ATOM 1 N TRP A 2 0.928 -7.550 3.987 1.00 0.00 N ATOM 2 CA TRP A 2 0.633 -8.361 2.773 1.00 0.00 C ATOM 3 C TRP A 2 1.229 -7.642 1.522 1.00 0.00 C ATOM 4 O TRP A 2 1.276 -6.407 1.533 1.00 0.00 O ATOM 5 CB TRP A 2 -0.856 -8.819 2.681 1.00 0.00 C ATOM 6 CG TRP A 2 -1.393 -8.996 1.246 1.00 0.00 C ATOM 7 CD1 TRP A 2 -1.715 -7.923 0.383 1.00 0.00 C ATOM 8 CD2 TRP A 2 -1.689 -10.144 0.533 1.00 0.00 C ATOM 9 NE1 TRP A 2 -2.216 -8.374 -0.849 1.00 0.00 N ATOM 10 CE2 TRP A 2 -2.192 -9.754 -0.737 1.00 0.00 C ATOM 11 CE3 TRP A 2 -1.510 -11.515 0.843 1.00 0.00 C ATOM 12 CZ2 TRP A 2 -2.595 -10.736 -1.673 1.00 0.00 C ATOM 13 CZ3 TRP A 2 -1.939 -12.467 -0.086 1.00 0.00 C ATOM 14 CH2 TRP A 2 -2.478 -12.083 -1.322 1.00 0.00 C ATOM 15 H1 TRP A 2 0.173 -7.055 4.476 1.00 0.00 H ATOM 16 HA TRP A 2 1.171 -9.323 2.838 1.00 0.00 H ATOM 17 HB2 TRP A 2 -1.050 -9.749 3.227 1.00 0.00 H ATOM 18 HB3 TRP A 2 -1.480 -8.063 3.195 1.00 0.00 H ATOM 19 HD1 TRP A 2 -1.538 -6.882 0.622 1.00 0.00 H ATOM 20 HE1 TRP A 2 -2.543 -7.810 -1.641 1.00 0.00 H ATOM 21 HE3 TRP A 2 -1.046 -11.828 1.767 1.00 0.00 H ATOM 22 HZ2 TRP A 2 -2.979 -10.454 -2.643 1.00 0.00 H ATOM 23 HZ3 TRP A 2 -1.861 -13.517 0.155 1.00 0.00 H ATOM 24 HH2 TRP A 2 -2.817 -12.841 -2.012 1.00 0.00 H HETATM 25 N DSG A 3 1.653 -8.302 0.419 1.00 0.00 N HETATM 26 CA DSG A 3 2.677 -7.862 -0.568 1.00 0.00 C HETATM 27 C DSG A 3 3.297 -6.440 -0.378 1.00 0.00 C HETATM 28 O DSG A 3 4.458 -6.333 0.018 1.00 0.00 O HETATM 29 CB DSG A 3 3.727 -9.011 -0.686 1.00 0.00 C HETATM 30 CG DSG A 3 3.846 -9.879 0.597 1.00 0.00 C HETATM 31 OD1 DSG A 3 4.084 -11.083 0.560 1.00 0.00 O HETATM 32 ND2 DSG A 3 3.654 -9.265 1.758 1.00 0.00 N HETATM 33 H DSG A 3 1.296 -9.275 0.387 1.00 0.00 H HETATM 34 HA DSG A 3 2.167 -7.864 -1.549 1.00 0.00 H HETATM 35 HB2 DSG A 3 3.491 -9.680 -1.533 1.00 0.00 H HETATM 36 HB3 DSG A 3 4.724 -8.600 -0.948 1.00 0.00 H HETATM 37 HD21 DSG A 3 3.529 -8.244 1.739 1.00 0.00 H HETATM 38 HD22 DSG A 3 3.611 -9.863 2.588 1.00 0.00 H ATOM 39 N ASP A 4 2.546 -5.334 -0.567 1.00 0.00 N ATOM 40 CA ASP A 4 3.010 -3.976 -0.982 1.00 0.00 C ATOM 41 C ASP A 4 2.717 -2.935 0.142 1.00 0.00 C ATOM 42 O ASP A 4 3.489 -2.895 1.113 1.00 0.00 O ATOM 43 CB ASP A 4 2.382 -3.692 -2.388 1.00 0.00 C ATOM 44 CG ASP A 4 2.172 -2.233 -2.800 1.00 0.00 C ATOM 45 OD1 ASP A 4 3.087 -1.399 -2.610 1.00 0.00 O ATOM 46 OD2 ASP A 4 1.088 -1.913 -3.334 1.00 0.00 O ATOM 47 H ASP A 4 1.540 -5.520 -0.560 1.00 0.00 H ATOM 48 HA ASP A 4 4.101 -4.015 -1.117 1.00 0.00 H ATOM 49 HB2 ASP A 4 3.037 -4.177 -3.155 1.00 0.00 H ATOM 50 HB3 ASP A 4 1.421 -4.245 -2.517 1.00 0.00 H ATOM 51 N THR A 5 1.711 -2.042 0.090 1.00 0.00 N ATOM 52 CA THR A 5 1.320 -1.064 1.138 1.00 0.00 C ATOM 53 C THR A 5 2.251 0.181 1.228 1.00 0.00 C ATOM 54 O THR A 5 2.718 0.520 2.326 1.00 0.00 O ATOM 55 CB THR A 5 -0.246 -0.828 1.161 1.00 0.00 C ATOM 56 OG1 THR A 5 -0.612 0.069 0.074 1.00 0.00 O ATOM 57 CG2 THR A 5 -1.112 -2.099 0.987 1.00 0.00 C ATOM 58 H THR A 5 1.097 -2.154 -0.726 1.00 0.00 H ATOM 59 HA THR A 5 1.467 -1.626 2.078 1.00 0.00 H ATOM 60 HB THR A 5 -0.506 -0.427 2.148 1.00 0.00 H ATOM 61 HG21 THR A 5 -0.966 -2.805 1.824 1.00 0.00 H ATOM 62 HG22 THR A 5 -0.864 -2.633 0.051 1.00 0.00 H ATOM 63 HG23 THR A 5 -2.182 -1.846 0.956 1.00 0.00 H ATOM 64 N GLY A 6 2.472 0.988 0.168 1.00 0.00 N ATOM 65 CA GLY A 6 3.541 2.020 0.089 1.00 0.00 C ATOM 66 C GLY A 6 3.161 3.104 -0.962 1.00 0.00 C ATOM 67 O GLY A 6 2.169 2.918 -1.673 1.00 0.00 O ATOM 68 H GLY A 6 1.759 0.909 -0.566 1.00 0.00 H ATOM 69 HA2 GLY A 6 3.711 2.452 1.091 1.00 0.00 H ATOM 70 HA3 GLY A 6 4.509 1.571 -0.205 1.00 0.00 H HETATM 71 N ORN A 7 3.902 4.212 -1.150 1.00 0.00 N HETATM 72 CA ORN A 7 4.753 4.925 -0.157 1.00 0.00 C HETATM 73 CB ORN A 7 6.072 5.275 -0.912 1.00 0.00 C HETATM 74 CG ORN A 7 6.706 4.127 -1.731 1.00 0.00 C HETATM 75 CD ORN A 7 8.035 4.529 -2.396 1.00 0.00 C HETATM 76 NE ORN A 7 8.127 5.988 -2.580 1.00 0.00 N HETATM 77 C ORN A 7 4.040 6.187 0.419 1.00 0.00 C HETATM 78 O ORN A 7 3.281 6.821 -0.325 1.00 0.00 O HETATM 79 H ORN A 7 3.964 4.519 -2.142 1.00 0.00 H HETATM 80 HA ORN A 7 5.030 4.227 0.657 1.00 0.00 H HETATM 81 HB2 ORN A 7 5.875 6.126 -1.592 1.00 0.00 H HETATM 82 HB3 ORN A 7 6.817 5.648 -0.188 1.00 0.00 H HETATM 83 HG2 ORN A 7 6.877 3.254 -1.071 1.00 0.00 H HETATM 84 HG3 ORN A 7 5.989 3.784 -2.501 1.00 0.00 H HETATM 85 HD2 ORN A 7 8.890 4.184 -1.786 1.00 0.00 H HETATM 86 HD3 ORN A 7 8.140 4.038 -3.382 1.00 0.00 H HETATM 87 HE1 ORN A 7 8.323 6.470 -1.695 1.00 0.00 H HETATM 88 HE2 ORN A 7 7.257 6.379 -2.953 1.00 0.00 H HETATM 89 HE3 ORN A 7 8.879 6.240 -3.234 1.00 0.00 H ATOM 90 N ASP A 8 4.239 6.638 1.672 1.00 0.00 N ATOM 91 CA ASP A 8 3.319 7.540 2.421 1.00 0.00 C ATOM 92 C ASP A 8 3.642 9.021 2.055 1.00 0.00 C ATOM 93 O ASP A 8 4.812 9.335 1.828 1.00 0.00 O ATOM 94 CB ASP A 8 3.414 7.207 3.939 1.00 0.00 C ATOM 95 CG ASP A 8 2.431 7.953 4.851 1.00 0.00 C ATOM 96 OD1 ASP A 8 1.263 7.526 4.981 1.00 0.00 O ATOM 97 OD2 ASP A 8 2.834 8.972 5.454 1.00 0.00 O ATOM 98 H ASP A 8 5.156 6.392 2.060 1.00 0.00 H ATOM 99 HA ASP A 8 2.280 7.339 2.105 1.00 0.00 H ATOM 100 HB2 ASP A 8 3.295 6.120 4.101 1.00 0.00 H ATOM 101 HB3 ASP A 8 4.431 7.432 4.313 1.00 0.00 H HETATM 102 N DAL A 9 2.703 9.988 2.098 1.00 0.00 N HETATM 103 CA DAL A 9 2.848 11.359 1.538 1.00 0.00 C HETATM 104 CB DAL A 9 3.938 12.306 2.093 1.00 0.00 C HETATM 105 C DAL A 9 1.473 12.023 1.217 1.00 0.00 C HETATM 106 O DAL A 9 1.074 12.937 1.941 1.00 0.00 O HETATM 107 H DAL A 9 1.831 9.701 2.557 1.00 0.00 H HETATM 108 HA DAL A 9 3.257 11.148 0.532 1.00 0.00 H HETATM 109 HB1 DAL A 9 3.669 12.738 3.069 1.00 0.00 H HETATM 110 HB2 DAL A 9 4.909 11.793 2.205 1.00 0.00 H HETATM 111 HB3 DAL A 9 4.108 13.161 1.416 1.00 0.00 H ATOM 112 N ASP A 10 0.702 11.623 0.187 1.00 0.00 N ATOM 113 CA ASP A 10 -0.769 11.828 0.074 1.00 0.00 C ATOM 114 C ASP A 10 -1.509 10.681 0.828 1.00 0.00 C ATOM 115 O ASP A 10 -2.345 10.976 1.685 1.00 0.00 O ATOM 116 CB ASP A 10 -1.134 11.964 -1.435 1.00 0.00 C ATOM 117 CG ASP A 10 -1.327 10.657 -2.216 1.00 0.00 C ATOM 118 OD1 ASP A 10 -0.322 10.115 -2.727 1.00 0.00 O ATOM 119 OD2 ASP A 10 -2.473 10.171 -2.334 1.00 0.00 O ATOM 120 H ASP A 10 1.226 11.237 -0.607 1.00 0.00 H ATOM 121 HA ASP A 10 -1.043 12.779 0.566 1.00 0.00 H ATOM 122 HB2 ASP A 10 -2.076 12.539 -1.537 1.00 0.00 H ATOM 123 HB3 ASP A 10 -0.381 12.583 -1.962 1.00 0.00 H ATOM 124 N GLY A 11 -1.347 9.385 0.490 1.00 0.00 N ATOM 125 CA GLY A 11 -1.759 8.219 1.315 1.00 0.00 C ATOM 126 C GLY A 11 -2.928 7.473 0.601 1.00 0.00 C ATOM 127 O GLY A 11 -2.937 7.425 -0.630 1.00 0.00 O ATOM 128 H GLY A 11 -0.803 9.251 -0.371 1.00 0.00 H ATOM 129 HA2 GLY A 11 -0.929 7.528 1.488 1.00 0.00 H ATOM 130 HA3 GLY A 11 -2.067 8.578 2.302 1.00 0.00 H HETATM 131 N DSN A 12 -3.984 6.985 1.283 1.00 0.00 N HETATM 132 CA DSN A 12 -5.047 6.110 0.714 1.00 0.00 C HETATM 133 C DSN A 12 -4.499 4.696 0.352 1.00 0.00 C HETATM 134 O DSN A 12 -3.429 4.334 0.853 1.00 0.00 O HETATM 135 CB DSN A 12 -6.445 6.428 1.314 1.00 0.00 C HETATM 136 OG DSN A 12 -6.645 5.716 2.528 1.00 0.00 O HETATM 137 H DSN A 12 -4.030 7.294 2.260 1.00 0.00 H HETATM 138 HA DSN A 12 -5.154 6.562 -0.299 1.00 0.00 H HETATM 139 HB2 DSN A 12 -6.598 7.506 1.464 1.00 0.00 H HETATM 140 HB3 DSN A 12 -7.250 6.122 0.621 1.00 0.00 H HETATM 141 HG DSN A 12 -6.056 6.119 3.170 1.00 0.00 H HETATM 142 N LME A 13 -5.141 3.855 -0.482 1.00 0.00 N HETATM 143 CA LME A 13 -4.752 2.470 -0.837 1.00 0.00 C HETATM 144 CB LME A 13 -5.947 1.562 -1.343 1.00 0.00 C HETATM 145 C1 LME A 13 -5.771 0.067 -0.950 1.00 0.00 C HETATM 146 CG LME A 13 -7.356 2.025 -0.835 1.00 0.00 C HETATM 147 CD LME A 13 -7.966 3.332 -1.370 1.00 0.00 C HETATM 148 OE1 LME A 13 -8.731 3.988 -0.627 1.00 0.00 O HETATM 149 OE2 LME A 13 -7.669 3.713 -2.522 1.00 0.00 O HETATM 150 C LME A 13 -3.337 2.321 -1.496 1.00 0.00 C HETATM 151 O LME A 13 -2.765 3.319 -1.936 1.00 0.00 O HETATM 152 H LME A 13 -5.941 4.289 -0.984 1.00 0.00 H HETATM 153 HA LME A 13 -4.557 2.002 0.155 1.00 0.00 H HETATM 154 HB LME A 13 -5.948 1.621 -2.443 1.00 0.00 H HETATM 155 H11 LME A 13 -6.612 -0.558 -1.293 1.00 0.00 H HETATM 156 H12 LME A 13 -4.864 -0.382 -1.389 1.00 0.00 H HETATM 157 H13 LME A 13 -5.697 -0.060 0.147 1.00 0.00 H HETATM 158 HG2 LME A 13 -8.093 1.208 -1.019 1.00 0.00 H HETATM 159 HG3 LME A 13 -7.350 2.102 0.269 1.00 0.00 H HETATM 160 C KYN A 14 -0.942 -0.375 -1.199 1.00 0.00 C HETATM 161 N KYN A 14 -2.797 1.097 -1.674 1.00 0.00 N HETATM 162 C1 KYN A 14 0.052 0.771 -4.279 1.00 0.00 C HETATM 163 N1 KYN A 14 1.883 1.955 -6.403 1.00 0.00 N HETATM 164 O2 KYN A 14 0.773 1.548 -3.652 1.00 0.00 O HETATM 165 CA KYN A 14 -1.406 0.795 -2.104 1.00 0.00 C HETATM 166 CB KYN A 14 -1.349 0.547 -3.638 1.00 0.00 C HETATM 167 CG KYN A 14 1.417 0.710 -6.527 1.00 0.00 C HETATM 168 CZ KYN A 14 0.524 -1.900 -6.966 1.00 0.00 C HETATM 169 CD1 KYN A 14 1.815 0.002 -7.666 1.00 0.00 C HETATM 170 CD2 KYN A 14 0.551 0.104 -5.570 1.00 0.00 C HETATM 171 CE1 KYN A 14 1.369 -1.293 -7.879 1.00 0.00 C HETATM 172 CE2 KYN A 14 0.120 -1.214 -5.831 1.00 0.00 C HETATM 173 O KYN A 14 -0.905 -1.546 -1.580 1.00 0.00 O HETATM 174 H KYN A 14 -3.462 0.327 -1.479 1.00 0.00 H HETATM 175 HN1 KYN A 14 1.587 2.478 -5.573 1.00 0.00 H HETATM 176 HN1A KYN A 14 2.497 2.294 -7.154 1.00 0.00 H HETATM 177 HA KYN A 14 -0.748 1.657 -1.877 1.00 0.00 H HETATM 178 HB KYN A 14 -1.620 -0.509 -3.833 1.00 0.00 H HETATM 179 HBA KYN A 14 -2.146 1.108 -4.155 1.00 0.00 H HETATM 180 HZ KYN A 14 0.178 -2.909 -7.138 1.00 0.00 H HETATM 181 HD1 KYN A 14 2.474 0.442 -8.405 1.00 0.00 H HETATM 182 HE1 KYN A 14 1.684 -1.832 -8.762 1.00 0.00 H HETATM 183 HE2 KYN A 14 -0.530 -1.754 -5.165 1.00 0.00 H TER 184 KYN A 14 HETATM 185 C1 DKA A 1 2.130 -7.456 4.589 1.00 0.00 C HETATM 186 O1 DKA A 1 3.149 -7.585 3.903 1.00 0.00 O HETATM 187 C2 DKA A 1 2.287 -7.165 6.111 1.00 0.00 C HETATM 188 C3 DKA A 1 3.594 -7.663 6.765 1.00 0.00 C HETATM 189 C4 DKA A 1 4.239 -6.640 7.723 1.00 0.00 C HETATM 190 C5 DKA A 1 5.533 -7.151 8.378 1.00 0.00 C HETATM 191 C6 DKA A 1 6.714 -7.193 7.389 1.00 0.00 C HETATM 192 C7 DKA A 1 7.748 -8.281 7.736 1.00 0.00 C HETATM 193 C8 DKA A 1 8.828 -8.446 6.651 1.00 0.00 C HETATM 194 C9 DKA A 1 9.521 -9.821 6.701 1.00 0.00 C HETATM 195 C10 DKA A 1 10.756 -9.834 7.608 1.00 0.00 C HETATM 196 H21 DKA A 1 2.202 -6.083 6.314 1.00 0.00 H HETATM 197 H22 DKA A 1 1.429 -7.629 6.630 1.00 0.00 H HETATM 198 H31 DKA A 1 3.370 -8.587 7.331 1.00 0.00 H HETATM 199 H32 DKA A 1 4.313 -7.970 5.983 1.00 0.00 H HETATM 200 H41 DKA A 1 4.450 -5.698 7.181 1.00 0.00 H HETATM 201 H42 DKA A 1 3.508 -6.376 8.509 1.00 0.00 H HETATM 202 H51 DKA A 1 5.797 -6.506 9.237 1.00 0.00 H HETATM 203 H52 DKA A 1 5.358 -8.161 8.797 1.00 0.00 H HETATM 204 H61 DKA A 1 6.332 -7.359 6.363 1.00 0.00 H HETATM 205 H62 DKA A 1 7.209 -6.203 7.367 1.00 0.00 H HETATM 206 H71 DKA A 1 8.229 -8.040 8.703 1.00 0.00 H HETATM 207 H72 DKA A 1 7.228 -9.246 7.889 1.00 0.00 H HETATM 208 H81 DKA A 1 8.373 -8.298 5.653 1.00 0.00 H HETATM 209 H82 DKA A 1 9.586 -7.647 6.759 1.00 0.00 H HETATM 210 H91 DKA A 1 9.821 -10.129 5.681 1.00 0.00 H HETATM 211 H92 DKA A 1 8.806 -10.591 7.050 1.00 0.00 H HETATM 212 H101 DKA A 1 11.541 -10.511 7.223 1.00 0.00 H HETATM 213 H102 DKA A 1 11.202 -8.825 7.685 1.00 0.00 H HETATM 214 H103 DKA A 1 10.506 -10.160 8.635 1.00 0.00 H