ATOM 1 N TRP A 2 2.231 -10.024 3.252 1.00 0.00 N ATOM 2 CA TRP A 2 1.856 -10.327 1.843 1.00 0.00 C ATOM 3 C TRP A 2 1.361 -9.014 1.160 1.00 0.00 C ATOM 4 O TRP A 2 0.920 -8.106 1.869 1.00 0.00 O ATOM 5 CB TRP A 2 0.948 -11.593 1.723 1.00 0.00 C ATOM 6 CG TRP A 2 1.477 -12.718 0.813 1.00 0.00 C ATOM 7 CD1 TRP A 2 2.127 -13.891 1.261 1.00 0.00 C ATOM 8 CD2 TRP A 2 1.338 -12.874 -0.555 1.00 0.00 C ATOM 9 NE1 TRP A 2 2.403 -14.771 0.200 1.00 0.00 N ATOM 10 CE2 TRP A 2 1.898 -14.126 -0.916 1.00 0.00 C ATOM 11 CE3 TRP A 2 0.722 -12.053 -1.534 1.00 0.00 C ATOM 12 CZ2 TRP A 2 1.835 -14.571 -2.259 1.00 0.00 C ATOM 13 CZ3 TRP A 2 0.644 -12.526 -2.846 1.00 0.00 C ATOM 14 CH2 TRP A 2 1.178 -13.774 -3.198 1.00 0.00 C ATOM 15 H1 TRP A 2 1.607 -10.342 4.014 1.00 0.00 H ATOM 16 HA TRP A 2 2.750 -10.609 1.260 1.00 0.00 H ATOM 17 HB2 TRP A 2 0.782 -12.021 2.733 1.00 0.00 H ATOM 18 HB3 TRP A 2 -0.063 -11.300 1.397 1.00 0.00 H ATOM 19 HD1 TRP A 2 2.342 -14.111 2.298 1.00 0.00 H ATOM 20 HE1 TRP A 2 2.827 -15.705 0.250 1.00 0.00 H ATOM 21 HE3 TRP A 2 0.309 -11.089 -1.268 1.00 0.00 H ATOM 22 HZ2 TRP A 2 2.272 -15.514 -2.552 1.00 0.00 H ATOM 23 HZ3 TRP A 2 0.159 -11.923 -3.598 1.00 0.00 H ATOM 24 HH2 TRP A 2 1.069 -14.129 -4.212 1.00 0.00 H HETATM 25 N DSG A 3 1.295 -8.883 -0.181 1.00 0.00 N HETATM 26 CA DSG A 3 1.111 -7.605 -0.920 1.00 0.00 C HETATM 27 C DSG A 3 1.934 -6.367 -0.445 1.00 0.00 C HETATM 28 O DSG A 3 2.706 -6.487 0.509 1.00 0.00 O HETATM 29 CB DSG A 3 1.248 -7.911 -2.444 1.00 0.00 C HETATM 30 CG DSG A 3 2.354 -8.915 -2.842 1.00 0.00 C HETATM 31 OD1 DSG A 3 2.226 -9.649 -3.822 1.00 0.00 O HETATM 32 ND2 DSG A 3 3.449 -8.974 -2.101 1.00 0.00 N HETATM 33 H DSG A 3 1.496 -9.760 -0.683 1.00 0.00 H HETATM 34 HA DSG A 3 0.039 -7.343 -0.804 1.00 0.00 H HETATM 35 HB2 DSG A 3 0.292 -8.292 -2.845 1.00 0.00 H HETATM 36 HB3 DSG A 3 1.408 -6.965 -3.001 1.00 0.00 H HETATM 37 HD21 DSG A 3 3.498 -8.340 -1.299 1.00 0.00 H HETATM 38 HD22 DSG A 3 4.180 -9.621 -2.420 1.00 0.00 H ATOM 39 N ASP A 4 1.866 -5.188 -1.101 1.00 0.00 N ATOM 40 CA ASP A 4 2.936 -4.153 -1.147 1.00 0.00 C ATOM 41 C ASP A 4 2.859 -3.267 0.132 1.00 0.00 C ATOM 42 O ASP A 4 3.400 -3.674 1.167 1.00 0.00 O ATOM 43 CB ASP A 4 2.839 -3.382 -2.499 1.00 0.00 C ATOM 44 CG ASP A 4 3.238 -1.898 -2.514 1.00 0.00 C ATOM 45 OD1 ASP A 4 4.060 -1.456 -1.680 1.00 0.00 O ATOM 46 OD2 ASP A 4 2.746 -1.167 -3.405 1.00 0.00 O ATOM 47 H ASP A 4 1.037 -5.099 -1.697 1.00 0.00 H ATOM 48 HA ASP A 4 3.915 -4.664 -1.138 1.00 0.00 H ATOM 49 HB2 ASP A 4 3.495 -3.901 -3.246 1.00 0.00 H ATOM 50 HB3 ASP A 4 1.830 -3.475 -2.947 1.00 0.00 H ATOM 51 N THR A 5 2.248 -2.069 0.150 1.00 0.00 N ATOM 52 CA THR A 5 2.156 -1.127 1.291 1.00 0.00 C ATOM 53 C THR A 5 3.309 -0.074 1.311 1.00 0.00 C ATOM 54 O THR A 5 4.304 -0.267 2.013 1.00 0.00 O ATOM 55 CB THR A 5 0.675 -0.629 1.504 1.00 0.00 C ATOM 56 OG1 THR A 5 0.036 -0.304 0.219 1.00 0.00 O ATOM 57 CG2 THR A 5 -0.269 -1.654 2.163 1.00 0.00 C ATOM 58 H THR A 5 1.695 -1.843 -0.696 1.00 0.00 H ATOM 59 HA THR A 5 2.302 -1.751 2.190 1.00 0.00 H ATOM 60 HB THR A 5 0.727 0.259 2.147 1.00 0.00 H ATOM 61 HG21 THR A 5 0.044 -1.897 3.196 1.00 0.00 H ATOM 62 HG22 THR A 5 -0.312 -2.600 1.595 1.00 0.00 H ATOM 63 HG23 THR A 5 -1.300 -1.258 2.228 1.00 0.00 H ATOM 64 N GLY A 6 3.289 1.005 0.500 1.00 0.00 N ATOM 65 CA GLY A 6 4.457 1.864 0.161 1.00 0.00 C ATOM 66 C GLY A 6 4.138 3.338 0.556 1.00 0.00 C ATOM 67 O GLY A 6 4.122 3.640 1.752 1.00 0.00 O ATOM 68 H GLY A 6 2.383 1.159 0.039 1.00 0.00 H ATOM 69 HA2 GLY A 6 5.354 1.482 0.669 1.00 0.00 H ATOM 70 HA3 GLY A 6 4.679 1.831 -0.919 1.00 0.00 H HETATM 71 N ORN A 7 3.935 4.306 -0.363 1.00 0.00 N HETATM 72 CA ORN A 7 4.115 5.763 -0.131 1.00 0.00 C HETATM 73 CB ORN A 7 3.642 6.504 -1.416 1.00 0.00 C HETATM 74 CG ORN A 7 3.778 5.746 -2.761 1.00 0.00 C HETATM 75 CD ORN A 7 2.477 5.044 -3.187 1.00 0.00 C HETATM 76 NE ORN A 7 1.302 5.904 -2.962 1.00 0.00 N HETATM 77 C ORN A 7 3.344 6.252 1.133 1.00 0.00 C HETATM 78 O ORN A 7 2.330 5.646 1.485 1.00 0.00 O HETATM 79 H ORN A 7 3.531 3.966 -1.242 1.00 0.00 H HETATM 80 HA ORN A 7 5.199 5.974 -0.036 1.00 0.00 H HETATM 81 HB2 ORN A 7 4.219 7.447 -1.511 1.00 0.00 H HETATM 82 HB3 ORN A 7 2.588 6.825 -1.294 1.00 0.00 H HETATM 83 HG2 ORN A 7 4.088 6.455 -3.551 1.00 0.00 H HETATM 84 HG3 ORN A 7 4.599 5.009 -2.683 1.00 0.00 H HETATM 85 HD2 ORN A 7 2.523 4.762 -4.255 1.00 0.00 H HETATM 86 HD3 ORN A 7 2.342 4.102 -2.623 1.00 0.00 H HETATM 87 HE1 ORN A 7 1.528 6.897 -3.098 1.00 0.00 H HETATM 88 HE2 ORN A 7 0.936 5.804 -2.008 1.00 0.00 H HETATM 89 HE3 ORN A 7 0.537 5.677 -3.607 1.00 0.00 H ATOM 90 N ASP A 8 3.774 7.295 1.875 1.00 0.00 N ATOM 91 CA ASP A 8 3.015 7.942 2.977 1.00 0.00 C ATOM 92 C ASP A 8 2.959 9.479 2.727 1.00 0.00 C ATOM 93 O ASP A 8 4.012 10.121 2.736 1.00 0.00 O ATOM 94 CB ASP A 8 3.648 7.523 4.338 1.00 0.00 C ATOM 95 CG ASP A 8 2.728 7.625 5.561 1.00 0.00 C ATOM 96 OD1 ASP A 8 1.494 7.757 5.400 1.00 0.00 O ATOM 97 OD2 ASP A 8 3.245 7.568 6.700 1.00 0.00 O ATOM 98 H ASP A 8 4.714 7.621 1.623 1.00 0.00 H ATOM 99 HA ASP A 8 1.976 7.569 2.971 1.00 0.00 H ATOM 100 HB2 ASP A 8 4.045 6.492 4.275 1.00 0.00 H ATOM 101 HB3 ASP A 8 4.536 8.151 4.549 1.00 0.00 H HETATM 102 N DAL A 9 1.796 10.133 2.530 1.00 0.00 N HETATM 103 CA DAL A 9 1.662 11.574 2.185 1.00 0.00 C HETATM 104 CB DAL A 9 1.751 12.641 3.298 1.00 0.00 C HETATM 105 C DAL A 9 0.586 11.830 1.084 1.00 0.00 C HETATM 106 O DAL A 9 -0.390 12.528 1.370 1.00 0.00 O HETATM 107 H DAL A 9 0.964 9.538 2.628 1.00 0.00 H HETATM 108 HA DAL A 9 2.611 11.764 1.648 1.00 0.00 H HETATM 109 HB1 DAL A 9 0.833 12.706 3.902 1.00 0.00 H HETATM 110 HB2 DAL A 9 2.594 12.453 3.986 1.00 0.00 H HETATM 111 HB3 DAL A 9 1.909 13.650 2.875 1.00 0.00 H ATOM 112 N ASP A 10 0.696 11.315 -0.165 1.00 0.00 N ATOM 113 CA ASP A 10 -0.356 11.424 -1.217 1.00 0.00 C ATOM 114 C ASP A 10 -1.372 10.251 -1.053 1.00 0.00 C ATOM 115 O ASP A 10 -2.569 10.490 -1.276 1.00 0.00 O ATOM 116 CB ASP A 10 0.296 11.523 -2.629 1.00 0.00 C ATOM 117 CG ASP A 10 -0.393 12.507 -3.598 1.00 0.00 C ATOM 118 OD1 ASP A 10 -0.029 13.703 -3.624 1.00 0.00 O ATOM 119 OD2 ASP A 10 -1.295 12.065 -4.343 1.00 0.00 O ATOM 120 H ASP A 10 1.557 10.775 -0.301 1.00 0.00 H ATOM 121 HA ASP A 10 -0.916 12.365 -1.056 1.00 0.00 H ATOM 122 HB2 ASP A 10 1.366 11.793 -2.567 1.00 0.00 H ATOM 123 HB3 ASP A 10 0.288 10.538 -3.134 1.00 0.00 H ATOM 124 N GLY A 11 -1.015 8.989 -0.737 1.00 0.00 N ATOM 125 CA GLY A 11 -1.963 7.891 -0.387 1.00 0.00 C ATOM 126 C GLY A 11 -2.642 8.221 0.977 1.00 0.00 C ATOM 127 O GLY A 11 -2.120 9.066 1.710 1.00 0.00 O ATOM 128 H GLY A 11 -0.016 8.788 -0.851 1.00 0.00 H ATOM 129 HA2 GLY A 11 -2.724 7.753 -1.158 1.00 0.00 H ATOM 130 HA3 GLY A 11 -1.405 6.952 -0.332 1.00 0.00 H HETATM 131 N DSN A 12 -3.704 7.530 1.436 1.00 0.00 N HETATM 132 CA DSN A 12 -4.721 6.830 0.601 1.00 0.00 C HETATM 133 C DSN A 12 -4.456 5.294 0.532 1.00 0.00 C HETATM 134 O DSN A 12 -3.814 4.767 1.448 1.00 0.00 O HETATM 135 CB DSN A 12 -6.111 7.520 0.679 1.00 0.00 C HETATM 136 OG DSN A 12 -6.578 7.858 -0.621 1.00 0.00 O HETATM 137 H DSN A 12 -3.757 7.485 2.461 1.00 0.00 H HETATM 138 HA DSN A 12 -4.396 7.148 -0.415 1.00 0.00 H HETATM 139 HB2 DSN A 12 -6.851 6.907 1.213 1.00 0.00 H HETATM 140 HB3 DSN A 12 -6.052 8.460 1.259 1.00 0.00 H HETATM 141 HG DSN A 12 -6.792 7.026 -1.048 1.00 0.00 H HETATM 142 N LME A 13 -4.987 4.506 -0.422 1.00 0.00 N HETATM 143 CA LME A 13 -4.718 3.074 -0.680 1.00 0.00 C HETATM 144 CB LME A 13 -5.885 2.312 -1.431 1.00 0.00 C HETATM 145 C1 LME A 13 -6.008 0.827 -0.993 1.00 0.00 C HETATM 146 CG LME A 13 -7.293 2.981 -1.257 1.00 0.00 C HETATM 147 CD LME A 13 -7.571 4.333 -1.938 1.00 0.00 C HETATM 148 OE1 LME A 13 -8.416 5.104 -1.429 1.00 0.00 O HETATM 149 OE2 LME A 13 -6.959 4.619 -2.991 1.00 0.00 O HETATM 150 C LME A 13 -3.228 2.727 -1.017 1.00 0.00 C HETATM 151 O LME A 13 -2.440 3.633 -1.292 1.00 0.00 O HETATM 152 H LME A 13 -5.574 5.031 -1.104 1.00 0.00 H HETATM 153 HA LME A 13 -4.805 2.615 0.331 1.00 0.00 H HETATM 154 HB LME A 13 -5.637 2.329 -2.505 1.00 0.00 H HETATM 155 H11 LME A 13 -6.831 0.303 -1.510 1.00 0.00 H HETATM 156 H12 LME A 13 -5.098 0.242 -1.216 1.00 0.00 H HETATM 157 H13 LME A 13 -6.195 0.733 0.094 1.00 0.00 H HETATM 158 HG2 LME A 13 -8.079 2.266 -1.593 1.00 0.00 H HETATM 159 HG3 LME A 13 -7.520 3.110 -0.182 1.00 0.00 H HETATM 160 C KYN A 14 -0.958 0.685 0.195 1.00 0.00 C HETATM 161 N KYN A 14 -2.836 1.435 -1.127 1.00 0.00 N HETATM 162 C1 KYN A 14 0.019 -0.073 -3.138 1.00 0.00 C HETATM 163 N1 KYN A 14 1.966 0.736 -5.357 1.00 0.00 N HETATM 164 O2 KYN A 14 0.915 0.560 -2.582 1.00 0.00 O HETATM 165 CA KYN A 14 -1.424 0.985 -1.250 1.00 0.00 C HETATM 166 CB KYN A 14 -1.285 -0.179 -2.271 1.00 0.00 C HETATM 167 CG KYN A 14 1.118 -0.281 -5.528 1.00 0.00 C HETATM 168 CZ KYN A 14 -0.597 -2.418 -6.084 1.00 0.00 C HETATM 169 CD1 KYN A 14 1.174 -0.941 -6.761 1.00 0.00 C HETATM 170 CD2 KYN A 14 0.184 -0.694 -4.532 1.00 0.00 C HETATM 171 CE1 KYN A 14 0.322 -2.001 -7.031 1.00 0.00 C HETATM 172 CE2 KYN A 14 -0.665 -1.777 -4.856 1.00 0.00 C HETATM 173 O KYN A 14 -1.408 1.278 1.184 1.00 0.00 O HETATM 174 H KYN A 14 -3.611 0.766 -1.013 1.00 0.00 H HETATM 175 HN1 KYN A 14 1.927 1.233 -4.461 1.00 0.00 H HETATM 176 HN1A KYN A 14 2.593 0.950 -6.145 1.00 0.00 H HETATM 177 HA KYN A 14 -0.805 1.827 -1.622 1.00 0.00 H HETATM 178 HB KYN A 14 -2.132 -0.145 -2.981 1.00 0.00 H HETATM 179 HBA KYN A 14 -1.389 -1.160 -1.782 1.00 0.00 H HETATM 180 HZ KYN A 14 -1.260 -3.242 -6.303 1.00 0.00 H HETATM 181 HD1 KYN A 14 1.876 -0.645 -7.532 1.00 0.00 H HETATM 182 HE1 KYN A 14 0.375 -2.504 -7.987 1.00 0.00 H HETATM 183 HE2 KYN A 14 -1.413 -2.155 -4.176 1.00 0.00 H TER 184 KYN A 14 HETATM 185 C1 DKA A 1 3.263 -9.265 3.665 1.00 0.00 C HETATM 186 O1 DKA A 1 3.804 -8.502 2.859 1.00 0.00 O HETATM 187 C2 DKA A 1 3.856 -9.382 5.102 1.00 0.00 C HETATM 188 C3 DKA A 1 5.244 -8.744 5.328 1.00 0.00 C HETATM 189 C4 DKA A 1 5.491 -8.311 6.788 1.00 0.00 C HETATM 190 C5 DKA A 1 6.684 -7.354 6.945 1.00 0.00 C HETATM 191 C6 DKA A 1 8.021 -8.105 7.093 1.00 0.00 C HETATM 192 C7 DKA A 1 8.529 -8.690 5.761 1.00 0.00 C HETATM 193 C8 DKA A 1 10.066 -8.773 5.696 1.00 0.00 C HETATM 194 C9 DKA A 1 10.718 -8.879 7.087 1.00 0.00 C HETATM 195 C10 DKA A 1 12.076 -9.588 7.055 1.00 0.00 C HETATM 196 H21 DKA A 1 3.168 -8.945 5.847 1.00 0.00 H HETATM 197 H22 DKA A 1 3.912 -10.457 5.351 1.00 0.00 H HETATM 198 H31 DKA A 1 6.018 -9.480 5.039 1.00 0.00 H HETATM 199 H32 DKA A 1 5.384 -7.891 4.640 1.00 0.00 H HETATM 200 H41 DKA A 1 4.581 -7.832 7.197 1.00 0.00 H HETATM 201 H42 DKA A 1 5.659 -9.214 7.404 1.00 0.00 H HETATM 202 H51 DKA A 1 6.740 -6.678 6.070 1.00 0.00 H HETATM 203 H52 DKA A 1 6.519 -6.700 7.824 1.00 0.00 H HETATM 204 H61 DKA A 1 8.784 -7.422 7.514 1.00 0.00 H HETATM 205 H62 DKA A 1 7.904 -8.918 7.836 1.00 0.00 H HETATM 206 H71 DKA A 1 8.098 -9.697 5.610 1.00 0.00 H HETATM 207 H72 DKA A 1 8.156 -8.070 4.924 1.00 0.00 H HETATM 208 H81 DKA A 1 10.361 -9.644 5.082 1.00 0.00 H HETATM 209 H82 DKA A 1 10.462 -7.884 5.167 1.00 0.00 H HETATM 210 H91 DKA A 1 10.046 -9.422 7.778 1.00 0.00 H HETATM 211 H92 DKA A 1 10.847 -7.870 7.521 1.00 0.00 H HETATM 212 H101 DKA A 1 12.814 -9.095 7.715 1.00 0.00 H HETATM 213 H102 DKA A 1 11.986 -10.638 7.393 1.00 0.00 H HETATM 214 H103 DKA A 1 12.503 -9.612 6.035 1.00 0.00 H