ATOM 1 N TRP A 2 6.343 -8.175 -1.998 1.00 0.00 N ATOM 2 CA TRP A 2 5.545 -7.033 -2.524 1.00 0.00 C ATOM 3 C TRP A 2 4.054 -7.233 -2.117 1.00 0.00 C ATOM 4 O TRP A 2 3.674 -8.361 -1.790 1.00 0.00 O ATOM 5 CB TRP A 2 5.856 -6.730 -4.025 1.00 0.00 C ATOM 6 CG TRP A 2 6.385 -5.320 -4.345 1.00 0.00 C ATOM 7 CD1 TRP A 2 7.746 -4.986 -4.541 1.00 0.00 C ATOM 8 CD2 TRP A 2 5.679 -4.160 -4.613 1.00 0.00 C ATOM 9 NE1 TRP A 2 7.904 -3.641 -4.920 1.00 0.00 N ATOM 10 CE2 TRP A 2 6.611 -3.149 -4.964 1.00 0.00 C ATOM 11 CE3 TRP A 2 4.286 -3.893 -4.631 1.00 0.00 C ATOM 12 CZ2 TRP A 2 6.153 -1.862 -5.338 1.00 0.00 C ATOM 13 CZ3 TRP A 2 3.859 -2.632 -5.050 1.00 0.00 C ATOM 14 CH2 TRP A 2 4.778 -1.619 -5.354 1.00 0.00 C ATOM 15 H1 TRP A 2 6.611 -8.935 -2.649 1.00 0.00 H ATOM 16 HA TRP A 2 5.837 -6.095 -2.020 1.00 0.00 H ATOM 17 HB2 TRP A 2 6.607 -7.463 -4.399 1.00 0.00 H ATOM 18 HB3 TRP A 2 4.969 -6.945 -4.640 1.00 0.00 H ATOM 19 HD1 TRP A 2 8.563 -5.689 -4.463 1.00 0.00 H ATOM 20 HE1 TRP A 2 8.772 -3.153 -5.165 1.00 0.00 H ATOM 21 HE3 TRP A 2 3.576 -4.649 -4.327 1.00 0.00 H ATOM 22 HZ2 TRP A 2 6.849 -1.084 -5.614 1.00 0.00 H ATOM 23 HZ3 TRP A 2 2.801 -2.437 -5.149 1.00 0.00 H ATOM 24 HH2 TRP A 2 4.416 -0.635 -5.613 1.00 0.00 H HETATM 25 N DSG A 3 3.161 -6.219 -2.097 1.00 0.00 N HETATM 26 CA DSG A 3 1.844 -6.192 -1.408 1.00 0.00 C HETATM 27 C DSG A 3 1.618 -5.088 -0.315 1.00 0.00 C HETATM 28 O DSG A 3 0.581 -4.424 -0.377 1.00 0.00 O HETATM 29 CB DSG A 3 0.736 -6.252 -2.505 1.00 0.00 C HETATM 30 CG DSG A 3 0.865 -5.207 -3.641 1.00 0.00 C HETATM 31 OD1 DSG A 3 0.524 -5.463 -4.794 1.00 0.00 O HETATM 32 ND2 DSG A 3 1.365 -4.019 -3.337 1.00 0.00 N HETATM 33 H DSG A 3 3.505 -5.381 -2.596 1.00 0.00 H HETATM 34 HA DSG A 3 1.754 -7.163 -0.887 1.00 0.00 H HETATM 35 HB2 DSG A 3 0.708 -7.253 -2.972 1.00 0.00 H HETATM 36 HB3 DSG A 3 -0.264 -6.153 -2.037 1.00 0.00 H HETATM 37 HD21 DSG A 3 1.561 -3.833 -2.347 1.00 0.00 H HETATM 38 HD22 DSG A 3 1.523 -3.377 -4.121 1.00 0.00 H ATOM 39 N ASP A 4 2.456 -4.953 0.731 1.00 0.00 N ATOM 40 CA ASP A 4 2.472 -3.950 1.836 1.00 0.00 C ATOM 41 C ASP A 4 1.091 -3.239 1.966 1.00 0.00 C ATOM 42 O ASP A 4 0.166 -3.831 2.528 1.00 0.00 O ATOM 43 CB ASP A 4 3.683 -2.991 1.610 1.00 0.00 C ATOM 44 CG ASP A 4 3.500 -1.505 1.944 1.00 0.00 C ATOM 45 OD1 ASP A 4 3.010 -1.177 3.049 1.00 0.00 O ATOM 46 OD2 ASP A 4 3.836 -0.656 1.090 1.00 0.00 O ATOM 47 H ASP A 4 3.206 -5.686 0.736 1.00 0.00 H ATOM 48 HA ASP A 4 2.654 -4.480 2.789 1.00 0.00 H ATOM 49 HB2 ASP A 4 4.552 -3.364 2.203 1.00 0.00 H ATOM 50 HB3 ASP A 4 4.041 -3.060 0.561 1.00 0.00 H ATOM 51 N THR A 5 0.844 -2.051 1.372 1.00 0.00 N ATOM 52 CA THR A 5 -0.352 -1.193 1.596 1.00 0.00 C ATOM 53 C THR A 5 -0.013 0.106 2.388 1.00 0.00 C ATOM 54 O THR A 5 -0.343 0.212 3.572 1.00 0.00 O ATOM 55 CB THR A 5 -1.282 -1.052 0.333 1.00 0.00 C ATOM 56 OG1 THR A 5 -2.667 -0.938 0.775 1.00 0.00 O ATOM 57 CG2 THR A 5 -1.027 0.192 -0.540 1.00 0.00 C ATOM 58 H THR A 5 1.562 -1.784 0.689 1.00 0.00 H ATOM 59 HA THR A 5 -0.987 -1.813 2.254 1.00 0.00 H ATOM 60 HB THR A 5 -1.132 -1.938 -0.314 1.00 0.00 H ATOM 61 HG21 THR A 5 -0.019 0.175 -0.995 1.00 0.00 H ATOM 62 HG22 THR A 5 -1.113 1.128 0.045 1.00 0.00 H ATOM 63 HG23 THR A 5 -1.752 0.253 -1.370 1.00 0.00 H ATOM 64 N GLY A 6 0.736 1.087 1.833 1.00 0.00 N ATOM 65 CA GLY A 6 0.765 2.515 2.253 1.00 0.00 C ATOM 66 C GLY A 6 1.463 3.358 1.144 1.00 0.00 C ATOM 67 O GLY A 6 0.996 3.303 -0.008 1.00 0.00 O ATOM 68 H GLY A 6 1.240 0.781 0.986 1.00 0.00 H ATOM 69 HA2 GLY A 6 -0.259 2.861 2.456 1.00 0.00 H ATOM 70 HA3 GLY A 6 1.324 2.646 3.195 1.00 0.00 H HETATM 71 N ORN A 7 2.505 4.178 1.368 1.00 0.00 N HETATM 72 CA ORN A 7 2.829 4.941 2.605 1.00 0.00 C HETATM 73 CB ORN A 7 4.372 4.842 2.799 1.00 0.00 C HETATM 74 CG ORN A 7 5.087 3.734 1.981 1.00 0.00 C HETATM 75 CD ORN A 7 5.648 4.243 0.643 1.00 0.00 C HETATM 76 NE ORN A 7 7.122 4.189 0.624 1.00 0.00 N HETATM 77 C ORN A 7 2.351 6.422 2.516 1.00 0.00 C HETATM 78 O ORN A 7 2.333 6.973 1.411 1.00 0.00 O HETATM 79 H ORN A 7 3.207 4.166 0.602 1.00 0.00 H HETATM 80 HA ORN A 7 2.359 4.428 3.469 1.00 0.00 H HETATM 81 HB2 ORN A 7 4.835 5.811 2.531 1.00 0.00 H HETATM 82 HB3 ORN A 7 4.604 4.691 3.869 1.00 0.00 H HETATM 83 HG2 ORN A 7 5.910 3.307 2.587 1.00 0.00 H HETATM 84 HG3 ORN A 7 4.385 2.900 1.803 1.00 0.00 H HETATM 85 HD2 ORN A 7 5.252 3.644 -0.197 1.00 0.00 H HETATM 86 HD3 ORN A 7 5.328 5.285 0.459 1.00 0.00 H HETATM 87 HE1 ORN A 7 7.527 4.647 1.447 1.00 0.00 H HETATM 88 HE2 ORN A 7 7.507 4.656 -0.205 1.00 0.00 H HETATM 89 HE3 ORN A 7 7.464 3.221 0.614 1.00 0.00 H ATOM 90 N ASP A 8 2.073 7.154 3.612 1.00 0.00 N ATOM 91 CA ASP A 8 1.415 8.490 3.609 1.00 0.00 C ATOM 92 C ASP A 8 2.380 9.535 2.969 1.00 0.00 C ATOM 93 O ASP A 8 3.360 9.910 3.615 1.00 0.00 O ATOM 94 CB ASP A 8 0.952 8.829 5.056 1.00 0.00 C ATOM 95 CG ASP A 8 0.113 10.105 5.210 1.00 0.00 C ATOM 96 OD1 ASP A 8 0.029 10.909 4.255 1.00 0.00 O ATOM 97 OD2 ASP A 8 -0.471 10.306 6.297 1.00 0.00 O ATOM 98 H ASP A 8 2.450 6.760 4.481 1.00 0.00 H ATOM 99 HA ASP A 8 0.510 8.446 2.977 1.00 0.00 H ATOM 100 HB2 ASP A 8 0.348 7.996 5.464 1.00 0.00 H ATOM 101 HB3 ASP A 8 1.825 8.893 5.732 1.00 0.00 H HETATM 102 N DAL A 9 2.113 10.128 1.787 1.00 0.00 N HETATM 103 CA DAL A 9 3.081 10.924 0.983 1.00 0.00 C HETATM 104 CB DAL A 9 3.619 12.263 1.534 1.00 0.00 C HETATM 105 C DAL A 9 2.756 10.901 -0.542 1.00 0.00 C HETATM 106 O DAL A 9 2.362 11.939 -1.079 1.00 0.00 O HETATM 107 H DAL A 9 1.136 10.037 1.489 1.00 0.00 H HETATM 108 HA DAL A 9 3.991 10.296 1.047 1.00 0.00 H HETATM 109 HB1 DAL A 9 2.887 13.081 1.455 1.00 0.00 H HETATM 110 HB2 DAL A 9 3.921 12.181 2.594 1.00 0.00 H HETATM 111 HB3 DAL A 9 4.512 12.595 0.977 1.00 0.00 H ATOM 112 N ASP A 10 2.894 9.789 -1.293 1.00 0.00 N ATOM 113 CA ASP A 10 2.203 9.534 -2.587 1.00 0.00 C ATOM 114 C ASP A 10 1.180 8.368 -2.399 1.00 0.00 C ATOM 115 O ASP A 10 0.055 8.501 -2.895 1.00 0.00 O ATOM 116 CB ASP A 10 3.274 9.307 -3.695 1.00 0.00 C ATOM 117 CG ASP A 10 3.608 10.533 -4.558 1.00 0.00 C ATOM 118 OD1 ASP A 10 3.573 11.664 -4.024 1.00 0.00 O ATOM 119 OD2 ASP A 10 3.922 10.376 -5.759 1.00 0.00 O ATOM 120 H ASP A 10 3.491 9.072 -0.867 1.00 0.00 H ATOM 121 HA ASP A 10 1.626 10.431 -2.871 1.00 0.00 H ATOM 122 HB2 ASP A 10 4.212 8.919 -3.255 1.00 0.00 H ATOM 123 HB3 ASP A 10 2.942 8.511 -4.387 1.00 0.00 H ATOM 124 N GLY A 11 1.516 7.192 -1.833 1.00 0.00 N ATOM 125 CA GLY A 11 0.648 6.269 -1.058 1.00 0.00 C ATOM 126 C GLY A 11 -0.776 6.175 -1.684 1.00 0.00 C ATOM 127 O GLY A 11 -0.936 5.498 -2.702 1.00 0.00 O ATOM 128 H GLY A 11 2.513 6.941 -1.989 1.00 0.00 H ATOM 129 HA2 GLY A 11 1.088 5.261 -0.987 1.00 0.00 H ATOM 130 HA3 GLY A 11 0.595 6.630 -0.016 1.00 0.00 H HETATM 131 N DSN A 12 -1.808 6.908 -1.220 1.00 0.00 N HETATM 132 CA DSN A 12 -3.249 6.537 -1.287 1.00 0.00 C HETATM 133 C DSN A 12 -3.661 5.614 -0.097 1.00 0.00 C HETATM 134 O DSN A 12 -2.996 5.664 0.943 1.00 0.00 O HETATM 135 CB DSN A 12 -4.111 7.662 -1.923 1.00 0.00 C HETATM 136 OG DSN A 12 -3.859 7.759 -3.319 1.00 0.00 O HETATM 137 H DSN A 12 -1.515 7.746 -0.699 1.00 0.00 H HETATM 138 HA DSN A 12 -3.227 5.803 -2.125 1.00 0.00 H HETATM 139 HB2 DSN A 12 -5.183 7.526 -1.729 1.00 0.00 H HETATM 140 HB3 DSN A 12 -3.866 8.644 -1.479 1.00 0.00 H HETATM 141 HG DSN A 12 -4.241 6.972 -3.712 1.00 0.00 H HETATM 142 N LME A 13 -4.778 4.861 -0.118 1.00 0.00 N HETATM 143 CA LME A 13 -5.290 3.925 0.908 1.00 0.00 C HETATM 144 CB LME A 13 -6.744 4.252 1.454 1.00 0.00 C HETATM 145 C1 LME A 13 -6.970 3.792 2.923 1.00 0.00 C HETATM 146 CG LME A 13 -7.124 5.769 1.379 1.00 0.00 C HETATM 147 CD LME A 13 -7.978 6.317 2.538 1.00 0.00 C HETATM 148 OE1 LME A 13 -7.592 7.345 3.138 1.00 0.00 O HETATM 149 OE2 LME A 13 -9.038 5.728 2.840 1.00 0.00 O HETATM 150 C LME A 13 -4.869 2.429 0.696 1.00 0.00 C HETATM 151 O LME A 13 -4.357 2.087 -0.370 1.00 0.00 O HETATM 152 H LME A 13 -5.322 4.970 -0.999 1.00 0.00 H HETATM 153 HA LME A 13 -4.688 4.175 1.806 1.00 0.00 H HETATM 154 HB LME A 13 -7.449 3.696 0.814 1.00 0.00 H HETATM 155 H11 LME A 13 -7.973 4.034 3.290 1.00 0.00 H HETATM 156 H12 LME A 13 -6.855 2.700 3.038 1.00 0.00 H HETATM 157 H13 LME A 13 -6.238 4.266 3.608 1.00 0.00 H HETATM 158 HG2 LME A 13 -7.635 5.981 0.420 1.00 0.00 H HETATM 159 HG3 LME A 13 -6.218 6.394 1.356 1.00 0.00 H HETATM 160 C KYN A 14 -3.146 0.218 1.378 1.00 0.00 C HETATM 161 N KYN A 14 -5.179 1.501 1.629 1.00 0.00 N HETATM 162 C1 KYN A 14 -4.575 -2.069 3.110 1.00 0.00 C HETATM 163 N1 KYN A 14 -4.057 -4.592 1.503 1.00 0.00 N HETATM 164 O2 KYN A 14 -3.358 -2.179 3.289 1.00 0.00 O HETATM 165 CA KYN A 14 -4.664 0.107 1.663 1.00 0.00 C HETATM 166 CB KYN A 14 -5.063 -0.599 2.989 1.00 0.00 C HETATM 167 CG KYN A 14 -5.159 -4.479 2.248 1.00 0.00 C HETATM 168 CZ KYN A 14 -7.512 -4.424 3.752 1.00 0.00 C HETATM 169 CD1 KYN A 14 -6.034 -5.570 2.244 1.00 0.00 C HETATM 170 CD2 KYN A 14 -5.458 -3.320 3.026 1.00 0.00 C HETATM 171 CE1 KYN A 14 -7.200 -5.538 2.993 1.00 0.00 C HETATM 172 CE2 KYN A 14 -6.656 -3.332 3.769 1.00 0.00 C HETATM 173 O KYN A 14 -2.465 1.214 1.633 1.00 0.00 O HETATM 174 H KYN A 14 -5.746 1.883 2.402 1.00 0.00 H HETATM 175 HN1 KYN A 14 -3.415 -3.791 1.508 1.00 0.00 H HETATM 176 HN1A KYN A 14 -3.940 -5.471 0.984 1.00 0.00 H HETATM 177 HA KYN A 14 -5.107 -0.469 0.823 1.00 0.00 H HETATM 178 HB KYN A 14 -4.608 -0.043 3.833 1.00 0.00 H HETATM 179 HBA KYN A 14 -6.145 -0.493 3.176 1.00 0.00 H HETATM 180 HZ KYN A 14 -8.423 -4.404 4.332 1.00 0.00 H HETATM 181 HD1 KYN A 14 -5.828 -6.461 1.662 1.00 0.00 H HETATM 182 HE1 KYN A 14 -7.870 -6.386 2.983 1.00 0.00 H HETATM 183 HE2 KYN A 14 -6.963 -2.506 4.386 1.00 0.00 H TER 184 KYN A 14 HETATM 185 C1 DKA A 1 6.664 -8.413 -0.711 1.00 0.00 C HETATM 186 O1 DKA A 1 5.876 -8.074 0.175 1.00 0.00 O HETATM 187 C2 DKA A 1 7.956 -9.186 -0.308 1.00 0.00 C HETATM 188 C3 DKA A 1 8.524 -8.882 1.093 1.00 0.00 C HETATM 189 C4 DKA A 1 9.259 -10.079 1.733 1.00 0.00 C HETATM 190 C5 DKA A 1 8.344 -11.289 1.987 1.00 0.00 C HETATM 191 C6 DKA A 1 7.722 -11.267 3.396 1.00 0.00 C HETATM 192 C7 DKA A 1 6.458 -12.140 3.504 1.00 0.00 C HETATM 193 C8 DKA A 1 5.532 -11.708 4.657 1.00 0.00 C HETATM 194 C9 DKA A 1 4.411 -10.756 4.200 1.00 0.00 C HETATM 195 C10 DKA A 1 3.744 -10.017 5.366 1.00 0.00 C HETATM 196 H21 DKA A 1 8.764 -9.008 -1.038 1.00 0.00 H HETATM 197 H22 DKA A 1 7.733 -10.267 -0.376 1.00 0.00 H HETATM 198 H31 DKA A 1 9.231 -8.035 1.009 1.00 0.00 H HETATM 199 H32 DKA A 1 7.718 -8.521 1.759 1.00 0.00 H HETATM 200 H41 DKA A 1 10.106 -10.387 1.091 1.00 0.00 H HETATM 201 H42 DKA A 1 9.709 -9.752 2.688 1.00 0.00 H HETATM 202 H51 DKA A 1 7.536 -11.312 1.230 1.00 0.00 H HETATM 203 H52 DKA A 1 8.921 -12.222 1.842 1.00 0.00 H HETATM 204 H61 DKA A 1 8.471 -11.608 4.137 1.00 0.00 H HETATM 205 H62 DKA A 1 7.478 -10.224 3.673 1.00 0.00 H HETATM 206 H71 DKA A 1 5.899 -12.106 2.549 1.00 0.00 H HETATM 207 H72 DKA A 1 6.753 -13.198 3.643 1.00 0.00 H HETATM 208 H81 DKA A 1 5.086 -12.605 5.128 1.00 0.00 H HETATM 209 H82 DKA A 1 6.133 -11.221 5.450 1.00 0.00 H HETATM 210 H91 DKA A 1 3.640 -11.323 3.644 1.00 0.00 H HETATM 211 H92 DKA A 1 4.814 -10.015 3.485 1.00 0.00 H HETATM 212 H101 DKA A 1 3.664 -10.657 6.265 1.00 0.00 H HETATM 213 H102 DKA A 1 4.325 -9.120 5.652 1.00 0.00 H HETATM 214 H103 DKA A 1 2.724 -9.677 5.106 1.00 0.00 H