.228 -11.705 6.719 1.00122.94 C ATOM 1034 H LEU A 352 -32.286 -12.402 3.042 1.00 0.00 H ATOM 1035 N VAL A 353 -29.778 -10.021 3.603 1.00129.42 N ATOM 1036 CA VAL A 353 -28.623 -9.104 3.507 1.00131.65 C ATOM 1037 C VAL A 353 -29.021 -7.749 2.890 1.00142.53 C ATOM 1038 O VAL A 353 -28.688 -6.692 3.440 1.00149.45 O ATOM 1039 CB VAL A 353 -27.374 -9.716 2.794 1.00120.16 C ATOM 1040 CG1 VAL A 353 -26.859 -10.943 3.539 1.00117.79 C ATOM 1041 CG2 VAL A 353 -27.627 -10.028 1.318 1.00112.63 C ATOM 1042 H VAL A 353 -29.864 -10.800 2.920 1.00 0.00 H ATOM 1043 N ARG A 354 -29.729 -7.800 1.757 1.00140.44 N ATOM 1044 CA ARG A 354 -30.102 -6.615 0.980 1.00139.52 C ATOM 1045 C ARG A 354 -31.233 -5.821 1.649 1.00144.33 C ATOM 1046 O ARG A 354 -30.973 -4.849 2.360 1.00140.56 O ATOM 1047 CB ARG A 354 -30.460 -7.009 -0.462 1.00132.62 C ATOM 1048 CG ARG A 354 -29.271 -7.468 -1.291 1.00131.52 C ATOM 1049 CD ARG A 354 -29.684 -7.907 -2.689 1.00133.35 C ATOM 1050 NE ARG A 354 -28.608 -7.683 -3.661 1.00129.79 N ATOM 1051 CZ ARG A 354 -28.718 -7.817 -4.983 1.00122.67 C ATOM 1052 NH1 ARG A 354 -29.866 -8.181 -5.542 1.00121.28 N ATOM 1053 NH2 ARG A 354 -27.665 -7.585 -5.755 1.00116.98 N ATOM 1054 OXT ARG A 354 -32.425 -6.111 1.512 1.00145.76 O ATOM 1055 HE ARG A 354 -27.681 -7.395 -3.287 1.00 0.00 H ATOM 1056 HH12 ARG A 354 -29.933 -8.280 -6.575 1.00 0.00 H ATOM 1057 HH11 ARG A 354 -30.698 -8.367 -4.947 1.00 0.00 H ATOM 1058 HH22 ARG A 354 -27.744 -7.688 -6.787 1.00 0.00 H ATOM 1059 HH21 ARG A 354 -26.760 -7.300 -5.329 1.00 0.00 H ATOM 1060 H ARG A 354 -30.032 -8.732 1.408 1.00 0.00 H TER 1061 ARG A 354 HETATM 1062 ZN ZN A 1 -18.480 -30.908 -9.503 1.00 25.97 ZN HETATM 1063 O HOH 2 -20.578 -18.320 5.167 1.00 51.29 O HETATM 1064 O HOH 3 -24.657 -29.625 3.249 1.00 40.79 O HETATM 1065 O HOH 4 -10.873 -31.141 -12.491 1.00 34.17 O HETATM 1066 O HOH 5 -3.629 -31.388 -7.888 1.00 34.34 O HETATM 1067 O HOH 6 -22.016 -26.669 -18.632 1.00 34.27 O HETATM 1068 O HOH 7 -22.320 -15.547 -2.174 1.00 38.55 O HETATM 1069 O HOH 8 -14.880 -35.117 8.081 1.00 51.94 O HETATM 1070 O HOH 9 -5.376 -21.368 -10.931 1.00 50.37 O HETATM 1071 O HOH 10 -36.978 -29.650 -4.530 1.00 42.97 O HETATM 1072 O HOH 11 0.613 -34.574 6.247 1.00 39.44 O HETATM 1073 O HOH 12 -26.439 -30.649 -15.497 1.00 41.17 O HETATM 1074 O HOH 13 -19.764 -31.041 3.000 1.00 30.04 O HETATM 1075 O HOH 14 -9.324 -21.613 4.479 1.00 37.31 O HETATM 1076 O HOH 15 -21.024 -32.742 -14.572 1.00 26.83 O HETATM 1077 O HOH 16 -12.068 -14.138 -2.759 1.00 58.08 O HETATM 1078 O HOH 17 -8.243 -21.460 7.149 1.00 48.81 O HETATM 1079 O HOH 18 -6.887 -23.775 -12.481 1.00 49.82 O HETATM 1080 O HOH 19 -13.685 -39.346 4.195 1.00 51.76 O HETATM 1081 O HOH 20 -15.873 -41.410 -8.259 1.00 39.75 O HETATM 1082 O HOH 21 -1.325 -29.347 -2.266 1.00 29.86 O HETATM 1083 O HOH 22 -29.735 -28.946 1.705 1.00 51.68 O HETATM 1084 O HOH 23 2.178 -26.467 -3.708 1.00 34.23 O HETATM 1085 O HOH 24 -20.767 -29.843 -20.300 1.00 40.78 O HETATM 1086 O HOH 25 -5.042 -33.803 -11.883 1.00 34.92 O HETATM 1087 O HOH 26 -28.977 -28.057 -9.976 1.00 30.35 O HETATM 1088 O HOH 27 -26.353 -31.367 -10.815 1.00 30.04 O HETATM 1089 O HOH 28 -29.207 -13.221 4.650 1.00 56.54 O HETATM 1090 O HOH 29 -15.454 -40.498 -5.176 1.00 42.90 O HETATM 1091 O HOH 30 -9.309 -22.865 -21.948 1.00 71.04 O HETATM 1092 O HOH 31 -15.795 -30.992 -20.327 1.00 59.27 O HETATM 1093 O HOH 32 -14.681 -24.386 6.033 1.00 56.73 O HETATM 1094 O HOH 33 -3.412 -36.127 -12.726 1.00 53.83 O HETATM 1095 O HOH 34 -16.557 -23.114 -14.542 1.00 32.97 O HETATM 1096 O HOH 35 -4.483 -25.793 -3.132 1.00 33.97 O HETATM 1097 O HOH 36 -3.200 -38.714 -6.312 1.00 40.60 O HETATM 1098 O HOH 37 -2.940 -35.567 1.938 1.00 41.34 O HETATM 1099 O HOH 38 -8.725 -41.752 -9.510 1.00 46.73 O HETATM 1100 O HOH 39 -28.488 -36.192 0.112 1.00 43.31 O HETATM 1101 O HOH 40 -20.138 -20.388 -11.088 1.00 33.76 O HETATM 1102 O HOH 41 -6.951 -38.630 5.605 1.00 48.32 O HETATM 1103 O HOH 42 -1.961 -27.039 -9.686 1.00 49.63 O HETATM 1104 O HOH 43 -21.556 -23.262 -12.822 1.00 26.77 O HETATM 1105 O HOH 44 -21.413 -18.741 0.847 1.00 49.27 O HETATM 1106 O HOH 45 -18.282 -33.582 2.670 1.00 40.96 O HETATM 1107 O HOH 46 -27.033 -11.247 -6.973 1.00 55.21 O HETATM 1108 O HOH 47 -24.130 -32.437 3.352 1.00 46.68 O HETATM 1109 O HOH 48 0.000 -28.845 0.000 1.00 52.09 O HETATM 1110 O HOH 49 -29.272 -26.074 4.383 1.00 45.54 O HETATM 1111 O HOH 50 -27.510 -37.703 -14.509 1.00 54.33 O HETATM 1112 O HOH 51 -21.622 -28.226 -14.426 1.00 28.70 O HETATM 1113 O HOH 52 -10.504 -20.939 -19.973 1.00 66.96 O HETATM 1114 O HOH 53 -25.879 -37.607 -12.010 1.00 44.45 O HETATM 1115 O HOH 54 -1.732 -25.530 -0.743 1.00 46.98 O HETATM 1116 O HOH 55 -17.321 -15.619 1.454 1.00 49.64 O HETATM 1117 O HOH 56 -21.587 -23.117 2.665 1.00 32.05 O HETATM 1118 O HOH 57 -19.773 -41.799 -16.485 1.00 53.81 O HETATM 1119 O HOH 58 -10.373 -44.303 -3.463 1.00 40.42 O HETATM 1120 O HOH 59 -29.710 -38.228 -8.259 1.00 57.38 O HETATM 1121 O HOH 60 -31.895 -23.242 5.312 1.00 39.34 O HETATM 1122 O HOH 61 -19.101 -18.224 -1.819 1.00 39.83 O HETATM 1123 O HOH 62 -14.184 -22.843 -12.328 1.00 50.65 O HETATM 1124 O HOH 63 -9.750 -27.881 9.755 1.00 56.61 O HETATM 1125 O HOH 64 -13.991 -42.973 -4.699 1.00 38.99 O HETATM 1126 O HOH 65 -14.141 -22.293 -21.850 1.00 45.48 O HETATM 1127 O HOH 66 -22.375 -26.006 -12.874 1.00 23.43 O HETATM 1128 O HOH 67 -28.542 -4.772 -3.104 1.00 56.26 O HETATM 1129 O HOH 68 -6.623 -28.218 9.249 1.00 47.69 O HETATM 1130 O HOH 69 -7.776 -18.558 1.974 1.00 57.32 O HETATM 1131 O HOH 70 -7.133 -37.200 -16.134 1.00 40.33 O HETATM 1132 O HOH 71 -6.948 -44.703 -6.411 1.00 61.34 O HETATM 1133 O HOH 72 -8.812 -40.324 4.249 1.00 47.20 O HETATM 1134 O HOH 73 -6.696 -43.914 -9.254 1.00 47.70 O HETATM 1135 O HOH 74 -32.836 -37.861 -4.764 1.00 57.21 O HETATM 1136 O HOH 75 -11.600 -30.094 10.261 1.00 49.47 O HETATM 1137 O HOH 76 -26.034 -16.794 -0.294 1.00 50.38 O HETATM 1138 O HOH 77 -23.870 -36.766 -20.353 1.00 21.89 O HETATM 1139 O HOH 78 -34.539 -7.862 3.378 1.00 53.21 O HETATM 1140 O HOH 79 -18.807 -39.074 -1.620 1.00 51.59 O HETATM 1141 O HOH 80 -14.798 -25.499 9.385 1.00 51.55 O HETATM 1142 O HOH 81 -11.728 -17.281 -12.397 1.00 59.35 O HETATM 1143 O HOH 82 -31.283 -11.196 -5.598 1.00 59.42 O HETATM 1144 O HOH 83 -36.405 -28.268 -9.209 1.00 47.81 O HETATM 1145 O HOH 84 -13.750 -28.316 9.173 1.00 57.01 O HETATM 1146 O HOH 85 -34.999 -7.486 0.535 1.00 33.05 O HETATM 1147 O HOH 86 -16.973 -17.573 8.525 1.00 43.27 O HETATM 1148 O HOH 87 -8.298 -31.283 7.403 1.00 38.86 O HETATM 1149 O HOH 88 -19.939 -36.523 2.307 1.00 31.78 O HETATM 1150 O HOH 89 -22.047 -20.627 4.215 1.00 40.38 O HETATM 1151 O HOH 90 -2.389 -29.475 9.718 1.00 51.85 O HETATM 1152 O HOH 91 -6.065 -29.447 -12.351 1.00 46.82 O HETATM 1153 O HOH 92 -23.004 -23.987 6.253 1.00 56.69 O HETATM 1154 O HOH 93 -2.368 -24.102 -9.611 1.00 41.84 O HETATM 1155 O HOH 94 -28.055 -38.703 -10.647 1.00 53.31 O HETATM 1156 O HOH 95 -1.782 -27.660 1.312 1.00 45.70 O HETATM 1157 O HOH 96 -25.137 -41.217 -2.583 1.00 59.53 O HETATM 1158 O HOH 97 -32.095 -36.986 -7.496 1.00 49.05 O HETATM 1159 O HOH 98 -3.722 -39.679 -10.503 1.00 59.63 O HETATM 1160 O HOH 99 -18.426 -39.285 -11.874 1.00 38.30 O HETATM 1161 O HOH 100 -4.339 -18.998 -3.980 1.00 53.62 O HETATM 1162 O HOH 101 -7.554 -17.349 -9.446 1.00 50.35 O HETATM 1163 O HOH 102 -26.164 -13.901 -0.499 1.00 50.56 O HETATM 1164 O HOH 103 -13.460 -38.066 8.015 1.00 53.24 O HETATM 1165 O HOH 104 -3.307 -32.685 7.350 1.00 26.84 O HETATM 1166 O HOH 105 -11.743 -27.330 -15.601 1.00 39.47 O HETATM 1167 O HOH 106 -17.780 -21.986 11.504 1.00 54.45 O HETATM 1168 O HOH 107 -36.533 -31.055 -8.902 1.00 49.09 O HETATM 1169 O HOH 108 -4.727 -43.245 -5.343 1.00 53.98 O HETATM 1170 O HOH 109 -9.913 -34.115 -20.400 1.00 57.27 O HETATM 1171 O HOH 110 -33.293 -8.416 -1.776 1.00 70.48 O HETATM 1172 O HOH 111 -20.607 -25.571 7.116 1.00 60.85 O HETATM 1173 O HOH 112 -4.393 -38.191 4.713 1.00 50.07 O HETATM 1174 O HOH 113 -6.715 -18.872 -11.929 1.00 59.90 O HETATM 1175 O HOH 114 -21.127 -43.792 -5.010 1.00 53.37 O HETATM 1176 O HOH 115 -17.880 -39.303 7.023 1.00 58.27 O HETATM 1177 O HOH 116 -10.316 -16.982 3.247 1.00 49.39 O HETATM 1178 O HOH 117 -29.084 -39.030 -1.876 1.00 59.83 O HETATM 1179 O HOH 118 -15.462 -33.937 -19.849 1.00 44.90 O HETATM 1180 O HOH 119 -16.004 -40.125 -1.762 1.00 47.38 O HETATM 1181 O HOH 120 -27.419 -40.603 -14.897 1.00 55.39 O HETATM 1182 O HOH 121 -27.638 -21.726 -5.508 1.00 42.20 O HETATM 1183 O HOH 122 -18.073 -41.709 -6.482 1.00 60.50 O HETATM 1184 O HOH 123 -23.061 -19.546 7.198 1.00 58.46 O HETATM 1185 O HOH 124 -22.003 -18.272 9.679 1.00 60.75 O HETATM 1186 O HOH 125 -13.287 -14.998 -10.948 1.00 65.55 O HETATM 1187 O HOH 126 -28.036 -31.305 -12.915 1.00 45.29 O HETATM 1188 O HOH 127 -12.671 -15.067 -8.049 1.00 61.02 O HETATM 1189 O HOH 128 -21.170 -39.295 -10.896 1.00 37.48 O HETATM 1190 O HOH 129 -11.109 -15.327 -14.644 1.00 55.54 O HETATM 1191 O HOH 130 4.099 -33.624 9.258 1.00 35.18 O HETATM 1192 O HOH 131 -21.777 -33.539 4.362 1.00 54.03 O HETATM 1193 O HOH 132 -19.188 -22.036 -14.017 1.00 36.50 O HETATM 1194 O HOH 133 -7.771 -16.892 -6.557 1.00 48.02 O HETATM 1195 O HOH 134 -10.422 -29.997 -15.025 1.00 29.99 O HETATM 1196 O HOH 135 -35.366 -29.335 -11.773 1.00 47.53 O HETATM 1197 O HOH 136 -3.122 -29.678 -10.014 1.00 35.12 O HETATM 1198 O HOH 137 -14.437 -27.244 11.884 1.00 57.66 O HETATM 1199 O HOH 138 -15.867 -44.550 -9.002 1.00 53.81 O HETATM 1200 O HOH 139 -14.641 -43.709 -2.037 1.00 58.16 O HETATM 1201 O HOH 140 -22.475 -41.380 -19.466 1.00 50.17 O HETATM 1202 O HOH 141 -17.421 -41.079 -10.324 1.00 47.82 O HETATM 1203 O HOH 142 -7.847 -28.593 11.990 1.00 58.09 O HETATM 1204 O HOH 143 -3.313 -21.730 -13.176 1.00 52.37 O HETATM 1205 O HOH 144 -29.810 -42.001 -12.943 1.00 55.52 O HETATM 1206 C1 UNN A 145 -14.390 -15.634 -4.326 1.00 0.04 C HETATM 1207 O2 UNN A 145 -15.782 -15.956 -4.236 1.00 -0.38 O HETATM 1208 C3 UNN A 145 -16.202 -16.332 -2.919 1.00 0.10 C HETATM 1209 C4 UNN A 145 -15.585 -17.679 -2.513 1.00 0.05 C HETATM 1210 C5 UNN A 145 -15.529 -17.775 -0.988 1.00 0.01 C HETATM 1211 N6 UNN A 145 -15.074 -19.118 -0.537 1.00 0.24 N HETATM 1212 C7 UNN A 145 -15.949 -20.224 -1.049 1.00 0.02 C HETATM 1213 C8 UNN A 145 -15.463 -21.557 -0.498 1.00 -0.02 C HETATM 1214 H9 UNN A 145 -16.106 -22.366 -0.875 1.00 0.03 H HETATM 1215 H10 UNN A 145 -15.505 -21.537 0.601 1.00 0.03 H HETATM 1216 H11 UNN A 145 -14.426 -21.732 -0.822 1.00 0.03 H HETATM 1217 C9 UNN A 145 -15.935 -20.184 -2.573 1.00 0.01 C HETATM 1218 N10 UNN A 145 -16.286 -18.854 -3.090 1.00 0.26 N HETATM 1219 C11 UNN A 145 -16.455 -18.870 -4.553 1.00 0.07 C HETATM 1220 C12 UNN A 145 -15.173 -19.004 -5.358 1.00 0.27 C HETATM 1221 O13 UNN A 145 -14.119 -19.298 -4.808 1.00 -0.37 O HETATM 1222 N14 UNN A 145 -15.245 -18.784 -6.714 1.00 -0.20 N HETATM 1223 C15 UNN A 145 -16.506 -18.424 -7.414 1.00 0.04 C HETATM 1224 C16 UNN A 145 -16.151 -18.409 -8.920 1.00 -0.03 C HETATM 1225 C19 UNN A 145 -14.640 -18.560 -8.908 1.00 -0.01 C HETATM 1226 C31 UNN A 145 -14.163 -18.773 -7.625 1.00 0.11 C HETATM 1227 C30 UNN A 145 -12.805 -18.934 -7.414 1.00 0.02 C HETATM 1228 C22 UNN A 145 -11.958 -18.874 -8.525 1.00 0.05 C HETATM 1229 C23 UNN A 145 -10.467 -19.038 -8.390 1.00 0.04 C HETATM 1230 C24 UNN A 145 -10.012 -20.438 -8.707 1.00 -0.03 C HETATM 1231 C25 UNN A 145 -10.129 -21.448 -7.763 1.00 -0.06 C HETATM 1232 C26 UNN A 145 -9.711 -22.732 -8.056 1.00 -0.07 C HETATM 1233 C27 UNN A 145 -9.175 -23.018 -9.289 1.00 -0.07 C HETATM 1234 C28 UNN A 145 -9.053 -22.026 -10.234 1.00 -0.07 C HETATM 1235 C29 UNN A 145 -9.469 -20.742 -9.947 1.00 -0.06 C HETATM 1236 H35 UNN A 145 -9.371 -19.965 -10.696 1.00 0.06 H HETATM 1237 H21 UNN A 145 -8.629 -22.253 -11.206 1.00 0.06 H HETATM 1238 H20 UNN A 145 -8.848 -24.026 -9.517 1.00 0.06 H HETATM 1239 H19 UNN A 145 -9.806 -23.515 -7.312 1.00 0.06 H HETATM 1240 H18 UNN A 145 -10.551 -21.228 -6.789 1.00 0.06 H HETATM 1241 H16 UNN A 145 -10.178 -18.798 -7.356 1.00 0.07 H HETATM 1242 H17 UNN A 145 -9.971 -18.340 -9.081 1.00 0.07 H HETATM 1243 N21 UNN A 145 -12.425 -18.667 -9.768 1.00 -0.28 N HETATM 1244 C20 UNN A 145 -13.739 -18.513 -9.953 1.00 0.02 C HETATM 1245 H34 UNN A 145 -14.110 -18.346 -10.957 1.00 0.10 H HETATM 1246 H36 UNN A 145 -12.410 -19.101 -6.418 1.00 0.06 H HETATM 1247 C17 UNN A 145 -16.826 -19.557 -9.663 1.00 -0.09 C HETATM 1248 H28 UNN A 145 -16.552 -19.516 -10.728 1.00 0.01 H HETATM 1249 H29 UNN A 145 -17.918 -19.468 -9.561 1.00 0.01 H HETATM 1250 H30 UNN A 145 -16.495 -20.515 -9.236 1.00 0.01 H HETATM 1251 C18 UNN A 145 -16.561 -17.092 -9.562 1.00 -0.09 C HETATM 1252 H31 UNN A 145 -16.078 -16.259 -9.031 1.00 0.01 H HETATM 1253 H32 UNN A 145 -17.654 -16.980 -9.503 1.00 0.01 H HETATM 1254 H33 UNN A 145 -16.248 -17.085 -10.617 1.00 0.01 H HETATM 1255 H14 UNN A 145 -17.286 -19.172 -7.210 1.00 0.05 H HETATM 1256 H15 UNN A 145 -16.855 -17.432 -7.091 1.00 0.05 H HETATM 1257 H12 UNN A 145 -17.107 -19.718 -4.810 1.00 0.11 H HETATM 1258 H13 UNN A 145 -16.944 -17.930 -4.848 1.00 0.11 H HETATM 1259 H27 UNN A 145 -17.227 -18.722 -2.752 1.00 0.21 H HETATM 1260 H25 UNN A 145 -16.661 -20.917 -2.955 1.00 0.09 H HETATM 1261 H26 UNN A 145 -14.927 -20.448 -2.926 1.00 0.09 H HETATM 1262 H8 UNN A 145 -16.980 -20.060 -0.702 1.00 0.09 H HETATM 1263 H23 UNN A 145 -15.082 -19.140 0.471 1.00 0.20 H HETATM 1264 H24 UNN A 145 -14.134 -19.269 -0.869 1.00 0.20 H HETATM 1265 H6 UNN A 145 -16.533 -17.584 -0.582 1.00 0.09 H HETATM 1266 H7 UNN A 145 -14.829 -17.016 -0.609 1.00 0.09 H HETATM 1267 H22 UNN A 145 -14.553 -17.697 -2.893 1.00 0.09 H HETATM 1268 H4 UNN A 145 -17.299 -16.418 -2.901 1.00 0.06 H HETATM 1269 H5 UNN A 145 -15.883 -15.559 -2.204 1.00 0.06 H HETATM 1270 H1 UNN A 145 -14.144 -15.357 -5.362 1.00 0.05 H HETATM 1271 H2 UNN A 145 -13.791 -16.508 -4.028 1.00 0.05 H HETATM 1272 H3 UNN A 145 -14.165 -14.790 -3.657 1.00 0.05 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 520 519 1062 CONECT 550 549 1062 CONECT 711 709 710 1062 CONECT 779 778 1062 CONECT 1062 520 550 711 779 CONECT 1206 1207 1270 1271 1272 CONECT 1207 1206 1208 CONECT 1208 1207 1209 1268 1269 CONECT 1209 1208 1210 1218 1267 CONECT 1210 1209 1211 1265 1266 CONECT 1211 1210 1212 1263 1264 CONECT 1212 1211 1213 1217 1262 CONECT 1213 1212 1214 1215 1216 CONECT 1214 1213 CONECT 1215 1213 CONECT 1216 1213 CONECT 1217 1212 1218 1260 1261 CONECT 1218 1209 1217 1219 1259 CONECT 1219 1218 1220 1257 1258 CONECT 1220 1219 1221 1222 CONECT 1221 1220 CONECT 1222 1220 1223 1226 CONECT 1223 1222 1224 1255 1256 CONECT 1224 1223 1225 1247 1251 CONECT 1225 1224 1226 1244 CONECT 1226 1222 1225 1227 CONECT 1227 1226 1228 1246 CONECT 1228 1227 1229 1243 CONECT 1229 1228 1230 1241 1242 CONECT 1230 1229 1231 1235 CONECT 1231 1230 1232 1240 CONECT 1232 1231 1233 1239 CONECT 1233 1232 1234 1238 CONECT 1234 1233 1235 1237 CONECT 1235 1230 1234 1236 CONECT 1236 1235 CONECT 1237 1234 CONECT 1238 1233 CONECT 1239 1232 CONECT 1240 1231 CONECT 1241 1229 CONECT 1242 1229 CONECT 1243 1228 1244 CONECT 1244 1225 1243 1245 CONECT 1245 1244 CONECT 1246 1227 CONECT 1247 1224 1248 1249 1250 CONECT 1248 1247 CONECT 1249 1247 CONECT 1250 1247 CONECT 1251 1224 1252 1253 1254 CONECT 1252 1251 CONECT 1253 1251 CONECT 1254 1251 CONECT 1255 1223 CONECT 1256 1223 CONECT 1257 1219 CONECT 1258 1219 CONECT 1259 1218 CONECT 1260 1217 CONECT 1261 1217 CONECT 1262 1212 CONECT 1263 1211 CONECT 1264 1211 CONECT 1265 1210 CONECT 1266 1210 CONECT 1267 1209 CONECT 1268 1208 CONECT 1269 1208 CONECT 1270 1206 CONECT 1271 1206 CONECT 1272 1206 MASTER 0 0 0 0 0 0 0 0 1271 1 76 9 END
Display Options:
Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
Goto PDB code:
3D presentation of molecule is powered by
3Dmol
, which supports all modern browsers and mobile devices via WebGL.
Hold mouse button:
left to rotate,middle to shift,right to zoom
Related entries of code: 5c83
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1g3f
RCSB PDB
PDBbind
117aa, >1G3F_1|Chain... at 99%
1nw9
RCSB PDB
PDBbind
98aa, >1NW9_1|Chain... at 100%
1tfq
RCSB PDB
PDBbind
117aa, >1TFQ_1|Chain... at 99%
1tft
RCSB PDB
PDBbind
117aa, >1TFT_1|Chain... at 99%
2jk7
RCSB PDB
PDBbind
116aa, >2JK7_1|Chain... at 100%
2opy
RCSB PDB
PDBbind
106aa, >2OPY_1|Chain... at 100%
2vsl
RCSB PDB
PDBbind
96aa, >2VSL_1|Chain... at 100%
3cm2
RCSB PDB
PDBbind
130aa, >3CM2_1|Chains... *
3cm7
RCSB PDB
PDBbind
130aa, >3CM7_1|Chains... at 100%
3eyl
RCSB PDB
PDBbind
122aa, >3EYL_1|Chains... at 95%
3g76
RCSB PDB
PDBbind
122aa, >3G76_1|Chains... at 95%
3hl5
RCSB PDB
PDBbind
95aa, >3HL5_1|Chains... at 95%
4ec4
RCSB PDB
PDBbind
122aa, >4EC4_1|Chains... at 95%
4hy0
RCSB PDB
PDBbind
125aa, >4HY0_1|Chains... at 93%
5c0k
RCSB PDB
PDBbind
110aa, >5C0K_1|Chain... at 97%
5c3k
RCSB PDB
PDBbind
110aa, >5C3K_1|Chain... at 97%
5c7a
RCSB PDB
PDBbind
110aa, >5C7A_1|Chain... at 97%
5c7b
RCSB PDB
PDBbind
110aa, >5C7B_1|Chain... at 97%
5c7c
RCSB PDB
PDBbind
110aa, >5C7C_1|Chain... at 97%
5c7d
RCSB PDB
PDBbind
110aa, >5C7D_1|Chain... at 97%
5c84
RCSB PDB
PDBbind
110aa, >5C84_1|Chain... at 97%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
5c83
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
E3 ubiquitin-protein ligase XIAP
Ligand Name
4YN
EC.Number
E.C.6.3.2.-
Resolution
2.33(Å)
Affinity (Kd/Ki/IC50)
IC50=0.16uM
Release Year
2015
Protein/NA Sequence
Check fasta file
Primary Reference
(2015) J.Med.Chem. Vol. 58: pp. 6574-6588
Ligand Properties
Formula
C
2
5
H
3
6
N
4
O
2
Molecular Weight
424.579
Exact Mass
424.284
No. of atoms
67
No. of bonds
70
Polar Surface Area
63.48
LOGP Value
2.84 (
Computed with XLOGP3
)
3.37 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 2
No. of Rotatable Bonds: 7
No. of Nitrogen and Oxygen Atoms: 6
No. of Rings: 4
Canonical SMILES
COC[C@H]1C[NH2+][C@@H](C[N@@H+]1CC(=O)N1CC(c2c1cc(nc2)Cc1ccccc1)(C)C)C
InChI String
InChI=1S/C25H34N4O2/c1-18-14-28(21(12-26-18)16-31-4)15-24(30)29-17-25(2,3)22-13-27-20(11-23(22)29)10-19-8-6-5-7-9-19/h5-9,11,13,18,21,26H,10,12,14-17H2,1-4H3/p+2/t18-,21-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P98170
Entrez Gene ID
NCBI Entrez Gene ID:
331
ASD
Information of known allosteric effects of PDB entries
This site has been visited
times since Nov 2007.
Copyright ©2007-2024 涓婃捣鐩堣禌鎬濅俊鎭鎶鏈夐檺鍏徃 缃戠珯澶囨鍙凤細
娌狪CP澶2021015625鍙-3
娌叕缃戝畨澶囷細
姝e湪鐢宠涓
Technical Support锛堟妧鏈敮鎸侊級:
yingsaisi@foxmail.com