ATOM 1 N TRP A 2 6.704 -2.090 -1.163 1.00 0.00 N ATOM 2 CA TRP A 2 6.380 -3.504 -0.831 1.00 0.00 C ATOM 3 C TRP A 2 4.946 -3.562 -0.222 1.00 0.00 C ATOM 4 O TRP A 2 4.507 -2.557 0.347 1.00 0.00 O ATOM 5 CB TRP A 2 7.534 -4.215 -0.050 1.00 0.00 C ATOM 6 CG TRP A 2 8.111 -5.483 -0.702 1.00 0.00 C ATOM 7 CD1 TRP A 2 9.307 -5.541 -1.453 1.00 0.00 C ATOM 8 CD2 TRP A 2 7.633 -6.781 -0.668 1.00 0.00 C ATOM 9 NE1 TRP A 2 9.581 -6.846 -1.897 1.00 0.00 N ATOM 10 CE2 TRP A 2 8.535 -7.602 -1.394 1.00 0.00 C ATOM 11 CE3 TRP A 2 6.509 -7.350 -0.016 1.00 0.00 C ATOM 12 CZ2 TRP A 2 8.306 -8.996 -1.488 1.00 0.00 C ATOM 13 CZ3 TRP A 2 6.280 -8.719 -0.163 1.00 0.00 C ATOM 14 CH2 TRP A 2 7.170 -9.532 -0.877 1.00 0.00 C ATOM 15 H1 TRP A 2 7.358 -1.571 -0.549 1.00 0.00 H ATOM 16 HA TRP A 2 6.304 -4.109 -1.753 1.00 0.00 H ATOM 17 HB2 TRP A 2 8.383 -3.524 0.126 1.00 0.00 H ATOM 18 HB3 TRP A 2 7.171 -4.436 0.970 1.00 0.00 H ATOM 19 HD1 TRP A 2 9.961 -4.697 -1.623 1.00 0.00 H ATOM 20 HE1 TRP A 2 10.388 -7.173 -2.440 1.00 0.00 H ATOM 21 HE3 TRP A 2 5.857 -6.740 0.593 1.00 0.00 H ATOM 22 HZ2 TRP A 2 8.990 -9.635 -2.029 1.00 0.00 H ATOM 23 HZ3 TRP A 2 5.403 -9.159 0.289 1.00 0.00 H ATOM 24 HH2 TRP A 2 6.980 -10.592 -0.950 1.00 0.00 H HETATM 25 N DSG A 3 4.219 -4.698 -0.185 1.00 0.00 N HETATM 26 CA DSG A 3 2.781 -4.808 0.176 1.00 0.00 C HETATM 27 C DSG A 3 1.825 -3.637 -0.213 1.00 0.00 C HETATM 28 O DSG A 3 2.204 -2.796 -1.029 1.00 0.00 O HETATM 29 CB DSG A 3 2.280 -6.209 -0.300 1.00 0.00 C HETATM 30 CG DSG A 3 3.118 -7.419 0.171 1.00 0.00 C HETATM 31 OD1 DSG A 3 3.196 -8.448 -0.499 1.00 0.00 O HETATM 32 ND2 DSG A 3 3.767 -7.320 1.322 1.00 0.00 N HETATM 33 H DSG A 3 4.783 -5.543 -0.348 1.00 0.00 H HETATM 34 HA DSG A 3 2.759 -4.887 1.283 1.00 0.00 H HETATM 35 HB2 DSG A 3 1.236 -6.376 0.026 1.00 0.00 H HETATM 36 HB3 DSG A 3 2.213 -6.225 -1.407 1.00 0.00 H HETATM 37 HD21 DSG A 3 3.608 -6.470 1.873 1.00 0.00 H HETATM 38 HD22 DSG A 3 4.384 -8.103 1.565 1.00 0.00 H ATOM 39 N ASP A 4 0.549 -3.596 0.233 1.00 0.00 N ATOM 40 CA ASP A 4 -0.548 -2.773 -0.346 1.00 0.00 C ATOM 41 C ASP A 4 -0.424 -1.315 0.205 1.00 0.00 C ATOM 42 O ASP A 4 -0.258 -0.392 -0.595 1.00 0.00 O ATOM 43 CB ASP A 4 -1.920 -3.452 -0.061 1.00 0.00 C ATOM 44 CG ASP A 4 -2.818 -3.683 -1.285 1.00 0.00 C ATOM 45 OD1 ASP A 4 -2.294 -3.663 -2.420 1.00 0.00 O ATOM 46 OD2 ASP A 4 -4.045 -3.868 -1.124 1.00 0.00 O ATOM 47 H ASP A 4 0.348 -4.280 0.967 1.00 0.00 H ATOM 48 HA ASP A 4 -0.421 -2.739 -1.441 1.00 0.00 H ATOM 49 HB2 ASP A 4 -1.785 -4.411 0.471 1.00 0.00 H ATOM 50 HB3 ASP A 4 -2.505 -2.831 0.650 1.00 0.00 H ATOM 51 N THR A 5 -0.375 -1.076 1.527 1.00 0.00 N ATOM 52 CA THR A 5 -0.841 0.084 2.303 1.00 0.00 C ATOM 53 C THR A 5 -0.826 1.406 1.459 1.00 0.00 C ATOM 54 O THR A 5 -1.853 2.024 1.200 1.00 0.00 O ATOM 55 CB THR A 5 -2.019 -0.281 3.276 1.00 0.00 C ATOM 56 OG1 THR A 5 -3.248 -0.573 2.553 1.00 0.00 O ATOM 57 CG2 THR A 5 -1.775 -1.551 4.135 1.00 0.00 C ATOM 58 H THR A 5 0.147 -1.773 2.075 1.00 0.00 H ATOM 59 HA THR A 5 -0.022 0.253 3.061 1.00 0.00 H ATOM 60 HB THR A 5 -2.045 0.556 3.973 1.00 0.00 H ATOM 61 HG21 THR A 5 -0.930 -1.418 4.831 1.00 0.00 H ATOM 62 HG22 THR A 5 -1.568 -2.435 3.510 1.00 0.00 H ATOM 63 HG23 THR A 5 -2.666 -1.782 4.752 1.00 0.00 H ATOM 64 N GLY A 6 0.398 1.926 1.145 1.00 0.00 N ATOM 65 CA GLY A 6 0.692 3.108 0.298 1.00 0.00 C ATOM 66 C GLY A 6 2.087 2.925 -0.373 1.00 0.00 C ATOM 67 O GLY A 6 2.139 2.442 -1.509 1.00 0.00 O ATOM 68 H GLY A 6 1.165 1.449 1.675 1.00 0.00 H ATOM 69 HA2 GLY A 6 -0.110 3.244 -0.443 1.00 0.00 H ATOM 70 HA3 GLY A 6 0.712 4.037 0.896 1.00 0.00 H HETATM 71 N ORN A 7 3.242 3.199 0.268 1.00 0.00 N HETATM 72 CA ORN A 7 3.433 3.257 1.743 1.00 0.00 C HETATM 73 CB ORN A 7 4.763 2.513 2.067 1.00 0.00 C HETATM 74 CG ORN A 7 4.841 1.750 3.416 1.00 0.00 C HETATM 75 CD ORN A 7 5.611 2.502 4.512 1.00 0.00 C HETATM 76 NE ORN A 7 4.889 2.475 5.797 1.00 0.00 N HETATM 77 C ORN A 7 3.440 4.727 2.266 1.00 0.00 C HETATM 78 O ORN A 7 2.867 5.597 1.608 1.00 0.00 O HETATM 79 H ORN A 7 4.052 3.270 -0.362 1.00 0.00 H HETATM 80 HA ORN A 7 2.628 2.671 2.230 1.00 0.00 H HETATM 81 HB2 ORN A 7 4.920 1.742 1.271 1.00 0.00 H HETATM 82 HB3 ORN A 7 5.639 3.187 1.959 1.00 0.00 H HETATM 83 HG2 ORN A 7 3.810 1.537 3.773 1.00 0.00 H HETATM 84 HG3 ORN A 7 5.299 0.754 3.246 1.00 0.00 H HETATM 85 HD2 ORN A 7 6.616 2.061 4.652 1.00 0.00 H HETATM 86 HD3 ORN A 7 5.775 3.556 4.219 1.00 0.00 H HETATM 87 HE1 ORN A 7 5.200 1.697 6.389 1.00 0.00 H HETATM 88 HE2 ORN A 7 3.877 2.366 5.659 1.00 0.00 H HETATM 89 HE3 ORN A 7 5.031 3.339 6.330 1.00 0.00 H ATOM 90 N ASP A 8 3.951 5.030 3.478 1.00 0.00 N ATOM 91 CA ASP A 8 4.528 6.336 3.899 1.00 0.00 C ATOM 92 C ASP A 8 4.931 7.155 2.635 1.00 0.00 C ATOM 93 O ASP A 8 5.957 6.847 2.026 1.00 0.00 O ATOM 94 CB ASP A 8 5.690 6.070 4.901 1.00 0.00 C ATOM 95 CG ASP A 8 6.656 7.240 5.135 1.00 0.00 C ATOM 96 OD1 ASP A 8 6.282 8.409 4.887 1.00 0.00 O ATOM 97 OD2 ASP A 8 7.802 6.989 5.567 1.00 0.00 O ATOM 98 H ASP A 8 4.007 4.210 4.105 1.00 0.00 H ATOM 99 HA ASP A 8 3.758 6.916 4.438 1.00 0.00 H ATOM 100 HB2 ASP A 8 5.279 5.789 5.891 1.00 0.00 H ATOM 101 HB3 ASP A 8 6.275 5.185 4.586 1.00 0.00 H HETATM 102 N DAL A 9 4.201 8.201 2.197 1.00 0.00 N HETATM 103 CA DAL A 9 4.657 9.226 1.217 1.00 0.00 C HETATM 104 CB DAL A 9 5.828 10.171 1.579 1.00 0.00 C HETATM 105 C DAL A 9 3.470 9.884 0.446 1.00 0.00 C HETATM 106 O DAL A 9 3.150 11.042 0.725 1.00 0.00 O HETATM 107 H DAL A 9 3.257 8.244 2.597 1.00 0.00 H HETATM 108 HA DAL A 9 5.136 8.599 0.442 1.00 0.00 H HETATM 109 HB1 DAL A 9 5.530 10.970 2.273 1.00 0.00 H HETATM 110 HB2 DAL A 9 6.672 9.623 2.036 1.00 0.00 H HETATM 111 HB3 DAL A 9 6.226 10.675 0.683 1.00 0.00 H ATOM 112 N ASP A 10 2.830 9.249 -0.556 1.00 0.00 N ATOM 113 CA ASP A 10 1.651 9.776 -1.298 1.00 0.00 C ATOM 114 C ASP A 10 0.393 8.932 -0.929 1.00 0.00 C ATOM 115 O ASP A 10 -0.667 9.520 -0.699 1.00 0.00 O ATOM 116 CB ASP A 10 1.989 9.817 -2.817 1.00 0.00 C ATOM 117 CG ASP A 10 2.457 11.174 -3.362 1.00 0.00 C ATOM 118 OD1 ASP A 10 2.050 12.214 -2.800 1.00 0.00 O ATOM 119 OD2 ASP A 10 3.233 11.213 -4.343 1.00 0.00 O ATOM 120 H ASP A 10 3.164 8.293 -0.720 1.00 0.00 H ATOM 121 HA ASP A 10 1.458 10.816 -0.976 1.00 0.00 H ATOM 122 HB2 ASP A 10 2.750 9.054 -3.064 1.00 0.00 H ATOM 123 HB3 ASP A 10 1.101 9.523 -3.409 1.00 0.00 H ATOM 124 N GLY A 11 0.392 7.584 -0.967 1.00 0.00 N ATOM 125 CA GLY A 11 -0.494 6.700 -0.160 1.00 0.00 C ATOM 126 C GLY A 11 -1.301 5.772 -1.120 1.00 0.00 C ATOM 127 O GLY A 11 -0.695 4.889 -1.734 1.00 0.00 O ATOM 128 H GLY A 11 1.006 7.189 -1.688 1.00 0.00 H ATOM 129 HA2 GLY A 11 0.073 6.095 0.551 1.00 0.00 H ATOM 130 HA3 GLY A 11 -1.164 7.324 0.436 1.00 0.00 H HETATM 131 N DSN A 12 -2.634 5.888 -1.273 1.00 0.00 N HETATM 132 CA DSN A 12 -3.516 4.982 -2.060 1.00 0.00 C HETATM 133 C DSN A 12 -4.249 3.953 -1.145 1.00 0.00 C HETATM 134 O DSN A 12 -4.333 4.195 0.064 1.00 0.00 O HETATM 135 CB DSN A 12 -4.113 5.691 -3.309 1.00 0.00 C HETATM 136 OG DSN A 12 -5.484 6.004 -3.103 1.00 0.00 O HETATM 137 H DSN A 12 -3.047 6.654 -0.720 1.00 0.00 H HETATM 138 HA DSN A 12 -2.756 4.329 -2.543 1.00 0.00 H HETATM 139 HB2 DSN A 12 -3.544 6.590 -3.588 1.00 0.00 H HETATM 140 HB3 DSN A 12 -4.057 5.034 -4.196 1.00 0.00 H HETATM 141 HG DSN A 12 -5.498 6.707 -2.448 1.00 0.00 H HETATM 142 N LME A 13 -4.817 2.828 -1.618 1.00 0.00 N HETATM 143 CA LME A 13 -5.799 1.962 -0.923 1.00 0.00 C HETATM 144 CB LME A 13 -6.957 1.408 -1.855 1.00 0.00 C HETATM 145 C1 LME A 13 -8.317 1.295 -1.111 1.00 0.00 C HETATM 146 CG LME A 13 -7.187 2.255 -3.154 1.00 0.00 C HETATM 147 CD LME A 13 -6.132 2.174 -4.273 1.00 0.00 C HETATM 148 OE1 LME A 13 -5.988 3.154 -5.037 1.00 0.00 O HETATM 149 OE2 LME A 13 -5.447 1.134 -4.387 1.00 0.00 O HETATM 150 C LME A 13 -5.213 1.038 0.195 1.00 0.00 C HETATM 151 O LME A 13 -3.999 0.837 0.231 1.00 0.00 O HETATM 152 H LME A 13 -4.606 2.632 -2.616 1.00 0.00 H HETATM 153 HA LME A 13 -6.371 2.691 -0.307 1.00 0.00 H HETATM 154 HB LME A 13 -6.649 0.398 -2.165 1.00 0.00 H HETATM 155 H11 LME A 13 -9.122 0.920 -1.768 1.00 0.00 H HETATM 156 H12 LME A 13 -8.278 0.594 -0.259 1.00 0.00 H HETATM 157 H13 LME A 13 -8.650 2.272 -0.714 1.00 0.00 H HETATM 158 HG2 LME A 13 -7.400 3.314 -2.903 1.00 0.00 H HETATM 159 HG3 LME A 13 -8.127 1.916 -3.632 1.00 0.00 H HETATM 160 C KYN A 14 -4.459 0.029 2.867 1.00 0.00 C HETATM 161 N KYN A 14 -6.031 0.356 1.021 1.00 0.00 N HETATM 162 C1 KYN A 14 -6.490 -1.842 4.208 1.00 0.00 C HETATM 163 N1 KYN A 14 -5.879 -1.874 7.186 1.00 0.00 N HETATM 164 O2 KYN A 14 -5.319 -2.230 4.255 1.00 0.00 O HETATM 165 CA KYN A 14 -5.621 -0.615 2.068 1.00 0.00 C HETATM 166 CB KYN A 14 -6.851 -1.053 2.917 1.00 0.00 C HETATM 167 CG KYN A 14 -7.109 -2.147 6.745 1.00 0.00 C HETATM 168 CZ KYN A 14 -9.738 -2.734 6.005 1.00 0.00 C HETATM 169 CD1 KYN A 14 -8.075 -2.434 7.714 1.00 0.00 C HETATM 170 CD2 KYN A 14 -7.457 -2.148 5.360 1.00 0.00 C HETATM 171 CE1 KYN A 14 -9.379 -2.724 7.341 1.00 0.00 C HETATM 172 CE2 KYN A 14 -8.794 -2.451 5.029 1.00 0.00 C HETATM 173 O KYN A 14 -4.596 0.930 3.698 1.00 0.00 O HETATM 174 H KYN A 14 -7.035 0.465 0.778 1.00 0.00 H HETATM 175 HN1 KYN A 14 -5.171 -1.657 6.475 1.00 0.00 H HETATM 176 HN1A KYN A 14 -5.740 -1.898 8.203 1.00 0.00 H HETATM 177 HA KYN A 14 -5.208 -1.521 1.582 1.00 0.00 H HETATM 178 HB KYN A 14 -7.398 -0.147 3.242 1.00 0.00 H HETATM 179 HBA KYN A 14 -7.589 -1.580 2.290 1.00 0.00 H HETATM 180 HZ KYN A 14 -10.755 -2.962 5.721 1.00 0.00 H HETATM 181 HD1 KYN A 14 -7.836 -2.439 8.770 1.00 0.00 H HETATM 182 HE1 KYN A 14 -10.118 -2.943 8.098 1.00 0.00 H HETATM 183 HE2 KYN A 14 -9.144 -2.487 4.013 1.00 0.00 H TER 184 KYN A 14 HETATM 185 C1 DKA A 1 6.343 -1.413 -2.271 1.00 0.00 C HETATM 186 O1 DKA A 1 5.299 -1.724 -2.849 1.00 0.00 O HETATM 187 C2 DKA A 1 7.133 -0.166 -2.771 1.00 0.00 C HETATM 188 C3 DKA A 1 6.761 0.369 -4.170 1.00 0.00 C HETATM 189 C4 DKA A 1 7.891 1.175 -4.842 1.00 0.00 C HETATM 190 C5 DKA A 1 7.846 1.124 -6.378 1.00 0.00 C HETATM 191 C6 DKA A 1 9.208 0.747 -6.992 1.00 0.00 C HETATM 192 C7 DKA A 1 10.368 1.596 -6.436 1.00 0.00 C HETATM 193 C8 DKA A 1 11.466 0.742 -5.772 1.00 0.00 C HETATM 194 C9 DKA A 1 12.056 1.403 -4.512 1.00 0.00 C HETATM 195 C10 DKA A 1 13.197 2.377 -4.829 1.00 0.00 C HETATM 196 H21 DKA A 1 8.219 -0.365 -2.773 1.00 0.00 H HETATM 197 H22 DKA A 1 6.987 0.641 -2.029 1.00 0.00 H HETATM 198 H31 DKA A 1 6.503 -0.491 -4.815 1.00 0.00 H HETATM 199 H32 DKA A 1 5.837 0.974 -4.109 1.00 0.00 H HETATM 200 H41 DKA A 1 7.851 2.230 -4.508 1.00 0.00 H HETATM 201 H42 DKA A 1 8.865 0.785 -4.488 1.00 0.00 H HETATM 202 H51 DKA A 1 7.081 0.393 -6.705 1.00 0.00 H HETATM 203 H52 DKA A 1 7.515 2.105 -6.769 1.00 0.00 H HETATM 204 H61 DKA A 1 9.414 -0.325 -6.809 1.00 0.00 H HETATM 205 H62 DKA A 1 9.159 0.860 -8.091 1.00 0.00 H HETATM 206 H71 DKA A 1 10.812 2.198 -7.252 1.00 0.00 H HETATM 207 H72 DKA A 1 9.971 2.324 -5.703 1.00 0.00 H HETATM 208 H81 DKA A 1 11.052 -0.250 -5.510 1.00 0.00 H HETATM 209 H82 DKA A 1 12.275 0.547 -6.501 1.00 0.00 H HETATM 210 H91 DKA A 1 12.429 0.626 -3.818 1.00 0.00 H HETATM 211 H92 DKA A 1 11.262 1.942 -3.962 1.00 0.00 H HETATM 212 H101 DKA A 1 14.004 2.321 -4.076 1.00 0.00 H HETATM 213 H102 DKA A 1 13.650 2.151 -5.812 1.00 0.00 H HETATM 214 H103 DKA A 1 12.843 3.424 -4.865 1.00 0.00 H