ATOM 1 N TRP A 2 0.201 -8.490 -2.868 1.00 0.00 N ATOM 2 CA TRP A 2 1.565 -8.610 -2.287 1.00 0.00 C ATOM 3 C TRP A 2 2.184 -7.186 -2.125 1.00 0.00 C ATOM 4 O TRP A 2 1.609 -6.225 -2.637 1.00 0.00 O ATOM 5 CB TRP A 2 2.442 -9.694 -2.990 1.00 0.00 C ATOM 6 CG TRP A 2 3.957 -9.403 -2.994 1.00 0.00 C ATOM 7 CD1 TRP A 2 4.569 -8.416 -3.801 1.00 0.00 C ATOM 8 CD2 TRP A 2 4.978 -9.947 -2.236 1.00 0.00 C ATOM 9 NE1 TRP A 2 5.955 -8.341 -3.575 1.00 0.00 N ATOM 10 CE2 TRP A 2 6.188 -9.295 -2.599 1.00 0.00 C ATOM 11 CE3 TRP A 2 4.971 -10.916 -1.203 1.00 0.00 C ATOM 12 CZ2 TRP A 2 7.411 -9.685 -2.003 1.00 0.00 C ATOM 13 CZ3 TRP A 2 6.190 -11.277 -0.619 1.00 0.00 C ATOM 14 CH2 TRP A 2 7.384 -10.641 -0.985 1.00 0.00 C ATOM 15 H1 TRP A 2 0.014 -8.826 -3.823 1.00 0.00 H ATOM 16 HA TRP A 2 1.500 -8.991 -1.253 1.00 0.00 H ATOM 17 HB2 TRP A 2 2.297 -10.694 -2.564 1.00 0.00 H ATOM 18 HB3 TRP A 2 2.098 -9.789 -4.037 1.00 0.00 H ATOM 19 HD1 TRP A 2 4.029 -7.755 -4.464 1.00 0.00 H ATOM 20 HE1 TRP A 2 6.628 -7.692 -3.995 1.00 0.00 H ATOM 21 HE3 TRP A 2 4.050 -11.361 -0.853 1.00 0.00 H ATOM 22 HZ2 TRP A 2 8.347 -9.245 -2.315 1.00 0.00 H ATOM 23 HZ3 TRP A 2 6.210 -12.053 0.131 1.00 0.00 H ATOM 24 HH2 TRP A 2 8.298 -10.888 -0.466 1.00 0.00 H HETATM 25 N DSG A 3 3.303 -6.977 -1.402 1.00 0.00 N HETATM 26 CA DSG A 3 3.738 -5.683 -0.813 1.00 0.00 C HETATM 27 C DSG A 3 3.179 -5.299 0.595 1.00 0.00 C HETATM 28 O DSG A 3 2.353 -6.042 1.130 1.00 0.00 O HETATM 29 CB DSG A 3 5.296 -5.612 -0.916 1.00 0.00 C HETATM 30 CG DSG A 3 6.079 -6.808 -0.333 1.00 0.00 C HETATM 31 OD1 DSG A 3 7.153 -7.165 -0.820 1.00 0.00 O HETATM 32 ND2 DSG A 3 5.578 -7.444 0.713 1.00 0.00 N HETATM 33 H DSG A 3 3.817 -7.843 -1.185 1.00 0.00 H HETATM 34 HA DSG A 3 3.397 -4.899 -1.517 1.00 0.00 H HETATM 35 HB2 DSG A 3 5.600 -5.494 -1.973 1.00 0.00 H HETATM 36 HB3 DSG A 3 5.656 -4.678 -0.435 1.00 0.00 H HETATM 37 HD21 DSG A 3 4.722 -7.054 1.124 1.00 0.00 H HETATM 38 HD22 DSG A 3 6.088 -8.277 1.028 1.00 0.00 H ATOM 39 N ASP A 4 3.485 -4.122 1.176 1.00 0.00 N ATOM 40 CA ASP A 4 3.158 -3.729 2.575 1.00 0.00 C ATOM 41 C ASP A 4 1.841 -2.896 2.579 1.00 0.00 C ATOM 42 O ASP A 4 1.032 -3.067 3.492 1.00 0.00 O ATOM 43 CB ASP A 4 4.388 -3.008 3.205 1.00 0.00 C ATOM 44 CG ASP A 4 4.866 -3.563 4.554 1.00 0.00 C ATOM 45 OD1 ASP A 4 4.567 -4.741 4.852 1.00 0.00 O ATOM 46 OD2 ASP A 4 5.525 -2.831 5.325 1.00 0.00 O ATOM 47 H ASP A 4 4.086 -3.520 0.606 1.00 0.00 H ATOM 48 HA ASP A 4 2.986 -4.650 3.158 1.00 0.00 H ATOM 49 HB2 ASP A 4 5.238 -3.010 2.497 1.00 0.00 H ATOM 50 HB3 ASP A 4 4.158 -1.937 3.361 1.00 0.00 H ATOM 51 N THR A 5 1.623 -1.913 1.682 1.00 0.00 N ATOM 52 CA THR A 5 0.401 -1.053 1.628 1.00 0.00 C ATOM 53 C THR A 5 0.639 0.321 2.322 1.00 0.00 C ATOM 54 O THR A 5 0.373 0.439 3.519 1.00 0.00 O ATOM 55 CB THR A 5 -0.352 -1.077 0.237 1.00 0.00 C ATOM 56 OG1 THR A 5 -1.798 -1.175 0.422 1.00 0.00 O ATOM 57 CG2 THR A 5 -0.143 0.178 -0.631 1.00 0.00 C ATOM 58 H THR A 5 2.425 -1.713 1.076 1.00 0.00 H ATOM 59 HA THR A 5 -0.321 -1.615 2.244 1.00 0.00 H ATOM 60 HB THR A 5 0.022 -1.949 -0.332 1.00 0.00 H ATOM 61 HG21 THR A 5 0.910 0.296 -0.941 1.00 0.00 H ATOM 62 HG22 THR A 5 -0.442 1.101 -0.104 1.00 0.00 H ATOM 63 HG23 THR A 5 -0.743 0.120 -1.559 1.00 0.00 H ATOM 64 N GLY A 6 1.212 1.355 1.673 1.00 0.00 N ATOM 65 CA GLY A 6 0.993 2.795 1.974 1.00 0.00 C ATOM 66 C GLY A 6 2.369 3.471 2.260 1.00 0.00 C ATOM 67 O GLY A 6 2.672 3.728 3.427 1.00 0.00 O ATOM 68 H GLY A 6 1.922 1.068 0.987 1.00 0.00 H ATOM 69 HA2 GLY A 6 0.463 3.270 1.138 1.00 0.00 H ATOM 70 HA3 GLY A 6 0.349 2.927 2.859 1.00 0.00 H HETATM 71 N ORN A 7 3.182 3.893 1.270 1.00 0.00 N HETATM 72 CA ORN A 7 4.235 4.934 1.400 1.00 0.00 C HETATM 73 CB ORN A 7 5.023 4.968 0.055 1.00 0.00 C HETATM 74 CG ORN A 7 5.123 3.635 -0.729 1.00 0.00 C HETATM 75 CD ORN A 7 4.104 3.538 -1.877 1.00 0.00 C HETATM 76 NE ORN A 7 4.631 4.138 -3.116 1.00 0.00 N HETATM 77 C ORN A 7 3.637 6.328 1.758 1.00 0.00 C HETATM 78 O ORN A 7 2.551 6.652 1.270 1.00 0.00 O HETATM 79 H ORN A 7 3.062 3.383 0.388 1.00 0.00 H HETATM 80 HA ORN A 7 4.961 4.609 2.171 1.00 0.00 H HETATM 81 HB2 ORN A 7 4.562 5.719 -0.615 1.00 0.00 H HETATM 82 HB3 ORN A 7 6.050 5.337 0.248 1.00 0.00 H HETATM 83 HG2 ORN A 7 6.147 3.525 -1.136 1.00 0.00 H HETATM 84 HG3 ORN A 7 4.989 2.789 -0.031 1.00 0.00 H HETATM 85 HD2 ORN A 7 3.839 2.482 -2.070 1.00 0.00 H HETATM 86 HD3 ORN A 7 3.164 4.050 -1.604 1.00 0.00 H HETATM 87 HE1 ORN A 7 5.325 3.530 -3.565 1.00 0.00 H HETATM 88 HE2 ORN A 7 5.088 5.039 -2.934 1.00 0.00 H HETATM 89 HE3 ORN A 7 3.887 4.308 -3.801 1.00 0.00 H ATOM 90 N ASP A 8 4.305 7.223 2.515 1.00 0.00 N ATOM 91 CA ASP A 8 3.684 8.288 3.349 1.00 0.00 C ATOM 92 C ASP A 8 3.594 9.603 2.517 1.00 0.00 C ATOM 93 O ASP A 8 4.575 10.350 2.481 1.00 0.00 O ATOM 94 CB ASP A 8 4.479 8.408 4.682 1.00 0.00 C ATOM 95 CG ASP A 8 3.855 9.312 5.754 1.00 0.00 C ATOM 96 OD1 ASP A 8 2.614 9.470 5.751 1.00 0.00 O ATOM 97 OD2 ASP A 8 4.590 9.865 6.604 1.00 0.00 O ATOM 98 H ASP A 8 5.324 7.109 2.485 1.00 0.00 H ATOM 99 HA ASP A 8 2.653 7.989 3.607 1.00 0.00 H ATOM 100 HB2 ASP A 8 4.653 7.407 5.121 1.00 0.00 H ATOM 101 HB3 ASP A 8 5.495 8.803 4.483 1.00 0.00 H HETATM 102 N DAL A 9 2.479 9.957 1.846 1.00 0.00 N HETATM 103 CA DAL A 9 2.108 11.348 1.465 1.00 0.00 C HETATM 104 CB DAL A 9 1.914 12.418 2.564 1.00 0.00 C HETATM 105 C DAL A 9 1.084 11.393 0.289 1.00 0.00 C HETATM 106 O DAL A 9 -0.100 11.632 0.539 1.00 0.00 O HETATM 107 H DAL A 9 1.888 9.164 1.573 1.00 0.00 H HETATM 108 HA DAL A 9 3.041 11.708 0.993 1.00 0.00 H HETATM 109 HB1 DAL A 9 0.959 12.312 3.098 1.00 0.00 H HETATM 110 HB2 DAL A 9 2.726 12.391 3.312 1.00 0.00 H HETATM 111 HB3 DAL A 9 1.915 13.436 2.134 1.00 0.00 H ATOM 112 N ASP A 10 1.468 11.268 -0.997 1.00 0.00 N ATOM 113 CA ASP A 10 0.562 11.020 -2.150 1.00 0.00 C ATOM 114 C ASP A 10 -0.307 9.759 -1.858 1.00 0.00 C ATOM 115 O ASP A 10 -1.525 9.823 -2.041 1.00 0.00 O ATOM 116 CB ASP A 10 1.416 10.943 -3.451 1.00 0.00 C ATOM 117 CG ASP A 10 2.061 12.259 -3.908 1.00 0.00 C ATOM 118 OD1 ASP A 10 3.139 12.631 -3.391 1.00 0.00 O ATOM 119 OD2 ASP A 10 1.479 12.935 -4.786 1.00 0.00 O ATOM 120 H ASP A 10 2.474 11.409 -1.147 1.00 0.00 H ATOM 121 HA ASP A 10 -0.127 11.877 -2.264 1.00 0.00 H ATOM 122 HB2 ASP A 10 2.238 10.209 -3.326 1.00 0.00 H ATOM 123 HB3 ASP A 10 0.808 10.534 -4.278 1.00 0.00 H ATOM 124 N GLY A 11 0.237 8.581 -1.489 1.00 0.00 N ATOM 125 CA GLY A 11 -0.465 7.269 -1.502 1.00 0.00 C ATOM 126 C GLY A 11 -1.185 7.058 -0.135 1.00 0.00 C ATOM 127 O GLY A 11 -0.528 7.164 0.905 1.00 0.00 O ATOM 128 H GLY A 11 1.185 8.665 -1.104 1.00 0.00 H ATOM 129 HA2 GLY A 11 -1.191 7.202 -2.317 1.00 0.00 H ATOM 130 HA3 GLY A 11 0.269 6.478 -1.684 1.00 0.00 H HETATM 131 N DSN A 12 -2.485 6.709 -0.052 1.00 0.00 N HETATM 132 CA DSN A 12 -3.258 5.990 -1.104 1.00 0.00 C HETATM 133 C DSN A 12 -3.832 4.639 -0.579 1.00 0.00 C HETATM 134 O DSN A 12 -4.035 4.524 0.637 1.00 0.00 O HETATM 135 CB DSN A 12 -3.972 6.968 -2.076 1.00 0.00 C HETATM 136 OG DSN A 12 -5.306 7.219 -1.648 1.00 0.00 O HETATM 137 H DSN A 12 -2.943 7.018 0.811 1.00 0.00 H HETATM 138 HA DSN A 12 -2.424 5.632 -1.750 1.00 0.00 H HETATM 139 HB2 DSN A 12 -3.419 7.909 -2.200 1.00 0.00 H HETATM 140 HB3 DSN A 12 -4.032 6.538 -3.092 1.00 0.00 H HETATM 141 HG DSN A 12 -5.232 7.748 -0.851 1.00 0.00 H HETATM 142 N LME A 13 -4.233 3.644 -1.394 1.00 0.00 N HETATM 143 CA LME A 13 -4.888 2.371 -1.016 1.00 0.00 C HETATM 144 CB LME A 13 -5.660 1.636 -2.192 1.00 0.00 C HETATM 145 C1 LME A 13 -6.903 0.851 -1.680 1.00 0.00 C HETATM 146 CG LME A 13 -6.133 2.575 -3.355 1.00 0.00 C HETATM 147 CD LME A 13 -6.168 4.103 -3.184 1.00 0.00 C HETATM 148 OE1 LME A 13 -6.728 4.584 -2.175 1.00 0.00 O HETATM 149 OE2 LME A 13 -5.619 4.823 -4.047 1.00 0.00 O HETATM 150 C LME A 13 -4.115 1.505 0.049 1.00 0.00 C HETATM 151 O LME A 13 -3.128 1.999 0.596 1.00 0.00 O HETATM 152 H LME A 13 -3.997 3.810 -2.392 1.00 0.00 H HETATM 153 HA LME A 13 -5.748 2.704 -0.398 1.00 0.00 H HETATM 154 HB LME A 13 -4.951 0.912 -2.623 1.00 0.00 H HETATM 155 H11 LME A 13 -7.445 0.351 -2.503 1.00 0.00 H HETATM 156 H12 LME A 13 -6.635 0.050 -0.970 1.00 0.00 H HETATM 157 H13 LME A 13 -7.627 1.512 -1.169 1.00 0.00 H HETATM 158 HG2 LME A 13 -5.579 2.322 -4.293 1.00 0.00 H HETATM 159 HG3 LME A 13 -7.180 2.311 -3.628 1.00 0.00 H HETATM 160 C KYN A 14 -2.507 -0.480 1.389 1.00 0.00 C HETATM 161 N KYN A 14 -4.616 0.315 0.438 1.00 0.00 N HETATM 162 C1 KYN A 14 -4.270 -1.998 3.578 1.00 0.00 C HETATM 163 N1 KYN A 14 -4.003 -4.743 4.914 1.00 0.00 N HETATM 164 O2 KYN A 14 -3.146 -2.408 3.292 1.00 0.00 O HETATM 165 CA KYN A 14 -4.024 -0.758 1.288 1.00 0.00 C HETATM 166 CB KYN A 14 -4.785 -0.857 2.640 1.00 0.00 C HETATM 167 CG KYN A 14 -4.890 -3.849 5.358 1.00 0.00 C HETATM 168 CZ KYN A 14 -6.820 -2.126 6.415 1.00 0.00 C HETATM 169 CD1 KYN A 14 -5.672 -4.235 6.452 1.00 0.00 C HETATM 170 CD2 KYN A 14 -5.062 -2.562 4.769 1.00 0.00 C HETATM 171 CE1 KYN A 14 -6.627 -3.377 6.974 1.00 0.00 C HETATM 172 CE2 KYN A 14 -6.051 -1.723 5.332 1.00 0.00 C HETATM 173 O KYN A 14 -2.000 0.245 2.247 1.00 0.00 O HETATM 174 H KYN A 14 -5.617 0.193 0.141 1.00 0.00 H HETATM 175 HN1 KYN A 14 -3.431 -4.475 4.106 1.00 0.00 H HETATM 176 HN1A KYN A 14 -3.968 -5.643 5.413 1.00 0.00 H HETATM 177 HA KYN A 14 -4.138 -1.732 0.770 1.00 0.00 H HETATM 178 HB KYN A 14 -5.848 -1.084 2.434 1.00 0.00 H HETATM 179 HBA KYN A 14 -4.827 0.121 3.142 1.00 0.00 H HETATM 180 HZ KYN A 14 -7.567 -1.460 6.823 1.00 0.00 H HETATM 181 HD1 KYN A 14 -5.558 -5.208 6.917 1.00 0.00 H HETATM 182 HE1 KYN A 14 -7.225 -3.684 7.819 1.00 0.00 H HETATM 183 HE2 KYN A 14 -6.269 -0.740 4.947 1.00 0.00 H TER 184 KYN A 14 HETATM 185 C1 DKA A 1 -0.906 -8.087 -2.212 1.00 0.00 C HETATM 186 O1 DKA A 1 -0.786 -7.335 -1.242 1.00 0.00 O HETATM 187 C2 DKA A 1 -2.338 -8.470 -2.693 1.00 0.00 C HETATM 188 C3 DKA A 1 -3.478 -8.291 -1.667 1.00 0.00 C HETATM 189 C4 DKA A 1 -4.682 -7.501 -2.218 1.00 0.00 C HETATM 190 C5 DKA A 1 -6.038 -8.149 -1.887 1.00 0.00 C HETATM 191 C6 DKA A 1 -6.225 -9.510 -2.585 1.00 0.00 C HETATM 192 C7 DKA A 1 -7.705 -9.865 -2.816 1.00 0.00 C HETATM 193 C8 DKA A 1 -7.920 -11.360 -3.117 1.00 0.00 C HETATM 194 C9 DKA A 1 -7.082 -11.855 -4.310 1.00 0.00 C HETATM 195 C10 DKA A 1 -6.414 -13.210 -4.049 1.00 0.00 C HETATM 196 H21 DKA A 1 -2.367 -9.519 -3.037 1.00 0.00 H HETATM 197 H22 DKA A 1 -2.563 -7.861 -3.587 1.00 0.00 H HETATM 198 H31 DKA A 1 -3.822 -9.292 -1.349 1.00 0.00 H HETATM 199 H32 DKA A 1 -3.087 -7.813 -0.749 1.00 0.00 H HETATM 200 H41 DKA A 1 -4.665 -6.465 -1.829 1.00 0.00 H HETATM 201 H42 DKA A 1 -4.577 -7.410 -3.315 1.00 0.00 H HETATM 202 H51 DKA A 1 -6.130 -8.282 -0.792 1.00 0.00 H HETATM 203 H52 DKA A 1 -6.856 -7.462 -2.178 1.00 0.00 H HETATM 204 H61 DKA A 1 -5.688 -9.506 -3.553 1.00 0.00 H HETATM 205 H62 DKA A 1 -5.742 -10.302 -1.980 1.00 0.00 H HETATM 206 H71 DKA A 1 -8.299 -9.579 -1.927 1.00 0.00 H HETATM 207 H72 DKA A 1 -8.102 -9.259 -3.653 1.00 0.00 H HETATM 208 H81 DKA A 1 -7.669 -11.957 -2.218 1.00 0.00 H HETATM 209 H82 DKA A 1 -8.992 -11.548 -3.313 1.00 0.00 H HETATM 210 H91 DKA A 1 -6.300 -11.112 -4.557 1.00 0.00 H HETATM 211 H92 DKA A 1 -7.719 -11.933 -5.212 1.00 0.00 H HETATM 212 H101 DKA A 1 -5.436 -13.096 -3.547 1.00 0.00 H HETATM 213 H102 DKA A 1 -7.044 -13.844 -3.399 1.00 0.00 H HETATM 214 H103 DKA A 1 -6.245 -13.772 -4.987 1.00 0.00 H