Datasets
Models
2074 lines (2073 with data), 160.8 kB
CRYST1 136.150 34.570 44.240 90.00 96.93 90.00 C 1 2 1 1 ATOM 1 N GLU A 3 -36.048 -13.578 14.500 1.00 57.01 N ATOM 2 CA GLU A 3 -34.597 -13.476 14.625 1.00 56.63 C ATOM 3 C GLU A 3 -33.903 -13.720 13.278 1.00 49.41 C ATOM 4 O GLU A 3 -34.013 -14.810 12.723 1.00 52.31 O ATOM 5 CB GLU A 3 -34.092 -14.527 15.624 1.00 63.73 C ATOM 6 CG GLU A 3 -34.547 -14.350 17.068 1.00 71.24 C ATOM 7 CD GLU A 3 -33.669 -13.400 17.886 1.00 75.48 C ATOM 8 OE1 GLU A 3 -32.629 -12.936 17.378 1.00 75.85 O ATOM 9 OE2 GLU A 3 -34.010 -13.132 19.058 1.00 78.14 O1- ATOM 10 H GLU A 3 -36.403 -14.167 15.016 1.00 68.43 H ATOM 11 HA GLU A 3 -34.354 -12.594 14.947 1.00 67.96 H ATOM 12 HB2 GLU A 3 -34.397 -15.399 15.330 1.00 76.48 H ATOM 13 HB3 GLU A 3 -33.122 -14.508 15.623 1.00 76.48 H ATOM 14 HG2 GLU A 3 -35.449 -13.993 17.069 1.00 85.50 H ATOM 15 HG3 GLU A 3 -34.536 -15.215 17.507 1.00 85.50 H ATOM 16 N GLN A 4 -33.205 -12.721 12.739 1.00 40.85 N ATOM 17 CA GLN A 4 -32.430 -12.881 11.505 1.00 36.48 C ATOM 18 C GLN A 4 -30.953 -12.643 11.784 1.00 29.56 C ATOM 19 O GLN A 4 -30.582 -11.669 12.444 1.00 27.40 O ATOM 20 CB GLN A 4 -32.891 -11.955 10.371 1.00 41.74 C ATOM 21 CG GLN A 4 -34.275 -12.234 9.875 1.00 50.80 C ATOM 22 CD GLN A 4 -34.798 -11.135 8.954 1.00 56.94 C ATOM 23 NE2 GLN A 4 -35.866 -11.442 8.204 1.00 60.80 N ATOM 24 OE1 GLN A 4 -34.254 -10.021 8.926 1.00 56.85 O ATOM 25 H GLN A 4 -33.163 -11.930 13.072 1.00 49.03 H ATOM 26 HA GLN A 4 -32.527 -13.795 11.196 1.00 43.79 H ATOM 27 HB2 GLN A 4 -32.871 -11.039 10.689 1.00 50.10 H ATOM 28 HB3 GLN A 4 -32.283 -12.055 9.621 1.00 50.10 H ATOM 29 HG2 GLN A 4 -34.271 -13.067 9.378 1.00 60.97 H ATOM 30 HG3 GLN A 4 -34.875 -12.302 10.633 1.00 60.97 H ATOM 31 HE21 GLN A 4 -36.198 -10.856 7.669 1.00 72.97 H ATOM 32 HE22 GLN A 4 -36.220 -12.224 8.258 1.00 72.97 H ATOM 33 N SER A 5 -30.116 -13.537 11.297 1.00 29.17 N ATOM 34 CA SER A 5 -28.688 -13.341 11.420 1.00 26.43 C ATOM 35 C SER A 5 -28.250 -12.278 10.430 1.00 27.65 C ATOM 36 O SER A 5 -28.689 -12.279 9.285 1.00 30.23 O ATOM 37 CB SER A 5 -27.974 -14.649 11.104 1.00 26.70 C ATOM 38 OG SER A 5 -26.577 -14.452 11.171 1.00 27.14 O ATOM 39 H SER A 5 -30.346 -14.261 10.895 1.00 35.01 H ATOM 40 HA SER A 5 -28.460 -13.058 12.319 1.00 31.72 H ATOM 41 HB2 SER A 5 -28.234 -15.321 11.754 1.00 32.05 H ATOM 42 HB3 SER A 5 -28.214 -14.937 10.209 1.00 32.05 H ATOM 43 HG SER A 5 -26.176 -15.169 10.998 1.00 32.58 H ATOM 44 N ILE A 6 -27.430 -11.334 10.870 1.00 25.55 N ATOM 45 CA ILE A 6 -26.890 -10.315 9.978 1.00 24.52 C ATOM 46 C ILE A 6 -25.422 -10.537 9.720 1.00 25.32 C ATOM 47 O ILE A 6 -24.860 -9.858 8.854 1.00 26.89 O ATOM 48 CB ILE A 6 -27.152 -8.878 10.492 1.00 27.64 C ATOM 49 CG1 ILE A 6 -26.370 -8.628 11.778 1.00 26.82 C ATOM 50 CG2 ILE A 6 -28.630 -8.677 10.658 1.00 26.44 C ATOM 51 CD1 ILE A 6 -26.324 -7.116 12.233 1.00 27.25 C ATOM 52 H ILE A 6 -27.170 -11.259 11.686 1.00 30.67 H ATOM 53 HA ILE A 6 -27.343 -10.397 9.124 1.00 29.43 H ATOM 54 HB ILE A 6 -26.836 -8.254 9.820 1.00 33.18 H ATOM 55 HG12 ILE A 6 -26.780 -9.138 12.494 1.00 32.19 H ATOM 56 HG13 ILE A 6 -25.456 -8.925 11.648 1.00 32.19 H ATOM 57 HG21 ILE A 6 -28.791 -7.777 10.980 1.00 31.74 H ATOM 58 HG22 ILE A 6 -29.063 -8.805 9.800 1.00 31.74 H ATOM 59 HG23 ILE A 6 -28.966 -9.323 11.298 1.00 31.74 H ATOM 60 HD11 ILE A 6 -25.810 -7.049 13.053 1.00 32.71 H ATOM 61 HD12 ILE A 6 -25.903 -6.589 11.535 1.00 32.71 H ATOM 62 HD13 ILE A 6 -27.230 -6.804 12.383 1.00 32.71 H ATOM 63 N CYS A 7 -24.790 -11.508 10.389 1.00 20.08 N ATOM 64 CA CYS A 7 -23.416 -11.890 10.072 1.00 18.94 C ATOM 65 C CYS A 7 -23.101 -13.218 10.697 1.00 19.43 C ATOM 66 O CYS A 7 -23.783 -13.646 11.627 1.00 19.52 O ATOM 67 CB CYS A 7 -22.366 -10.876 10.505 1.00 17.61 C ATOM 68 SG CYS A 7 -22.193 -10.657 12.272 1.00 19.77 S ATOM 69 H CYS A 7 -25.139 -11.960 11.032 1.00 24.10 H ATOM 70 HA CYS A 7 -23.341 -11.994 9.111 1.00 22.74 H ATOM 71 HB2 CYS A 7 -21.505 -11.160 10.162 1.00 21.14 H ATOM 72 HB3 CYS A 7 -22.597 -10.014 10.127 1.00 21.14 H ATOM 73 HG CYS A 7 -21.885 -11.706 12.767 1.00 23.74 H ATOM 74 N GLN A 8 -22.050 -13.849 10.182 1.00 17.36 N ATOM 75 CA GLN A 8 -21.433 -15.008 10.835 1.00 17.00 C ATOM 76 C GLN A 8 -19.940 -14.821 10.738 1.00 18.18 C ATOM 77 O GLN A 8 -19.430 -14.537 9.656 1.00 19.98 O ATOM 78 CB GLN A 8 -21.740 -16.319 10.086 1.00 25.69 C ATOM 79 CG GLN A 8 -23.142 -16.512 9.703 1.00 30.14 C ATOM 80 CD GLN A 8 -23.369 -17.821 9.003 1.00 29.40 C ATOM 81 NE2 GLN A 8 -23.273 -17.797 7.713 1.00 28.77 N ATOM 82 OE1 GLN A 8 -23.658 -18.811 9.623 1.00 30.38 O ATOM 83 H GLN A 8 -21.669 -13.624 9.444 1.00 20.85 H ATOM 84 HA GLN A 8 -21.704 -15.078 11.764 1.00 20.41 H ATOM 85 HB2 GLN A 8 -21.211 -16.338 9.273 1.00 30.84 H ATOM 86 HB3 GLN A 8 -21.488 -17.063 10.654 1.00 30.84 H ATOM 87 HG2 GLN A 8 -23.694 -16.498 10.501 1.00 36.17 H ATOM 88 HG3 GLN A 8 -23.408 -15.799 9.102 1.00 36.17 H ATOM 89 HE21 GLN A 8 -23.089 -17.060 7.309 1.00 34.53 H ATOM 90 HE22 GLN A 8 -23.394 -18.517 7.259 1.00 34.53 H ATOM 91 N ALA A 9 -19.235 -14.955 11.821 1.00 14.87 N ATOM 92 CA ALA A 9 -17.803 -14.767 11.835 1.00 14.68 C ATOM 93 C ALA A 9 -17.164 -15.793 12.762 1.00 14.36 C ATOM 94 O ALA A 9 -17.706 -16.102 13.828 1.00 15.81 O ATOM 95 CB ALA A 9 -17.529 -13.330 12.341 1.00 17.00 C ATOM 96 H ALA A 9 -19.565 -15.161 12.588 1.00 17.79 H ATOM 97 HA ALA A 9 -17.439 -14.869 10.942 1.00 17.57 H ATOM 98 HB1 ALA A 9 -16.571 -13.179 12.360 1.00 20.42 H ATOM 99 HB2 ALA A 9 -17.953 -12.698 11.739 1.00 20.42 H ATOM 100 HB3 ALA A 9 -17.897 -13.234 13.233 1.00 20.42 H ATOM 101 N ARG A 10 -15.955 -16.223 12.414 1.00 15.37 N ATOM 102 CA ARG A 10 -15.244 -17.266 13.144 1.00 16.39 C ATOM 103 C ARG A 10 -14.411 -16.560 14.221 1.00 17.65 C ATOM 104 O ARG A 10 -13.576 -15.695 13.890 1.00 17.29 O ATOM 105 CB ARG A 10 -14.316 -17.982 12.184 1.00 18.04 C ATOM 106 CG ARG A 10 -13.638 -19.224 12.788 1.00 20.42 C ATOM 107 CD ARG A 10 -14.612 -20.286 13.200 1.00 20.05 C ATOM 108 NE ARG A 10 -15.317 -20.778 12.037 1.00 17.69 N ATOM 109 CZ ARG A 10 -14.894 -21.702 11.178 1.00 17.98 C ATOM 110 NH1 ARG A 10 -13.796 -22.363 11.411 1.00 18.71 N1+ ATOM 111 NH2 ARG A 10 -15.614 -21.918 10.116 1.00 20.71 N ATOM 112 H ARG A 10 -15.516 -15.918 11.741 1.00 18.45 H ATOM 113 HA ARG A 10 -15.860 -17.895 13.552 1.00 19.67 H ATOM 114 HB2 ARG A 10 -14.827 -18.270 11.411 1.00 21.66 H ATOM 115 HB3 ARG A 10 -13.618 -17.368 11.908 1.00 21.66 H ATOM 116 HG2 ARG A 10 -13.039 -19.607 12.129 1.00 24.51 H ATOM 117 HG3 ARG A 10 -13.137 -18.957 13.575 1.00 24.51 H ATOM 118 HD2 ARG A 10 -14.135 -21.025 13.608 1.00 24.07 H ATOM 119 HD3 ARG A 10 -15.259 -19.913 13.819 1.00 24.07 H ATOM 120 HE ARG A 10 -16.091 -20.436 11.884 1.00 21.24 H ATOM 121 HH11 ARG A 10 -13.322 -22.178 12.105 1.00 22.46 H ATOM 122 HH12 ARG A 10 -13.537 -22.973 10.864 1.00 22.46 H ATOM 123 HH21 ARG A 10 -16.349 -21.487 10.001 1.00 24.86 H ATOM 124 HH22 ARG A 10 -15.397 -22.548 9.572 1.00 24.86 H ATOM 125 N ALA A 11 -14.598 -16.933 15.490 1.00 16.00 N ATOM 126 CA ALA A 11 -13.778 -16.331 16.539 1.00 14.84 C ATOM 127 C ALA A 11 -13.705 -17.225 17.757 1.00 14.98 C ATOM 128 O ALA A 11 -14.611 -18.016 17.994 1.00 15.29 O ATOM 129 CB ALA A 11 -14.343 -14.964 16.979 1.00 14.80 C ATOM 130 H ALA A 11 -15.172 -17.512 15.761 1.00 19.20 H ATOM 131 HA ALA A 11 -12.877 -16.195 16.205 1.00 17.81 H ATOM 132 HB1 ALA A 11 -14.359 -14.368 16.214 1.00 17.77 H ATOM 133 HB2 ALA A 11 -15.243 -15.090 17.319 1.00 17.77 H ATOM 134 HB3 ALA A 11 -13.775 -14.596 17.674 1.00 17.77 H ATOM 135 N ALA A 12 -12.593 -17.136 18.456 1.00 14.02 N ATOM 136 CA ALA A 12 -12.506 -17.750 19.791 1.00 13.23 C ATOM 137 C ALA A 12 -13.069 -16.735 20.773 1.00 14.96 C ATOM 138 O ALA A 12 -12.588 -15.589 20.851 1.00 14.37 O ATOM 139 CB ALA A 12 -11.061 -18.003 20.125 1.00 15.34 C ATOM 140 H ALA A 12 -11.878 -16.735 18.197 1.00 16.83 H ATOM 141 HA ALA A 12 -13.012 -18.576 19.833 1.00 15.86 H ATOM 142 HB1 ALA A 12 -10.583 -17.159 20.118 1.00 18.42 H ATOM 143 HB2 ALA A 12 -11.008 -18.408 21.005 1.00 18.42 H ATOM 144 HB3 ALA A 12 -10.685 -18.602 19.461 1.00 18.42 H ATOM 145 N VAL A 13 -14.119 -17.098 21.446 1.00 14.55 N ATOM 146 CA VAL A 13 -14.830 -16.172 22.315 1.00 13.77 C ATOM 147 C VAL A 13 -14.239 -16.238 23.723 1.00 13.41 C ATOM 148 O VAL A 13 -14.140 -17.339 24.307 1.00 14.16 O ATOM 149 CB VAL A 13 -16.335 -16.482 22.346 1.00 14.18 C ATOM 150 CG1 VAL A 13 -17.101 -15.464 23.250 1.00 14.97 C ATOM 151 CG2 VAL A 13 -16.943 -16.523 20.906 1.00 15.60 C ATOM 152 H VAL A 13 -14.458 -17.888 21.426 1.00 17.47 H ATOM 153 HA VAL A 13 -14.714 -15.269 21.980 1.00 16.54 H ATOM 154 HB VAL A 13 -16.456 -17.361 22.736 1.00 17.03 H ATOM 155 HG11 VAL A 13 -16.467 -14.829 23.618 1.00 17.97 H ATOM 156 HG12 VAL A 13 -17.761 -14.999 22.711 1.00 17.97 H ATOM 157 HG13 VAL A 13 -17.540 -15.948 23.967 1.00 17.97 H ATOM 158 HG21 VAL A 13 -16.241 -16.343 20.261 1.00 18.73 H ATOM 159 HG22 VAL A 13 -17.320 -17.403 20.748 1.00 18.73 H ATOM 160 HG23 VAL A 13 -17.637 -15.849 20.837 1.00 18.73 H ATOM 161 N AMET A 14 -13.763 -15.090 24.207 0.71 13.75 N ATOM 162 N BMET A 14 -13.996 -15.079 24.309 0.29 14.83 N ATOM 163 CA AMET A 14 -13.081 -14.971 25.487 0.71 15.14 C ATOM 164 CA BMET A 14 -13.384 -15.026 25.620 0.29 15.53 C ATOM 165 C AMET A 14 -13.882 -14.042 26.389 0.71 13.99 C ATOM 166 C BMET A 14 -14.144 -14.078 26.544 0.29 14.53 C ATOM 167 O AMET A 14 -14.600 -13.139 25.931 0.71 14.24 O ATOM 168 O BMET A 14 -14.873 -13.168 26.112 0.29 13.58 O ATOM 169 CB AMET A 14 -11.671 -14.406 25.342 0.71 16.89 C ATOM 170 CB BMET A 14 -11.911 -14.635 25.478 0.29 16.87 C ATOM 171 CG AMET A 14 -10.849 -14.916 24.159 0.71 18.93 C ATOM 172 CG BMET A 14 -11.200 -15.311 24.293 0.29 19.02 C ATOM 173 SD AMET A 14 -10.589 -16.678 24.263 0.71 21.04 S ATOM 174 SD BMET A 14 -9.435 -14.971 24.281 0.29 22.14 S ATOM 175 CE AMET A 14 -9.552 -16.877 25.703 0.71 23.33 C ATOM 176 CE BMET A 14 -8.910 -16.063 25.581 0.29 22.85 C ATOM 177 H AMET A 14 -13.828 -14.341 23.791 0.71 16.51 H ATOM 178 H BMET A 14 -14.175 -14.310 23.969 0.29 17.81 H ATOM 179 HA AMET A 14 -13.018 -15.846 25.901 0.71 18.17 H ATOM 180 HA BMET A 14 -13.411 -15.915 26.007 0.29 18.65 H ATOM 181 HB2AMET A 14 -11.738 -13.443 25.251 0.71 20.27 H ATOM 182 HB2BMET A 14 -11.853 -13.675 25.351 0.29 20.25 H ATOM 183 HB3AMET A 14 -11.176 -14.618 26.149 0.71 20.27 H ATOM 184 HB3BMET A 14 -11.441 -14.888 26.289 0.29 20.25 H ATOM 185 HG2AMET A 14 -11.322 -14.726 23.334 0.71 22.73 H ATOM 186 HG2BMET A 14 -11.322 -16.271 24.354 0.29 22.83 H ATOM 187 HG3AMET A 14 -9.983 -14.480 24.159 0.71 22.73 H ATOM 188 HG3BMET A 14 -11.578 -14.978 23.464 0.29 22.83 H ATOM 189 HE1AMET A 14 -9.363 -17.820 25.828 0.71 28.01 H ATOM 190 HE1BMET A 14 -9.143 -16.974 25.340 0.29 27.43 H ATOM 191 HE2AMET A 14 -10.018 -16.526 26.478 0.71 28.01 H ATOM 192 HE2BMET A 14 -7.950 -15.984 25.690 0.29 27.43 H ATOM 193 HE3AMET A 14 -8.725 -16.389 25.565 0.71 28.01 H ATOM 194 HE3BMET A 14 -9.359 -15.812 26.403 0.29 27.43 H ATOM 195 N AVAL A 15 -13.782 -14.294 27.694 0.71 12.21 N ATOM 196 N BVAL A 15 -13.961 -14.339 27.841 0.29 13.26 N ATOM 197 CA AVAL A 15 -14.308 -13.374 28.699 0.71 14.46 C ATOM 198 CA BVAL A 15 -14.462 -13.521 28.946 0.29 12.99 C ATOM 199 C AVAL A 15 -13.202 -13.061 29.693 0.71 13.42 C ATOM 200 C BVAL A 15 -13.251 -13.097 29.765 0.29 13.63 C ATOM 201 O AVAL A 15 -12.300 -13.845 29.947 0.71 13.97 O ATOM 202 O BVAL A 15 -12.314 -13.873 29.947 0.29 14.08 O ATOM 203 CB AVAL A 15 -15.582 -13.862 29.408 0.71 14.12 C ATOM 204 CB BVAL A 15 -15.463 -14.297 29.830 0.29 15.58 C ATOM 205 CG1AVAL A 15 -16.777 -13.957 28.472 0.71 15.69 C ATOM 206 CG1BVAL A 15 -16.097 -13.376 30.825 0.29 13.29 C ATOM 207 CG2AVAL A 15 -15.355 -15.225 30.114 0.71 14.86 C ATOM 208 CG2BVAL A 15 -16.530 -14.940 29.025 0.29 14.80 C ATOM 209 H AVAL A 15 -13.412 -14.997 28.025 0.71 14.60 H ATOM 210 H BVAL A 15 -13.523 -15.026 28.117 0.29 15.92 H ATOM 211 HA AVAL A 15 -14.534 -12.543 28.253 0.71 17.36 H ATOM 212 HA BVAL A 15 -14.899 -12.728 28.598 0.29 15.60 H ATOM 213 HB AVAL A 15 -15.809 -13.218 30.097 0.71 16.96 H ATOM 214 HB BVAL A 15 -14.990 -14.990 30.316 0.29 18.71 H ATOM 215 HG11AVAL A 15 -17.547 -14.268 28.973 0.71 18.84 H ATOM 216 HG11BVAL A 15 -16.721 -13.881 31.369 0.29 15.95 H ATOM 217 HG12AVAL A 15 -16.957 -13.079 28.100 0.71 18.84 H ATOM 218 HG12BVAL A 15 -15.404 -12.992 31.385 0.29 15.95 H ATOM 219 HG13AVAL A 15 -16.571 -14.582 27.760 0.71 18.84 H ATOM 220 HG13BVAL A 15 -16.566 -12.672 30.350 0.29 15.95 H ATOM 221 HG21AVAL A 15 -16.179 -15.496 30.548 0.71 17.85 H ATOM 222 HG21BVAL A 15 -17.132 -15.413 29.621 0.29 17.77 H ATOM 223 HG22AVAL A 15 -15.097 -15.884 29.451 0.71 17.85 H ATOM 224 HG22BVAL A 15 -17.015 -14.254 28.540 0.29 17.77 H ATOM 225 HG23AVAL A 15 -14.651 -15.125 30.773 0.71 17.85 H ATOM 226 HG23BVAL A 15 -16.123 -15.562 28.402 0.29 17.77 H ATOM 227 N TYR A 16 -13.246 -11.859 30.260 1.00 12.87 N ATOM 228 CA TYR A 16 -12.137 -11.460 31.118 1.00 13.48 C ATOM 229 C TYR A 16 -12.366 -11.867 32.570 1.00 14.12 C ATOM 230 O TYR A 16 -13.400 -11.545 33.162 1.00 16.51 O ATOM 231 CB TYR A 16 -11.933 -9.928 31.062 1.00 13.58 C ATOM 232 CG TYR A 16 -10.592 -9.514 31.574 1.00 14.33 C ATOM 233 CD1 TYR A 16 -9.403 -9.774 30.878 1.00 14.60 C ATOM 234 CD2 TYR A 16 -10.530 -8.825 32.766 1.00 17.07 C ATOM 235 CE1 TYR A 16 -8.204 -9.364 31.406 1.00 17.95 C ATOM 236 CE2 TYR A 16 -9.340 -8.409 33.264 1.00 19.52 C ATOM 237 CZ TYR A 16 -8.198 -8.694 32.583 1.00 20.37 C ATOM 238 OH TYR A 16 -7.051 -8.206 33.195 1.00 27.65 O ATOM 239 H ATYR A 16 -13.875 -11.280 30.170 0.71 15.40 H ATOM 240 H BTYR A 16 -13.844 -11.257 30.121 0.29 15.40 H ATOM 241 HA TYR A 16 -11.323 -11.887 30.808 1.00 16.13 H ATOM 242 HB2 TYR A 16 -12.008 -9.632 30.141 1.00 16.25 H ATOM 243 HB3 TYR A 16 -12.610 -9.498 31.606 1.00 16.25 H ATOM 244 HD1 TYR A 16 -9.424 -10.241 30.074 1.00 17.48 H ATOM 245 HD2 TYR A 16 -11.313 -8.636 33.231 1.00 20.49 H ATOM 246 HE1 TYR A 16 -7.408 -9.531 30.956 1.00 21.55 H ATOM 247 HE2 TYR A 16 -9.303 -7.949 34.071 1.00 23.43 H ATOM 248 HH TYR A 16 -6.377 -8.388 32.729 1.00 33.19 H ATOM 249 N ASP A 17 -11.391 -12.541 33.144 1.00 14.77 N ATOM 250 CA ASP A 17 -11.420 -12.908 34.553 1.00 15.63 C ATOM 251 C ASP A 17 -10.857 -11.706 35.294 1.00 16.18 C ATOM 252 O ASP A 17 -9.637 -11.523 35.425 1.00 16.77 O ATOM 253 CB ASP A 17 -10.645 -14.211 34.750 1.00 16.26 C ATOM 254 CG ASP A 17 -10.561 -14.665 36.173 1.00 17.38 C ATOM 255 OD1 ASP A 17 -10.987 -13.958 37.119 1.00 17.76 O ATOM 256 OD2 ASP A 17 -10.032 -15.791 36.387 1.00 18.09 O1- ATOM 257 H ASP A 17 -10.684 -12.807 32.733 1.00 17.67 H ATOM 258 HA ASP A 17 -12.337 -13.046 34.836 1.00 18.71 H ATOM 259 HB2 ASP A 17 -11.082 -14.912 34.242 1.00 19.47 H ATOM 260 HB3 ASP A 17 -9.740 -14.086 34.426 1.00 19.47 H ATOM 261 N AASP A 18 -11.761 -10.933 35.890 0.61 17.35 N ATOM 262 N BASP A 18 -11.755 -10.938 35.899 0.39 17.66 N ATOM 263 CA AASP A 18 -11.341 -9.741 36.593 0.61 20.92 C ATOM 264 CA BASP A 18 -11.346 -9.716 36.557 0.39 20.77 C ATOM 265 C AASP A 18 -10.468 -10.080 37.791 0.61 21.06 C ATOM 266 C BASP A 18 -10.763 -9.945 37.949 0.39 20.85 C ATOM 267 O AASP A 18 -9.540 -9.341 38.133 0.61 23.93 O ATOM 268 O BASP A 18 -10.330 -8.970 38.577 0.39 21.55 O ATOM 269 CB AASP A 18 -12.600 -9.012 37.075 0.61 23.40 C ATOM 270 CB BASP A 18 -12.540 -8.757 36.643 0.39 23.09 C ATOM 271 CG AASP A 18 -13.381 -8.391 35.937 0.61 23.42 C ATOM 272 CG BASP A 18 -13.627 -9.256 37.579 0.39 24.79 C ATOM 273 OD1AASP A 18 -12.761 -7.659 35.147 0.61 23.43 O ATOM 274 OD1BASP A 18 -13.396 -9.269 38.795 0.39 26.43 O ATOM 275 OD2AASP A 18 -14.605 -8.611 35.819 0.61 23.40 O1- ATOM 276 OD2BASP A 18 -14.741 -9.549 37.121 0.39 25.01 O1- ATOM 277 H AASP A 18 -12.608 -11.079 35.900 0.61 20.83 H ATOM 278 H BASP A 18 -12.598 -11.104 35.940 0.39 21.20 H ATOM 279 HA AASP A 18 -10.847 -9.159 35.995 0.61 25.11 H ATOM 280 HA BASP A 18 -10.662 -9.288 36.019 0.39 24.94 H ATOM 281 HB2AASP A 18 -13.179 -9.645 37.527 0.61 28.09 H ATOM 282 HB2BASP A 18 -12.232 -7.898 36.971 0.39 27.72 H ATOM 283 HB3AASP A 18 -12.341 -8.303 37.684 0.61 28.09 H ATOM 284 HB3BASP A 18 -12.928 -8.655 35.760 0.39 27.72 H ATOM 285 N ALA A 19 -10.736 -11.187 38.443 1.00 18.55 N ATOM 286 CA ALA A 19 -9.982 -11.502 39.657 1.00 21.46 C ATOM 287 C ALA A 19 -8.535 -11.842 39.346 1.00 20.62 C ATOM 288 O ALA A 19 -7.626 -11.343 40.018 1.00 23.77 O ATOM 289 CB ALA A 19 -10.621 -12.629 40.474 1.00 20.95 C ATOM 290 H AALA A 19 -11.332 -11.766 38.221 0.61 22.22 H ATOM 291 H BALA A 19 -11.144 -11.860 38.096 0.39 22.22 H ATOM 292 HA ALA A 19 -9.975 -10.711 40.220 1.00 25.76 H ATOM 293 HB1 ALA A 19 -10.661 -13.430 39.928 1.00 25.15 H ATOM 294 HB2 ALA A 19 -10.080 -12.793 41.262 1.00 25.15 H ATOM 295 HB3 ALA A 19 -11.515 -12.361 40.736 1.00 25.15 H ATOM 296 N ASN A 20 -8.304 -12.645 38.327 1.00 24.31 N ATOM 297 CA ASN A 20 -6.982 -13.142 37.978 1.00 26.90 C ATOM 298 C ASN A 20 -6.349 -12.376 36.831 1.00 25.88 C ATOM 299 O ASN A 20 -5.215 -12.663 36.472 1.00 26.98 O ATOM 300 CB ASN A 20 -7.054 -14.629 37.628 1.00 28.40 C ATOM 301 CG ASN A 20 -7.144 -15.505 38.847 1.00 35.91 C ATOM 302 ND2 ASN A 20 -7.341 -16.796 38.630 1.00 39.12 N ATOM 303 OD1 ASN A 20 -7.010 -15.038 39.991 1.00 41.22 O ATOM 304 H ASN A 20 -8.920 -12.930 37.799 1.00 29.18 H ATOM 305 HA ASN A 20 -6.402 -13.049 38.750 1.00 32.29 H ATOM 306 HB2 ASN A 20 -7.841 -14.789 37.084 1.00 34.08 H ATOM 307 HB3 ASN A 20 -6.254 -14.878 37.138 1.00 34.08 H ATOM 308 HD21 ASN A 20 -7.400 -17.340 39.294 1.00 46.96 H ATOM 309 HD22 ASN A 20 -7.409 -17.092 37.826 1.00 46.96 H ATOM 310 N LYS A 21 -7.068 -11.419 36.251 1.00 22.90 N ATOM 311 CA LYS A 21 -6.539 -10.480 35.269 1.00 21.50 C ATOM 312 C LYS A 21 -6.041 -11.180 34.006 1.00 23.65 C ATOM 313 O LYS A 21 -4.917 -10.969 33.565 1.00 25.72 O ATOM 314 CB LYS A 21 -5.438 -9.580 35.862 1.00 25.24 C ATOM 315 CG LYS A 21 -5.764 -8.986 37.227 1.00 32.51 C ATOM 316 CD LYS A 21 -6.956 -8.100 37.187 1.00 37.03 C ATOM 317 CE LYS A 21 -7.029 -7.249 38.463 1.00 40.78 C ATOM 318 NZ LYS A 21 -7.271 -8.033 39.734 1.00 44.25 N1+ ATOM 319 H LYS A 21 -7.901 -11.290 36.419 1.00 27.49 H ATOM 320 HA LYS A 21 -7.264 -9.895 34.998 1.00 25.81 H ATOM 321 HB2 LYS A 21 -4.628 -10.106 35.957 1.00 30.29 H ATOM 322 HB3 LYS A 21 -5.278 -8.843 35.252 1.00 30.29 H ATOM 323 HG2 LYS A 21 -5.945 -9.706 37.852 1.00 39.02 H ATOM 324 HG3 LYS A 21 -5.008 -8.461 37.534 1.00 39.02 H ATOM 325 HD2 LYS A 21 -6.892 -7.505 36.423 1.00 44.45 H ATOM 326 HD3 LYS A 21 -7.760 -8.640 37.130 1.00 44.45 H ATOM 327 HE2 LYS A 21 -6.189 -6.774 38.566 1.00 48.94 H ATOM 328 HE3 LYS A 21 -7.754 -6.612 38.369 1.00 48.94 H ATOM 329 HZ1 LYS A 21 -6.613 -8.619 39.859 1.00 53.11 H ATOM 330 HZ2 LYS A 21 -7.301 -7.479 40.431 1.00 53.11 H ATOM 331 HZ3 LYS A 21 -8.043 -8.471 39.679 1.00 53.11 H ATOM 332 N LYS A 22 -6.900 -12.010 33.420 1.00 17.33 N ATOM 333 CA LYS A 22 -6.575 -12.748 32.197 1.00 18.19 C ATOM 334 C LYS A 22 -7.841 -13.135 31.452 1.00 18.01 C ATOM 335 O LYS A 22 -8.927 -13.200 32.027 1.00 16.28 O ATOM 336 CB LYS A 22 -5.695 -13.948 32.468 1.00 23.76 C ATOM 337 CG LYS A 22 -6.377 -15.024 33.169 1.00 28.65 C ATOM 338 CD LYS A 22 -5.449 -16.243 33.308 1.00 37.87 C ATOM 339 CE LYS A 22 -4.293 -15.929 34.211 1.00 49.26 C ATOM 340 NZ LYS A 22 -3.656 -17.169 34.785 1.00 57.84 N1+ ATOM 341 H LYS A 22 -7.693 -12.167 33.716 1.00 20.81 H ATOM 342 HA LYS A 22 -6.073 -12.155 31.615 1.00 21.83 H ATOM 343 HB2 LYS A 22 -5.376 -14.300 31.622 1.00 28.52 H ATOM 344 HB3 LYS A 22 -4.943 -13.669 33.012 1.00 28.52 H ATOM 345 HG2 LYS A 22 -6.628 -14.725 34.057 1.00 34.39 H ATOM 346 HG3 LYS A 22 -7.163 -15.292 32.666 1.00 34.39 H ATOM 347 HD2 LYS A 22 -5.945 -16.984 33.690 1.00 45.45 H ATOM 348 HD3 LYS A 22 -5.100 -16.484 32.436 1.00 45.45 H ATOM 349 HE2 LYS A 22 -3.617 -15.450 33.707 1.00 59.13 H ATOM 350 HE3 LYS A 22 -4.606 -15.383 34.949 1.00 59.13 H ATOM 351 HZ1 LYS A 22 -2.976 -16.944 35.314 1.00 69.42 H ATOM 352 HZ2 LYS A 22 -4.254 -17.625 35.260 1.00 69.42 H ATOM 353 HZ3 LYS A 22 -3.352 -17.686 34.128 1.00 69.42 H ATOM 354 N TRP A 23 -7.687 -13.365 30.141 1.00 16.58 N ATOM 355 CA TRP A 23 -8.789 -13.811 29.333 1.00 14.57 C ATOM 356 C TRP A 23 -8.952 -15.308 29.537 1.00 16.04 C ATOM 357 O TRP A 23 -7.954 -16.033 29.656 1.00 21.82 O ATOM 358 CB TRP A 23 -8.508 -13.581 27.854 1.00 15.50 C ATOM 359 CG TRP A 23 -8.495 -12.120 27.489 1.00 15.99 C ATOM 360 CD1 TRP A 23 -7.396 -11.331 27.244 1.00 18.04 C ATOM 361 CD2 TRP A 23 -9.624 -11.285 27.345 1.00 14.64 C ATOM 362 CE2 TRP A 23 -9.138 -9.980 27.019 1.00 15.41 C ATOM 363 CE3 TRP A 23 -11.000 -11.467 27.468 1.00 13.90 C ATOM 364 NE1 TRP A 23 -7.776 -10.051 26.975 1.00 15.63 N ATOM 365 CZ2 TRP A 23 -9.961 -8.914 26.862 1.00 13.74 C ATOM 366 CZ3 TRP A 23 -11.829 -10.370 27.237 1.00 16.42 C ATOM 367 CH2 TRP A 23 -11.296 -9.110 26.927 1.00 14.25 C ATOM 368 H TRP A 23 -6.950 -13.265 29.710 1.00 19.91 H ATOM 369 HA TRP A 23 -9.608 -13.356 29.586 1.00 17.43 H ATOM 370 HB2 TRP A 23 -7.640 -13.953 27.636 1.00 18.61 H ATOM 371 HB3 TRP A 23 -9.198 -14.016 27.329 1.00 18.61 H ATOM 372 HD1 TRP A 23 -6.515 -11.625 27.282 1.00 21.66 H ATOM 373 HE1 TRP A 23 -7.245 -9.397 26.801 1.00 18.76 H ATOM 374 HE3 TRP A 23 -11.356 -12.301 27.677 1.00 16.69 H ATOM 375 HZ2 TRP A 23 -9.617 -8.085 26.617 1.00 16.50 H ATOM 376 HZ3 TRP A 23 -12.750 -10.469 27.319 1.00 19.71 H ATOM 377 HH2 TRP A 23 -11.871 -8.391 26.794 1.00 17.10 H ATOM 378 N VAL A 24 -10.197 -15.764 29.562 1.00 14.68 N ATOM 379 CA VAL A 24 -10.513 -17.186 29.740 1.00 17.15 C ATOM 380 C VAL A 24 -11.537 -17.571 28.680 1.00 17.70 C ATOM 381 O VAL A 24 -12.332 -16.725 28.226 1.00 15.55 O ATOM 382 CB VAL A 24 -11.037 -17.461 31.155 1.00 20.57 C ATOM 383 CG1 VAL A 24 -10.047 -16.971 32.250 1.00 22.71 C ATOM 384 CG2 VAL A 24 -12.282 -16.851 31.405 1.00 22.74 C ATOM 385 H VAL A 24 -10.892 -15.265 29.478 1.00 17.63 H ATOM 386 HA VAL A 24 -9.712 -17.716 29.601 1.00 20.59 H ATOM 387 HB VAL A 24 -11.149 -18.418 31.265 1.00 24.70 H ATOM 388 HG11 VAL A 24 -10.422 -17.167 33.124 1.00 27.26 H ATOM 389 HG12 VAL A 24 -9.202 -17.434 32.141 1.00 27.26 H ATOM 390 HG13 VAL A 24 -9.916 -16.015 32.152 1.00 27.26 H ATOM 391 HG21 VAL A 24 -12.559 -17.060 32.310 1.00 27.30 H ATOM 392 HG22 VAL A 24 -12.190 -15.891 31.300 1.00 27.30 H ATOM 393 HG23 VAL A 24 -12.933 -17.193 30.772 1.00 27.30 H ATOM 394 N PRO A 25 -11.547 -18.813 28.214 1.00 14.90 N ATOM 395 CA PRO A 25 -12.516 -19.195 27.163 1.00 16.06 C ATOM 396 C PRO A 25 -13.953 -19.099 27.657 1.00 14.80 C ATOM 397 O PRO A 25 -14.322 -19.680 28.682 1.00 15.98 O ATOM 398 CB PRO A 25 -12.139 -20.662 26.845 1.00 16.46 C ATOM 399 CG PRO A 25 -11.533 -21.160 28.158 1.00 17.64 C ATOM 400 CD PRO A 25 -10.731 -19.952 28.652 1.00 17.88 C ATOM 401 HA PRO A 25 -12.402 -18.646 26.372 1.00 19.28 H ATOM 402 HB2 PRO A 25 -12.934 -21.167 26.614 1.00 19.76 H ATOM 403 HB3 PRO A 25 -11.486 -20.689 26.128 1.00 19.76 H ATOM 404 HG2 PRO A 25 -12.238 -21.390 28.783 1.00 21.18 H ATOM 405 HG3 PRO A 25 -10.953 -21.919 27.990 1.00 21.18 H ATOM 406 HD2 PRO A 25 -10.659 -19.965 29.619 1.00 21.46 H ATOM 407 HD3 PRO A 25 -9.859 -19.928 28.228 1.00 21.46 H ATOM 408 N ALA A 26 -14.797 -18.470 26.841 1.00 14.52 N ATOM 409 CA ALA A 26 -16.215 -18.450 27.150 1.00 13.95 C ATOM 410 C ALA A 26 -16.785 -19.870 27.073 1.00 16.86 C ATOM 411 O ALA A 26 -16.544 -20.609 26.103 1.00 18.21 O ATOM 412 CB ALA A 26 -16.971 -17.526 26.197 1.00 17.09 C ATOM 413 H ALA A 26 -14.576 -18.057 26.120 1.00 17.44 H ATOM 414 HA ALA A 26 -16.341 -18.122 28.054 1.00 16.75 H ATOM 415 HB1 ALA A 26 -17.913 -17.536 26.429 1.00 20.52 H ATOM 416 HB2 ALA A 26 -16.617 -16.627 26.283 1.00 20.52 H ATOM 417 HB3 ALA A 26 -16.851 -17.844 25.288 1.00 20.52 H ATOM 418 N GLY A 27 -17.556 -20.231 28.096 1.00 16.62 N ATOM 419 CA GLY A 27 -18.130 -21.542 28.175 1.00 16.77 C ATOM 420 C GLY A 27 -17.204 -22.621 28.697 1.00 18.57 C ATOM 421 O GLY A 27 -17.645 -23.743 28.838 1.00 21.01 O ATOM 422 H GLY A 27 -17.757 -19.719 28.758 1.00 19.96 H ATOM 423 HA2 GLY A 27 -18.906 -21.510 28.756 1.00 20.13 H ATOM 424 HA3 GLY A 27 -18.428 -21.807 27.291 1.00 20.13 H ATOM 425 N GLY A 28 -15.917 -22.326 28.907 1.00 17.34 N ATOM 426 CA GLY A 28 -15.022 -23.232 29.568 1.00 18.29 C ATOM 427 C GLY A 28 -13.930 -23.882 28.757 1.00 17.78 C ATOM 428 O GLY A 28 -12.932 -24.318 29.354 1.00 19.03 O ATOM 429 H GLY A 28 -15.547 -21.589 28.666 1.00 20.82 H ATOM 430 HA2 GLY A 28 -14.592 -22.755 30.295 1.00 21.95 H ATOM 431 HA3 GLY A 28 -15.549 -23.945 29.961 1.00 21.95 H ATOM 432 N ASER A 29 -14.069 -23.970 27.437 0.32 17.19 N ATOM 433 N BSER A 29 -14.069 -23.937 27.429 0.68 17.16 N ATOM 434 CA ASER A 29 -13.114 -24.727 26.637 0.32 17.87 C ATOM 435 CA BSER A 29 -13.140 -24.705 26.607 0.68 17.79 C ATOM 436 C ASER A 29 -12.634 -23.870 25.472 0.32 16.95 C ATOM 437 C BSER A 29 -12.636 -23.837 25.457 0.68 16.92 C ATOM 438 O ASER A 29 -13.432 -23.244 24.773 0.32 17.06 O ATOM 439 O BSER A 29 -13.414 -23.190 24.758 0.68 17.61 O ATOM 440 CB ASER A 29 -13.692 -26.080 26.155 0.32 19.77 C ATOM 441 CB BSER A 29 -13.710 -26.075 26.105 0.68 19.51 C ATOM 442 OG ASER A 29 -14.852 -25.866 25.376 0.32 19.53 O ATOM 443 OG BSER A 29 -13.721 -27.002 27.149 0.68 21.34 O ATOM 444 H ASER A 29 -14.702 -23.604 26.984 0.32 20.58 H ATOM 445 H BSER A 29 -14.690 -23.540 26.985 0.68 20.54 H ATOM 446 HA ASER A 29 -12.342 -24.924 27.189 0.32 21.46 H ATOM 447 HA BSER A 29 -12.368 -24.913 27.156 0.68 21.30 H ATOM 448 HB2ASER A 29 -13.027 -26.536 25.616 0.32 23.73 H ATOM 449 HB2BSER A 29 -14.616 -25.945 25.786 0.68 23.42 H ATOM 450 HB3ASER A 29 -13.923 -26.620 26.927 0.32 23.73 H ATOM 451 HB3BSER A 29 -13.148 -26.410 25.389 0.68 23.42 H ATOM 452 HG ASER A 29 -15.164 -26.602 25.117 0.32 23.45 H ATOM 453 HG BSER A 29 -12.940 -27.121 27.436 0.68 25.62 H ATOM 454 N THR A 30 -11.324 -23.877 25.277 1.00 17.48 N ATOM 455 CA THR A 30 -10.707 -23.035 24.244 1.00 18.87 C ATOM 456 C THR A 30 -10.962 -23.615 22.852 1.00 18.23 C ATOM 457 O THR A 30 -10.789 -24.784 22.617 1.00 20.60 O ATOM 458 CB THR A 30 -9.213 -22.908 24.498 1.00 24.92 C ATOM 459 CG2 THR A 30 -8.617 -21.920 23.417 1.00 27.90 C ATOM 460 OG1 THR A 30 -8.985 -22.266 25.756 1.00 25.21 O ATOM 461 H THR A 30 -10.774 -24.362 25.725 1.00 20.99 H ATOM 462 HA THR A 30 -11.098 -22.148 24.279 1.00 22.66 H ATOM 463 HB THR A 30 -8.768 -23.769 24.452 1.00 29.91 H ATOM 464 HG1 THR A 30 -9.328 -21.499 25.753 1.00 30.26 H ATOM 465 HG21 THR A 30 -9.042 -21.051 23.493 1.00 33.49 H ATOM 466 HG22 THR A 30 -7.662 -21.817 23.552 1.00 33.49 H ATOM 467 HG23 THR A 30 -8.773 -22.270 22.526 1.00 33.49 H ATOM 468 N GLY A 31 -11.408 -22.749 21.959 1.00 18.26 N ATOM 469 CA GLY A 31 -11.562 -23.136 20.566 1.00 18.09 C ATOM 470 C GLY A 31 -12.449 -22.136 19.858 1.00 15.61 C ATOM 471 O GLY A 31 -12.904 -21.167 20.438 1.00 17.13 O ATOM 472 H GLY A 31 -11.628 -21.936 22.130 1.00 21.92 H ATOM 473 HA2 GLY A 31 -10.696 -23.156 20.129 1.00 21.72 H ATOM 474 HA3 GLY A 31 -11.966 -24.016 20.508 1.00 21.72 H ATOM 475 N PHE A 32 -12.618 -22.377 18.532 1.00 17.40 N ATOM 476 CA PHE A 32 -13.323 -21.380 17.711 1.00 15.26 C ATOM 477 C PHE A 32 -14.821 -21.658 17.655 1.00 16.22 C ATOM 478 O PHE A 32 -15.269 -22.807 17.714 1.00 17.03 O ATOM 479 CB PHE A 32 -12.743 -21.368 16.286 1.00 18.22 C ATOM 480 CG PHE A 32 -11.450 -20.652 16.242 1.00 22.39 C ATOM 481 CD1 PHE A 32 -10.290 -21.339 16.370 1.00 27.09 C ATOM 482 CD2 PHE A 32 -11.394 -19.286 16.140 1.00 22.32 C ATOM 483 CE1 PHE A 32 -9.077 -20.645 16.378 1.00 30.53 C ATOM 484 CE2 PHE A 32 -10.216 -18.608 16.160 1.00 23.69 C ATOM 485 CZ PHE A 32 -9.054 -19.276 16.260 1.00 29.67 C ATOM 486 H PHE A 32 -12.345 -23.075 18.110 1.00 20.89 H ATOM 487 HA PHE A 32 -13.193 -20.500 18.098 1.00 18.27 H ATOM 488 HB2 PHE A 32 -12.597 -22.280 15.991 1.00 21.88 H ATOM 489 HB3 PHE A 32 -13.362 -20.916 15.692 1.00 21.88 H ATOM 490 HD1 PHE A 32 -10.300 -22.265 16.452 1.00 32.52 H ATOM 491 HD2 PHE A 32 -12.189 -18.806 16.073 1.00 26.79 H ATOM 492 HE1 PHE A 32 -8.278 -21.115 16.451 1.00 36.65 H ATOM 493 HE2 PHE A 32 -10.212 -17.682 16.072 1.00 28.44 H ATOM 494 HZ PHE A 32 -8.245 -18.817 16.258 1.00 35.62 H ATOM 495 N SER A 33 -15.589 -20.562 17.579 1.00 16.10 N ATOM 496 CA SER A 33 -17.037 -20.547 17.468 1.00 15.61 C ATOM 497 C SER A 33 -17.467 -19.815 16.197 1.00 15.75 C ATOM 498 O SER A 33 -16.718 -19.005 15.657 1.00 16.91 O ATOM 499 CB SER A 33 -17.618 -19.807 18.684 1.00 14.73 C ATOM 500 OG SER A 33 -17.382 -20.616 19.874 1.00 17.47 O ATOM 501 H SER A 33 -15.258 -19.768 17.591 1.00 19.32 H ATOM 502 HA SER A 33 -17.383 -21.454 17.449 1.00 18.74 H ATOM 503 HB2 SER A 33 -17.175 -18.950 18.783 1.00 17.68 H ATOM 504 HB3 SER A 33 -18.573 -19.683 18.561 1.00 17.68 H ATOM 505 HG SER A 33 -17.693 -20.228 20.551 1.00 20.98 H ATOM 506 N ARG A 34 -18.674 -20.115 15.738 1.00 16.21 N ATOM 507 CA ARG A 34 -19.346 -19.288 14.729 1.00 16.24 C ATOM 508 C ARG A 34 -20.209 -18.279 15.484 1.00 15.15 C ATOM 509 O ARG A 34 -21.113 -18.685 16.255 1.00 15.95 O ATOM 510 CB ARG A 34 -20.228 -20.192 13.868 1.00 19.24 C ATOM 511 CG ARG A 34 -21.039 -19.486 12.849 1.00 20.19 C ATOM 512 CD ARG A 34 -21.654 -20.345 11.773 1.00 23.11 C ATOM 513 NE ARG A 34 -20.607 -20.898 10.907 1.00 22.39 N ATOM 514 CZ ARG A 34 -20.210 -22.171 10.900 1.00 23.23 C ATOM 515 NH1 ARG A 34 -19.249 -22.532 10.102 1.00 22.03 N1+ ATOM 516 NH2 ARG A 34 -20.764 -23.082 11.654 1.00 23.11 N ATOM 517 H ARG A 34 -19.133 -20.795 15.993 1.00 19.47 H ATOM 518 HA ARG A 34 -18.700 -18.824 14.173 1.00 19.49 H ATOM 519 HB2 ARG A 34 -19.659 -20.825 13.402 1.00 23.09 H ATOM 520 HB3 ARG A 34 -20.839 -20.671 14.449 1.00 23.09 H ATOM 521 HG2 ARG A 34 -21.764 -19.028 13.302 1.00 24.24 H ATOM 522 HG3 ARG A 34 -20.472 -18.833 12.409 1.00 24.24 H ATOM 523 HD2 ARG A 34 -22.137 -21.080 12.181 1.00 27.74 H ATOM 524 HD3 ARG A 34 -22.250 -19.806 11.230 1.00 27.74 H ATOM 525 HE ARG A 34 -20.218 -20.359 10.362 1.00 26.87 H ATOM 526 HH11 ARG A 34 -18.876 -21.951 9.589 1.00 26.45 H ATOM 527 HH12 ARG A 34 -18.996 -23.353 10.077 1.00 26.45 H ATOM 528 HH21 ARG A 34 -21.398 -22.865 12.195 1.00 27.74 H ATOM 529 HH22 ARG A 34 -20.488 -23.895 11.619 1.00 27.74 H ATOM 530 N VAL A 35 -19.908 -16.989 15.332 1.00 13.81 N ATOM 531 CA VAL A 35 -20.503 -15.933 16.119 1.00 13.73 C ATOM 532 C VAL A 35 -21.389 -15.122 15.220 1.00 15.83 C ATOM 533 O VAL A 35 -20.934 -14.599 14.165 1.00 14.62 O ATOM 534 CB VAL A 35 -19.424 -15.062 16.755 1.00 16.24 C ATOM 535 CG1 VAL A 35 -20.088 -14.119 17.728 1.00 17.86 C ATOM 536 CG2 VAL A 35 -18.372 -15.872 17.509 1.00 17.92 C ATOM 537 H VAL A 35 -19.340 -16.701 14.754 1.00 16.52 H ATOM 538 HA VAL A 35 -21.046 -16.318 16.825 1.00 16.48 H ATOM 539 HB VAL A 35 -18.980 -14.539 16.069 1.00 19.49 H ATOM 540 HG11 VAL A 35 -19.410 -13.560 18.138 1.00 21.44 H ATOM 541 HG12 VAL A 35 -20.725 -13.567 17.247 1.00 21.44 H ATOM 542 HG13 VAL A 35 -20.545 -14.638 18.408 1.00 21.44 H ATOM 543 HG21 VAL A 35 -17.718 -15.264 17.887 1.00 21.52 H ATOM 544 HG22 VAL A 35 -18.807 -16.373 18.216 1.00 21.52 H ATOM 545 HG23 VAL A 35 -17.939 -16.480 16.890 1.00 21.52 H ATOM 546 N HIS A 36 -22.638 -15.003 15.588 1.00 15.71 N ATOM 547 CA HIS A 36 -23.608 -14.231 14.842 1.00 16.25 C ATOM 548 C HIS A 36 -23.975 -12.961 15.578 1.00 17.45 C ATOM 549 O HIS A 36 -23.907 -12.904 16.801 1.00 16.06 O ATOM 550 CB HIS A 36 -24.949 -14.942 14.671 1.00 19.00 C ATOM 551 CG HIS A 36 -24.892 -16.275 13.993 1.00 19.68 C ATOM 552 CD2 HIS A 36 -24.370 -17.466 14.391 1.00 22.68 C ATOM 553 ND1 HIS A 36 -25.462 -16.495 12.754 1.00 23.04 N ATOM 554 CE1 HIS A 36 -25.314 -17.772 12.435 1.00 23.23 C ATOM 555 NE2 HIS A 36 -24.639 -18.374 13.396 1.00 23.30 N ATOM 556 H HIS A 36 -22.965 -15.371 16.293 1.00 18.86 H ATOM 557 HA HIS A 36 -23.254 -14.003 13.968 1.00 19.51 H ATOM 558 HB2 HIS A 36 -25.338 -15.079 15.549 1.00 22.81 H ATOM 559 HB3 HIS A 36 -25.533 -14.373 14.144 1.00 22.81 H ATOM 560 HD2 HIS A 36 -23.921 -17.634 15.187 1.00 27.23 H ATOM 561 HE1 HIS A 36 -25.595 -18.167 11.641 1.00 27.89 H ATOM 562 N ILE A 37 -24.441 -11.974 14.828 1.00 17.65 N ATOM 563 CA ILE A 37 -25.332 -10.976 15.377 1.00 16.13 C ATOM 564 C ILE A 37 -26.711 -11.275 14.848 1.00 20.00 C ATOM 565 O ILE A 37 -26.906 -11.418 13.638 1.00 21.35 O ATOM 566 CB ILE A 37 -24.908 -9.525 15.064 1.00 17.17 C ATOM 567 CG1 ILE A 37 -23.564 -9.306 15.709 1.00 17.07 C ATOM 568 CG2 ILE A 37 -25.971 -8.480 15.546 1.00 19.96 C ATOM 569 CD1 ILE A 37 -22.927 -7.924 15.371 1.00 20.54 C ATOM 570 H ILE A 37 -24.254 -11.862 13.997 1.00 21.19 H ATOM 571 HA ILE A 37 -25.356 -11.075 16.341 1.00 19.37 H ATOM 572 HB ILE A 37 -24.805 -9.436 14.104 1.00 20.61 H ATOM 573 HG12 ILE A 37 -23.666 -9.359 16.672 1.00 20.50 H ATOM 574 HG13 ILE A 37 -22.954 -9.996 15.404 1.00 20.50 H ATOM 575 HG21 ILE A 37 -25.658 -7.588 15.328 1.00 23.97 H ATOM 576 HG22 ILE A 37 -26.812 -8.656 15.096 1.00 23.97 H ATOM 577 HG23 ILE A 37 -26.085 -8.565 16.506 1.00 23.97 H ATOM 578 HD11 ILE A 37 -22.069 -7.854 15.818 1.00 24.65 H ATOM 579 HD12 ILE A 37 -22.807 -7.858 14.411 1.00 24.65 H ATOM 580 HD13 ILE A 37 -23.519 -7.220 15.680 1.00 24.65 H ATOM 581 N TYR A 38 -27.664 -11.388 15.751 1.00 18.63 N ATOM 582 CA TYR A 38 -29.054 -11.613 15.388 1.00 22.37 C ATOM 583 C TYR A 38 -29.871 -10.356 15.627 1.00 25.16 C ATOM 584 O TYR A 38 -29.790 -9.718 16.696 1.00 24.45 O ATOM 585 CB TYR A 38 -29.650 -12.765 16.214 1.00 22.99 C ATOM 586 CG TYR A 38 -29.227 -14.140 15.790 1.00 24.22 C ATOM 587 CD1 TYR A 38 -29.778 -14.728 14.670 1.00 28.24 C ATOM 588 CD2 TYR A 38 -28.253 -14.837 16.485 1.00 22.92 C ATOM 589 CE1 TYR A 38 -29.397 -16.004 14.264 1.00 29.33 C ATOM 590 CE2 TYR A 38 -27.862 -16.126 16.114 1.00 22.93 C ATOM 591 CZ TYR A 38 -28.431 -16.696 14.989 1.00 28.47 C ATOM 592 OH TYR A 38 -28.036 -17.953 14.599 1.00 28.56 O ATOM 593 H TYR A 38 -27.532 -11.337 16.600 1.00 22.37 H ATOM 594 HA TYR A 38 -29.111 -11.844 14.448 1.00 26.86 H ATOM 595 HB2 TYR A 38 -29.383 -12.650 17.140 1.00 27.60 H ATOM 596 HB3 TYR A 38 -30.617 -12.723 16.148 1.00 27.60 H ATOM 597 HD1 TYR A 38 -30.428 -14.270 14.187 1.00 33.90 H ATOM 598 HD2 TYR A 38 -27.878 -14.453 17.244 1.00 27.52 H ATOM 599 HE1 TYR A 38 -29.782 -16.390 13.511 1.00 35.21 H ATOM 600 HE2 TYR A 38 -27.208 -16.579 16.596 1.00 27.53 H ATOM 601 HH TYR A 38 -27.451 -18.247 15.126 1.00 34.28 H ATOM 602 N HIS A 39 -30.685 -10.029 14.647 1.00 26.32 N ATOM 603 CA HIS A 39 -31.564 -8.878 14.695 1.00 30.57 C ATOM 604 C HIS A 39 -32.955 -9.422 14.954 1.00 37.36 C ATOM 605 O HIS A 39 -33.456 -10.240 14.174 1.00 38.28 O ATOM 606 CB HIS A 39 -31.547 -8.154 13.354 1.00 33.30 C ATOM 607 CG HIS A 39 -32.339 -6.884 13.337 1.00 40.36 C ATOM 608 CD2 HIS A 39 -32.757 -6.080 14.342 1.00 41.99 C ATOM 609 ND1 HIS A 39 -32.741 -6.278 12.166 1.00 42.92 N ATOM 610 CE1 HIS A 39 -33.396 -5.165 12.455 1.00 45.31 C ATOM 611 NE2 HIS A 39 -33.407 -5.016 13.770 1.00 44.00 N ATOM 612 H HIS A 39 -30.749 -10.474 13.914 1.00 31.60 H ATOM 613 HA HIS A 39 -31.306 -8.271 15.406 1.00 36.69 H ATOM 614 HB2 HIS A 39 -30.630 -7.934 13.130 1.00 39.97 H ATOM 615 HB3 HIS A 39 -31.918 -8.743 12.678 1.00 39.97 H ATOM 616 HD2 HIS A 39 -32.626 -6.222 15.252 1.00 50.40 H ATOM 617 HE1 HIS A 39 -33.773 -4.581 11.839 1.00 54.38 H ATOM 618 N HIS A 40 -33.586 -8.956 16.027 1.00 42.79 N ATOM 619 CA HIS A 40 -34.973 -9.310 16.304 1.00 47.99 C ATOM 620 C HIS A 40 -35.784 -8.262 15.559 1.00 52.95 C ATOM 621 O HIS A 40 -35.935 -7.127 16.024 1.00 52.56 O ATOM 622 CB HIS A 40 -35.280 -9.250 17.794 1.00 47.46 C ATOM 623 CG HIS A 40 -36.606 -9.845 18.158 1.00 48.92 C ATOM 624 CD2 HIS A 40 -36.914 -10.984 18.820 1.00 48.84 C ATOM 625 ND1 HIS A 40 -37.808 -9.230 17.873 1.00 51.50 N ATOM 626 CE1 HIS A 40 -38.799 -9.983 18.316 1.00 52.85 C ATOM 627 NE2 HIS A 40 -38.282 -11.050 18.901 1.00 51.83 N ATOM 628 H HIS A 40 -33.233 -8.432 16.611 1.00 51.35 H ATOM 629 HA HIS A 40 -35.179 -10.193 15.960 1.00 57.60 H ATOM 630 HB2 HIS A 40 -34.593 -9.737 18.275 1.00 56.96 H ATOM 631 HB3 HIS A 40 -35.284 -8.322 18.076 1.00 56.96 H ATOM 632 HD2 HIS A 40 -36.311 -11.613 19.147 1.00 58.61 H ATOM 633 HE1 HIS A 40 -39.705 -9.788 18.242 1.00 63.43 H ATOM 634 N THR A 41 -36.281 -8.631 14.379 1.00 58.43 N ATOM 635 CA THR A 41 -36.879 -7.630 13.506 1.00 62.28 C ATOM 636 C THR A 41 -38.119 -7.018 14.148 1.00 64.44 C ATOM 637 O THR A 41 -38.439 -5.848 13.897 1.00 64.57 O ATOM 638 CB THR A 41 -37.215 -8.286 12.169 1.00 63.15 C ATOM 639 CG2 THR A 41 -35.935 -8.771 11.494 1.00 61.35 C ATOM 640 OG1 THR A 41 -38.077 -9.408 12.392 1.00 63.76 O ATOM 641 H THR A 41 -36.285 -9.433 14.069 1.00 70.12 H ATOM 642 HA THR A 41 -36.238 -6.921 13.345 1.00 74.74 H ATOM 643 HB THR A 41 -37.652 -7.644 11.588 1.00 75.78 H ATOM 644 HG1 THR A 41 -38.787 -9.155 12.763 1.00 76.53 H ATOM 645 HG21 THR A 41 -36.146 -9.187 10.644 1.00 73.63 H ATOM 646 HG22 THR A 41 -35.338 -8.022 11.339 1.00 73.63 H ATOM 647 HG23 THR A 41 -35.487 -9.418 12.060 1.00 73.63 H ATOM 648 N GLY A 42 -38.806 -7.777 14.999 1.00 65.11 N ATOM 649 CA GLY A 42 -39.994 -7.278 15.653 1.00 67.97 C ATOM 650 C GLY A 42 -39.751 -6.014 16.454 1.00 69.39 C ATOM 651 O GLY A 42 -40.360 -4.976 16.182 1.00 73.61 O ATOM 652 H GLY A 42 -38.598 -8.585 15.211 1.00 78.15 H ATOM 653 HA2 GLY A 42 -40.672 -7.089 14.985 1.00 81.57 H ATOM 654 HA3 GLY A 42 -40.339 -7.958 16.253 1.00 81.57 H ATOM 655 N ASN A 43 -38.813 -6.055 17.401 1.00 65.87 N ATOM 656 CA ASN A 43 -38.602 -4.938 18.319 1.00 64.20 C ATOM 657 C ASN A 43 -37.259 -4.234 18.113 1.00 57.14 C ATOM 658 O ASN A 43 -36.828 -3.452 18.972 1.00 53.04 O ATOM 659 CB ASN A 43 -38.814 -5.381 19.775 1.00 67.29 C ATOM 660 CG ASN A 43 -37.758 -6.361 20.272 1.00 67.75 C ATOM 661 ND2 ASN A 43 -37.697 -6.534 21.587 1.00 67.37 N ATOM 662 OD1 ASN A 43 -37.007 -6.948 19.494 1.00 68.79 O ATOM 663 H ASN A 43 -38.285 -6.721 17.531 1.00 79.05 H ATOM 664 HA ASN A 43 -39.287 -4.278 18.132 1.00 77.05 H ATOM 665 HB2 ASN A 43 -38.787 -4.599 20.348 1.00 80.76 H ATOM 666 HB3 ASN A 43 -39.680 -5.813 19.848 1.00 80.76 H ATOM 667 HD21 ASN A 43 -37.119 -7.076 21.922 1.00 80.85 H ATOM 668 HD22 ASN A 43 -38.234 -6.105 22.103 1.00 80.85 H ATOM 669 N ASN A 44 -36.621 -4.454 16.962 1.00 51.66 N ATOM 670 CA ASN A 44 -35.389 -3.764 16.595 1.00 49.79 C ATOM 671 C ASN A 44 -34.356 -3.851 17.712 1.00 43.24 C ATOM 672 O ASN A 44 -33.802 -2.842 18.159 1.00 45.04 O ATOM 673 CB ASN A 44 -35.659 -2.307 16.214 1.00 53.91 C ATOM 674 CG ASN A 44 -34.399 -1.570 15.739 1.00 55.42 C ATOM 675 ND2 ASN A 44 -34.247 -0.333 16.189 1.00 55.31 N ATOM 676 OD1 ASN A 44 -33.577 -2.108 14.975 1.00 55.96 O ATOM 677 H AASN A 44 -36.891 -5.013 16.366 1.00 62.00 H ATOM 678 H BASN A 44 -36.891 -5.013 16.366 0.00 62.00 H ATOM 679 HA ASN A 44 -35.012 -4.202 15.816 1.00 59.75 H ATOM 680 HB2 ASN A 44 -36.309 -2.284 15.495 1.00 64.70 H ATOM 681 HB3 ASN A 44 -36.006 -1.838 16.989 1.00 64.70 H ATOM 682 HD21 ASN A 44 -34.836 0.009 16.715 1.00 66.38 H ATOM 683 HD22 ASN A 44 -33.559 0.128 15.956 1.00 66.38 H ATOM 684 N THR A 45 -34.110 -5.073 18.173 1.00 41.12 N ATOM 685 CA THR A 45 -33.028 -5.339 19.098 1.00 34.35 C ATOM 686 C THR A 45 -32.035 -6.267 18.424 1.00 29.57 C ATOM 687 O THR A 45 -32.337 -6.901 17.411 1.00 30.81 O ATOM 688 CB THR A 45 -33.502 -5.964 20.411 1.00 33.81 C ATOM 689 CG2 THR A 45 -34.332 -4.970 21.181 1.00 36.81 C ATOM 690 OG1 THR A 45 -34.319 -7.098 20.134 1.00 35.28 O ATOM 691 H THR A 45 -34.566 -5.771 17.960 1.00 49.35 H ATOM 692 HA THR A 45 -32.574 -4.507 19.305 1.00 41.23 H ATOM 693 HB THR A 45 -32.740 -6.226 20.950 1.00 40.58 H ATOM 694 HG1 THR A 45 -34.988 -6.866 19.682 1.00 42.35 H ATOM 695 HG21 THR A 45 -35.106 -4.709 20.658 1.00 44.18 H ATOM 696 HG22 THR A 45 -34.633 -5.366 22.014 1.00 44.18 H ATOM 697 HG23 THR A 45 -33.804 -4.181 21.379 1.00 44.18 H ATOM 698 N PHE A 46 -30.831 -6.271 18.965 1.00 24.60 N ATOM 699 CA PHE A 46 -29.746 -7.115 18.459 1.00 24.18 C ATOM 700 C PHE A 46 -29.066 -7.868 19.598 1.00 24.96 C ATOM 701 O PHE A 46 -28.979 -7.360 20.718 1.00 23.48 O ATOM 702 CB PHE A 46 -28.719 -6.235 17.773 1.00 24.78 C ATOM 703 CG PHE A 46 -29.244 -5.494 16.595 1.00 25.66 C ATOM 704 CD1 PHE A 46 -29.912 -4.271 16.770 1.00 27.56 C ATOM 705 CD2 PHE A 46 -29.059 -6.001 15.313 1.00 25.11 C ATOM 706 CE1 PHE A 46 -30.412 -3.575 15.674 1.00 29.44 C ATOM 707 CE2 PHE A 46 -29.537 -5.334 14.201 1.00 27.39 C ATOM 708 CZ PHE A 46 -30.206 -4.114 14.363 1.00 29.74 C ATOM 709 H PHE A 46 -30.605 -5.786 19.638 1.00 29.53 H ATOM 710 HA PHE A 46 -30.094 -7.755 17.818 1.00 29.03 H ATOM 711 HB2 PHE A 46 -28.393 -5.581 18.412 1.00 29.74 H ATOM 712 HB3 PHE A 46 -27.985 -6.791 17.470 1.00 29.74 H ATOM 713 HD1 PHE A 46 -30.036 -3.933 17.627 1.00 33.08 H ATOM 714 HD2 PHE A 46 -28.613 -6.809 15.203 1.00 30.14 H ATOM 715 HE1 PHE A 46 -30.854 -2.765 15.789 1.00 35.33 H ATOM 716 HE2 PHE A 46 -29.406 -5.688 13.350 1.00 32.87 H ATOM 717 HZ PHE A 46 -30.532 -3.661 13.619 1.00 35.69 H ATOM 718 N ARG A 47 -28.625 -9.116 19.327 1.00 22.26 N ATOM 719 CA ARG A 47 -27.850 -9.894 20.291 1.00 23.00 C ATOM 720 C ARG A 47 -26.690 -10.565 19.576 1.00 18.62 C ATOM 721 O ARG A 47 -26.771 -10.842 18.377 1.00 20.47 O ATOM 722 CB ARG A 47 -28.670 -11.020 20.938 1.00 27.41 C ATOM 723 CG ARG A 47 -29.878 -10.561 21.703 1.00 35.78 C ATOM 724 CD ARG A 47 -30.584 -11.729 22.407 1.00 40.59 C ATOM 725 NE ARG A 47 -29.817 -12.212 23.553 1.00 41.78 N ATOM 726 CZ ARG A 47 -29.771 -11.605 24.733 1.00 42.36 C ATOM 727 NH1 ARG A 47 -29.044 -12.117 25.711 1.00 41.14 N1+ ATOM 728 NH2 ARG A 47 -30.431 -10.472 24.928 1.00 41.64 N ATOM 729 H ARG A 47 -28.767 -9.526 18.585 1.00 26.72 H ATOM 730 HA ARG A 47 -27.502 -9.314 20.986 1.00 27.61 H ATOM 731 HB2 ARG A 47 -28.976 -11.620 20.240 1.00 32.90 H ATOM 732 HB3 ARG A 47 -28.099 -11.504 21.555 1.00 32.90 H ATOM 733 HG2 ARG A 47 -29.603 -9.921 22.378 1.00 42.94 H ATOM 734 HG3 ARG A 47 -30.507 -10.151 21.089 1.00 42.94 H ATOM 735 HD2 ARG A 47 -31.451 -11.433 22.725 1.00 48.72 H ATOM 736 HD3 ARG A 47 -30.689 -12.463 21.781 1.00 48.72 H ATOM 737 HE ARG A 47 -29.365 -12.938 23.456 1.00 50.14 H ATOM 738 HH11 ARG A 47 -29.011 -11.721 26.475 1.00 49.37 H ATOM 739 HH12 ARG A 47 -28.611 -12.849 25.588 1.00 49.37 H ATOM 740 HH21 ARG A 47 -30.903 -10.135 24.293 1.00 49.98 H ATOM 741 HH22 ARG A 47 -30.397 -10.080 25.693 1.00 49.98 H ATOM 742 N VAL A 48 -25.611 -10.810 20.309 1.00 17.00 N ATOM 743 CA VAL A 48 -24.488 -11.628 19.868 1.00 15.28 C ATOM 744 C VAL A 48 -24.710 -13.039 20.393 1.00 18.14 C ATOM 745 O VAL A 48 -24.822 -13.226 21.604 1.00 17.05 O ATOM 746 CB VAL A 48 -23.147 -11.085 20.369 1.00 15.28 C ATOM 747 CG1 VAL A 48 -22.005 -11.878 19.918 1.00 17.03 C ATOM 748 CG2 VAL A 48 -22.972 -9.597 20.003 1.00 16.80 C ATOM 749 H VAL A 48 -25.502 -10.497 21.103 1.00 20.41 H ATOM 750 HA VAL A 48 -24.467 -11.658 18.898 1.00 18.34 H ATOM 751 HB VAL A 48 -23.153 -11.134 21.338 1.00 18.34 H ATOM 752 HG11 VAL A 48 -21.190 -11.485 20.267 1.00 20.45 H ATOM 753 HG12 VAL A 48 -22.102 -12.786 20.246 1.00 20.45 H ATOM 754 HG13 VAL A 48 -21.985 -11.877 18.948 1.00 20.45 H ATOM 755 HG21 VAL A 48 -22.114 -9.289 20.336 1.00 20.17 H ATOM 756 HG22 VAL A 48 -23.006 -9.504 19.038 1.00 20.17 H ATOM 757 HG23 VAL A 48 -23.688 -9.086 20.411 1.00 20.17 H ATOM 758 N VAL A 49 -24.732 -14.023 19.499 1.00 16.14 N ATOM 759 CA VAL A 49 -24.836 -15.442 19.870 1.00 17.39 C ATOM 760 C VAL A 49 -23.756 -16.198 19.133 1.00 18.00 C ATOM 761 O VAL A 49 -23.656 -16.126 17.896 1.00 17.75 O ATOM 762 CB VAL A 49 -26.230 -16.007 19.556 1.00 20.68 C ATOM 763 CG1 VAL A 49 -26.318 -17.524 19.875 1.00 24.57 C ATOM 764 CG2 VAL A 49 -27.293 -15.169 20.293 1.00 23.38 C ATOM 765 H VAL A 49 -24.687 -13.896 18.650 1.00 19.38 H ATOM 766 HA VAL A 49 -24.677 -15.536 20.822 1.00 20.88 H ATOM 767 HB VAL A 49 -26.392 -15.904 18.605 1.00 24.83 H ATOM 768 HG11 VAL A 49 -25.461 -17.825 20.217 1.00 29.49 H ATOM 769 HG12 VAL A 49 -27.009 -17.666 20.541 1.00 29.49 H ATOM 770 HG13 VAL A 49 -26.538 -18.005 19.062 1.00 29.49 H ATOM 771 HG21 VAL A 49 -26.849 -14.468 20.795 1.00 28.07 H ATOM 772 HG22 VAL A 49 -27.896 -14.780 19.641 1.00 28.07 H ATOM 773 HG23 VAL A 49 -27.786 -15.747 20.897 1.00 28.07 H ATOM 774 N GLY A 50 -22.972 -16.951 19.876 1.00 14.77 N ATOM 775 CA GLY A 50 -21.913 -17.775 19.292 1.00 15.83 C ATOM 776 C GLY A 50 -21.950 -19.207 19.790 1.00 14.81 C ATOM 777 O GLY A 50 -22.249 -19.459 20.959 1.00 15.88 O ATOM 778 H GLY A 50 -23.026 -17.008 20.732 1.00 17.73 H ATOM 779 HA2 GLY A 50 -22.007 -17.784 18.326 1.00 19.00 H ATOM 780 HA3 GLY A 50 -21.049 -17.395 19.513 1.00 19.00 H ATOM 781 N ARG A 51 -21.716 -20.132 18.878 1.00 14.96 N ATOM 782 CA ARG A 51 -21.718 -21.569 19.180 1.00 17.90 C ATOM 783 C ARG A 51 -20.397 -22.186 18.757 1.00 17.74 C ATOM 784 O ARG A 51 -19.908 -21.950 17.627 1.00 16.20 O ATOM 785 CB ARG A 51 -22.859 -22.233 18.440 1.00 19.28 C ATOM 786 CG ARG A 51 -24.248 -21.841 18.953 1.00 25.75 C ATOM 787 CD ARG A 51 -25.351 -22.475 18.103 1.00 30.95 C ATOM 788 NE ARG A 51 -26.687 -22.408 18.714 1.00 39.01 N ATOM 789 CZ ARG A 51 -27.236 -23.312 19.554 1.00 41.15 C ATOM 790 NH1 ARG A 51 -28.474 -23.091 20.002 1.00 43.29 N1+ ATOM 791 NH2 ARG A 51 -26.597 -24.418 19.974 1.00 39.51 N ATOM 792 H ARG A 51 -21.549 -19.957 18.053 1.00 17.90 H ATOM 793 HA ARG A 51 -21.839 -21.707 20.133 1.00 21.49 H ATOM 794 HB2 ARG A 51 -22.809 -21.985 17.503 1.00 23.15 H ATOM 795 HB3 ARG A 51 -22.771 -23.195 18.530 1.00 23.15 H ATOM 796 HG2 ARG A 51 -24.352 -22.149 19.867 1.00 30.91 H ATOM 797 HG3 ARG A 51 -24.346 -20.877 18.910 1.00 30.91 H ATOM 798 HD2 ARG A 51 -25.391 -22.015 17.250 1.00 37.15 H ATOM 799 HD3 ARG A 51 -25.137 -23.411 17.962 1.00 37.15 H ATOM 800 HE ARG A 51 -27.167 -21.723 18.516 1.00 46.83 H ATOM 801 HH11 ARG A 51 -28.903 -22.389 19.753 1.00 51.96 H ATOM 802 HH12 ARG A 51 -28.841 -23.649 20.544 1.00 51.96 H ATOM 803 HH21 ARG A 51 -25.799 -24.584 19.698 1.00 47.42 H ATOM 804 HH22 ARG A 51 -26.988 -24.962 20.513 1.00 47.42 H ATOM 805 N LYS A 52 -19.845 -23.056 19.626 1.00 16.26 N ATOM 806 CA LYS A 52 -18.587 -23.706 19.320 1.00 16.27 C ATOM 807 C LYS A 52 -18.731 -24.578 18.065 1.00 18.08 C ATOM 808 O LYS A 52 -19.723 -25.281 17.904 1.00 18.59 O ATOM 809 CB LYS A 52 -18.180 -24.596 20.523 1.00 19.91 C ATOM 810 CG LYS A 52 -16.730 -25.116 20.504 1.00 26.56 C ATOM 811 CD LYS A 52 -15.647 -24.041 20.798 1.00 24.27 C ATOM 812 CE LYS A 52 -15.700 -23.557 22.154 1.00 21.69 C ATOM 813 NZ LYS A 52 -15.362 -24.686 23.214 1.00 20.14 N1+ ATOM 814 H LYS A 52 -20.185 -23.274 20.386 1.00 19.52 H ATOM 815 HA LYS A 52 -17.897 -23.042 19.168 1.00 19.48 H ATOM 816 HB2 LYS A 52 -18.293 -24.082 21.337 1.00 23.90 H ATOM 817 HB3 LYS A 52 -18.766 -25.369 20.544 1.00 23.90 H ATOM 818 HG2 LYS A 52 -16.643 -25.812 21.174 1.00 31.88 H ATOM 819 HG3 LYS A 52 -16.546 -25.485 19.626 1.00 31.88 H ATOM 820 HD2 LYS A 52 -14.770 -24.428 20.652 1.00 29.13 H ATOM 821 HD3 LYS A 52 -15.781 -23.286 20.204 1.00 29.13 H ATOM 822 HE2 LYS A 52 -15.053 -22.841 22.260 1.00 26.04 H ATOM 823 HE3 LYS A 52 -16.593 -23.228 22.338 1.00 26.04 H ATOM 824 HZ1 LYS A 52 -15.404 -24.352 24.038 1.00 24.17 H ATOM 825 HZ2 LYS A 52 -15.946 -25.354 23.143 1.00 24.17 H ATOM 826 HZ3 LYS A 52 -14.543 -25.002 23.071 1.00 24.17 H ATOM 827 N ILE A 53 -17.732 -24.536 17.183 1.00 17.93 N ATOM 828 CA ILE A 53 -17.806 -25.328 15.953 1.00 19.82 C ATOM 829 C ILE A 53 -17.848 -26.825 16.296 1.00 21.76 C ATOM 830 O ILE A 53 -18.616 -27.580 15.705 1.00 23.12 O ATOM 831 CB ILE A 53 -16.619 -24.996 15.020 1.00 20.84 C ATOM 832 CG1 ILE A 53 -16.617 -23.531 14.474 1.00 23.23 C ATOM 833 CG2 ILE A 53 -16.567 -26.035 13.857 1.00 21.76 C ATOM 834 CD1 ILE A 53 -17.807 -23.210 13.631 1.00 26.46 C ATOM 835 H ILE A 53 -17.016 -24.067 17.269 1.00 21.52 H ATOM 836 HA ILE A 53 -18.625 -25.106 15.484 1.00 23.80 H ATOM 837 HB ILE A 53 -15.807 -25.108 15.540 1.00 25.02 H ATOM 838 HG12 ILE A 53 -16.609 -22.917 15.225 1.00 27.89 H ATOM 839 HG13 ILE A 53 -15.823 -23.399 13.932 1.00 27.89 H ATOM 840 HG21 ILE A 53 -15.820 -25.820 13.276 1.00 26.13 H ATOM 841 HG22 ILE A 53 -16.451 -26.922 14.231 1.00 26.13 H ATOM 842 HG23 ILE A 53 -17.398 -25.991 13.358 1.00 26.13 H ATOM 843 HD11 ILE A 53 -17.741 -22.291 13.329 1.00 31.76 H ATOM 844 HD12 ILE A 53 -17.824 -23.809 12.869 1.00 31.76 H ATOM 845 HD13 ILE A 53 -18.610 -23.327 14.163 1.00 31.76 H ATOM 846 N GLN A 54 -17.054 -27.262 17.289 1.00 19.70 N ATOM 847 CA GLN A 54 -16.932 -28.685 17.606 1.00 21.96 C ATOM 848 C GLN A 54 -18.246 -29.281 18.094 1.00 22.89 C ATOM 849 O GLN A 54 -18.641 -30.374 17.656 1.00 27.31 O ATOM 850 CB GLN A 54 -15.852 -28.912 18.676 1.00 27.18 C ATOM 851 CG GLN A 54 -15.823 -30.350 19.167 1.00 35.28 C ATOM 852 CD GLN A 54 -14.823 -30.584 20.272 1.00 38.72 C ATOM 853 NE2 GLN A 54 -14.401 -31.852 20.406 1.00 37.75 N ATOM 854 OE1 GLN A 54 -14.427 -29.655 21.009 1.00 37.99 O ATOM 855 H GLN A 54 -16.578 -26.750 17.791 1.00 23.60 H ATOM 856 HA GLN A 54 -16.666 -29.164 16.805 1.00 26.36 H ATOM 857 HB2 GLN A 54 -14.983 -28.705 18.298 1.00 32.63 H ATOM 858 HB3 GLN A 54 -16.032 -28.337 19.436 1.00 32.63 H ATOM 859 HG2 GLN A 54 -16.702 -30.584 19.507 1.00 42.35 H ATOM 860 HG3 GLN A 54 -15.591 -30.931 18.426 1.00 42.35 H ATOM 861 HE21 GLN A 54 -14.702 -32.463 19.882 1.00 45.30 H ATOM 862 HE22 GLN A 54 -13.830 -32.052 21.017 1.00 45.30 H ATOM 863 N ASP A 55 -18.829 -28.693 19.133 1.00 21.68 N ATOM 864 CA ASP A 55 -19.914 -29.348 19.841 1.00 22.18 C ATOM 865 C ASP A 55 -21.180 -28.521 19.929 1.00 21.70 C ATOM 866 O ASP A 55 -22.144 -28.950 20.553 1.00 22.66 O ATOM 867 CB ASP A 55 -19.447 -29.788 21.241 1.00 22.57 C ATOM 868 CG ASP A 55 -19.185 -28.626 22.166 1.00 22.86 C ATOM 869 OD1 ASP A 55 -19.400 -27.491 21.820 1.00 20.85 O ATOM 870 OD2 ASP A 55 -18.823 -28.889 23.326 1.00 28.92 O1- ATOM 871 H ASP A 55 -18.615 -27.921 19.444 1.00 26.03 H ATOM 872 HA ASP A 55 -20.141 -30.156 19.354 1.00 26.57 H ATOM 873 HB2 ASP A 55 -20.133 -30.342 21.643 1.00 27.04 H ATOM 874 HB3 ASP A 55 -18.623 -30.292 21.154 1.00 27.04 H ATOM 875 N HIS A 56 -21.222 -27.349 19.310 1.00 21.01 N ATOM 876 CA HIS A 56 -22.414 -26.534 19.205 1.00 20.22 C ATOM 877 C HIS A 56 -22.764 -25.808 20.495 1.00 21.61 C ATOM 878 O HIS A 56 -23.856 -25.213 20.565 1.00 22.35 O ATOM 879 CB HIS A 56 -23.604 -27.373 18.735 1.00 24.43 C ATOM 880 CG HIS A 56 -23.326 -28.089 17.448 1.00 25.80 C ATOM 881 CD2 HIS A 56 -23.131 -27.577 16.208 1.00 26.00 C ATOM 882 ND1 HIS A 56 -23.125 -29.445 17.339 1.00 30.36 N ATOM 883 CE1 HIS A 56 -22.867 -29.743 16.072 1.00 28.00 C ATOM 884 NE2 HIS A 56 -22.853 -28.621 15.375 1.00 28.85 N ATOM 885 H HIS A 56 -20.539 -26.993 18.928 1.00 25.22 H ATOM 886 HA HIS A 56 -22.257 -25.856 18.530 1.00 24.23 H ATOM 887 HB2 HIS A 56 -23.810 -28.037 19.411 1.00 29.33 H ATOM 888 HB3 HIS A 56 -24.367 -26.791 18.597 1.00 29.33 H ATOM 889 HD2 HIS A 56 -23.188 -26.680 15.967 1.00 31.21 H ATOM 890 HE1 HIS A 56 -22.706 -30.594 15.735 1.00 33.61 H ATOM 891 N GLN A 57 -21.917 -25.882 21.523 1.00 20.46 N ATOM 892 CA GLN A 57 -22.202 -25.209 22.784 1.00 19.28 C ATOM 893 C GLN A 57 -22.397 -23.709 22.542 1.00 17.74 C ATOM 894 O GLN A 57 -21.572 -23.067 21.901 1.00 17.47 O ATOM 895 CB GLN A 57 -21.047 -25.399 23.772 1.00 19.88 C ATOM 896 CG GLN A 57 -21.324 -24.683 25.123 1.00 20.63 C ATOM 897 CD GLN A 57 -20.067 -24.576 25.989 1.00 22.84 C ATOM 898 NE2 GLN A 57 -20.273 -24.377 27.278 1.00 21.64 N ATOM 899 OE1 GLN A 57 -18.951 -24.684 25.526 1.00 23.62 O ATOM 900 H GLN A 57 -21.173 -26.315 21.513 1.00 24.57 H ATOM 901 HA GLN A 57 -23.013 -25.572 23.175 1.00 23.15 H ATOM 902 HB2 GLN A 57 -20.930 -26.346 23.949 1.00 23.87 H ATOM 903 HB3 GLN A 57 -20.236 -25.027 23.392 1.00 23.87 H ATOM 904 HG2 GLN A 57 -21.646 -23.785 24.946 1.00 24.77 H ATOM 905 HG3 GLN A 57 -21.990 -25.185 25.618 1.00 24.77 H ATOM 906 HE21 GLN A 57 -21.075 -24.315 27.581 1.00 25.98 H ATOM 907 HE22 GLN A 57 -19.604 -24.308 27.814 1.00 25.98 H ATOM 908 N VAL A 58 -23.447 -23.136 23.137 1.00 18.03 N ATOM 909 CA VAL A 58 -23.615 -21.683 23.105 1.00 17.08 C ATOM 910 C VAL A 58 -22.618 -21.131 24.114 1.00 16.47 C ATOM 911 O VAL A 58 -22.704 -21.426 25.323 1.00 18.72 O ATOM 912 CB VAL A 58 -25.059 -21.271 23.439 1.00 17.97 C ATOM 913 CG1 VAL A 58 -25.185 -19.749 23.532 1.00 17.82 C ATOM 914 CG2 VAL A 58 -26.090 -21.788 22.465 1.00 20.02 C ATOM 915 H VAL A 58 -24.066 -23.560 23.558 1.00 21.58 H ATOM 916 HA VAL A 58 -23.389 -21.345 22.225 1.00 20.44 H ATOM 917 HB VAL A 58 -25.283 -21.631 24.311 1.00 21.51 H ATOM 918 HG11 VAL A 58 -24.318 -19.350 23.359 1.00 21.40 H ATOM 919 HG12 VAL A 58 -25.827 -19.445 22.871 1.00 21.40 H ATOM 920 HG13 VAL A 58 -25.488 -19.512 24.422 1.00 21.40 H ATOM 921 HG21 VAL A 58 -26.968 -21.485 22.745 1.00 24.03 H ATOM 922 HG22 VAL A 58 -25.888 -21.445 21.580 1.00 24.03 H ATOM 923 HG23 VAL A 58 -26.060 -22.757 22.459 1.00 24.03 H ATOM 924 N VAL A 59 -21.681 -20.322 23.654 1.00 16.62 N ATOM 925 CA VAL A 59 -20.647 -19.744 24.509 1.00 14.43 C ATOM 926 C VAL A 59 -20.872 -18.265 24.776 1.00 15.53 C ATOM 927 O VAL A 59 -20.231 -17.717 25.696 1.00 17.78 O ATOM 928 CB VAL A 59 -19.225 -19.965 23.964 1.00 17.41 C ATOM 929 CG1 VAL A 59 -18.959 -21.497 23.890 1.00 21.38 C ATOM 930 CG2 VAL A 59 -18.963 -19.315 22.637 1.00 17.55 C ATOM 931 H VAL A 59 -21.617 -20.084 22.830 1.00 19.95 H ATOM 932 HA VAL A 59 -20.690 -20.193 25.368 1.00 17.27 H ATOM 933 HB VAL A 59 -18.593 -19.591 24.598 1.00 20.91 H ATOM 934 HG11 VAL A 59 -18.064 -21.646 23.546 1.00 25.66 H ATOM 935 HG12 VAL A 59 -19.040 -21.874 24.780 1.00 25.66 H ATOM 936 HG13 VAL A 59 -19.613 -21.902 23.298 1.00 25.66 H ATOM 937 HG21 VAL A 59 -18.050 -19.503 22.369 1.00 21.07 H ATOM 938 HG22 VAL A 59 -19.582 -19.675 21.983 1.00 21.07 H ATOM 939 HG23 VAL A 59 -19.092 -18.358 22.724 1.00 21.07 H ATOM 940 N ILE A 60 -21.758 -17.613 24.027 1.00 15.91 N ATOM 941 CA ILE A 60 -22.077 -16.183 24.227 1.00 14.85 C ATOM 942 C ILE A 60 -23.511 -15.969 23.778 1.00 16.59 C ATOM 943 O ILE A 60 -23.960 -16.508 22.741 1.00 15.81 O ATOM 944 CB ILE A 60 -21.046 -15.225 23.592 1.00 13.50 C ATOM 945 CG1 ILE A 60 -21.363 -13.774 23.950 1.00 17.63 C ATOM 946 CG2 ILE A 60 -20.951 -15.421 22.042 1.00 17.67 C ATOM 947 CD1 ILE A 60 -20.280 -12.851 23.415 1.00 18.84 C ATOM 948 H ILE A 60 -22.200 -17.976 23.385 1.00 19.10 H ATOM 949 HA ILE A 60 -22.059 -16.010 25.181 1.00 17.83 H ATOM 950 HB ILE A 60 -20.178 -15.438 23.968 1.00 16.21 H ATOM 951 HG12 ILE A 60 -22.210 -13.519 23.551 1.00 21.17 H ATOM 952 HG13 ILE A 60 -21.400 -13.679 24.915 1.00 21.17 H ATOM 953 HG21 ILE A 60 -20.294 -14.803 21.686 1.00 21.21 H ATOM 954 HG22 ILE A 60 -20.681 -16.334 21.856 1.00 21.21 H ATOM 955 HG23 ILE A 60 -21.820 -15.246 21.648 1.00 21.21 H ATOM 956 HD11 ILE A 60 -20.499 -11.937 23.652 1.00 22.62 H ATOM 957 HD12 ILE A 60 -19.430 -13.101 23.809 1.00 22.62 H ATOM 958 HD13 ILE A 60 -20.237 -12.942 22.450 1.00 22.62 H ATOM 959 N ASN A 61 -24.234 -15.181 24.557 1.00 18.11 N ATOM 960 CA ASN A 61 -25.615 -14.829 24.228 1.00 19.63 C ATOM 961 C ASN A 61 -25.861 -13.499 24.957 1.00 22.07 C ATOM 962 O ASN A 61 -26.318 -13.487 26.104 1.00 22.90 O ATOM 963 CB ASN A 61 -26.603 -15.885 24.655 1.00 23.02 C ATOM 964 CG ASN A 61 -28.035 -15.493 24.405 1.00 26.86 C ATOM 965 ND2 ASN A 61 -28.955 -16.224 25.040 1.00 32.66 N ATOM 966 OD1 ASN A 61 -28.335 -14.535 23.693 1.00 25.26 O ATOM 967 H ASN A 61 -23.949 -14.832 25.290 1.00 21.74 H ATOM 968 HA ASN A 61 -25.701 -14.686 23.273 1.00 23.57 H ATOM 969 HB2 ASN A 61 -26.426 -16.700 24.159 1.00 27.63 H ATOM 970 HB3 ASN A 61 -26.499 -16.047 25.605 1.00 27.63 H ATOM 971 HD21 ASN A 61 -28.712 -16.871 25.552 1.00 39.20 H ATOM 972 HD22 ASN A 61 -29.791 -16.048 24.937 1.00 39.20 H ATOM 973 N ACYS A 62 -25.593 -12.394 24.273 0.66 19.40 N ATOM 974 N BCYS A 62 -25.539 -12.387 24.267 0.34 19.79 N ATOM 975 CA ACYS A 62 -25.620 -11.151 25.017 0.66 18.97 C ATOM 976 CA BCYS A 62 -25.394 -11.061 24.867 0.34 19.47 C ATOM 977 C ACYS A 62 -26.168 -10.015 24.185 0.66 19.98 C ATOM 978 C BCYS A 62 -26.288 -10.064 24.129 0.34 20.12 C ATOM 979 O ACYS A 62 -25.821 -9.863 23.011 0.66 18.84 O ATOM 980 O BCYS A 62 -26.438 -10.130 22.908 0.34 19.48 O ATOM 981 CB ACYS A 62 -24.224 -10.802 25.463 0.66 19.12 C ATOM 982 CB BCYS A 62 -23.892 -10.640 24.768 0.34 17.76 C ATOM 983 SG ACYS A 62 -23.145 -10.335 24.198 0.66 18.39 S ATOM 984 SG BCYS A 62 -23.281 -9.099 25.591 0.34 18.66 S ATOM 985 H ACYS A 62 -25.405 -12.337 23.436 0.66 23.29 H ATOM 986 H BCYS A 62 -25.396 -12.386 23.419 0.34 23.76 H ATOM 987 HA ACYS A 62 -26.179 -11.255 25.803 0.66 22.78 H ATOM 988 HA BCYS A 62 -25.654 -11.088 25.801 0.34 23.38 H ATOM 989 HB2ACYS A 62 -24.277 -10.064 26.089 0.66 22.95 H ATOM 990 HB2BCYS A 62 -23.365 -11.369 25.132 0.34 21.32 H ATOM 991 HB3ACYS A 62 -23.840 -11.576 25.904 0.66 22.95 H ATOM 992 HB3BCYS A 62 -23.681 -10.547 23.826 0.34 21.32 H ATOM 993 HG ACYS A 62 -22.072 -10.083 24.673 0.66 22.07 H ATOM 994 HG BCYS A 62 -23.478 -9.182 26.772 0.34 22.41 H ATOM 995 N ALA A 63 -26.915 -9.160 24.875 1.00 21.69 N ATOM 996 CA ALA A 63 -27.590 -8.025 24.261 1.00 24.32 C ATOM 997 C ALA A 63 -26.546 -7.044 23.771 1.00 25.02 C ATOM 998 O ALA A 63 -25.442 -6.956 24.322 1.00 25.03 O ATOM 999 CB ALA A 63 -28.479 -7.325 25.298 1.00 25.95 C ATOM 1000 H ALA A 63 -27.006 -9.198 25.729 1.00 26.04 H ATOM 1001 HA ALA A 63 -28.134 -8.318 23.514 1.00 29.19 H ATOM 1002 HB1 ALA A 63 -27.924 -7.015 26.031 1.00 31.15 H ATOM 1003 HB2 ALA A 63 -28.922 -6.572 24.877 1.00 31.15 H ATOM 1004 HB3 ALA A 63 -29.138 -7.956 25.626 1.00 31.15 H ATOM 1005 N ILE A 64 -26.885 -6.337 22.686 1.00 21.92 N ATOM 1006 CA ILE A 64 -26.132 -5.169 22.238 1.00 22.95 C ATOM 1007 C ILE A 64 -26.986 -3.951 22.545 1.00 22.73 C ATOM 1008 O ILE A 64 -27.937 -3.653 21.799 1.00 23.49 O ATOM 1009 CB ILE A 64 -25.863 -5.231 20.725 1.00 20.63 C ATOM 1010 CG1 ILE A 64 -25.167 -6.540 20.327 1.00 19.64 C ATOM 1011 CG2 ILE A 64 -25.100 -3.931 20.270 1.00 23.99 C ATOM 1012 CD1 ILE A 64 -25.078 -6.728 18.826 1.00 21.38 C ATOM 1013 H ILE A 64 -27.561 -6.522 22.187 1.00 26.31 H ATOM 1014 HA ILE A 64 -25.290 -5.104 22.715 1.00 27.55 H ATOM 1015 HB ILE A 64 -26.726 -5.223 20.281 1.00 24.77 H ATOM 1016 HG12 ILE A 64 -24.264 -6.537 20.682 1.00 23.58 H ATOM 1017 HG13 ILE A 64 -25.665 -7.286 20.694 1.00 23.58 H ATOM 1018 HG21 ILE A 64 -24.936 -3.980 19.315 1.00 28.79 H ATOM 1019 HG22 ILE A 64 -25.647 -3.156 20.473 1.00 28.79 H ATOM 1020 HG23 ILE A 64 -24.258 -3.876 20.748 1.00 28.79 H ATOM 1021 HD11 ILE A 64 -25.975 -6.742 18.457 1.00 25.67 H ATOM 1022 HD12 ILE A 64 -24.574 -5.992 18.445 1.00 25.67 H ATOM 1023 HD13 ILE A 64 -24.631 -7.568 18.640 1.00 25.67 H ATOM 1024 N PRO A 65 -26.690 -3.209 23.606 1.00 23.19 N ATOM 1025 CA PRO A 65 -27.490 -2.034 23.953 1.00 24.08 C ATOM 1026 C PRO A 65 -27.087 -0.827 23.135 1.00 22.29 C ATOM 1027 O PRO A 65 -25.950 -0.708 22.683 1.00 23.23 O ATOM 1028 CB PRO A 65 -27.136 -1.797 25.419 1.00 25.36 C ATOM 1029 CG PRO A 65 -25.742 -2.232 25.489 1.00 25.65 C ATOM 1030 CD PRO A 65 -25.610 -3.435 24.571 1.00 25.09 C ATOM 1031 HA PRO A 65 -28.440 -2.209 23.858 1.00 28.91 H ATOM 1032 HB2 PRO A 65 -27.220 -0.855 25.635 1.00 30.44 H ATOM 1033 HB3 PRO A 65 -27.701 -2.341 25.991 1.00 30.44 H ATOM 1034 HG2 PRO A 65 -25.165 -1.512 25.189 1.00 30.79 H ATOM 1035 HG3 PRO A 65 -25.527 -2.478 26.402 1.00 30.79 H ATOM 1036 HD2 PRO A 65 -24.748 -3.432 24.126 1.00 30.11 H ATOM 1037 HD3 PRO A 65 -25.758 -4.258 25.062 1.00 30.11 H ATOM 1038 N LYS A 66 -28.048 0.055 22.930 1.00 26.10 N ATOM 1039 CA LYS A 66 -27.775 1.325 22.306 1.00 25.90 C ATOM 1040 C LYS A 66 -26.652 2.028 23.063 1.00 26.33 C ATOM 1041 O LYS A 66 -26.615 2.014 24.297 1.00 24.68 O ATOM 1042 CB LYS A 66 -29.061 2.154 22.329 1.00 31.16 C ATOM 1043 CG LYS A 66 -29.029 3.421 21.490 1.00 35.66 C ATOM 1044 CD LYS A 66 -30.254 4.264 21.750 1.00 43.94 C ATOM 1045 CE LYS A 66 -30.105 5.665 21.142 1.00 50.00 C ATOM 1046 NZ LYS A 66 -29.812 5.660 19.687 1.00 52.49 N1+ ATOM 1047 H LYS A 66 -28.872 -0.062 23.147 1.00 31.33 H ATOM 1048 HA LYS A 66 -27.501 1.191 21.385 1.00 31.09 H ATOM 1049 HB2 LYS A 66 -29.788 1.603 21.998 1.00 37.40 H ATOM 1050 HB3 LYS A 66 -29.243 2.415 23.245 1.00 37.40 H ATOM 1051 HG2 LYS A 66 -28.244 3.942 21.722 1.00 42.80 H ATOM 1052 HG3 LYS A 66 -29.013 3.186 20.550 1.00 42.80 H ATOM 1053 HD2 LYS A 66 -31.027 3.838 21.349 1.00 52.74 H ATOM 1054 HD3 LYS A 66 -30.380 4.360 22.707 1.00 52.74 H ATOM 1055 HE2 LYS A 66 -30.933 6.152 21.276 1.00 60.01 H ATOM 1056 HE3 LYS A 66 -29.377 6.124 21.589 1.00 60.01 H ATOM 1057 HZ1 LYS A 66 -30.470 5.255 19.246 1.00 63.00 H ATOM 1058 HZ2 LYS A 66 -29.737 6.496 19.390 1.00 63.00 H ATOM 1059 HZ3 LYS A 66 -29.050 5.228 19.532 1.00 63.00 H ATOM 1060 N GLY A 67 -25.686 2.580 22.314 1.00 23.99 N ATOM 1061 CA GLY A 67 -24.600 3.320 22.935 1.00 24.79 C ATOM 1062 C GLY A 67 -23.374 2.510 23.257 1.00 20.76 C ATOM 1063 O GLY A 67 -22.374 3.065 23.715 1.00 20.79 O ATOM 1064 H GLY A 67 -25.643 2.536 21.456 1.00 28.79 H ATOM 1065 HA2 GLY A 67 -24.333 4.041 22.342 1.00 29.75 H ATOM 1066 HA3 GLY A 67 -24.921 3.716 23.760 1.00 29.75 H ATOM 1067 N ALEU A 68 -23.405 1.204 23.008 0.48 19.54 N ATOM 1068 N BLEU A 68 -23.422 1.205 23.043 0.52 19.55 N ATOM 1069 CA ALEU A 68 -22.272 0.347 23.306 0.48 18.08 C ATOM 1070 CA BLEU A 68 -22.283 0.362 23.326 0.52 18.10 C ATOM 1071 C ALEU A 68 -20.994 0.834 22.636 0.48 17.85 C ATOM 1072 C BLEU A 68 -21.021 0.897 22.658 0.52 17.92 C ATOM 1073 O ALEU A 68 -20.966 1.126 21.436 0.48 18.19 O ATOM 1074 O BLEU A 68 -21.044 1.350 21.503 0.52 18.42 O ATOM 1075 CB ALEU A 68 -22.590 -1.072 22.832 0.48 17.13 C ATOM 1076 CB BLEU A 68 -22.611 -1.040 22.812 0.52 17.16 C ATOM 1077 CG ALEU A 68 -21.494 -2.114 23.049 0.48 15.78 C ATOM 1078 CG BLEU A 68 -21.498 -2.061 22.954 0.52 15.82 C ATOM 1079 CD1ALEU A 68 -22.096 -3.484 23.330 0.48 15.24 C ATOM 1080 CD1BLEU A 68 -21.407 -2.589 24.353 0.52 15.49 C ATOM 1081 CD2ALEU A 68 -20.519 -2.315 21.854 0.48 15.24 C ATOM 1082 CD2BLEU A 68 -21.615 -3.288 21.970 0.52 15.11 C ATOM 1083 H ALEU A 68 -24.077 0.791 22.664 0.48 23.40 H ATOM 1084 H BLEU A 68 -24.105 0.785 22.733 0.52 23.41 H ATOM 1085 HA ALEU A 68 -22.127 0.325 24.265 0.48 21.65 H ATOM 1086 HA BLEU A 68 -22.136 0.318 24.283 0.52 21.67 H ATOM 1087 HB2ALEU A 68 -23.379 -1.382 23.303 0.48 20.50 H ATOM 1088 HB2BLEU A 68 -23.378 -1.375 23.302 0.52 20.55 H ATOM 1089 HB3ALEU A 68 -22.774 -1.041 21.880 0.48 20.50 H ATOM 1090 HB3BLEU A 68 -22.831 -0.978 21.869 0.52 20.55 H ATOM 1091 HG ALEU A 68 -20.967 -1.857 23.822 0.48 18.89 H ATOM 1092 HG BLEU A 68 -20.657 -1.618 22.760 0.52 18.94 H ATOM 1093 HD11ALEU A 68 -21.378 -4.122 23.463 0.48 18.25 H ATOM 1094 HD11BLEU A 68 -22.248 -3.013 24.585 0.52 18.54 H ATOM 1095 HD12ALEU A 68 -22.643 -3.430 24.129 0.48 18.25 H ATOM 1096 HD12BLEU A 68 -20.686 -3.236 24.399 0.52 18.54 H ATOM 1097 HD13ALEU A 68 -22.640 -3.750 22.573 0.48 18.25 H ATOM 1098 HD13BLEU A 68 -21.230 -1.851 24.957 0.52 18.54 H ATOM 1099 HD21ALEU A 68 -19.866 -2.992 22.090 0.48 18.24 H ATOM 1100 HD21BLEU A 68 -21.593 -2.962 21.056 0.52 18.08 H ATOM 1101 HD22ALEU A 68 -21.026 -2.601 21.078 0.48 18.24 H ATOM 1102 HD22BLEU A 68 -20.870 -3.889 22.125 0.52 18.08 H ATOM 1103 HD23ALEU A 68 -20.072 -1.475 21.666 0.48 18.24 H ATOM 1104 HD23BLEU A 68 -22.452 -3.748 22.138 0.52 18.08 H ATOM 1105 N LYS A 69 -19.918 0.837 23.401 1.00 17.41 N ATOM 1106 CA LYS A 69 -18.585 1.159 22.914 1.00 19.01 C ATOM 1107 C LYS A 69 -17.876 -0.124 22.511 1.00 16.65 C ATOM 1108 O LYS A 69 -17.527 -0.953 23.351 1.00 18.51 O ATOM 1109 CB LYS A 69 -17.830 1.963 23.990 1.00 23.36 C ATOM 1110 CG LYS A 69 -16.497 2.485 23.541 1.00 31.13 C ATOM 1111 CD LYS A 69 -15.781 3.373 24.578 1.00 35.53 C ATOM 1112 CE LYS A 69 -16.519 4.679 24.882 1.00 43.33 C ATOM 1113 NZ LYS A 69 -15.617 5.652 25.546 1.00 44.91 N1+ ATOM 1114 H LYS A 69 -19.922 0.626 24.235 1.00 20.84 H ATOM 1115 HA LYS A 69 -18.664 1.717 22.124 1.00 22.82 H ATOM 1116 HB2 LYS A 69 -18.374 2.724 24.248 1.00 28.04 H ATOM 1117 HB3 LYS A 69 -17.680 1.391 24.759 1.00 28.04 H ATOM 1118 HG2 LYS A 69 -15.918 1.731 23.347 1.00 37.36 H ATOM 1119 HG3 LYS A 69 -16.625 3.014 22.738 1.00 37.36 H ATOM 1120 HD2 LYS A 69 -15.698 2.878 25.409 1.00 42.65 H ATOM 1121 HD3 LYS A 69 -14.901 3.600 24.241 1.00 42.65 H ATOM 1122 HE2 LYS A 69 -16.835 5.070 24.053 1.00 52.00 H ATOM 1123 HE3 LYS A 69 -17.264 4.497 25.476 1.00 52.00 H ATOM 1124 HZ1 LYS A 69 -15.314 5.314 26.311 1.00 53.91 H ATOM 1125 HZ2 LYS A 69 -14.925 5.835 25.017 1.00 53.91 H ATOM 1126 HZ3 LYS A 69 -16.057 6.407 25.717 1.00 53.91 H ATOM 1127 N TYR A 70 -17.718 -0.320 21.208 1.00 16.06 N ATOM 1128 CA TYR A 70 -17.094 -1.491 20.656 1.00 15.18 C ATOM 1129 C TYR A 70 -15.667 -1.127 20.308 1.00 17.12 C ATOM 1130 O TYR A 70 -15.437 -0.223 19.479 1.00 20.36 O ATOM 1131 CB TYR A 70 -17.859 -1.898 19.392 1.00 15.90 C ATOM 1132 CG TYR A 70 -17.366 -3.161 18.717 1.00 16.34 C ATOM 1133 CD1 TYR A 70 -17.579 -4.425 19.230 1.00 15.10 C ATOM 1134 CD2 TYR A 70 -16.700 -3.058 17.498 1.00 17.68 C ATOM 1135 CE1 TYR A 70 -17.155 -5.577 18.553 1.00 15.34 C ATOM 1136 CE2 TYR A 70 -16.270 -4.203 16.805 1.00 17.27 C ATOM 1137 CZ TYR A 70 -16.479 -5.445 17.362 1.00 14.87 C ATOM 1138 OH TYR A 70 -16.072 -6.595 16.729 1.00 16.51 O ATOM 1139 H TYR A 70 -17.978 0.240 20.610 1.00 19.22 H ATOM 1140 HA TYR A 70 -17.102 -2.220 21.296 1.00 18.17 H ATOM 1141 HB2 TYR A 70 -18.790 -2.037 19.626 1.00 19.09 H ATOM 1142 HB3 TYR A 70 -17.791 -1.177 18.746 1.00 19.09 H ATOM 1143 HD1 TYR A 70 -18.033 -4.515 20.037 1.00 18.13 H ATOM 1144 HD2 TYR A 70 -16.556 -2.218 17.125 1.00 21.23 H ATOM 1145 HE1 TYR A 70 -17.298 -6.419 18.922 1.00 18.42 H ATOM 1146 HE2 TYR A 70 -15.814 -4.121 15.998 1.00 20.73 H ATOM 1147 HH TYR A 70 -16.302 -7.267 17.177 1.00 19.82 H ATOM 1148 N ASN A 71 -14.709 -1.811 20.911 1.00 15.85 N ATOM 1149 CA ASN A 71 -13.303 -1.463 20.792 1.00 16.28 C ATOM 1150 C ASN A 71 -12.616 -2.428 19.836 1.00 15.78 C ATOM 1151 O ASN A 71 -12.538 -3.623 20.115 1.00 16.24 O ATOM 1152 CB ASN A 71 -12.617 -1.512 22.161 1.00 16.00 C ATOM 1153 CG ASN A 71 -11.258 -0.897 22.116 1.00 19.62 C ATOM 1154 ND2 ASN A 71 -10.239 -1.639 22.478 1.00 19.04 N ATOM 1155 OD1 ASN A 71 -11.131 0.295 21.746 1.00 24.20 O ATOM 1156 H ASN A 71 -14.851 -2.499 21.407 1.00 19.03 H ATOM 1157 HA ASN A 71 -13.219 -0.564 20.437 1.00 19.54 H ATOM 1158 HB2 ASN A 71 -13.151 -1.021 22.804 1.00 19.20 H ATOM 1159 HB3 ASN A 71 -12.523 -2.437 22.438 1.00 19.20 H ATOM 1160 HD21 ASN A 71 -9.443 -1.314 22.464 1.00 22.85 H ATOM 1161 HD22 ASN A 71 -10.368 -2.452 22.731 1.00 22.85 H ATOM 1162 N GLN A 72 -12.007 -1.914 18.793 1.00 16.94 N ATOM 1163 CA GLN A 72 -11.251 -2.744 17.828 1.00 16.45 C ATOM 1164 C GLN A 72 -9.767 -2.606 18.201 1.00 17.24 C ATOM 1165 O GLN A 72 -9.025 -1.816 17.674 1.00 21.65 O ATOM 1166 CB GLN A 72 -11.541 -2.308 16.395 1.00 17.81 C ATOM 1167 CG GLN A 72 -13.042 -2.458 16.053 1.00 18.39 C ATOM 1168 CD GLN A 72 -13.328 -2.070 14.621 1.00 22.31 C ATOM 1169 NE2 GLN A 72 -14.384 -1.383 14.439 1.00 23.24 N ATOM 1170 OE1 GLN A 72 -12.638 -2.485 13.698 1.00 23.60 O ATOM 1171 H GLN A 72 -12.005 -1.075 18.602 1.00 20.34 H ATOM 1172 HA GLN A 72 -11.509 -3.674 17.926 1.00 19.75 H ATOM 1173 HB2 GLN A 72 -11.296 -1.375 16.288 1.00 21.38 H ATOM 1174 HB3 GLN A 72 -11.032 -2.861 15.782 1.00 21.38 H ATOM 1175 HG2 GLN A 72 -13.306 -3.383 16.176 1.00 22.08 H ATOM 1176 HG3 GLN A 72 -13.561 -1.881 16.634 1.00 22.08 H ATOM 1177 HE21 GLN A 72 -14.602 -1.131 13.647 1.00 27.90 H ATOM 1178 HE22 GLN A 72 -14.880 -1.171 15.110 1.00 27.90 H ATOM 1179 N ALA A 73 -9.371 -3.359 19.221 1.00 16.65 N ATOM 1180 CA ALA A 73 -8.024 -3.273 19.786 1.00 18.49 C ATOM 1181 C ALA A 73 -6.949 -3.546 18.748 1.00 18.99 C ATOM 1182 O ALA A 73 -5.959 -2.833 18.662 1.00 21.08 O ATOM 1183 CB ALA A 73 -7.898 -4.224 20.979 1.00 20.50 C ATOM 1184 H ALA A 73 -9.872 -3.939 19.612 1.00 19.93 H ATOM 1185 HA ALA A 73 -7.887 -2.372 20.116 1.00 22.19 H ATOM 1186 HB1 ALA A 73 -8.548 -3.972 21.653 1.00 24.61 H ATOM 1187 HB2 ALA A 73 -8.066 -5.131 20.679 1.00 24.61 H ATOM 1188 HB3 ALA A 73 -7.001 -4.156 21.342 1.00 24.61 H ATOM 1189 N THR A 74 -7.126 -4.626 17.963 1.00 19.15 N ATOM 1190 CA THR A 74 -6.253 -4.959 16.839 1.00 20.07 C ATOM 1191 C THR A 74 -7.155 -5.333 15.673 1.00 19.87 C ATOM 1192 O THR A 74 -8.377 -5.367 15.809 1.00 19.24 O ATOM 1193 CB THR A 74 -5.321 -6.132 17.162 1.00 19.92 C ATOM 1194 CG2 THR A 74 -4.703 -5.967 18.557 1.00 19.83 C ATOM 1195 OG1 THR A 74 -6.120 -7.285 17.146 1.00 20.83 O ATOM 1196 H THR A 74 -7.765 -5.191 18.072 1.00 22.99 H ATOM 1197 HA THR A 74 -5.718 -4.188 16.592 1.00 24.10 H ATOM 1198 HB THR A 74 -4.616 -6.198 16.499 1.00 23.91 H ATOM 1199 HG1 THR A 74 -5.652 -7.961 17.319 1.00 25.00 H ATOM 1200 HG21 THR A 74 -4.190 -5.145 18.597 1.00 23.80 H ATOM 1201 HG22 THR A 74 -5.403 -5.935 19.228 1.00 23.80 H ATOM 1202 HG23 THR A 74 -4.116 -6.715 18.750 1.00 23.80 H ATOM 1203 N GLN A 75 -6.551 -5.645 14.529 1.00 20.90 N ATOM 1204 CA GLN A 75 -7.354 -6.094 13.385 1.00 20.59 C ATOM 1205 C GLN A 75 -7.984 -7.465 13.574 1.00 21.28 C ATOM 1206 O GLN A 75 -8.874 -7.813 12.785 1.00 25.09 O ATOM 1207 CB GLN A 75 -6.521 -6.140 12.122 1.00 23.36 C ATOM 1208 CG GLN A 75 -6.020 -4.777 11.761 1.00 28.53 C ATOM 1209 CD GLN A 75 -5.352 -4.765 10.419 1.00 34.48 C ATOM 1210 NE2 GLN A 75 -5.974 -4.080 9.479 1.00 36.90 N ATOM 1211 OE1 GLN A 75 -4.289 -5.368 10.222 1.00 37.07 O ATOM 1212 H GLN A 75 -5.704 -5.608 14.387 1.00 25.08 H ATOM 1213 HA GLN A 75 -8.071 -5.457 13.242 1.00 24.72 H ATOM 1214 HB2 GLN A 75 -5.756 -6.720 12.261 1.00 28.04 H ATOM 1215 HB3 GLN A 75 -7.065 -6.469 11.389 1.00 28.04 H ATOM 1216 HG2 GLN A 75 -6.767 -4.159 11.733 1.00 34.24 H ATOM 1217 HG3 GLN A 75 -5.372 -4.489 12.424 1.00 34.24 H ATOM 1218 HE21 GLN A 75 -6.712 -3.678 9.657 1.00 44.29 H ATOM 1219 HE22 GLN A 75 -5.640 -4.036 8.687 1.00 44.29 H ATOM 1220 N THR A 76 -7.618 -8.226 14.613 1.00 18.73 N ATOM 1221 CA THR A 76 -8.211 -9.530 14.846 1.00 17.55 C ATOM 1222 C THR A 76 -8.653 -9.736 16.286 1.00 16.63 C ATOM 1223 O THR A 76 -9.033 -10.850 16.650 1.00 18.85 O ATOM 1224 CB THR A 76 -7.272 -10.671 14.464 1.00 22.21 C ATOM 1225 CG2 THR A 76 -7.034 -10.703 12.929 1.00 22.43 C ATOM 1226 OG1 THR A 76 -5.989 -10.501 15.071 1.00 22.74 O ATOM 1227 H THR A 76 -7.025 -8.001 15.194 1.00 22.48 H ATOM 1228 HA THR A 76 -9.001 -9.608 14.288 1.00 21.07 H ATOM 1229 HB THR A 76 -7.655 -11.519 14.738 1.00 26.66 H ATOM 1230 HG1 THR A 76 -6.066 -10.488 15.907 1.00 27.29 H ATOM 1231 HG21 THR A 76 -7.877 -10.830 12.466 1.00 26.92 H ATOM 1232 HG22 THR A 76 -6.637 -9.867 12.638 1.00 26.92 H ATOM 1233 HG23 THR A 76 -6.436 -11.432 12.702 1.00 26.92 H ATOM 1234 N PHE A 77 -8.641 -8.691 17.120 1.00 16.74 N ATOM 1235 CA PHE A 77 -9.108 -8.821 18.497 1.00 15.43 C ATOM 1236 C PHE A 77 -9.963 -7.619 18.859 1.00 15.53 C ATOM 1237 O PHE A 77 -9.439 -6.495 18.925 1.00 16.82 O ATOM 1238 CB PHE A 77 -7.966 -9.008 19.512 1.00 18.33 C ATOM 1239 CG PHE A 77 -8.427 -9.436 20.885 1.00 18.12 C ATOM 1240 CD1 PHE A 77 -8.633 -10.747 21.171 1.00 17.94 C ATOM 1241 CD2 PHE A 77 -8.649 -8.496 21.909 1.00 18.92 C ATOM 1242 CE1 PHE A 77 -9.054 -11.171 22.434 1.00 20.44 C ATOM 1243 CE2 PHE A 77 -9.067 -8.917 23.171 1.00 19.89 C ATOM 1244 CZ PHE A 77 -9.254 -10.232 23.438 1.00 18.67 C ATOM 1245 H PHE A 77 -8.369 -7.903 16.911 1.00 20.10 H ATOM 1246 HA PHE A 77 -9.675 -9.606 18.553 1.00 18.53 H ATOM 1247 HB2 PHE A 77 -7.360 -9.688 19.178 1.00 22.00 H ATOM 1248 HB3 PHE A 77 -7.493 -8.166 19.608 1.00 22.00 H ATOM 1249 HD1 PHE A 77 -8.489 -11.382 20.506 1.00 21.54 H ATOM 1250 HD2 PHE A 77 -8.513 -7.591 21.744 1.00 22.72 H ATOM 1251 HE1 PHE A 77 -9.184 -12.076 22.605 1.00 24.54 H ATOM 1252 HE2 PHE A 77 -9.208 -8.287 23.842 1.00 23.88 H ATOM 1253 HZ PHE A 77 -9.542 -10.502 24.280 1.00 22.42 H ATOM 1254 N HIS A 78 -11.273 -7.854 19.039 1.00 15.75 N ATOM 1255 CA HIS A 78 -12.241 -6.802 19.374 1.00 15.70 C ATOM 1256 C HIS A 78 -12.916 -7.121 20.702 1.00 14.80 C ATOM 1257 O HIS A 78 -13.016 -8.282 21.085 1.00 14.43 O ATOM 1258 CB HIS A 78 -13.291 -6.596 18.280 1.00 14.40 C ATOM 1259 CG HIS A 78 -12.719 -6.281 16.940 1.00 14.80 C ATOM 1260 CD2 HIS A 78 -11.459 -6.019 16.548 1.00 16.63 C ATOM 1261 ND1 HIS A 78 -13.514 -6.207 15.815 1.00 16.86 N ATOM 1262 CE1 HIS A 78 -12.751 -5.943 14.777 1.00 17.20 C ATOM 1263 NE2 HIS A 78 -11.505 -5.810 15.181 1.00 17.83 N ATOM 1264 H HIS A 78 -11.630 -8.634 18.970 1.00 18.91 H ATOM 1265 HA HIS A 78 -11.763 -5.965 19.482 1.00 18.85 H ATOM 1266 HB2 HIS A 78 -13.815 -7.408 18.194 1.00 17.29 H ATOM 1267 HB3 HIS A 78 -13.867 -5.859 18.536 1.00 17.29 H ATOM 1268 HD2 HIS A 78 -10.702 -5.998 17.088 1.00 19.96 H ATOM 1269 HE1 HIS A 78 -13.049 -5.837 13.902 1.00 20.65 H ATOM 1270 N AGLN A 79 -13.399 -6.099 21.385 0.61 13.60 N ATOM 1271 N BGLN A 79 -13.328 -6.093 21.431 0.39 14.03 N ATOM 1272 CA AGLN A 79 -13.868 -6.257 22.752 0.61 14.07 C ATOM 1273 CA BGLN A 79 -13.854 -6.313 22.773 0.39 14.40 C ATOM 1274 C AGLN A 79 -15.009 -5.297 23.036 0.61 13.60 C ATOM 1275 C BGLN A 79 -14.931 -5.283 23.096 0.39 13.95 C ATOM 1276 O AGLN A 79 -15.133 -4.234 22.419 0.61 15.14 O ATOM 1277 O BGLN A 79 -14.972 -4.190 22.517 0.39 15.05 O ATOM 1278 CB AGLN A 79 -12.701 -6.079 23.727 0.61 15.76 C ATOM 1279 CB BGLN A 79 -12.702 -6.394 23.801 0.39 16.48 C ATOM 1280 CG AGLN A 79 -11.861 -4.911 23.502 0.61 21.19 C ATOM 1281 CG BGLN A 79 -12.048 -5.114 24.222 0.39 19.79 C ATOM 1282 CD AGLN A 79 -10.568 -4.957 24.311 0.61 20.96 C ATOM 1283 CD BGLN A 79 -10.709 -4.851 23.532 0.39 22.00 C ATOM 1284 NE2AGLN A 79 -10.532 -5.770 25.378 0.61 20.73 N ATOM 1285 NE2BGLN A 79 -9.596 -5.188 24.175 0.39 21.77 N ATOM 1286 OE1AGLN A 79 -9.619 -4.280 23.971 0.61 23.10 O ATOM 1287 OE1BGLN A 79 -10.696 -4.357 22.441 0.39 20.53 O ATOM 1288 H AGLN A 79 -13.468 -5.298 21.079 0.61 16.33 H ATOM 1289 H BGLN A 79 -13.315 -5.271 21.179 0.39 16.84 H ATOM 1290 HA AGLN A 79 -14.208 -7.158 22.862 0.61 16.89 H ATOM 1291 HA BGLN A 79 -14.290 -7.179 22.779 0.39 17.29 H ATOM 1292 HB2AGLN A 79 -13.060 -6.009 24.625 0.61 18.93 H ATOM 1293 HB2BGLN A 79 -13.048 -6.812 24.605 0.39 19.78 H ATOM 1294 HB3AGLN A 79 -12.131 -6.861 23.667 0.61 18.93 H ATOM 1295 HB3BGLN A 79 -12.006 -6.957 23.426 0.39 19.78 H ATOM 1296 HG2AGLN A 79 -11.626 -4.866 22.562 0.61 25.44 H ATOM 1297 HG2BGLN A 79 -12.641 -4.376 24.010 0.39 23.76 H ATOM 1298 HG3AGLN A 79 -12.350 -4.115 23.762 0.61 25.44 H ATOM 1299 HG3BGLN A 79 -11.889 -5.144 25.178 0.39 23.76 H ATOM 1300 HE21AGLN A 79 -11.222 -6.241 25.583 0.61 24.88 H ATOM 1301 HE21BGLN A 79 -9.641 -5.544 24.956 0.39 26.14 H ATOM 1302 HE22AGLN A 79 -9.819 -5.820 25.856 0.61 24.88 H ATOM 1303 HE22BGLN A 79 -8.830 -5.050 23.809 0.39 26.14 H ATOM 1304 N TRP A 80 -15.801 -5.637 24.047 1.00 14.06 N ATOM 1305 CA TRP A 80 -16.797 -4.720 24.571 1.00 14.67 C ATOM 1306 C TRP A 80 -17.175 -5.178 25.958 1.00 17.38 C ATOM 1307 O TRP A 80 -16.791 -6.248 26.387 1.00 14.68 O ATOM 1308 CB TRP A 80 -18.035 -4.644 23.691 1.00 14.20 C ATOM 1309 CG TRP A 80 -18.886 -5.912 23.658 1.00 13.81 C ATOM 1310 CD1 TRP A 80 -20.012 -6.157 24.420 1.00 16.42 C ATOM 1311 CD2 TRP A 80 -18.728 -7.020 22.797 1.00 15.29 C ATOM 1312 CE2 TRP A 80 -19.774 -7.933 23.116 1.00 14.46 C ATOM 1313 CE3 TRP A 80 -17.807 -7.332 21.784 1.00 17.82 C ATOM 1314 NE1 TRP A 80 -20.521 -7.375 24.120 1.00 17.61 N ATOM 1315 CZ2 TRP A 80 -19.900 -9.173 22.493 1.00 16.88 C ATOM 1316 CZ3 TRP A 80 -17.923 -8.566 21.148 1.00 17.88 C ATOM 1317 CH2 TRP A 80 -18.988 -9.474 21.509 1.00 17.55 C ATOM 1318 H TRP A 80 -15.804 -6.408 24.428 1.00 16.88 H ATOM 1319 HA TRP A 80 -16.414 -3.832 24.636 1.00 17.61 H ATOM 1320 HB2 TRP A 80 -18.598 -3.923 24.013 1.00 17.05 H ATOM 1321 HB3 TRP A 80 -17.755 -4.457 22.781 1.00 17.05 H ATOM 1322 HD1 TRP A 80 -20.346 -5.586 25.074 1.00 19.71 H ATOM 1323 HE1 TRP A 80 -21.210 -7.734 24.488 1.00 21.15 H ATOM 1324 HE3 TRP A 80 -17.112 -6.751 21.575 1.00 21.40 H ATOM 1325 HZ2 TRP A 80 -20.593 -9.756 22.707 1.00 20.27 H ATOM 1326 HZ3 TRP A 80 -17.319 -8.803 20.481 1.00 21.47 H ATOM 1327 HH2 TRP A 80 -19.060 -10.286 21.061 1.00 21.08 H ATOM 1328 N AARG A 81 -17.866 -4.330 26.694 0.37 16.46 N ATOM 1329 N BARG A 81 -17.948 -4.334 26.633 0.63 16.68 N ATOM 1330 CA AARG A 81 -18.190 -4.670 28.074 0.37 16.94 C ATOM 1331 CA BARG A 81 -18.343 -4.549 28.017 0.63 16.52 C ATOM 1332 C AARG A 81 -19.659 -4.368 28.338 0.37 17.97 C ATOM 1333 C BARG A 81 -19.864 -4.584 28.157 0.63 17.40 C ATOM 1334 O AARG A 81 -20.204 -3.424 27.730 0.37 16.82 O ATOM 1335 O BARG A 81 -20.634 -4.013 27.379 0.63 18.45 O ATOM 1336 CB AARG A 81 -17.223 -3.950 29.014 0.37 19.06 C ATOM 1337 CB BARG A 81 -17.800 -3.468 28.910 0.63 19.34 C ATOM 1338 CG AARG A 81 -17.088 -2.449 28.798 0.37 21.33 C ATOM 1339 CG BARG A 81 -16.318 -3.231 28.881 0.63 20.12 C ATOM 1340 CD AARG A 81 -16.236 -1.770 29.830 0.37 24.05 C ATOM 1341 CD BARG A 81 -15.984 -2.124 29.841 0.63 24.07 C ATOM 1342 NE AARG A 81 -15.500 -0.629 29.277 0.37 25.26 N ATOM 1343 NE BARG A 81 -16.647 -0.861 29.509 0.63 25.07 N ATOM 1344 CZ AARG A 81 -16.074 0.439 28.739 0.37 26.46 C ATOM 1345 CZ BARG A 81 -16.034 0.209 29.001 0.63 25.95 C ATOM 1346 NH1AARG A 81 -15.314 1.430 28.296 0.37 27.12 N1+ ATOM 1347 NH1BARG A 81 -16.801 1.259 28.676 0.63 27.93 N1+ ATOM 1348 NH2AARG A 81 -17.410 0.544 28.667 0.37 26.43 N ATOM 1349 NH2BARG A 81 -14.692 0.308 28.916 0.63 23.10 N ATOM 1350 H AARG A 81 -18.157 -3.565 26.430 0.37 19.76 H ATOM 1351 H BARG A 81 -18.265 -3.608 26.298 0.63 20.03 H ATOM 1352 HA AARG A 81 -18.061 -5.624 28.197 0.37 20.34 H ATOM 1353 HA BARG A 81 -17.991 -5.400 28.322 0.63 19.83 H ATOM 1354 HB2AARG A 81 -17.525 -4.086 29.926 0.37 22.88 H ATOM 1355 HB2BARG A 81 -18.226 -2.632 28.664 0.63 23.21 H ATOM 1356 HB3AARG A 81 -16.342 -4.340 28.904 0.37 22.88 H ATOM 1357 HB3BARG A 81 -18.035 -3.688 29.825 0.63 23.21 H ATOM 1358 HG2AARG A 81 -16.684 -2.293 27.930 0.37 25.61 H ATOM 1359 HG2BARG A 81 -15.852 -4.036 29.157 0.63 24.16 H ATOM 1360 HG3AARG A 81 -17.970 -2.047 28.829 0.37 25.61 H ATOM 1361 HG3BARG A 81 -16.046 -2.964 27.989 0.63 24.16 H ATOM 1362 HD2AARG A 81 -16.804 -1.445 30.546 0.37 28.86 H ATOM 1363 HD2BARG A 81 -16.263 -2.385 30.732 0.63 28.89 H ATOM 1364 HD3AARG A 81 -15.591 -2.406 30.178 0.37 28.86 H ATOM 1365 HD3BARG A 81 -15.026 -1.972 29.825 0.63 28.89 H ATOM 1366 HE AARG A 81 -14.641 -0.653 29.304 0.37 30.33 H ATOM 1367 HE BARG A 81 -17.493 -0.804 29.653 0.63 30.09 H ATOM 1368 HH11AARG A 81 -14.458 1.367 28.338 0.37 32.55 H ATOM 1369 HH11BARG A 81 -17.655 1.212 28.765 0.63 33.53 H ATOM 1370 HH12AARG A 81 -15.677 2.123 27.940 0.37 32.55 H ATOM 1371 HH12BARG A 81 -16.438 1.989 28.400 0.63 33.53 H ATOM 1372 HH21AARG A 81 -17.908 -0.092 28.963 0.37 31.73 H ATOM 1373 HH21BARG A 81 -14.198 -0.368 29.113 0.63 27.72 H ATOM 1374 HH22AARG A 81 -17.767 1.243 28.316 0.37 31.73 H ATOM 1375 HH22BARG A 81 -14.333 1.027 28.611 0.63 27.72 H ATOM 1376 N ASP A 82 -20.295 -5.195 29.244 1.00 22.71 N ATOM 1377 CA ASP A 82 -21.666 -4.997 29.727 1.00 25.43 C ATOM 1378 C ASP A 82 -21.481 -4.707 31.228 1.00 21.32 C ATOM 1379 O ASP A 82 -20.359 -4.508 31.704 1.00 18.60 O ATOM 1380 CB ASP A 82 -22.641 -6.183 29.401 1.00 27.03 C ATOM 1381 CG ASP A 82 -22.347 -7.454 30.117 1.00 31.53 C ATOM 1382 OD1 ASP A 82 -21.617 -7.446 31.080 1.00 32.05 O ATOM 1383 OD2 ASP A 82 -22.928 -8.535 29.747 1.00 34.53 O1- ATOM 1384 H ASP A 82 -19.876 -5.817 29.661 1.00 27.26 H ATOM 1385 HA ASP A 82 -22.029 -4.198 29.315 1.00 30.53 H ATOM 1386 HB2 ASP A 82 -23.543 -5.915 29.640 1.00 32.45 H ATOM 1387 HB3 ASP A 82 -22.598 -6.366 28.450 1.00 32.45 H ATOM 1388 N ALA A 83 -22.572 -4.607 31.989 1.00 22.15 N ATOM 1389 CA ALA A 83 -22.451 -4.296 33.413 1.00 18.43 C ATOM 1390 C ALA A 83 -21.808 -5.459 34.214 1.00 18.02 C ATOM 1391 O ALA A 83 -21.471 -5.263 35.368 1.00 18.70 O ATOM 1392 CB ALA A 83 -23.783 -3.814 34.024 1.00 21.40 C ATOM 1393 H ALA A 83 -23.379 -4.713 31.711 1.00 26.59 H ATOM 1394 HA ALA A 83 -21.837 -3.549 33.488 1.00 22.07 H ATOM 1395 HB1 ALA A 83 -24.448 -4.513 33.921 1.00 25.69 H ATOM 1396 HB2 ALA A 83 -23.646 -3.623 34.965 1.00 25.69 H ATOM 1397 HB3 ALA A 83 -24.070 -3.012 33.561 1.00 25.69 H ATOM 1398 N ARG A 84 -21.708 -6.650 33.640 1.00 20.78 N ATOM 1399 CA ARG A 84 -21.139 -7.790 34.361 1.00 28.12 C ATOM 1400 C ARG A 84 -19.816 -8.289 33.813 1.00 25.65 C ATOM 1401 O ARG A 84 -18.902 -8.581 34.599 1.00 28.76 O ATOM 1402 CB ARG A 84 -22.093 -8.979 34.353 1.00 37.64 C ATOM 1403 CG ARG A 84 -21.715 -9.992 35.437 1.00 43.12 C ATOM 1404 CD ARG A 84 -22.728 -11.151 35.497 1.00 44.78 C ATOM 1405 NE ARG A 84 -23.700 -11.017 36.594 1.00 45.94 N ATOM 1406 CZ ARG A 84 -24.935 -11.523 36.566 1.00 47.46 C ATOM 1407 NH1 ARG A 84 -25.737 -11.380 37.605 1.00 48.54 N1+ ATOM 1408 NH2 ARG A 84 -25.381 -12.164 35.486 1.00 46.88 N ATOM 1409 H ARG A 84 -21.959 -6.828 32.837 1.00 24.95 H ATOM 1410 HA ARG A 84 -20.996 -7.532 35.286 1.00 33.75 H ATOM 1411 HB2 ARG A 84 -22.995 -8.668 34.525 1.00 45.18 H ATOM 1412 HB3 ARG A 84 -22.047 -9.422 33.491 1.00 45.18 H ATOM 1413 HG2 ARG A 84 -20.840 -10.361 35.240 1.00 51.76 H ATOM 1414 HG3 ARG A 84 -21.707 -9.549 36.300 1.00 51.76 H ATOM 1415 HD2 ARG A 84 -23.222 -11.180 34.662 1.00 53.74 H ATOM 1416 HD3 ARG A 84 -22.246 -11.984 35.625 1.00 53.74 H ATOM 1417 HE ARG A 84 -23.472 -10.548 37.278 1.00 55.14 H ATOM 1418 HH11 ARG A 84 -25.464 -10.960 38.305 1.00 58.26 H ATOM 1419 HH12 ARG A 84 -26.537 -11.694 37.577 1.00 58.26 H ATOM 1420 HH21 ARG A 84 -24.866 -12.269 34.805 1.00 56.27 H ATOM 1421 HH22 ARG A 84 -26.180 -12.481 35.473 1.00 56.27 H ATOM 1422 N GLN A 85 -19.629 -8.234 32.515 1.00 17.58 N ATOM 1423 CA GLN A 85 -18.573 -8.995 31.885 1.00 18.98 C ATOM 1424 C GLN A 85 -17.871 -8.140 30.844 1.00 15.14 C ATOM 1425 O GLN A 85 -18.462 -7.210 30.331 1.00 15.68 O ATOM 1426 CB GLN A 85 -19.161 -10.260 31.108 1.00 22.33 C ATOM 1427 CG GLN A 85 -19.838 -11.330 31.947 1.00 36.44 C ATOM 1428 CD GLN A 85 -18.918 -12.464 32.175 1.00 45.21 C ATOM 1429 NE2 GLN A 85 -17.977 -12.289 33.092 1.00 49.16 N ATOM 1430 OE1 GLN A 85 -19.013 -13.480 31.502 1.00 46.01 O ATOM 1431 H GLN A 85 -20.100 -7.762 31.971 1.00 21.11 H ATOM 1432 HA GLN A 85 -17.928 -9.292 32.547 1.00 22.78 H ATOM 1433 HB2 GLN A 85 -19.816 -9.942 30.467 1.00 26.80 H ATOM 1434 HB3 GLN A 85 -18.431 -10.688 30.633 1.00 26.80 H ATOM 1435 HG2 GLN A 85 -20.086 -10.957 32.808 1.00 43.74 H ATOM 1436 HG3 GLN A 85 -20.622 -11.659 31.481 1.00 43.74 H ATOM 1437 HE21 GLN A 85 -17.926 -11.544 33.518 1.00 59.00 H ATOM 1438 HE22 GLN A 85 -17.418 -12.920 33.260 1.00 59.00 H ATOM 1439 N VAL A 86 -16.615 -8.451 30.556 1.00 14.21 N ATOM 1440 CA VAL A 86 -15.922 -7.940 29.375 1.00 13.32 C ATOM 1441 C VAL A 86 -15.747 -9.100 28.435 1.00 13.68 C ATOM 1442 O VAL A 86 -15.245 -10.165 28.832 1.00 15.00 O ATOM 1443 CB VAL A 86 -14.539 -7.375 29.699 1.00 15.91 C ATOM 1444 CG1 VAL A 86 -13.865 -6.799 28.508 1.00 20.05 C ATOM 1445 CG2 VAL A 86 -14.723 -6.313 30.825 1.00 19.20 C ATOM 1446 H VAL A 86 -16.129 -8.970 31.039 1.00 17.06 H ATOM 1447 HA VAL A 86 -16.455 -7.254 28.942 1.00 15.99 H ATOM 1448 HB VAL A 86 -13.980 -8.088 30.046 1.00 19.10 H ATOM 1449 HG11 VAL A 86 -12.996 -6.458 28.772 1.00 24.08 H ATOM 1450 HG12 VAL A 86 -13.758 -7.493 27.839 1.00 24.08 H ATOM 1451 HG13 VAL A 86 -14.410 -6.078 28.155 1.00 24.08 H ATOM 1452 HG21 VAL A 86 -15.663 -6.258 31.057 1.00 23.05 H ATOM 1453 HG22 VAL A 86 -14.206 -6.583 31.600 1.00 23.05 H ATOM 1454 HG23 VAL A 86 -14.410 -5.454 30.502 1.00 23.05 H ATOM 1455 N TYR A 87 -16.146 -8.910 27.199 1.00 11.91 N ATOM 1456 CA TYR A 87 -16.054 -9.933 26.165 1.00 13.43 C ATOM 1457 C TYR A 87 -14.940 -9.597 25.198 1.00 14.76 C ATOM 1458 O TYR A 87 -14.711 -8.432 24.846 1.00 13.79 O ATOM 1459 CB TYR A 87 -17.362 -10.070 25.406 1.00 14.48 C ATOM 1460 CG TYR A 87 -18.604 -10.320 26.222 1.00 15.91 C ATOM 1461 CD1 TYR A 87 -19.376 -9.242 26.620 1.00 23.46 C ATOM 1462 CD2 TYR A 87 -19.013 -11.588 26.578 1.00 21.36 C ATOM 1463 CE1 TYR A 87 -20.520 -9.394 27.422 1.00 26.08 C ATOM 1464 CE2 TYR A 87 -20.177 -11.724 27.347 1.00 22.85 C ATOM 1465 CZ TYR A 87 -20.925 -10.638 27.721 1.00 28.27 C ATOM 1466 OH TYR A 87 -22.093 -10.733 28.483 1.00 37.31 O ATOM 1467 H TYR A 87 -16.487 -8.173 26.918 1.00 14.24 H ATOM 1468 HA TYR A 87 -15.852 -10.787 26.577 1.00 16.13 H ATOM 1469 HB2 TYR A 87 -17.508 -9.251 24.907 1.00 17.38 H ATOM 1470 HB3 TYR A 87 -17.274 -10.810 24.785 1.00 17.38 H ATOM 1471 HD1 TYR A 87 -19.097 -8.383 26.397 1.00 28.16 H ATOM 1472 HD2 TYR A 87 -18.524 -12.336 26.319 1.00 25.64 H ATOM 1473 HE1 TYR A 87 -21.033 -8.656 27.663 1.00 31.30 H ATOM 1474 HE2 TYR A 87 -20.466 -12.576 27.584 1.00 27.44 H ATOM 1475 HH TYR A 87 -22.277 -11.540 28.626 1.00 44.79 H ATOM 1476 N GLY A 88 -14.301 -10.607 24.656 1.00 14.55 N ATOM 1477 CA GLY A 88 -13.317 -10.430 23.637 1.00 12.99 C ATOM 1478 C GLY A 88 -13.508 -11.470 22.572 1.00 13.65 C ATOM 1479 O GLY A 88 -13.738 -12.647 22.862 1.00 16.02 O ATOM 1480 H GLY A 88 -14.429 -11.429 24.873 1.00 17.46 H ATOM 1481 HA2 GLY A 88 -13.404 -9.549 23.240 1.00 15.60 H ATOM 1482 HA3 GLY A 88 -12.428 -10.521 24.014 1.00 15.60 H ATOM 1483 N LEU A 89 -13.397 -11.081 21.328 1.00 13.50 N ATOM 1484 CA LEU A 89 -13.451 -12.001 20.193 1.00 13.55 C ATOM 1485 C LEU A 89 -12.087 -12.020 19.524 1.00 13.96 C ATOM 1486 O LEU A 89 -11.568 -10.985 19.067 1.00 14.94 O ATOM 1487 CB LEU A 89 -14.512 -11.576 19.194 1.00 13.70 C ATOM 1488 CG LEU A 89 -15.946 -11.551 19.653 1.00 16.67 C ATOM 1489 CD1 LEU A 89 -16.876 -11.027 18.574 1.00 18.61 C ATOM 1490 CD2 LEU A 89 -16.387 -12.934 20.036 1.00 18.54 C ATOM 1491 H LEU A 89 -13.286 -10.261 21.094 1.00 16.21 H ATOM 1492 HA LEU A 89 -13.657 -12.896 20.505 1.00 16.27 H ATOM 1493 HB2 LEU A 89 -14.296 -10.680 18.893 1.00 16.45 H ATOM 1494 HB3 LEU A 89 -14.469 -12.182 18.438 1.00 16.45 H ATOM 1495 HG LEU A 89 -16.026 -10.977 20.431 1.00 20.01 H ATOM 1496 HD11 LEU A 89 -17.784 -11.028 18.913 1.00 22.34 H ATOM 1497 HD12 LEU A 89 -16.610 -10.123 18.341 1.00 22.34 H ATOM 1498 HD13 LEU A 89 -16.811 -11.602 17.796 1.00 22.34 H ATOM 1499 HD21 LEU A 89 -16.305 -13.516 19.265 1.00 22.26 H ATOM 1500 HD22 LEU A 89 -15.823 -13.257 20.756 1.00 22.26 H ATOM 1501 HD23 LEU A 89 -17.311 -12.901 20.329 1.00 22.26 H ATOM 1502 N ASN A 90 -11.454 -13.226 19.513 1.00 15.23 N ATOM 1503 CA ASN A 90 -10.178 -13.387 18.832 1.00 15.67 C ATOM 1504 C ASN A 90 -10.501 -14.044 17.500 1.00 15.91 C ATOM 1505 O ASN A 90 -10.760 -15.247 17.413 1.00 15.60 O ATOM 1506 CB ASN A 90 -9.261 -14.262 19.666 1.00 18.55 C ATOM 1507 CG ASN A 90 -7.775 -14.159 19.281 1.00 26.30 C ATOM 1508 ND2 ASN A 90 -7.454 -13.505 18.206 1.00 28.71 N ATOM 1509 OD1 ASN A 90 -6.927 -14.681 20.014 1.00 33.43 O ATOM 1510 H ASN A 90 -11.751 -13.940 19.889 1.00 18.29 H ATOM 1511 HA ASN A 90 -9.759 -12.526 18.679 1.00 18.82 H ATOM 1512 HB2 ASN A 90 -9.345 -14.001 20.596 1.00 22.27 H ATOM 1513 HB3 ASN A 90 -9.531 -15.187 19.559 1.00 22.27 H ATOM 1514 HD21 ASN A 90 -6.628 -13.437 17.974 1.00 34.46 H ATOM 1515 HD22 ASN A 90 -8.067 -13.140 17.725 1.00 34.46 H ATOM 1516 N PHE A 91 -10.551 -13.244 16.449 1.00 14.78 N ATOM 1517 CA PHE A 91 -11.077 -13.674 15.168 1.00 16.46 C ATOM 1518 C PHE A 91 -10.118 -14.617 14.458 1.00 17.33 C ATOM 1519 O PHE A 91 -8.895 -14.530 14.574 1.00 18.18 O ATOM 1520 CB PHE A 91 -11.425 -12.472 14.293 1.00 16.74 C ATOM 1521 CG PHE A 91 -12.578 -11.679 14.780 1.00 15.70 C ATOM 1522 CD1 PHE A 91 -13.882 -12.100 14.577 1.00 15.45 C ATOM 1523 CD2 PHE A 91 -12.364 -10.503 15.511 1.00 17.03 C ATOM 1524 CE1 PHE A 91 -14.948 -11.382 15.039 1.00 15.25 C ATOM 1525 CE2 PHE A 91 -13.437 -9.754 15.947 1.00 15.71 C ATOM 1526 CZ PHE A 91 -14.742 -10.207 15.746 1.00 15.07 C ATOM 1527 H PHE A 91 -10.281 -12.427 16.455 1.00 17.74 H ATOM 1528 HA PHE A 91 -11.899 -14.164 15.325 1.00 19.76 H ATOM 1529 HB2 PHE A 91 -10.656 -11.882 14.255 1.00 20.10 H ATOM 1530 HB3 PHE A 91 -11.639 -12.788 13.401 1.00 20.10 H ATOM 1531 HD1 PHE A 91 -14.036 -12.889 14.109 1.00 18.55 H ATOM 1532 HD2 PHE A 91 -11.498 -10.196 15.652 1.00 20.45 H ATOM 1533 HE1 PHE A 91 -15.813 -11.683 14.882 1.00 18.30 H ATOM 1534 HE2 PHE A 91 -13.288 -8.974 16.432 1.00 18.86 H ATOM 1535 HZ PHE A 91 -15.466 -9.710 16.053 1.00 18.10 H ATOM 1536 N GLY A 92 -10.701 -15.493 13.649 1.00 17.39 N ATOM 1537 CA GLY A 92 -9.869 -16.453 12.895 1.00 18.70 C ATOM 1538 C GLY A 92 -9.071 -15.822 11.765 1.00 20.56 C ATOM 1539 O GLY A 92 -8.064 -16.393 11.315 1.00 22.96 O ATOM 1540 H GLY A 92 -11.548 -15.561 13.516 1.00 20.88 H ATOM 1541 HA2 GLY A 92 -9.246 -16.880 13.503 1.00 22.45 H ATOM 1542 HA3 GLY A 92 -10.440 -17.139 12.515 1.00 22.45 H ATOM 1543 N SER A 93 -9.494 -14.649 11.304 1.00 20.07 N ATOM 1544 CA SER A 93 -8.845 -13.936 10.229 1.00 20.37 C ATOM 1545 C SER A 93 -9.300 -12.484 10.295 1.00 19.00 C ATOM 1546 O SER A 93 -10.302 -12.180 10.935 1.00 18.57 O ATOM 1547 CB SER A 93 -9.252 -14.544 8.880 1.00 21.97 C ATOM 1548 OG SER A 93 -10.593 -14.240 8.543 1.00 20.06 O ATOM 1549 H SER A 93 -10.182 -14.237 11.616 1.00 24.09 H ATOM 1550 HA SER A 93 -7.881 -13.979 10.326 1.00 24.45 H ATOM 1551 HB2 SER A 93 -8.669 -14.191 8.190 1.00 26.37 H ATOM 1552 HB3 SER A 93 -9.154 -15.508 8.929 1.00 26.37 H ATOM 1553 HG SER A 93 -10.788 -14.584 7.802 1.00 24.08 H ATOM 1554 N LYS A 94 -8.563 -11.607 9.622 1.00 19.98 N ATOM 1555 CA LYS A 94 -8.997 -10.220 9.537 1.00 21.09 C ATOM 1556 C LYS A 94 -10.317 -10.105 8.800 1.00 20.56 C ATOM 1557 O LYS A 94 -11.150 -9.257 9.101 1.00 20.75 O ATOM 1558 CB LYS A 94 -7.927 -9.373 8.848 1.00 27.62 C ATOM 1559 CG LYS A 94 -6.568 -9.299 9.550 1.00 36.50 C ATOM 1560 CD LYS A 94 -5.545 -8.535 8.696 1.00 45.97 C ATOM 1561 CE LYS A 94 -4.156 -8.535 9.325 1.00 51.00 C ATOM 1562 NZ LYS A 94 -3.645 -9.915 9.646 1.00 52.70 N1+ ATOM 1563 H LYS A 94 -7.826 -11.784 9.216 1.00 23.93 H ATOM 1564 HA LYS A 94 -9.123 -9.872 10.434 1.00 25.32 H ATOM 1565 HB2 LYS A 94 -7.774 -9.738 7.962 1.00 33.15 H ATOM 1566 HB3 LYS A 94 -8.260 -8.466 8.769 1.00 33.15 H ATOM 1567 HG2 LYS A 94 -6.668 -8.835 10.396 1.00 43.81 H ATOM 1568 HG3 LYS A 94 -6.233 -10.198 9.697 1.00 43.81 H ATOM 1569 HD2 LYS A 94 -5.481 -8.955 7.824 1.00 55.17 H ATOM 1570 HD3 LYS A 94 -5.834 -7.614 8.602 1.00 55.17 H ATOM 1571 HE2 LYS A 94 -3.532 -8.122 8.707 1.00 61.21 H ATOM 1572 HE3 LYS A 94 -4.186 -8.028 10.152 1.00 61.21 H ATOM 1573 HZ1 LYS A 94 -2.834 -9.862 10.009 1.00 63.25 H ATOM 1574 HZ2 LYS A 94 -4.194 -10.316 10.220 1.00 63.25 H ATOM 1575 HZ3 LYS A 94 -3.597 -10.402 8.902 1.00 63.25 H ATOM 1576 N GLU A 95 -10.550 -10.966 7.807 1.00 20.15 N ATOM 1577 CA GLU A 95 -11.833 -10.892 7.125 1.00 20.00 C ATOM 1578 C GLU A 95 -12.986 -11.125 8.091 1.00 18.54 C ATOM 1579 O GLU A 95 -14.046 -10.520 7.957 1.00 18.65 O ATOM 1580 CB GLU A 95 -11.887 -11.927 5.961 1.00 22.64 C ATOM 1581 CG GLU A 95 -11.230 -11.555 4.755 1.00 32.59 C ATOM 1582 CD GLU A 95 -11.655 -12.506 3.637 1.00 42.51 C ATOM 1583 OE1 GLU A 95 -11.985 -12.021 2.553 1.00 48.41 O ATOM 1584 OE2 GLU A 95 -11.742 -13.720 3.894 1.00 45.48 O1- ATOM 1585 H GLU A 95 -10.010 -11.572 7.523 1.00 24.13 H ATOM 1586 HA GLU A 95 -11.937 -10.006 6.744 1.00 23.95 H ATOM 1587 HB2 GLU A 95 -11.479 -12.752 6.268 1.00 27.17 H ATOM 1588 HB3 GLU A 95 -12.818 -12.091 5.743 1.00 27.17 H ATOM 1589 HG2 GLU A 95 -11.485 -10.652 4.508 1.00 39.12 H ATOM 1590 HG3 GLU A 95 -10.270 -11.621 4.871 1.00 39.12 H ATOM 1591 N ASP A 96 -12.866 -12.116 8.981 1.00 17.67 N ATOM 1592 CA ASP A 96 -13.921 -12.376 9.935 1.00 16.47 C ATOM 1593 C ASP A 96 -14.110 -11.189 10.860 1.00 15.82 C ATOM 1594 O ASP A 96 -15.228 -10.837 11.189 1.00 15.33 O ATOM 1595 CB ASP A 96 -13.499 -13.610 10.750 1.00 16.02 C ATOM 1596 CG ASP A 96 -13.713 -14.932 10.047 1.00 16.58 C ATOM 1597 OD1 ASP A 96 -14.880 -15.278 9.831 1.00 17.07 O ATOM 1598 OD2 ASP A 96 -12.690 -15.527 9.682 1.00 18.90 O1- ATOM 1599 H ASP A 96 -12.187 -12.641 9.045 1.00 21.16 H ATOM 1600 HA ASP A 96 -14.755 -12.563 9.475 1.00 19.72 H ATOM 1601 HB2 ASP A 96 -12.554 -13.536 10.957 1.00 19.18 H ATOM 1602 HB3 ASP A 96 -14.013 -13.628 11.573 1.00 19.18 H ATOM 1603 N ALA A 97 -13.022 -10.591 11.316 1.00 15.97 N ATOM 1604 CA ALA A 97 -13.133 -9.391 12.146 1.00 15.83 C ATOM 1605 C ALA A 97 -13.841 -8.255 11.406 1.00 16.44 C ATOM 1606 O ALA A 97 -14.676 -7.562 12.006 1.00 16.53 O ATOM 1607 CB ALA A 97 -11.725 -8.954 12.532 1.00 17.47 C ATOM 1608 H ALA A 97 -12.216 -10.851 11.165 1.00 19.12 H ATOM 1609 HA ALA A 97 -13.630 -9.595 12.954 1.00 19.01 H ATOM 1610 HB1 ALA A 97 -11.782 -8.158 13.084 1.00 20.97 H ATOM 1611 HB2 ALA A 97 -11.297 -9.670 13.026 1.00 20.97 H ATOM 1612 HB3 ALA A 97 -11.223 -8.762 11.725 1.00 20.97 H ATOM 1613 N ASN A 98 -13.540 -8.064 10.126 1.00 18.48 N ATOM 1614 CA ASN A 98 -14.192 -6.996 9.393 1.00 18.30 C ATOM 1615 C ASN A 98 -15.678 -7.296 9.216 1.00 18.68 C ATOM 1616 O ASN A 98 -16.518 -6.391 9.265 1.00 18.55 O ATOM 1617 CB ASN A 98 -13.528 -6.899 8.034 1.00 19.51 C ATOM 1618 CG ASN A 98 -12.165 -6.289 8.075 1.00 22.48 C ATOM 1619 ND2 ASN A 98 -11.406 -6.429 6.978 1.00 27.39 N ATOM 1620 OD1 ASN A 98 -11.812 -5.630 9.088 1.00 24.64 O ATOM 1621 H ASN A 98 -12.975 -8.527 9.672 1.00 22.19 H ATOM 1622 HA ASN A 98 -14.089 -6.153 9.861 1.00 21.97 H ATOM 1623 HB2 ASN A 98 -13.443 -7.791 7.663 1.00 23.36 H ATOM 1624 HB3 ASN A 98 -14.081 -6.353 7.453 1.00 23.36 H ATOM 1625 HD21 ASN A 98 -10.614 -6.093 6.957 1.00 32.87 H ATOM 1626 HD22 ASN A 98 -11.711 -6.853 6.295 1.00 32.87 H ATOM 1627 N VAL A 99 -16.019 -8.557 8.872 1.00 17.46 N ATOM 1628 CA VAL A 99 -17.430 -8.929 8.772 1.00 18.22 C ATOM 1629 C VAL A 99 -18.192 -8.628 10.077 1.00 18.00 C ATOM 1630 O VAL A 99 -19.282 -8.032 10.078 1.00 19.77 O ATOM 1631 CB VAL A 99 -17.538 -10.434 8.403 1.00 18.66 C ATOM 1632 CG1 VAL A 99 -18.957 -10.926 8.632 1.00 21.14 C ATOM 1633 CG2 VAL A 99 -17.139 -10.606 6.981 1.00 23.26 C ATOM 1634 H VAL A 99 -15.465 -9.191 8.698 1.00 20.90 H ATOM 1635 HA VAL A 99 -17.842 -8.415 8.060 1.00 21.87 H ATOM 1636 HB VAL A 99 -16.936 -10.951 8.959 1.00 22.40 H ATOM 1637 HG11 VAL A 99 -19.007 -11.865 8.397 1.00 25.38 H ATOM 1638 HG12 VAL A 99 -19.185 -10.805 9.567 1.00 25.38 H ATOM 1639 HG13 VAL A 99 -19.563 -10.412 8.075 1.00 25.38 H ATOM 1640 HG21 VAL A 99 -16.904 -9.741 6.612 1.00 27.93 H ATOM 1641 HG22 VAL A 99 -16.376 -11.203 6.938 1.00 27.93 H ATOM 1642 HG23 VAL A 99 -17.884 -10.985 6.488 1.00 27.93 H ATOM 1643 N PHE A 100 -17.670 -9.082 11.221 1.00 15.83 N ATOM 1644 CA PHE A 100 -18.386 -8.888 12.475 1.00 16.14 C ATOM 1645 C PHE A 100 -18.434 -7.408 12.876 1.00 16.85 C ATOM 1646 O PHE A 100 -19.512 -6.908 13.208 1.00 15.63 O ATOM 1647 CB PHE A 100 -17.768 -9.760 13.571 1.00 14.02 C ATOM 1648 CG PHE A 100 -18.549 -9.772 14.859 1.00 16.82 C ATOM 1649 CD1 PHE A 100 -18.365 -8.795 15.783 1.00 17.04 C ATOM 1650 CD2 PHE A 100 -19.533 -10.740 15.110 1.00 18.54 C ATOM 1651 CE1 PHE A 100 -19.058 -8.747 16.972 1.00 17.08 C ATOM 1652 CE2 PHE A 100 -20.244 -10.685 16.314 1.00 15.35 C ATOM 1653 CZ PHE A 100 -20.021 -9.684 17.226 1.00 16.52 C ATOM 1654 H PHE A 100 -16.919 -9.495 11.294 1.00 19.01 H ATOM 1655 HA PHE A 100 -19.302 -9.184 12.352 1.00 19.38 H ATOM 1656 HB2 PHE A 100 -17.715 -10.674 13.250 1.00 16.84 H ATOM 1657 HB3 PHE A 100 -16.878 -9.429 13.768 1.00 16.84 H ATOM 1658 HD1 PHE A 100 -17.719 -8.146 15.620 1.00 20.46 H ATOM 1659 HD2 PHE A 100 -19.698 -11.417 14.494 1.00 22.26 H ATOM 1660 HE1 PHE A 100 -18.897 -8.064 17.583 1.00 20.50 H ATOM 1661 HE2 PHE A 100 -20.892 -11.328 16.492 1.00 18.43 H ATOM 1662 HZ PHE A 100 -20.494 -9.665 18.026 1.00 19.84 H ATOM 1663 N ALA A 101 -17.305 -6.682 12.724 1.00 16.17 N ATOM 1664 CA ALA A 101 -17.320 -5.269 13.119 1.00 16.20 C ATOM 1665 C ALA A 101 -18.261 -4.490 12.242 1.00 17.24 C ATOM 1666 O ALA A 101 -18.900 -3.555 12.709 1.00 17.82 O ATOM 1667 CB ALA A 101 -15.915 -4.683 13.025 1.00 20.08 C ATOM 1668 H ALA A 101 -16.558 -6.971 12.411 1.00 19.42 H ATOM 1669 HA ALA A 101 -17.622 -5.194 14.037 1.00 19.45 H ATOM 1670 HB1 ALA A 101 -15.602 -4.758 12.109 1.00 24.11 H ATOM 1671 HB2 ALA A 101 -15.944 -3.750 13.289 1.00 24.11 H ATOM 1672 HB3 ALA A 101 -15.326 -5.177 13.617 1.00 24.11 H ATOM 1673 N ASER A 102 -18.337 -4.827 10.960 0.37 17.38 N ATOM 1674 N BSER A 102 -18.328 -4.808 10.928 0.63 17.42 N ATOM 1675 CA ASER A 102 -19.217 -4.075 10.089 0.37 18.56 C ATOM 1676 CA BSER A 102 -19.270 -4.124 10.033 0.63 18.58 C ATOM 1677 C ASER A 102 -20.680 -4.297 10.456 0.37 18.48 C ATOM 1678 C BSER A 102 -20.678 -4.285 10.541 0.63 18.42 C ATOM 1679 O ASER A 102 -21.472 -3.344 10.408 0.37 19.84 O ATOM 1680 O BSER A 102 -21.431 -3.307 10.658 0.63 19.71 O ATOM 1681 CB ASER A 102 -18.895 -4.391 8.631 0.37 20.11 C ATOM 1682 CB BSER A 102 -19.216 -4.656 8.583 0.63 20.45 C ATOM 1683 OG ASER A 102 -17.673 -3.755 8.228 0.37 22.55 O ATOM 1684 OG BSER A 102 -20.398 -4.235 7.803 0.63 21.66 O ATOM 1685 H ASER A 102 -17.903 -5.467 10.583 0.37 20.81 H ATOM 1686 H BSER A 102 -17.844 -5.406 10.544 0.63 20.85 H ATOM 1687 HA ASER A 102 -19.034 -3.132 10.221 0.37 22.22 H ATOM 1688 HA BSER A 102 -19.061 -3.177 10.015 0.63 22.25 H ATOM 1689 HB2ASER A 102 -18.799 -5.351 8.530 0.37 24.14 H ATOM 1690 HB2BSER A 102 -18.418 -4.311 8.152 0.63 24.55 H ATOM 1691 HB3ASER A 102 -19.618 -4.069 8.071 0.37 24.14 H ATOM 1692 HB3BSER A 102 -19.185 -5.625 8.606 0.63 24.55 H ATOM 1693 HG ASER A 102 -17.506 -3.936 7.425 0.37 27.07 H ATOM 1694 HG BSER A 102 -20.438 -3.396 7.772 0.63 26.01 H ATOM 1695 N ALA A 103 -21.044 -5.514 10.898 1.00 17.64 N ATOM 1696 CA ALA A 103 -22.392 -5.747 11.346 1.00 19.37 C ATOM 1697 C ALA A 103 -22.635 -5.069 12.697 1.00 19.31 C ATOM 1698 O ALA A 103 -23.721 -4.539 12.920 1.00 20.80 O ATOM 1699 CB ALA A 103 -22.642 -7.265 11.431 1.00 22.03 C ATOM 1700 H ALA A 103 -20.529 -6.202 10.913 1.00 21.17 H ATOM 1701 HA ALA A 103 -23.013 -5.372 10.701 1.00 23.25 H ATOM 1702 HB1 ALA A 103 -23.551 -7.419 11.733 1.00 26.44 H ATOM 1703 HB2 ALA A 103 -22.514 -7.656 10.553 1.00 26.44 H ATOM 1704 HB3 ALA A 103 -22.014 -7.653 12.061 1.00 26.44 H ATOM 1705 N MET A 104 -21.647 -5.106 13.604 1.00 16.60 N ATOM 1706 CA MET A 104 -21.809 -4.457 14.904 1.00 16.24 C ATOM 1707 C MET A 104 -21.981 -2.948 14.724 1.00 18.97 C ATOM 1708 O MET A 104 -22.909 -2.352 15.276 1.00 18.96 O ATOM 1709 CB MET A 104 -20.551 -4.698 15.709 1.00 17.16 C ATOM 1710 CG MET A 104 -20.542 -3.992 17.081 1.00 19.10 C ATOM 1711 SD MET A 104 -21.888 -4.498 18.237 1.00 18.29 S ATOM 1712 CE MET A 104 -21.236 -6.113 18.828 1.00 18.76 C ATOM 1713 H MET A 104 -20.888 -5.494 13.490 1.00 19.93 H ATOM 1714 HA MET A 104 -22.570 -4.830 15.376 1.00 19.44 H ATOM 1715 HB2 MET A 104 -20.459 -5.651 15.866 1.00 20.60 H ATOM 1716 HB3 MET A 104 -19.790 -4.373 15.204 1.00 20.60 H ATOM 1717 HG2 MET A 104 -19.697 -4.180 17.518 1.00 22.93 H ATOM 1718 HG3 MET A 104 -20.627 -3.037 16.936 1.00 22.93 H ATOM 1719 HE1 MET A 104 -21.128 -6.706 18.068 1.00 22.53 H ATOM 1720 HE2 MET A 104 -20.381 -5.969 19.261 1.00 22.53 H ATOM 1721 HE3 MET A 104 -21.866 -6.495 19.459 1.00 22.53 H ATOM 1722 N MET A 105 -21.150 -2.345 13.869 1.00 20.17 N ATOM 1723 CA MET A 105 -21.266 -0.907 13.651 1.00 19.07 C ATOM 1724 C MET A 105 -22.609 -0.568 13.034 1.00 20.28 C ATOM 1725 O MET A 105 -23.199 0.463 13.362 1.00 22.17 O ATOM 1726 CB MET A 105 -20.091 -0.373 12.813 1.00 19.62 C ATOM 1727 CG MET A 105 -18.738 -0.520 13.526 1.00 18.80 C ATOM 1728 SD MET A 105 -17.298 0.005 12.596 1.00 24.10 S ATOM 1729 CE MET A 105 -17.699 1.727 12.285 1.00 23.38 C ATOM 1730 H MET A 105 -20.531 -2.734 13.417 1.00 24.21 H ATOM 1731 HA MET A 105 -21.217 -0.469 14.515 1.00 22.84 H ATOM 1732 HB2 MET A 105 -20.046 -0.869 11.980 1.00 23.50 H ATOM 1733 HB3 MET A 105 -20.234 0.569 12.631 1.00 23.50 H ATOM 1734 HG2 MET A 105 -18.764 0.007 14.340 1.00 22.51 H ATOM 1735 HG3 MET A 105 -18.612 -1.455 13.752 1.00 22.51 H ATOM 1736 HE1 MET A 105 -16.979 2.132 11.777 1.00 28.07 H ATOM 1737 HE2 MET A 105 -18.526 1.772 11.781 1.00 28.07 H ATOM 1738 HE3 MET A 105 -17.803 2.185 13.134 1.00 28.07 H ATOM 1739 N HIS A 106 -23.127 -1.432 12.145 1.00 20.36 N ATOM 1740 CA HIS A 106 -24.461 -1.234 11.585 1.00 24.06 C ATOM 1741 C HIS A 106 -25.540 -1.279 12.675 1.00 24.82 C ATOM 1742 O HIS A 106 -26.361 -0.345 12.778 1.00 25.00 O ATOM 1743 CB HIS A 106 -24.740 -2.249 10.432 1.00 28.20 C ATOM 1744 CG HIS A 106 -26.163 -2.218 9.967 1.00 30.60 C ATOM 1745 CD2 HIS A 106 -27.228 -2.991 10.288 1.00 29.66 C ATOM 1746 ND1 HIS A 106 -26.647 -1.224 9.158 1.00 30.41 N ATOM 1747 CE1 HIS A 106 -27.945 -1.388 8.974 1.00 32.66 C ATOM 1748 NE2 HIS A 106 -28.325 -2.449 9.666 1.00 32.74 N ATOM 1749 H HIS A 106 -22.724 -2.133 11.854 1.00 24.39 H ATOM 1750 HA HIS A 106 -24.493 -0.347 11.194 1.00 28.88 H ATOM 1751 HB2 HIS A 106 -24.173 -2.032 9.676 1.00 33.85 H ATOM 1752 HB3 HIS A 106 -24.547 -3.146 10.747 1.00 33.85 H ATOM 1753 HD2 HIS A 106 -27.220 -3.738 10.843 1.00 35.61 H ATOM 1754 HE1 HIS A 106 -28.494 -0.854 8.446 1.00 39.20 H ATOM 1755 N ALA A 107 -25.517 -2.304 13.533 1.00 24.52 N ATOM 1756 CA ALA A 107 -26.505 -2.412 14.597 1.00 25.88 C ATOM 1757 C ALA A 107 -26.459 -1.179 15.487 1.00 24.05 C ATOM 1758 O ALA A 107 -27.484 -0.574 15.772 1.00 26.10 O ATOM 1759 CB ALA A 107 -26.253 -3.655 15.447 1.00 27.71 C ATOM 1760 H ALA A 107 -24.942 -2.943 13.517 1.00 29.44 H ATOM 1761 HA ALA A 107 -27.392 -2.479 14.209 1.00 31.07 H ATOM 1762 HB1 ALA A 107 -26.925 -3.701 16.146 1.00 33.26 H ATOM 1763 HB2 ALA A 107 -26.310 -4.441 14.881 1.00 33.26 H ATOM 1764 HB3 ALA A 107 -25.369 -3.594 15.841 1.00 33.26 H ATOM 1765 N LEU A 108 -25.269 -0.761 15.864 1.00 21.14 N ATOM 1766 CA LEU A 108 -25.177 0.436 16.728 1.00 21.14 C ATOM 1767 C LEU A 108 -25.647 1.725 16.054 1.00 24.42 C ATOM 1768 O LEU A 108 -26.045 2.665 16.757 1.00 26.02 O ATOM 1769 CB LEU A 108 -23.747 0.606 17.204 1.00 21.53 C ATOM 1770 CG LEU A 108 -23.214 -0.513 18.074 1.00 20.92 C ATOM 1771 CD1 LEU A 108 -21.725 -0.368 18.303 1.00 21.22 C ATOM 1772 CD2 LEU A 108 -24.016 -0.623 19.336 1.00 22.22 C ATOM 1773 H LEU A 108 -24.519 -1.123 15.652 1.00 25.38 H ATOM 1774 HA LEU A 108 -25.733 0.295 17.511 1.00 25.32 H ATOM 1775 HB2 LEU A 108 -23.170 0.670 16.426 1.00 25.84 H ATOM 1776 HB3 LEU A 108 -23.689 1.427 17.718 1.00 25.84 H ATOM 1777 HG LEU A 108 -23.340 -1.345 17.592 1.00 25.11 H ATOM 1778 HD11 LEU A 108 -21.555 0.480 18.744 1.00 25.47 H ATOM 1779 HD12 LEU A 108 -21.419 -1.099 18.862 1.00 25.47 H ATOM 1780 HD13 LEU A 108 -21.270 -0.393 17.447 1.00 25.47 H ATOM 1781 HD21 LEU A 108 -24.940 -0.809 19.108 1.00 26.67 H ATOM 1782 HD22 LEU A 108 -23.657 -1.345 19.876 1.00 26.67 H ATOM 1783 HD23 LEU A 108 -23.957 0.215 19.822 1.00 26.67 H ATOM 1784 N GLU A 109 -25.636 1.803 14.710 1.00 23.57 N ATOM 1785 CA GLU A 109 -26.160 2.986 14.006 1.00 29.54 C ATOM 1786 C GLU A 109 -27.675 2.963 13.916 1.00 31.65 C ATOM 1787 O GLU A 109 -28.323 4.043 13.933 1.00 34.54 O ATOM 1788 CB GLU A 109 -25.633 2.989 12.566 1.00 35.70 C ATOM 1789 CG GLU A 109 -24.182 3.423 12.355 1.00 45.35 C ATOM 1790 CD GLU A 109 -24.053 4.935 12.105 1.00 54.81 C ATOM 1791 OE1 GLU A 109 -25.016 5.677 12.390 1.00 58.05 O ATOM 1792 OE2 GLU A 109 -22.980 5.381 11.629 1.00 57.44 O1- ATOM 1793 H GLU A 109 -25.333 1.189 14.190 1.00 28.24 H ATOM 1794 HA GLU A 109 -25.876 3.798 14.453 1.00 35.45 H ATOM 1795 HB2 GLU A 109 -25.716 2.089 12.213 1.00 42.85 H ATOM 1796 HB3 GLU A 109 -26.189 3.589 12.044 1.00 42.85 H ATOM 1797 HG2 GLU A 109 -23.667 3.203 13.146 1.00 54.44 H ATOM 1798 HG3 GLU A 109 -23.821 2.959 11.583 1.00 54.44 H ATOM 1799 N VAL A 110 -28.226 1.748 13.897 1.00 38.61 N ATOM 1800 CA VAL A 110 -29.635 1.434 13.722 1.00 43.86 C ATOM 1801 C VAL A 110 -30.385 1.580 15.035 1.00 45.66 C ATOM 1802 O VAL A 110 -31.553 1.972 15.039 1.00 47.84 O ATOM 1803 CB VAL A 110 -29.689 -0.020 13.197 1.00 48.47 C ATOM 1804 CG1 VAL A 110 -31.054 -0.635 13.340 1.00 49.91 C ATOM 1805 CG2 VAL A 110 -29.283 -0.046 11.741 1.00 51.85 C ATOM 1806 H VAL A 110 -27.754 1.036 13.993 1.00 46.35 H ATOM 1807 HA VAL A 110 -30.030 2.026 13.063 1.00 52.65 H ATOM 1808 HB VAL A 110 -29.059 -0.563 13.696 1.00 58.18 H ATOM 1809 HG11 VAL A 110 -31.028 -1.542 12.996 1.00 59.90 H ATOM 1810 HG12 VAL A 110 -31.300 -0.643 14.278 1.00 59.90 H ATOM 1811 HG13 VAL A 110 -31.692 -0.107 12.835 1.00 59.90 H ATOM 1812 HG21 VAL A 110 -29.320 -0.961 11.420 1.00 62.23 H ATOM 1813 HG22 VAL A 110 -29.896 0.507 11.232 1.00 62.23 H ATOM 1814 HG23 VAL A 110 -28.380 0.298 11.658 1.00 62.23 H ATOM 1815 N LEU A 111 -29.736 1.265 16.149 1.00 39.71 N ATOM 1816 CA LEU A 111 -30.358 1.292 17.463 1.00 40.15 C ATOM 1817 C LEU A 111 -30.752 2.694 17.847 1.00 45.87 C ATOM 1818 O LEU A 111 -30.048 3.672 17.535 1.00 47.28 O ATOM 1819 CB LEU A 111 -29.407 0.709 18.523 1.00 34.80 C ATOM 1820 CG LEU A 111 -29.354 -0.800 18.496 1.00 33.66 C ATOM 1821 CD1 LEU A 111 -28.172 -1.318 19.279 1.00 30.76 C ATOM 1822 CD2 LEU A 111 -30.670 -1.371 19.007 1.00 36.61 C ATOM 1823 OXT LEU A 111 -31.785 2.825 18.496 1.00 48.83 O1- ATOM 1824 H LEU A 111 -28.911 1.025 16.168 1.00 47.66 H ATOM 1825 HA LEU A 111 -31.161 0.747 17.446 1.00 48.19 H ATOM 1826 HB2 LEU A 111 -28.511 1.043 18.360 1.00 41.77 H ATOM 1827 HB3 LEU A 111 -29.709 0.982 19.403 1.00 41.77 H ATOM 1828 HG LEU A 111 -29.246 -1.089 17.577 1.00 40.40 H ATOM 1829 HD11 LEU A 111 -28.250 -1.023 20.200 1.00 36.93 H ATOM 1830 HD12 LEU A 111 -28.169 -2.287 19.241 1.00 36.93 H ATOM 1831 HD13 LEU A 111 -27.356 -0.969 18.887 1.00 36.93 H ATOM 1832 HD21 LEU A 111 -30.623 -2.340 18.985 1.00 43.94 H ATOM 1833 HD22 LEU A 111 -30.814 -1.068 19.917 1.00 43.94 H ATOM 1834 HD23 LEU A 111 -31.391 -1.062 18.437 1.00 43.94 H TER HETATM 1835 CL 8V2 A 201 -13.569 -3.675 26.664 1.00 19.22 CL HETATM 1836 C1 8V2 A 201 -3.395 -12.457 26.096 1.00 33.23 C HETATM 1837 N1 8V2 A 201 -4.266 -10.878 24.381 1.00 24.88 N HETATM 1838 O1 8V2 A 201 -4.368 -12.262 26.845 1.00 32.43 O HETATM 1839 C2 8V2 A 201 -3.335 -11.992 24.749 1.00 26.93 C HETATM 1840 N2 8V2 A 201 -5.132 -7.304 24.624 1.00 22.84 N HETATM 1841 O2 8V2 A 201 -2.194 -12.961 26.540 1.00 33.98 O HETATM 1842 C3 8V2 A 201 -3.691 -13.029 23.703 1.00 29.37 C HETATM 1843 N3 8V2 A 201 -6.166 -5.479 27.601 1.00 21.11 N HETATM 1844 O3 8V2 A 201 -8.127 -5.803 26.740 1.00 20.08 O HETATM 1845 C4 8V2 A 201 -5.195 -12.895 23.628 1.00 29.39 C HETATM 1846 N4 8V2 A 201 -10.589 -1.105 28.609 1.00 29.11 N HETATM 1847 O4 8V2 A 201 -8.270 -2.753 27.544 1.00 28.53 O HETATM 1848 C5 8V2 A 201 -5.316 -11.349 23.418 1.00 27.05 C HETATM 1849 N5 8V2 A 201 -9.350 -4.323 28.769 1.00 18.96 N HETATM 1850 O5 8V2 A 201 -12.719 -1.173 29.471 1.00 40.22 O HETATM 1851 C6 8V2 A 201 -5.165 -10.745 22.110 1.00 24.52 C HETATM 1852 O6 8V2 A 201 -5.834 -7.995 26.601 1.00 21.73 O HETATM 1853 C7 8V2 A 201 -4.810 -9.426 21.791 1.00 23.35 C HETATM 1854 O7 8V2 A 201 -3.320 -9.229 25.460 1.00 22.79 O HETATM 1855 C8 8V2 A 201 -4.470 -8.377 22.646 1.00 25.58 C HETATM 1856 C9 8V2 A 201 -4.042 -5.294 26.729 1.00 26.06 C HETATM 1857 C10 8V2 A 201 -5.463 -5.703 26.334 1.00 24.31 C HETATM 1858 C11 8V2 A 201 -9.328 -3.133 28.082 1.00 24.22 C HETATM 1859 C12 8V2 A 201 -10.663 -2.406 27.860 1.00 22.04 C HETATM 1860 C13 8V2 A 201 -10.921 -2.169 26.341 1.00 17.34 C HETATM 1861 C14 8V2 A 201 -12.078 -1.487 26.070 1.00 14.48 C HETATM 1862 C15 8V2 A 201 -13.339 -2.046 26.119 1.00 12.79 C HETATM 1863 C16 8V2 A 201 -11.988 -0.161 25.573 1.00 15.20 C HETATM 1864 C17 8V2 A 201 -13.176 0.522 25.287 1.00 13.93 C HETATM 1865 C18 8V2 A 201 -14.412 -0.067 25.354 1.00 13.06 C HETATM 1866 C19 8V2 A 201 -14.512 -1.390 25.797 1.00 13.60 C HETATM 1867 C20 8V2 A 201 -5.489 -7.056 25.862 1.00 23.31 C HETATM 1868 C21 8V2 A 201 -5.093 -8.624 24.031 1.00 22.52 C HETATM 1869 C22 8V2 A 201 -4.717 -6.287 23.554 1.00 26.26 C HETATM 1870 C23 8V2 A 201 -5.100 -7.058 22.338 1.00 25.66 C HETATM 1871 C24 8V2 A 201 -4.242 -4.206 27.766 1.00 25.98 C HETATM 1872 C25 8V2 A 201 -4.208 -9.589 24.646 1.00 22.89 C HETATM 1873 C26 8V2 A 201 -7.286 -4.292 29.757 1.00 23.20 C HETATM 1874 C27 8V2 A 201 -5.224 -4.987 28.661 1.00 24.72 C HETATM 1875 C28 8V2 A 201 -5.900 -4.209 29.594 1.00 25.09 C HETATM 1876 C29 8V2 A 201 -9.931 -6.019 30.214 1.00 20.38 C HETATM 1877 C30 8V2 A 201 -10.497 -4.976 29.258 1.00 20.27 C HETATM 1878 C31 8V2 A 201 -7.487 -5.446 27.714 1.00 18.99 C HETATM 1879 C32 8V2 A 201 -11.596 -0.669 29.388 1.00 38.13 C HETATM 1880 C33 8V2 A 201 -11.302 0.634 30.149 1.00 40.91 C HETATM 1881 C34 8V2 A 201 -8.714 -6.385 29.549 1.00 17.43 C HETATM 1882 C35 8V2 A 201 -8.117 -5.085 28.921 1.00 19.86 C HETATM 1883 C87 8V2 A 201 -2.326 -14.338 26.915 1.00 39.93 C HETATM 1884 H5 8V2 A 201 -6.317 -11.060 23.739 1.00 32.47 H HETATM 1885 H6 8V2 A 201 -5.417 -11.384 21.263 1.00 29.43 H HETATM 1886 H7 8V2 A 201 -4.805 -9.186 20.728 1.00 28.02 H HETATM 1887 H8 8V2 A 201 -3.393 -8.240 22.739 1.00 30.71 H HETATM 1888 H10 8V2 A 201 -5.873 -5.003 25.606 1.00 29.18 H HETATM 1889 H12 8V2 A 201 -11.476 -3.010 28.266 1.00 26.46 H HETATM 1890 H13 8V2 A 201 -10.084 -1.610 25.926 1.00 20.82 H HETATM 1891 H16 8V2 A 201 -11.024 0.343 25.499 1.00 18.25 H HETATM 1892 H17 8V2 A 201 -13.110 1.547 24.923 1.00 16.72 H HETATM 1893 H18 8V2 A 201 -15.308 0.500 25.102 1.00 15.68 H HETATM 1894 H19 8V2 A 201 -15.480 -1.882 25.896 1.00 16.33 H HETATM 1895 H21 8V2 A 201 -6.115 -8.975 23.883 1.00 27.03 H HETATM 1896 H22 8V2 A 201 -3.635 -6.145 23.592 1.00 31.53 H HETATM 1897 H23 8V2 A 201 -4.749 -6.598 21.411 1.00 30.80 H HETATM 1898 H24 8V2 A 201 -3.336 -3.887 28.287 1.00 31.18 H HETATM 1899 H25 8V2 A 201 -2.295 -11.695 24.616 1.00 32.32 H HETATM 1900 H26 8V2 A 201 -7.760 -3.635 30.486 1.00 27.85 H HETATM 1901 H27 8V2 A 201 -4.766 -5.851 29.142 1.00 29.67 H HETATM 1902 H28 8V2 A 201 -5.330 -3.536 30.234 1.00 30.12 H HETATM 1903 H29 8V2 A 201 -9.509 -5.575 31.065 1.00 24.47 H HETATM 1904 H30 8V2 A 201 -10.923 -5.509 28.404 1.00 24.34 H HETATM 1905 H31 8V2 A 201 -3.325 -12.693 22.731 1.00 35.26 H HETATM 1906 H32 8V2 A 201 -3.304 -14.026 23.923 1.00 35.26 H HETATM 1907 H33 8V2 A 201 -10.893 0.396 31.131 1.00 49.10 H HETATM 1908 H34 8V2 A 201 -12.225 1.202 30.267 1.00 49.10 H HETATM 1909 H35 8V2 A 201 -10.579 1.227 29.588 1.00 49.10 H HETATM 1910 H36 8V2 A 201 -10.971 -3.139 25.850 1.00 20.82 H HETATM 1911 H37 8V2 A 201 -11.252 -4.319 29.697 1.00 24.34 H HETATM 1912 H38 8V2 A 201 -10.462 -6.901 30.412 1.00 24.47 H HETATM 1913 H39 8V2 A 201 -9.089 -6.950 28.692 1.00 20.93 H HETATM 1914 H41 8V2 A 201 -5.701 -13.482 22.860 1.00 35.27 H HETATM 1915 H42 8V2 A 201 -5.575 -13.157 24.617 1.00 35.27 H HETATM 1916 H43 8V2 A 201 -9.714 -0.621 28.620 1.00 34.95 H HETATM 1917 H4A 8V2 A 201 -8.011 -7.014 30.100 1.00 20.93 H HETATM 1918 H4B 8V2 A 201 -4.744 -3.352 27.306 1.00 31.18 H HETATM 1919 H87 8V2 A 201 -1.363 -14.714 27.262 1.00 47.92 H HETATM 1920 H91 8V2 A 201 -3.598 -6.120 27.286 1.00 31.28 H HETATM 1921 H92 8V2 A 201 -3.406 -5.041 25.879 1.00 31.28 H HETATM 1922 H93 8V2 A 201 -5.234 -5.329 23.635 1.00 31.53 H HETATM 1923 H94 8V2 A 201 -6.185 -7.178 22.312 1.00 30.80 H HETATM 1924 H95 8V2 A 201 -2.652 -14.919 26.053 1.00 47.92 H HETATM 1925 H96 8V2 A 201 -3.061 -14.428 27.714 1.00 47.92 H HETATM 1926 O1 SO4 A 202 -24.071 -23.530 12.620 1.00 84.32 O HETATM 1927 O2 SO4 A 202 -24.625 -21.271 13.186 1.00 79.92 O HETATM 1928 O3 SO4 A 202 -25.304 -23.061 14.590 1.00 82.11 O1- HETATM 1929 O4 SO4 A 202 -23.001 -22.526 14.470 1.00 80.71 O HETATM 1930 S SO4 A 202 -24.247 -22.581 13.717 1.00 81.26 S HETATM 1931 N ANO3 A 203 -18.205 -18.528 10.547 0.65 25.20 N HETATM 1932 N BNO3 A 203 -17.731 -18.793 10.621 0.35 25.93 N HETATM 1933 O1 ANO3 A 203 -19.317 -18.627 9.990 0.65 25.76 O HETATM 1934 O1 BNO3 A 203 -17.887 -19.332 11.750 0.35 24.96 O HETATM 1935 O2 ANO3 A 203 -17.474 -17.607 10.189 0.65 25.18 O HETATM 1936 O2 BNO3 A 203 -18.538 -17.919 10.205 0.35 24.45 O HETATM 1937 O3 ANO3 A 203 -17.818 -19.303 11.499 0.65 24.24 O HETATM 1938 O3 BNO3 A 203 -16.740 -19.145 9.935 0.35 25.42 O HETATM 1939 C1 GOL A 204 -23.386 -18.427 27.273 1.00 43.67 C HETATM 1940 O1 GOL A 204 -24.577 -17.724 27.543 1.00 43.41 O HETATM 1941 C2 GOL A 204 -22.894 -19.042 28.563 1.00 46.93 C HETATM 1942 O2 GOL A 204 -23.768 -20.082 28.958 1.00 47.31 O HETATM 1943 C3 GOL A 204 -21.494 -19.622 28.436 1.00 50.10 C HETATM 1944 O3 GOL A 204 -21.201 -20.382 29.591 1.00 51.87 O HETATM 1945 HO1 GOL A 204 -24.875 -17.264 26.730 1.00 52.10 H HETATM 1946 HO2 GOL A 204 -23.748 -20.798 28.289 1.00 56.78 H HETATM 1947 HO3 GOL A 204 -20.270 -20.229 29.856 1.00 62.25 H HETATM 1948 H2 GOL A 204 -22.878 -18.268 29.330 1.00 56.33 H HETATM 1949 H11 GOL A 204 -23.573 -19.208 26.536 1.00 52.42 H HETATM 1950 H12 GOL A 204 -22.634 -17.747 26.874 1.00 52.42 H HETATM 1951 H31 GOL A 204 -21.434 -20.256 27.551 1.00 60.13 H HETATM 1952 H32 GOL A 204 -20.768 -18.816 28.329 1.00 60.13 H CONECT 1835 1862 CONECT 1836 1838 1839 1841 CONECT 1837 1839 1848 1872 CONECT 1838 1836 CONECT 1839 1836 1837 1842 1899 CONECT 1840 1867 1868 1869 CONECT 1841 1836 1883 CONECT 1842 1839 1845 1905 1906 CONECT 1843 1857 1874 1878 CONECT 1844 1878 CONECT 1845 1842 1848 1914 1915 CONECT 1846 1859 1879 1916 CONECT 1847 1858 CONECT 1848 1837 1845 1851 1884 CONECT 1849 1858 1877 1882 CONECT 1850 1879 CONECT 1851 1848 1853 1885 CONECT 1852 1867 CONECT 1853 1851 1855 1886 CONECT 1854 1872 CONECT 1855 1853 1868 1870 1887 CONECT 1856 1857 1871 1920 1921 CONECT 1857 1843 1856 1867 1888 CONECT 1858 1847 1849 1859 CONECT 1859 1846 1858 1860 1889 CONECT 1860 1859 1861 1890 1910 CONECT 1861 1860 1862 1863 CONECT 1862 1835 1861 1866 CONECT 1863 1861 1864 1891 CONECT 1864 1863 1865 1892 CONECT 1865 1864 1866 1893 CONECT 1866 1862 1865 1894 CONECT 1867 1840 1852 1857 CONECT 1868 1840 1855 1872 1895 CONECT 1869 1840 1870 1896 1922 CONECT 1870 1855 1869 1897 1923 CONECT 1871 1856 1874 1898 1918 CONECT 1872 1837 1854 1868 CONECT 1873 1875 1882 1900 CONECT 1874 1843 1871 1875 1901 CONECT 1875 1873 1874 1902 CONECT 1876 1877 1881 1903 1912 CONECT 1877 1849 1876 1904 1911 CONECT 1878 1843 1844 1882 CONECT 1879 1846 1850 1880 CONECT 1880 1879 1907 1908 1909 CONECT 1881 1876 1882 1913 1917 CONECT 1882 1849 1873 1878 1881 CONECT 1883 1841 1919 1924 1925 CONECT 1884 1848 CONECT 1885 1851 CONECT 1886 1853 CONECT 1887 1855 CONECT 1888 1857 CONECT 1889 1859 CONECT 1890 1860 CONECT 1891 1863 CONECT 1892 1864 CONECT 1893 1865 CONECT 1894 1866 CONECT 1895 1868 CONECT 1896 1869 CONECT 1897 1870 CONECT 1898 1871 CONECT 1899 1839 CONECT 1900 1873 CONECT 1901 1874 CONECT 1902 1875 CONECT 1903 1876 CONECT 1904 1877 CONECT 1905 1842 CONECT 1906 1842 CONECT 1907 1880 CONECT 1908 1880 CONECT 1909 1880 CONECT 1910 1860 CONECT 1911 1877 CONECT 1912 1876 CONECT 1913 1881 CONECT 1914 1845 CONECT 1915 1845 CONECT 1916 1846 CONECT 1917 1881 CONECT 1918 1871 CONECT 1919 1883 CONECT 1920 1856 CONECT 1921 1856 CONECT 1922 1869 CONECT 1923 1870 CONECT 1924 1883 CONECT 1925 1883 CONECT 1926 1930 CONECT 1927 1930 CONECT 1928 1930 CONECT 1929 1930 CONECT 1930 1926 1927 1928 1929 CONECT 1931 1933 1935 1937 CONECT 1932 1934 1936 1938 CONECT 1933 1931 CONECT 1934 1932 CONECT 1935 1931 CONECT 1936 1932 CONECT 1937 1931 CONECT 1938 1932 CONECT 1939 1940 1941 1949 1950 CONECT 1940 1939 1945 CONECT 1941 1939 1942 1943 1948 CONECT 1942 1941 1946 CONECT 1943 1941 1944 1951 1952 CONECT 1944 1943 1947 CONECT 1945 1940 CONECT 1946 1942 CONECT 1947 1944 CONECT 1948 1941 CONECT 1949 1939 CONECT 1950 1939 CONECT 1951 1943 CONECT 1952 1943 END