ATOM 1 N GLY A 1 -14.290 7.912 10.255 1.00 2.35 N ATOM 2 CA GLY A 1 -13.600 8.389 9.024 1.00 1.58 C ATOM 3 C GLY A 1 -13.624 7.360 7.912 1.00 1.16 C ATOM 4 O GLY A 1 -12.577 7.018 7.352 1.00 1.12 O ATOM 5 H1 GLY A 1 -15.286 7.699 10.046 1.00 2.47 H ATOM 6 H2 GLY A 1 -14.251 8.644 10.993 1.00 2.69 H ATOM 7 H3 GLY A 1 -13.829 7.051 10.612 1.00 2.71 H ATOM 8 HA2 GLY A 1 -14.088 9.289 8.678 1.00 1.50 H ATOM 9 HA3 GLY A 1 -12.573 8.619 9.266 1.00 1.88 H ATOM 10 N ILE A 2 -14.833 6.880 7.580 1.00 1.20 N ATOM 11 CA ILE A 2 -15.030 5.868 6.523 1.00 1.08 C ATOM 12 C ILE A 2 -14.648 6.428 5.142 1.00 1.43 C ATOM 13 O ILE A 2 -14.024 5.730 4.339 1.00 2.45 O ATOM 14 CB ILE A 2 -16.500 5.334 6.473 1.00 1.15 C ATOM 15 CG1 ILE A 2 -17.107 5.202 7.879 1.00 1.40 C ATOM 16 CG2 ILE A 2 -16.564 3.981 5.766 1.00 1.45 C ATOM 17 CD1 ILE A 2 -17.926 6.402 8.304 1.00 1.69 C ATOM 18 H ILE A 2 -15.618 7.217 8.058 1.00 1.54 H ATOM 19 HA ILE A 2 -14.378 5.035 6.746 1.00 1.12 H ATOM 20 HB ILE A 2 -17.091 6.035 5.901 1.00 1.36 H ATOM 21 HG12 ILE A 2 -17.751 4.336 7.905 1.00 1.59 H ATOM 22 HG13 ILE A 2 -16.310 5.072 8.597 1.00 1.58 H ATOM 23 HG21 ILE A 2 -17.587 3.635 5.744 1.00 1.73 H ATOM 24 HG22 ILE A 2 -15.954 3.267 6.299 1.00 1.49 H ATOM 25 HG23 ILE A 2 -16.197 4.085 4.756 1.00 1.68 H ATOM 26 HD11 ILE A 2 -18.789 6.494 7.660 1.00 2.05 H ATOM 27 HD12 ILE A 2 -17.325 7.295 8.228 1.00 1.74 H ATOM 28 HD13 ILE A 2 -18.252 6.272 9.325 1.00 1.76 H ATOM 29 N GLY A 3 -15.015 7.697 4.893 1.00 1.01 N ATOM 30 CA GLY A 3 -14.712 8.354 3.619 1.00 1.23 C ATOM 31 C GLY A 3 -13.229 8.652 3.434 1.00 0.93 C ATOM 32 O GLY A 3 -12.717 8.591 2.310 1.00 1.16 O ATOM 33 H GLY A 3 -15.499 8.194 5.585 1.00 1.23 H ATOM 34 HA2 GLY A 3 -15.039 7.715 2.813 1.00 1.67 H ATOM 35 HA3 GLY A 3 -15.262 9.282 3.570 1.00 1.55 H ATOM 36 N ALA A 4 -12.541 8.963 4.546 1.00 0.96 N ATOM 37 CA ALA A 4 -11.106 9.268 4.528 1.00 0.91 C ATOM 38 C ALA A 4 -10.269 8.004 4.299 1.00 0.91 C ATOM 39 O ALA A 4 -9.394 7.985 3.426 1.00 1.37 O ATOM 40 CB ALA A 4 -10.694 9.959 5.823 1.00 1.32 C ATOM 41 H ALA A 4 -13.017 8.989 5.402 1.00 1.33 H ATOM 42 HA ALA A 4 -10.926 9.954 3.712 1.00 1.01 H ATOM 43 HB1 ALA A 4 -9.666 10.281 5.749 1.00 1.53 H ATOM 44 HB2 ALA A 4 -10.796 9.269 6.647 1.00 1.55 H ATOM 45 HB3 ALA A 4 -11.329 10.817 5.991 1.00 1.62 H ATOM 46 N VAL A 5 -10.566 6.939 5.069 1.00 0.84 N ATOM 47 CA VAL A 5 -9.849 5.654 4.949 1.00 0.86 C ATOM 48 C VAL A 5 -10.144 4.996 3.587 1.00 0.72 C ATOM 49 O VAL A 5 -9.304 4.270 3.051 1.00 0.86 O ATOM 50 CB VAL A 5 -10.206 4.668 6.112 1.00 1.06 C ATOM 51 CG1 VAL A 5 -9.338 3.410 6.073 1.00 1.28 C ATOM 52 CG2 VAL A 5 -10.062 5.342 7.473 1.00 1.11 C ATOM 53 H VAL A 5 -11.284 7.020 5.732 1.00 1.11 H ATOM 54 HA VAL A 5 -8.790 5.868 5.003 1.00 0.96 H ATOM 55 HB VAL A 5 -11.237 4.366 5.994 1.00 1.11 H ATOM 56 HG11 VAL A 5 -9.570 2.785 6.924 1.00 1.45 H ATOM 57 HG12 VAL A 5 -8.295 3.690 6.107 1.00 1.25 H ATOM 58 HG13 VAL A 5 -9.534 2.864 5.163 1.00 1.33 H ATOM 59 HG21 VAL A 5 -10.748 6.174 7.538 1.00 1.32 H ATOM 60 HG22 VAL A 5 -9.050 5.700 7.592 1.00 1.19 H ATOM 61 HG23 VAL A 5 -10.285 4.629 8.254 1.00 1.46 H ATOM 62 N LEU A 6 -11.332 5.283 3.031 1.00 0.63 N ATOM 63 CA LEU A 6 -11.747 4.737 1.732 1.00 0.66 C ATOM 64 C LEU A 6 -11.040 5.457 0.576 1.00 0.68 C ATOM 65 O LEU A 6 -10.630 4.818 -0.396 1.00 1.05 O ATOM 66 CB LEU A 6 -13.273 4.849 1.573 1.00 0.80 C ATOM 67 CG LEU A 6 -13.922 3.895 0.556 1.00 0.91 C ATOM 68 CD1 LEU A 6 -14.106 2.501 1.148 1.00 1.08 C ATOM 69 CD2 LEU A 6 -15.259 4.453 0.089 1.00 1.13 C ATOM 70 H LEU A 6 -11.946 5.880 3.509 1.00 0.71 H ATOM 71 HA LEU A 6 -11.469 3.693 1.711 1.00 0.75 H ATOM 72 HB2 LEU A 6 -13.725 4.668 2.537 1.00 0.88 H ATOM 73 HB3 LEU A 6 -13.504 5.862 1.276 1.00 0.89 H ATOM 74 HG LEU A 6 -13.278 3.807 -0.307 1.00 1.10 H ATOM 75 HD11 LEU A 6 -14.591 1.863 0.424 1.00 1.22 H ATOM 76 HD12 LEU A 6 -14.715 2.565 2.037 1.00 1.49 H ATOM 77 HD13 LEU A 6 -13.141 2.088 1.402 1.00 1.18 H ATOM 78 HD21 LEU A 6 -15.918 4.567 0.937 1.00 1.24 H ATOM 79 HD22 LEU A 6 -15.704 3.775 -0.624 1.00 1.27 H ATOM 80 HD23 LEU A 6 -15.104 5.415 -0.378 1.00 1.31 H ATOM 81 N LYS A 7 -10.886 6.786 0.703 1.00 0.57 N ATOM 82 CA LYS A 7 -10.228 7.603 -0.331 1.00 0.64 C ATOM 83 C LYS A 7 -8.704 7.423 -0.330 1.00 0.66 C ATOM 84 O LYS A 7 -8.050 7.677 -1.345 1.00 0.74 O ATOM 85 CB LYS A 7 -10.579 9.083 -0.156 1.00 0.73 C ATOM 86 CG LYS A 7 -11.998 9.429 -0.583 1.00 1.05 C ATOM 87 CD LYS A 7 -12.174 10.928 -0.781 1.00 1.19 C ATOM 88 CE LYS A 7 -13.574 11.273 -1.272 1.00 1.59 C ATOM 89 NZ LYS A 7 -13.824 10.784 -2.660 1.00 1.52 N1+ ATOM 90 H LYS A 7 -11.225 7.227 1.510 1.00 0.69 H ATOM 91 HA LYS A 7 -10.605 7.273 -1.287 1.00 0.70 H ATOM 92 HB2 LYS A 7 -10.464 9.348 0.885 1.00 0.78 H ATOM 93 HB3 LYS A 7 -9.895 9.675 -0.746 1.00 0.92 H ATOM 94 HG2 LYS A 7 -12.217 8.926 -1.513 1.00 1.52 H ATOM 95 HG3 LYS A 7 -12.685 9.093 0.180 1.00 1.25 H ATOM 96 HD2 LYS A 7 -12.002 11.427 0.161 1.00 1.19 H ATOM 97 HD3 LYS A 7 -11.453 11.271 -1.508 1.00 1.49 H ATOM 98 HE2 LYS A 7 -14.295 10.821 -0.608 1.00 1.94 H ATOM 99 HE3 LYS A 7 -13.692 12.347 -1.252 1.00 2.19 H ATOM 100 HZ1 LYS A 7 -14.787 11.036 -2.961 1.00 2.02 H ATOM 101 HZ2 LYS A 7 -13.721 9.750 -2.697 1.00 1.72 H ATOM 102 HZ3 LYS A 7 -13.142 11.212 -3.319 1.00 1.75 H ATOM 103 N VAL A 8 -8.149 6.988 0.813 1.00 0.65 N ATOM 104 CA VAL A 8 -6.700 6.748 0.937 1.00 0.75 C ATOM 105 C VAL A 8 -6.374 5.281 0.586 1.00 0.73 C ATOM 106 O VAL A 8 -5.236 4.963 0.227 1.00 1.09 O ATOM 107 CB VAL A 8 -6.167 7.100 2.367 1.00 0.88 C ATOM 108 CG1 VAL A 8 -4.652 6.915 2.476 1.00 0.99 C ATOM 109 CG2 VAL A 8 -6.529 8.532 2.749 1.00 0.86 C ATOM 110 H VAL A 8 -8.725 6.823 1.588 1.00 0.62 H ATOM 111 HA VAL A 8 -6.201 7.390 0.223 1.00 0.81 H ATOM 112 HB VAL A 8 -6.637 6.435 3.076 1.00 0.96 H ATOM 113 HG11 VAL A 8 -4.323 7.206 3.463 1.00 1.09 H ATOM 114 HG12 VAL A 8 -4.159 7.531 1.737 1.00 0.94 H ATOM 115 HG13 VAL A 8 -4.402 5.878 2.304 1.00 1.05 H ATOM 116 HG21 VAL A 8 -7.603 8.651 2.722 1.00 1.28 H ATOM 117 HG22 VAL A 8 -6.074 9.218 2.049 1.00 1.02 H ATOM 118 HG23 VAL A 8 -6.168 8.742 3.745 1.00 1.30 H ATOM 119 N LEU A 9 -7.385 4.404 0.686 1.00 0.61 N ATOM 120 CA LEU A 9 -7.221 2.978 0.378 1.00 0.66 C ATOM 121 C LEU A 9 -7.596 2.653 -1.076 1.00 0.63 C ATOM 122 O LEU A 9 -7.313 1.551 -1.557 1.00 0.80 O ATOM 123 CB LEU A 9 -8.070 2.133 1.340 1.00 0.82 C ATOM 124 CG LEU A 9 -7.315 1.484 2.515 1.00 0.99 C ATOM 125 CD1 LEU A 9 -6.879 2.523 3.547 1.00 1.17 C ATOM 126 CD2 LEU A 9 -8.184 0.422 3.172 1.00 1.19 C ATOM 127 H LEU A 9 -8.264 4.728 0.977 1.00 0.78 H ATOM 128 HA LEU A 9 -6.182 2.730 0.527 1.00 0.73 H ATOM 129 HB2 LEU A 9 -8.844 2.766 1.749 1.00 0.84 H ATOM 130 HB3 LEU A 9 -8.541 1.346 0.770 1.00 0.90 H ATOM 131 HG LEU A 9 -6.427 0.999 2.137 1.00 1.16 H ATOM 132 HD11 LEU A 9 -6.534 2.022 4.439 1.00 1.48 H ATOM 133 HD12 LEU A 9 -7.715 3.161 3.792 1.00 1.24 H ATOM 134 HD13 LEU A 9 -6.078 3.121 3.140 1.00 1.43 H ATOM 135 HD21 LEU A 9 -9.087 0.878 3.549 1.00 1.29 H ATOM 136 HD22 LEU A 9 -7.642 -0.033 3.988 1.00 1.33 H ATOM 137 HD23 LEU A 9 -8.441 -0.334 2.444 1.00 1.33 H ATOM 138 N THR A 10 -8.224 3.616 -1.769 1.00 0.58 N ATOM 139 CA THR A 10 -8.635 3.433 -3.169 1.00 0.70 C ATOM 140 C THR A 10 -7.545 3.871 -4.153 1.00 0.70 C ATOM 141 O THR A 10 -7.454 3.329 -5.258 1.00 0.88 O ATOM 142 CB THR A 10 -9.932 4.204 -3.496 1.00 0.82 C ATOM 143 OG1 THR A 10 -9.905 5.504 -2.893 1.00 0.97 O ATOM 144 CG2 THR A 10 -11.159 3.437 -3.022 1.00 1.05 C ATOM 145 H THR A 10 -8.414 4.470 -1.327 1.00 0.61 H ATOM 146 HA THR A 10 -8.827 2.380 -3.317 1.00 0.80 H ATOM 147 HB THR A 10 -9.996 4.321 -4.568 1.00 0.97 H ATOM 148 HG1 THR A 10 -9.898 6.175 -3.579 1.00 1.15 H ATOM 149 HG21 THR A 10 -12.051 3.984 -3.292 1.00 1.35 H ATOM 150 HG22 THR A 10 -11.120 3.322 -1.949 1.00 1.45 H ATOM 151 HG23 THR A 10 -11.178 2.463 -3.488 1.00 1.46 H ATOM 152 N THR A 11 -6.726 4.851 -3.746 1.00 0.59 N ATOM 153 CA THR A 11 -5.642 5.370 -4.590 1.00 0.70 C ATOM 154 C THR A 11 -4.331 4.617 -4.355 1.00 0.80 C ATOM 155 O THR A 11 -3.657 4.225 -5.313 1.00 1.51 O ATOM 156 CB THR A 11 -5.405 6.879 -4.355 1.00 0.65 C ATOM 157 OG1 THR A 11 -5.369 7.162 -2.951 1.00 0.51 O ATOM 158 CG2 THR A 11 -6.490 7.717 -5.021 1.00 0.76 C ATOM 159 H THR A 11 -6.855 5.235 -2.853 1.00 0.51 H ATOM 160 HA THR A 11 -5.937 5.234 -5.621 1.00 0.88 H ATOM 161 HB THR A 11 -4.452 7.146 -4.789 1.00 0.76 H ATOM 162 HG1 THR A 11 -5.680 6.397 -2.461 1.00 0.97 H ATOM 163 HG21 THR A 11 -6.333 8.759 -4.788 1.00 1.28 H ATOM 164 HG22 THR A 11 -7.459 7.408 -4.655 1.00 1.01 H ATOM 165 HG23 THR A 11 -6.448 7.577 -6.091 1.00 1.16 H ATOM 166 N GLY A 12 -3.981 4.421 -3.078 1.00 0.88 N ATOM 167 CA GLY A 12 -2.757 3.717 -2.727 1.00 0.94 C ATOM 168 C GLY A 12 -3.007 2.273 -2.342 1.00 0.89 C ATOM 169 O GLY A 12 -3.368 1.985 -1.197 1.00 0.98 O ATOM 170 H GLY A 12 -4.563 4.762 -2.368 1.00 1.39 H ATOM 171 HA2 GLY A 12 -2.086 3.742 -3.573 1.00 1.07 H ATOM 172 HA3 GLY A 12 -2.289 4.224 -1.896 1.00 0.97 H ATOM 173 N LEU A 13 -2.815 1.368 -3.307 1.00 0.80 N ATOM 174 CA LEU A 13 -3.014 -0.065 -3.086 1.00 0.75 C ATOM 175 C LEU A 13 -1.758 -0.880 -3.466 1.00 0.67 C ATOM 176 O LEU A 13 -1.333 -1.721 -2.668 1.00 0.63 O ATOM 177 CB LEU A 13 -4.240 -0.573 -3.865 1.00 0.84 C ATOM 178 CG LEU A 13 -5.122 -1.596 -3.132 1.00 0.93 C ATOM 179 CD1 LEU A 13 -6.534 -1.575 -3.696 1.00 1.50 C ATOM 180 CD2 LEU A 13 -4.535 -3.000 -3.240 1.00 1.20 C ATOM 181 H LEU A 13 -2.530 1.675 -4.193 1.00 0.80 H ATOM 182 HA LEU A 13 -3.196 -0.202 -2.031 1.00 0.77 H ATOM 183 HB2 LEU A 13 -4.853 0.278 -4.120 1.00 1.04 H ATOM 184 HB3 LEU A 13 -3.894 -1.030 -4.780 1.00 0.87 H ATOM 185 HG LEU A 13 -5.177 -1.334 -2.085 1.00 1.14 H ATOM 186 HD11 LEU A 13 -7.141 -2.300 -3.174 1.00 1.65 H ATOM 187 HD12 LEU A 13 -6.505 -1.819 -4.747 1.00 1.79 H ATOM 188 HD13 LEU A 13 -6.959 -0.591 -3.566 1.00 1.82 H ATOM 189 HD21 LEU A 13 -4.445 -3.273 -4.281 1.00 1.54 H ATOM 190 HD22 LEU A 13 -5.185 -3.702 -2.738 1.00 1.48 H ATOM 191 HD23 LEU A 13 -3.559 -3.019 -2.778 1.00 1.47 H ATOM 192 N PRO A 14 -1.130 -0.668 -4.677 1.00 0.71 N ATOM 193 CA PRO A 14 0.077 -1.419 -5.086 1.00 0.73 C ATOM 194 C PRO A 14 1.368 -0.896 -4.437 1.00 0.75 C ATOM 195 O PRO A 14 2.436 -1.498 -4.596 1.00 0.92 O ATOM 196 CB PRO A 14 0.136 -1.220 -6.614 1.00 0.85 C ATOM 197 CG PRO A 14 -1.098 -0.459 -6.986 1.00 0.91 C ATOM 198 CD PRO A 14 -1.517 0.277 -5.749 1.00 0.81 C ATOM 199 HA PRO A 14 -0.026 -2.472 -4.864 1.00 0.70 H ATOM 200 HB2 PRO A 14 1.027 -0.659 -6.872 1.00 0.90 H ATOM 201 HB3 PRO A 14 0.146 -2.177 -7.112 1.00 0.93 H ATOM 202 HG2 PRO A 14 -0.876 0.237 -7.785 1.00 1.08 H ATOM 203 HG3 PRO A 14 -1.877 -1.142 -7.289 1.00 1.01 H ATOM 204 HD2 PRO A 14 -0.976 1.209 -5.661 1.00 0.90 H ATOM 205 HD3 PRO A 14 -2.581 0.452 -5.749 1.00 0.84 H ATOM 206 N ALA A 15 1.254 0.220 -3.696 1.00 0.67 N ATOM 207 CA ALA A 15 2.399 0.843 -3.017 1.00 0.73 C ATOM 208 C ALA A 15 2.859 0.026 -1.806 1.00 0.73 C ATOM 209 O ALA A 15 4.062 -0.103 -1.560 1.00 0.88 O ATOM 210 CB ALA A 15 2.047 2.262 -2.592 1.00 0.80 C ATOM 211 H ALA A 15 0.371 0.634 -3.602 1.00 0.63 H ATOM 212 HA ALA A 15 3.212 0.900 -3.726 1.00 0.77 H ATOM 213 HB1 ALA A 15 1.728 2.828 -3.454 1.00 0.79 H ATOM 214 HB2 ALA A 15 2.915 2.732 -2.153 1.00 0.92 H ATOM 215 HB3 ALA A 15 1.248 2.232 -1.866 1.00 0.78 H ATOM 216 N LEU A 16 1.891 -0.536 -1.066 1.00 0.64 N ATOM 217 CA LEU A 16 2.179 -1.356 0.118 1.00 0.67 C ATOM 218 C LEU A 16 2.751 -2.721 -0.286 1.00 0.63 C ATOM 219 O LEU A 16 3.630 -3.260 0.395 1.00 0.76 O ATOM 220 CB LEU A 16 0.905 -1.541 0.954 1.00 0.75 C ATOM 221 CG LEU A 16 1.124 -1.740 2.460 1.00 0.96 C ATOM 222 CD1 LEU A 16 1.173 -0.400 3.185 1.00 1.20 C ATOM 223 CD2 LEU A 16 0.030 -2.622 3.043 1.00 1.23 C ATOM 224 H LEU A 16 0.957 -0.393 -1.325 1.00 0.63 H ATOM 225 HA LEU A 16 2.915 -0.833 0.710 1.00 0.72 H ATOM 226 HB2 LEU A 16 0.282 -0.669 0.816 1.00 0.81 H ATOM 227 HB3 LEU A 16 0.375 -2.402 0.575 1.00 0.95 H ATOM 228 HG LEU A 16 2.071 -2.236 2.615 1.00 1.21 H ATOM 229 HD11 LEU A 16 1.319 -0.568 4.242 1.00 1.66 H ATOM 230 HD12 LEU A 16 0.244 0.128 3.029 1.00 1.38 H ATOM 231 HD13 LEU A 16 1.991 0.189 2.797 1.00 1.32 H ATOM 232 HD21 LEU A 16 -0.934 -2.173 2.855 1.00 1.24 H ATOM 233 HD22 LEU A 16 0.179 -2.723 4.108 1.00 1.49 H ATOM 234 HD23 LEU A 16 0.069 -3.598 2.581 1.00 1.81 H ATOM 235 N ILE A 17 2.254 -3.254 -1.417 1.00 0.53 N ATOM 236 CA ILE A 17 2.704 -4.549 -1.957 1.00 0.52 C ATOM 237 C ILE A 17 4.134 -4.422 -2.518 1.00 0.53 C ATOM 238 O ILE A 17 4.947 -5.344 -2.385 1.00 0.63 O ATOM 239 CB ILE A 17 1.745 -5.087 -3.077 1.00 0.54 C ATOM 240 CG1 ILE A 17 0.239 -4.854 -2.742 1.00 0.60 C ATOM 241 CG2 ILE A 17 2.005 -6.573 -3.366 1.00 0.58 C ATOM 242 CD1 ILE A 17 -0.251 -5.425 -1.410 1.00 0.64 C ATOM 243 H ILE A 17 1.562 -2.758 -1.904 1.00 0.54 H ATOM 244 HA ILE A 17 2.709 -5.261 -1.145 1.00 0.55 H ATOM 245 HB ILE A 17 1.978 -4.545 -3.982 1.00 0.55 H ATOM 246 HG12 ILE A 17 0.050 -3.793 -2.722 1.00 0.61 H ATOM 247 HG13 ILE A 17 -0.359 -5.297 -3.526 1.00 0.64 H ATOM 248 HG21 ILE A 17 1.288 -6.929 -4.092 1.00 1.05 H ATOM 249 HG22 ILE A 17 1.905 -7.141 -2.453 1.00 1.42 H ATOM 250 HG23 ILE A 17 3.004 -6.693 -3.757 1.00 1.01 H ATOM 251 HD11 ILE A 17 -0.070 -6.489 -1.387 1.00 1.20 H ATOM 252 HD12 ILE A 17 -1.310 -5.238 -1.306 1.00 1.20 H ATOM 253 HD13 ILE A 17 0.280 -4.951 -0.598 1.00 1.23 H ATOM 254 N SER A 18 4.423 -3.259 -3.130 1.00 0.53 N ATOM 255 CA SER A 18 5.745 -2.972 -3.703 1.00 0.60 C ATOM 256 C SER A 18 6.777 -2.672 -2.607 1.00 0.59 C ATOM 257 O SER A 18 7.969 -2.946 -2.780 1.00 0.88 O ATOM 258 CB SER A 18 5.659 -1.791 -4.672 1.00 0.73 C ATOM 259 OG SER A 18 4.800 -2.083 -5.760 1.00 0.80 O ATOM 260 H SER A 18 3.724 -2.576 -3.197 1.00 0.57 H ATOM 261 HA SER A 18 6.064 -3.848 -4.249 1.00 0.63 H ATOM 262 HB2 SER A 18 5.275 -0.928 -4.149 1.00 0.74 H ATOM 263 HB3 SER A 18 6.644 -1.571 -5.056 1.00 0.81 H ATOM 264 HG SER A 18 3.888 -2.079 -5.459 1.00 1.10 H ATOM 265 N TRP A 19 6.301 -2.112 -1.479 1.00 0.49 N ATOM 266 CA TRP A 19 7.163 -1.784 -0.334 1.00 0.54 C ATOM 267 C TRP A 19 7.542 -3.043 0.453 1.00 0.50 C ATOM 268 O TRP A 19 8.672 -3.159 0.939 1.00 0.59 O ATOM 269 CB TRP A 19 6.474 -0.778 0.590 1.00 0.68 C ATOM 270 CG TRP A 19 6.885 0.644 0.335 1.00 0.62 C ATOM 271 CD1 TRP A 19 6.289 1.533 -0.514 1.00 0.96 C ATOM 272 CD2 TRP A 19 7.983 1.350 0.923 1.00 0.63 C ATOM 273 NE1 TRP A 19 6.950 2.743 -0.485 1.00 1.09 N ATOM 274 CE2 TRP A 19 7.999 2.670 0.396 1.00 0.90 C ATOM 275 CE3 TRP A 19 8.989 1.024 1.863 1.00 0.84 C ATOM 276 CZ2 TRP A 19 8.939 3.658 0.748 1.00 1.16 C ATOM 277 CZ3 TRP A 19 9.932 1.979 2.220 1.00 1.15 C ATOM 278 CH2 TRP A 19 9.917 3.298 1.672 1.00 1.24 C ATOM 279 H TRP A 19 5.343 -1.914 -1.420 1.00 0.60 H ATOM 280 HA TRP A 19 8.067 -1.338 -0.723 1.00 0.59 H ATOM 281 HB2 TRP A 19 5.405 -0.845 0.452 1.00 0.97 H ATOM 282 HB3 TRP A 19 6.715 -1.017 1.616 1.00 0.79 H ATOM 283 HD1 TRP A 19 5.424 1.305 -1.120 1.00 1.22 H ATOM 284 HE1 TRP A 19 6.708 3.537 -1.007 1.00 1.40 H ATOM 285 HE3 TRP A 19 9.034 0.032 2.287 1.00 0.96 H ATOM 286 HZ2 TRP A 19 8.913 4.644 0.307 1.00 1.42 H ATOM 287 HZ3 TRP A 19 10.692 1.722 2.941 1.00 1.44 H ATOM 288 HH2 TRP A 19 10.661 4.019 1.980 1.00 1.52 H ATOM 289 N ILE A 20 6.588 -3.988 0.563 1.00 0.52 N ATOM 290 CA ILE A 20 6.823 -5.260 1.274 1.00 0.56 C ATOM 291 C ILE A 20 7.669 -6.219 0.420 1.00 0.59 C ATOM 292 O ILE A 20 8.448 -7.013 0.956 1.00 0.75 O ATOM 293 CB ILE A 20 5.501 -5.964 1.717 1.00 0.71 C ATOM 294 CG1 ILE A 20 4.521 -6.160 0.546 1.00 0.93 C ATOM 295 CG2 ILE A 20 4.830 -5.181 2.838 1.00 1.12 C ATOM 296 CD1 ILE A 20 4.567 -7.549 -0.057 1.00 1.33 C ATOM 297 H ILE A 20 5.711 -3.825 0.159 1.00 0.58 H ATOM 298 HA ILE A 20 7.386 -5.024 2.167 1.00 0.57 H ATOM 299 HB ILE A 20 5.765 -6.934 2.113 1.00 1.00 H ATOM 300 HG12 ILE A 20 3.514 -5.983 0.893 1.00 1.04 H ATOM 301 HG13 ILE A 20 4.760 -5.451 -0.233 1.00 1.17 H ATOM 302 HG21 ILE A 20 5.498 -5.120 3.684 1.00 1.42 H ATOM 303 HG22 ILE A 20 3.920 -5.682 3.132 1.00 1.21 H ATOM 304 HG23 ILE A 20 4.597 -4.185 2.491 1.00 1.32 H ATOM 305 HD11 ILE A 20 3.942 -7.580 -0.937 1.00 1.70 H ATOM 306 HD12 ILE A 20 4.207 -8.266 0.666 1.00 1.35 H ATOM 307 HD13 ILE A 20 5.584 -7.790 -0.327 1.00 1.51 H ATOM 308 N LYS A 21 7.504 -6.122 -0.913 1.00 0.54 N ATOM 309 CA LYS A 21 8.257 -6.951 -1.866 1.00 0.66 C ATOM 310 C LYS A 21 9.698 -6.451 -2.012 1.00 0.60 C ATOM 311 O LYS A 21 10.621 -7.250 -2.197 1.00 0.70 O ATOM 312 CB LYS A 21 7.570 -6.959 -3.234 1.00 0.79 C ATOM 313 CG LYS A 21 6.382 -7.904 -3.318 1.00 1.01 C ATOM 314 CD LYS A 21 5.817 -7.963 -4.729 1.00 1.03 C ATOM 315 CE LYS A 21 4.728 -9.017 -4.850 1.00 1.13 C ATOM 316 NZ LYS A 21 4.153 -9.066 -6.223 1.00 1.58 N1+ ATOM 317 H LYS A 21 6.855 -5.476 -1.261 1.00 0.52 H ATOM 318 HA LYS A 21 8.279 -7.959 -1.479 1.00 0.75 H ATOM 319 HB2 LYS A 21 7.223 -5.960 -3.455 1.00 1.00 H ATOM 320 HB3 LYS A 21 8.290 -7.253 -3.983 1.00 0.90 H ATOM 321 HG2 LYS A 21 6.700 -8.894 -3.027 1.00 1.29 H ATOM 322 HG3 LYS A 21 5.611 -7.559 -2.646 1.00 1.39 H ATOM 323 HD2 LYS A 21 5.401 -6.999 -4.979 1.00 1.28 H ATOM 324 HD3 LYS A 21 6.615 -8.203 -5.416 1.00 1.06 H ATOM 325 HE2 LYS A 21 5.150 -9.982 -4.612 1.00 1.11 H ATOM 326 HE3 LYS A 21 3.941 -8.786 -4.147 1.00 1.19 H ATOM 327 HZ1 LYS A 21 3.429 -9.811 -6.281 1.00 1.84 H ATOM 328 HZ2 LYS A 21 4.901 -9.271 -6.916 1.00 1.52 H ATOM 329 HZ3 LYS A 21 3.716 -8.153 -6.461 1.00 2.10 H ATOM 330 N ARG A 22 9.877 -5.121 -1.918 1.00 0.56 N ATOM 331 CA ARG A 22 11.203 -4.495 -2.017 1.00 0.56 C ATOM 332 C ARG A 22 11.968 -4.598 -0.690 1.00 0.52 C ATOM 333 O ARG A 22 13.202 -4.580 -0.678 1.00 0.66 O ATOM 334 CB ARG A 22 11.078 -3.027 -2.437 1.00 0.63 C ATOM 335 CG ARG A 22 10.814 -2.836 -3.923 1.00 0.92 C ATOM 336 CD ARG A 22 10.849 -1.367 -4.312 1.00 1.04 C ATOM 337 NE ARG A 22 10.737 -1.178 -5.763 1.00 1.25 N ATOM 338 CZ ARG A 22 11.219 -0.122 -6.435 1.00 1.56 C ATOM 339 NH1 ARG A 22 11.855 0.865 -5.805 1.00 1.61 N1+ ATOM 340 NH2 ARG A 22 11.062 -0.056 -7.750 1.00 2.06 N ATOM 341 H ARG A 22 9.094 -4.548 -1.779 1.00 0.61 H ATOM 342 HA ARG A 22 11.759 -5.027 -2.775 1.00 0.67 H ATOM 343 HB2 ARG A 22 10.265 -2.575 -1.888 1.00 0.98 H ATOM 344 HB3 ARG A 22 11.996 -2.514 -2.188 1.00 0.82 H ATOM 345 HG2 ARG A 22 11.570 -3.365 -4.484 1.00 1.19 H ATOM 346 HG3 ARG A 22 9.840 -3.239 -4.160 1.00 1.48 H ATOM 347 HD2 ARG A 22 10.027 -0.860 -3.829 1.00 1.28 H ATOM 348 HD3 ARG A 22 11.782 -0.941 -3.974 1.00 1.34 H ATOM 349 HE ARG A 22 10.277 -1.879 -6.270 1.00 1.43 H ATOM 350 HH11 ARG A 22 11.981 0.826 -4.814 1.00 1.53 H ATOM 351 HH12 ARG A 22 12.207 1.644 -6.324 1.00 1.91 H ATOM 352 HH21 ARG A 22 10.588 -0.791 -8.235 1.00 2.25 H ATOM 353 HH22 ARG A 22 11.419 0.729 -8.258 1.00 2.34 H ATOM 354 N LYS A 23 11.220 -4.708 0.420 1.00 0.54 N ATOM 355 CA LYS A 23 11.809 -4.837 1.759 1.00 0.58 C ATOM 356 C LYS A 23 12.136 -6.299 2.086 1.00 0.55 C ATOM 357 O LYS A 23 13.016 -6.573 2.907 1.00 0.59 O ATOM 358 CB LYS A 23 10.861 -4.274 2.821 1.00 0.76 C ATOM 359 CG LYS A 23 11.117 -2.814 3.157 1.00 0.87 C ATOM 360 CD LYS A 23 10.209 -2.336 4.281 1.00 0.92 C ATOM 361 CE LYS A 23 10.632 -0.971 4.804 1.00 1.04 C ATOM 362 NZ LYS A 23 11.844 -1.051 5.667 1.00 1.28 N1+ ATOM 363 H LYS A 23 10.244 -4.702 0.333 1.00 0.65 H ATOM 364 HA LYS A 23 12.726 -4.267 1.771 1.00 0.61 H ATOM 365 HB2 LYS A 23 9.846 -4.367 2.465 1.00 0.93 H ATOM 366 HB3 LYS A 23 10.970 -4.853 3.726 1.00 0.93 H ATOM 367 HG2 LYS A 23 12.146 -2.700 3.465 1.00 1.19 H ATOM 368 HG3 LYS A 23 10.934 -2.215 2.278 1.00 1.25 H ATOM 369 HD2 LYS A 23 9.198 -2.269 3.909 1.00 1.26 H ATOM 370 HD3 LYS A 23 10.250 -3.050 5.091 1.00 1.17 H ATOM 371 HE2 LYS A 23 10.845 -0.330 3.963 1.00 1.40 H ATOM 372 HE3 LYS A 23 9.818 -0.551 5.378 1.00 1.42 H ATOM 373 HZ1 LYS A 23 11.658 -1.661 6.489 1.00 1.46 H ATOM 374 HZ2 LYS A 23 12.106 -0.103 6.006 1.00 1.73 H ATOM 375 HZ3 LYS A 23 12.641 -1.446 5.129 1.00 1.85 H ATOM 376 N ARG A 24 11.419 -7.226 1.433 1.00 0.60 N ATOM 377 CA ARG A 24 11.620 -8.665 1.637 1.00 0.70 C ATOM 378 C ARG A 24 12.654 -9.231 0.653 1.00 0.66 C ATOM 379 O ARG A 24 13.358 -10.193 0.976 1.00 0.76 O ATOM 380 CB ARG A 24 10.288 -9.407 1.483 1.00 0.89 C ATOM 381 CG ARG A 24 10.138 -10.607 2.408 1.00 1.36 C ATOM 382 CD ARG A 24 8.796 -11.294 2.214 1.00 1.41 C ATOM 383 NE ARG A 24 8.600 -12.396 3.161 1.00 1.42 N ATOM 384 CZ ARG A 24 7.547 -13.227 3.157 1.00 1.54 C ATOM 385 NH1 ARG A 24 6.573 -13.101 2.258 1.00 1.76 N1+ ATOM 386 NH2 ARG A 24 7.470 -14.189 4.065 1.00 1.78 N ATOM 387 H ARG A 24 10.734 -6.931 0.798 1.00 0.65 H ATOM 388 HA ARG A 24 11.985 -8.807 2.643 1.00 0.76 H ATOM 389 HB2 ARG A 24 9.482 -8.719 1.690 1.00 0.92 H ATOM 390 HB3 ARG A 24 10.199 -9.753 0.464 1.00 1.17 H ATOM 391 HG2 ARG A 24 10.926 -11.314 2.196 1.00 1.78 H ATOM 392 HG3 ARG A 24 10.217 -10.272 3.432 1.00 1.59 H ATOM 393 HD2 ARG A 24 8.010 -10.566 2.356 1.00 1.52 H ATOM 394 HD3 ARG A 24 8.747 -11.683 1.208 1.00 1.59 H ATOM 395 HE ARG A 24 9.292 -12.529 3.842 1.00 1.58 H ATOM 396 HH11 ARG A 24 6.619 -12.377 1.569 1.00 1.84 H ATOM 397 HH12 ARG A 24 5.796 -13.730 2.271 1.00 2.01 H ATOM 398 HH21 ARG A 24 8.193 -14.292 4.747 1.00 1.94 H ATOM 399 HH22 ARG A 24 6.687 -14.812 4.068 1.00 1.96 H ATOM 400 N GLN A 25 12.734 -8.629 -0.544 1.00 0.59 N ATOM 401 CA GLN A 25 13.679 -9.068 -1.580 1.00 0.62 C ATOM 402 C GLN A 25 15.002 -8.299 -1.494 1.00 0.58 C ATOM 403 O GLN A 25 16.076 -8.897 -1.607 1.00 0.68 O ATOM 404 CB GLN A 25 13.068 -8.903 -2.977 1.00 0.70 C ATOM 405 CG GLN A 25 11.978 -9.920 -3.299 1.00 1.11 C ATOM 406 CD GLN A 25 11.382 -9.750 -4.690 1.00 1.18 C ATOM 407 OE1 GLN A 25 12.062 -9.348 -5.638 1.00 1.50 O ATOM 408 NE2 GLN A 25 10.096 -10.059 -4.818 1.00 1.28 N ATOM 409 H GLN A 25 12.144 -7.870 -0.733 1.00 0.59 H ATOM 410 HA GLN A 25 13.882 -10.115 -1.412 1.00 0.73 H ATOM 411 HB2 GLN A 25 12.642 -7.914 -3.056 1.00 0.73 H ATOM 412 HB3 GLN A 25 13.853 -9.005 -3.713 1.00 1.04 H ATOM 413 HG2 GLN A 25 12.399 -10.911 -3.227 1.00 1.51 H ATOM 414 HG3 GLN A 25 11.186 -9.817 -2.571 1.00 1.30 H ATOM 415 HE21 GLN A 25 9.615 -10.372 -4.024 1.00 1.53 H ATOM 416 HE22 GLN A 25 9.682 -9.961 -5.700 1.00 1.31 H ATOM 417 N GLN A 26 14.911 -6.977 -1.298 1.00 0.55 N ATOM 418 CA GLN A 26 16.096 -6.121 -1.195 1.00 0.64 C ATOM 419 C GLN A 26 16.383 -5.754 0.263 1.00 0.76 C ATOM 420 O GLN A 26 17.506 -5.905 0.746 1.00 0.87 O ATOM 421 CB GLN A 26 15.925 -4.851 -2.041 1.00 0.78 C ATOM 422 CG GLN A 26 16.018 -5.093 -3.540 1.00 0.82 C ATOM 423 CD GLN A 26 15.829 -3.824 -4.348 1.00 1.06 C ATOM 424 OE1 GLN A 26 14.710 -3.472 -4.721 1.00 1.31 O ATOM 425 NE2 GLN A 26 16.927 -3.128 -4.621 1.00 1.13 N ATOM 426 H GLN A 26 14.024 -6.569 -1.221 1.00 0.55 H ATOM 427 HA GLN A 26 16.936 -6.681 -1.577 1.00 0.63 H ATOM 428 HB2 GLN A 26 14.958 -4.420 -1.828 1.00 0.84 H ATOM 429 HB3 GLN A 26 16.692 -4.143 -1.764 1.00 0.89 H ATOM 430 HG2 GLN A 26 16.991 -5.503 -3.766 1.00 0.80 H ATOM 431 HG3 GLN A 26 15.254 -5.801 -3.826 1.00 0.78 H ATOM 432 HE21 GLN A 26 17.785 -3.468 -4.291 1.00 1.11 H ATOM 433 HE22 GLN A 26 16.834 -2.303 -5.142 1.00 1.29 H HETATM 434 N NH2 A 27 15.355 -5.272 0.959 1.00 0.84 N HETATM 435 HN1 NH2 A 27 14.492 -5.180 0.505 1.00 0.81 H HETATM 436 HN2 NH2 A 27 15.504 -5.029 1.897 1.00 0.97 H TER 437 NH2 A 27 HETATM 438 RU 3UQ A 101 8.027 2.933 2.712 1.00 0.85 RU HETATM 439 CC1 3UQ A 101 7.251 2.373 4.698 1.00 1.25 C HETATM 440 CC2 3UQ A 101 8.174 3.456 4.843 1.00 1.23 C HETATM 441 CC3 3UQ A 101 7.655 4.581 4.124 1.00 1.10 C HETATM 442 CC4 3UQ A 101 6.164 2.830 3.890 1.00 1.17 C HETATM 443 CC5 3UQ A 101 6.411 4.193 3.535 1.00 1.11 C HETATM 444 HC1 3UQ A 101 7.356 1.376 5.127 1.00 1.46 H HETATM 445 HC2 3UQ A 101 9.111 3.427 5.400 1.00 1.46 H HETATM 446 HC3 3UQ A 101 8.126 5.560 4.041 1.00 1.19 H HETATM 447 HC4 3UQ A 101 5.296 2.240 3.594 1.00 1.33 H HETATM 448 HC5 3UQ A 101 5.765 4.824 2.925 1.00 1.25 H