ATOM 1 N TRP A 2 3.633 -7.710 0.609 1.00 0.00 N ATOM 2 CA TRP A 2 3.056 -6.726 1.564 1.00 0.00 C ATOM 3 C TRP A 2 3.883 -5.407 1.500 1.00 0.00 C ATOM 4 O TRP A 2 5.075 -5.485 1.156 1.00 0.00 O ATOM 5 CB TRP A 2 2.779 -7.337 2.976 1.00 0.00 C ATOM 6 CG TRP A 2 2.853 -6.338 4.148 1.00 0.00 C ATOM 7 CD1 TRP A 2 4.064 -5.827 4.670 1.00 0.00 C ATOM 8 CD2 TRP A 2 1.852 -5.782 4.925 1.00 0.00 C ATOM 9 NE1 TRP A 2 3.842 -4.972 5.764 1.00 0.00 N ATOM 10 CE2 TRP A 2 2.465 -4.958 5.905 1.00 0.00 C ATOM 11 CE3 TRP A 2 0.439 -5.864 4.841 1.00 0.00 C ATOM 12 CZ2 TRP A 2 1.673 -4.298 6.875 1.00 0.00 C ATOM 13 CZ3 TRP A 2 -0.323 -5.203 5.811 1.00 0.00 C ATOM 14 CH2 TRP A 2 0.288 -4.472 6.838 1.00 0.00 C ATOM 15 H1 TRP A 2 4.172 -8.514 0.959 1.00 0.00 H ATOM 16 HA TRP A 2 2.046 -6.433 1.234 1.00 0.00 H ATOM 17 HB2 TRP A 2 1.795 -7.831 2.998 1.00 0.00 H ATOM 18 HB3 TRP A 2 3.495 -8.148 3.180 1.00 0.00 H ATOM 19 HD1 TRP A 2 5.037 -6.024 4.246 1.00 0.00 H ATOM 20 HE1 TRP A 2 4.537 -4.442 6.301 1.00 0.00 H ATOM 21 HE3 TRP A 2 -0.051 -6.409 4.048 1.00 0.00 H ATOM 22 HZ2 TRP A 2 2.126 -3.683 7.639 1.00 0.00 H ATOM 23 HZ3 TRP A 2 -1.400 -5.265 5.774 1.00 0.00 H ATOM 24 HH2 TRP A 2 -0.322 -4.040 7.619 1.00 0.00 H HETATM 25 N DSG A 3 3.388 -4.181 1.786 1.00 0.00 N HETATM 26 CA DSG A 3 3.907 -2.888 1.256 1.00 0.00 C HETATM 27 C DSG A 3 3.208 -2.284 -0.013 1.00 0.00 C HETATM 28 O DSG A 3 2.968 -1.076 -0.019 1.00 0.00 O HETATM 29 CB DSG A 3 4.024 -1.899 2.455 1.00 0.00 C HETATM 30 CG DSG A 3 2.746 -1.720 3.308 1.00 0.00 C HETATM 31 OD1 DSG A 3 2.803 -1.420 4.499 1.00 0.00 O HETATM 32 ND2 DSG A 3 1.573 -1.908 2.722 1.00 0.00 N HETATM 33 H DSG A 3 2.656 -4.194 2.505 1.00 0.00 H HETATM 34 HA DSG A 3 4.954 -3.086 0.961 1.00 0.00 H HETATM 35 HB2 DSG A 3 4.840 -2.209 3.133 1.00 0.00 H HETATM 36 HB3 DSG A 3 4.353 -0.904 2.090 1.00 0.00 H HETATM 37 HD21 DSG A 3 1.582 -2.082 1.711 1.00 0.00 H HETATM 38 HD22 DSG A 3 0.747 -1.867 3.330 1.00 0.00 H ATOM 39 N ASP A 4 3.006 -3.032 -1.115 1.00 0.00 N ATOM 40 CA ASP A 4 2.132 -2.740 -2.285 1.00 0.00 C ATOM 41 C ASP A 4 1.087 -1.641 -1.906 1.00 0.00 C ATOM 42 O ASP A 4 1.063 -0.600 -2.562 1.00 0.00 O ATOM 43 CB ASP A 4 1.504 -4.077 -2.784 1.00 0.00 C ATOM 44 CG ASP A 4 1.310 -4.208 -4.299 1.00 0.00 C ATOM 45 OD1 ASP A 4 1.972 -3.456 -5.050 1.00 0.00 O ATOM 46 OD2 ASP A 4 0.501 -5.049 -4.752 1.00 0.00 O ATOM 47 H ASP A 4 3.505 -3.944 -1.079 1.00 0.00 H ATOM 48 HA ASP A 4 2.752 -2.336 -3.105 1.00 0.00 H ATOM 49 HB2 ASP A 4 2.085 -4.944 -2.417 1.00 0.00 H ATOM 50 HB3 ASP A 4 0.506 -4.210 -2.314 1.00 0.00 H ATOM 51 N THR A 5 0.312 -1.769 -0.803 1.00 0.00 N ATOM 52 CA THR A 5 -0.860 -0.931 -0.433 1.00 0.00 C ATOM 53 C THR A 5 -0.504 0.137 0.643 1.00 0.00 C ATOM 54 O THR A 5 -1.110 0.162 1.715 1.00 0.00 O ATOM 55 CB THR A 5 -1.684 -0.458 -1.685 1.00 0.00 C ATOM 56 OG1 THR A 5 -3.071 -0.229 -1.292 1.00 0.00 O ATOM 57 CG2 THR A 5 -1.232 0.880 -2.317 1.00 0.00 C ATOM 58 H THR A 5 0.670 -2.460 -0.139 1.00 0.00 H ATOM 59 HA THR A 5 -1.555 -1.647 0.039 1.00 0.00 H ATOM 60 HB THR A 5 -1.578 -1.230 -2.471 1.00 0.00 H ATOM 61 HG21 THR A 5 -0.207 0.807 -2.725 1.00 0.00 H ATOM 62 HG22 THR A 5 -1.241 1.700 -1.577 1.00 0.00 H ATOM 63 HG23 THR A 5 -1.892 1.170 -3.149 1.00 0.00 H ATOM 64 N GLY A 6 0.516 1.006 0.427 1.00 0.00 N ATOM 65 CA GLY A 6 0.726 2.287 1.150 1.00 0.00 C ATOM 66 C GLY A 6 2.249 2.489 1.418 1.00 0.00 C ATOM 67 O GLY A 6 2.742 2.003 2.438 1.00 0.00 O ATOM 68 H GLY A 6 1.102 0.753 -0.387 1.00 0.00 H ATOM 69 HA2 GLY A 6 0.293 3.116 0.568 1.00 0.00 H ATOM 70 HA3 GLY A 6 0.197 2.294 2.120 1.00 0.00 H HETATM 71 N ORN A 7 3.035 3.216 0.598 1.00 0.00 N HETATM 72 CA ORN A 7 4.272 3.942 0.996 1.00 0.00 C HETATM 73 CB ORN A 7 5.122 4.143 -0.295 1.00 0.00 C HETATM 74 CG ORN A 7 4.876 3.147 -1.455 1.00 0.00 C HETATM 75 CD ORN A 7 3.860 3.668 -2.487 1.00 0.00 C HETATM 76 NE ORN A 7 3.025 2.576 -3.018 1.00 0.00 N HETATM 77 C ORN A 7 3.957 5.296 1.701 1.00 0.00 C HETATM 78 O ORN A 7 3.104 6.039 1.208 1.00 0.00 O HETATM 79 H ORN A 7 2.776 3.155 -0.394 1.00 0.00 H HETATM 80 HA ORN A 7 4.870 3.284 1.658 1.00 0.00 H HETATM 81 HB2 ORN A 7 4.947 5.165 -0.686 1.00 0.00 H HETATM 82 HB3 ORN A 7 6.196 4.115 -0.031 1.00 0.00 H HETATM 83 HG2 ORN A 7 5.836 2.931 -1.962 1.00 0.00 H HETATM 84 HG3 ORN A 7 4.533 2.180 -1.042 1.00 0.00 H HETATM 85 HD2 ORN A 7 3.208 4.436 -2.032 1.00 0.00 H HETATM 86 HD3 ORN A 7 4.382 4.160 -3.328 1.00 0.00 H HETATM 87 HE1 ORN A 7 2.703 1.949 -2.272 1.00 0.00 H HETATM 88 HE2 ORN A 7 3.539 2.003 -3.696 1.00 0.00 H HETATM 89 HE3 ORN A 7 2.191 2.935 -3.494 1.00 0.00 H ATOM 90 N ASP A 8 4.657 5.725 2.771 1.00 0.00 N ATOM 91 CA ASP A 8 4.199 6.714 3.779 1.00 0.00 C ATOM 92 C ASP A 8 4.175 8.133 3.135 1.00 0.00 C ATOM 93 O ASP A 8 5.099 8.911 3.388 1.00 0.00 O ATOM 94 CB ASP A 8 5.107 6.564 5.047 1.00 0.00 C ATOM 95 CG ASP A 8 6.257 5.521 5.022 1.00 0.00 C ATOM 96 OD1 ASP A 8 6.013 4.338 5.341 1.00 0.00 O ATOM 97 OD2 ASP A 8 7.392 5.911 4.672 1.00 0.00 O ATOM 98 H ASP A 8 5.538 5.219 2.916 1.00 0.00 H ATOM 99 HA ASP A 8 3.162 6.474 4.079 1.00 0.00 H ATOM 100 HB2 ASP A 8 5.565 7.541 5.273 1.00 0.00 H ATOM 101 HB3 ASP A 8 4.476 6.274 5.904 1.00 0.00 H HETATM 102 N DAL A 9 3.124 8.576 2.417 1.00 0.00 N HETATM 103 CA DAL A 9 3.002 9.929 1.808 1.00 0.00 C HETATM 104 CB DAL A 9 2.989 11.180 2.715 1.00 0.00 C HETATM 105 C DAL A 9 2.017 9.957 0.600 1.00 0.00 C HETATM 106 O DAL A 9 0.865 10.353 0.784 1.00 0.00 O HETATM 107 H DAL A 9 2.344 7.911 2.371 1.00 0.00 H HETATM 108 HA DAL A 9 3.989 10.044 1.321 1.00 0.00 H HETATM 109 HB1 DAL A 9 2.025 11.327 3.223 1.00 0.00 H HETATM 110 HB2 DAL A 9 3.776 11.139 3.489 1.00 0.00 H HETATM 111 HB3 DAL A 9 3.170 12.100 2.131 1.00 0.00 H ATOM 112 N ASP A 10 2.405 9.628 -0.650 1.00 0.00 N ATOM 113 CA ASP A 10 1.748 10.069 -1.909 1.00 0.00 C ATOM 114 C ASP A 10 0.233 9.707 -1.857 1.00 0.00 C ATOM 115 O ASP A 10 -0.596 10.597 -2.065 1.00 0.00 O ATOM 116 CB ASP A 10 2.526 9.462 -3.116 1.00 0.00 C ATOM 117 CG ASP A 10 3.889 10.097 -3.422 1.00 0.00 C ATOM 118 OD1 ASP A 10 3.942 11.269 -3.857 1.00 0.00 O ATOM 119 OD2 ASP A 10 4.919 9.412 -3.241 1.00 0.00 O ATOM 120 H ASP A 10 3.290 9.107 -0.680 1.00 0.00 H ATOM 121 HA ASP A 10 1.823 11.169 -1.989 1.00 0.00 H ATOM 122 HB2 ASP A 10 2.661 8.371 -2.984 1.00 0.00 H ATOM 123 HB3 ASP A 10 1.915 9.553 -4.034 1.00 0.00 H ATOM 124 N GLY A 11 -0.201 8.485 -1.484 1.00 0.00 N ATOM 125 CA GLY A 11 -1.541 7.917 -1.793 1.00 0.00 C ATOM 126 C GLY A 11 -2.304 7.652 -0.459 1.00 0.00 C ATOM 127 O GLY A 11 -3.019 8.542 0.005 1.00 0.00 O ATOM 128 H GLY A 11 0.518 7.910 -1.031 1.00 0.00 H ATOM 129 HA2 GLY A 11 -2.129 8.583 -2.431 1.00 0.00 H ATOM 130 HA3 GLY A 11 -1.408 6.990 -2.359 1.00 0.00 H HETATM 131 N DSN A 12 -2.222 6.473 0.190 1.00 0.00 N HETATM 132 CA DSN A 12 -3.263 5.905 1.091 1.00 0.00 C HETATM 133 C DSN A 12 -3.421 4.366 0.889 1.00 0.00 C HETATM 134 O DSN A 12 -2.483 3.743 0.375 1.00 0.00 O HETATM 135 CB DSN A 12 -3.348 6.668 2.440 1.00 0.00 C HETATM 136 OG DSN A 12 -2.370 7.697 2.509 1.00 0.00 O HETATM 137 H DSN A 12 -1.323 5.994 0.067 1.00 0.00 H HETATM 138 HA DSN A 12 -4.185 6.278 0.587 1.00 0.00 H HETATM 139 HB2 DSN A 12 -4.355 7.073 2.627 1.00 0.00 H HETATM 140 HB3 DSN A 12 -3.162 5.984 3.291 1.00 0.00 H HETATM 141 HG DSN A 12 -2.653 8.367 1.882 1.00 0.00 H HETATM 142 N LME A 13 -4.501 3.679 1.306 1.00 0.00 N HETATM 143 CA LME A 13 -4.655 2.213 1.466 1.00 0.00 C HETATM 144 CB LME A 13 -5.119 1.732 2.904 1.00 0.00 C HETATM 145 C1 LME A 13 -4.591 0.317 3.273 1.00 0.00 C HETATM 146 CG LME A 13 -4.709 2.695 4.071 1.00 0.00 C HETATM 147 CD LME A 13 -4.431 2.025 5.432 1.00 0.00 C HETATM 148 OE1 LME A 13 -5.282 2.133 6.341 1.00 0.00 O HETATM 149 OE2 LME A 13 -3.358 1.402 5.590 1.00 0.00 O HETATM 150 C LME A 13 -5.208 1.475 0.196 1.00 0.00 C HETATM 151 O LME A 13 -5.716 2.131 -0.712 1.00 0.00 O HETATM 152 H LME A 13 -5.327 4.279 1.505 1.00 0.00 H HETATM 153 HA LME A 13 -3.608 1.844 1.468 1.00 0.00 H HETATM 154 HB LME A 13 -6.221 1.689 2.878 1.00 0.00 H HETATM 155 H11 LME A 13 -4.907 -0.001 4.276 1.00 0.00 H HETATM 156 H12 LME A 13 -4.956 -0.460 2.578 1.00 0.00 H HETATM 157 H13 LME A 13 -3.485 0.278 3.248 1.00 0.00 H HETATM 158 HG2 LME A 13 -3.841 3.322 3.795 1.00 0.00 H HETATM 159 HG3 LME A 13 -5.529 3.407 4.257 1.00 0.00 H HETATM 160 C KYN A 14 -4.024 -1.230 -1.436 1.00 0.00 C HETATM 161 N KYN A 14 -5.237 0.122 0.162 1.00 0.00 N HETATM 162 C1 KYN A 14 -7.124 -2.430 -2.082 1.00 0.00 C HETATM 163 N1 KYN A 14 -7.887 -2.165 -5.011 1.00 0.00 N HETATM 164 O2 KYN A 14 -6.384 -3.242 -2.645 1.00 0.00 O HETATM 165 CA KYN A 14 -5.434 -0.717 -1.049 1.00 0.00 C HETATM 166 CB KYN A 14 -6.514 -1.807 -0.795 1.00 0.00 C HETATM 167 CG KYN A 14 -8.806 -2.007 -4.056 1.00 0.00 C HETATM 168 CZ KYN A 14 -10.860 -1.642 -2.199 1.00 0.00 C HETATM 169 CD1 KYN A 14 -10.107 -1.717 -4.479 1.00 0.00 C HETATM 170 CD2 KYN A 14 -8.510 -2.118 -2.664 1.00 0.00 C HETATM 171 CE1 KYN A 14 -11.123 -1.537 -3.553 1.00 0.00 C HETATM 172 CE2 KYN A 14 -9.575 -1.927 -1.759 1.00 0.00 C HETATM 173 O KYN A 14 -3.793 -2.373 -1.839 1.00 0.00 O HETATM 174 H KYN A 14 -5.000 -0.306 1.071 1.00 0.00 H HETATM 175 HN1 KYN A 14 -6.932 -2.377 -4.701 1.00 0.00 H HETATM 176 HN1A KYN A 14 -8.209 -2.064 -5.980 1.00 0.00 H HETATM 177 HA KYN A 14 -5.784 -0.078 -1.885 1.00 0.00 H HETATM 178 HB KYN A 14 -6.052 -2.638 -0.229 1.00 0.00 H HETATM 179 HBA KYN A 14 -7.286 -1.430 -0.100 1.00 0.00 H HETATM 180 HZ KYN A 14 -11.656 -1.500 -1.482 1.00 0.00 H HETATM 181 HD1 KYN A 14 -10.356 -1.628 -5.530 1.00 0.00 H HETATM 182 HE1 KYN A 14 -12.125 -1.315 -3.891 1.00 0.00 H HETATM 183 HE2 KYN A 14 -9.451 -1.993 -0.694 1.00 0.00 H TER 184 KYN A 14 HETATM 185 C1 DKA A 1 3.647 -7.599 -0.735 1.00 0.00 C HETATM 186 O1 DKA A 1 2.766 -6.939 -1.291 1.00 0.00 O HETATM 187 C2 DKA A 1 4.717 -8.317 -1.612 1.00 0.00 C HETATM 188 C3 DKA A 1 4.460 -8.339 -3.134 1.00 0.00 C HETATM 189 C4 DKA A 1 4.272 -9.760 -3.704 1.00 0.00 C HETATM 190 C5 DKA A 1 5.324 -10.135 -4.762 1.00 0.00 C HETATM 191 C6 DKA A 1 4.857 -11.295 -5.663 1.00 0.00 C HETATM 192 C7 DKA A 1 5.711 -11.443 -6.936 1.00 0.00 C HETATM 193 C8 DKA A 1 5.079 -10.754 -8.162 1.00 0.00 C HETATM 194 C9 DKA A 1 5.919 -10.927 -9.442 1.00 0.00 C HETATM 195 C10 DKA A 1 6.137 -12.397 -9.816 1.00 0.00 C HETATM 196 H21 DKA A 1 4.852 -9.362 -1.285 1.00 0.00 H HETATM 197 H22 DKA A 1 5.688 -7.824 -1.419 1.00 0.00 H HETATM 198 H31 DKA A 1 3.550 -7.747 -3.343 1.00 0.00 H HETATM 199 H32 DKA A 1 5.276 -7.813 -3.662 1.00 0.00 H HETATM 200 H41 DKA A 1 4.296 -10.502 -2.883 1.00 0.00 H HETATM 201 H42 DKA A 1 3.261 -9.835 -4.146 1.00 0.00 H HETATM 202 H51 DKA A 1 5.554 -9.254 -5.389 1.00 0.00 H HETATM 203 H52 DKA A 1 6.270 -10.408 -4.259 1.00 0.00 H HETATM 204 H61 DKA A 1 4.878 -12.241 -5.090 1.00 0.00 H HETATM 205 H62 DKA A 1 3.797 -11.139 -5.944 1.00 0.00 H HETATM 206 H71 DKA A 1 6.720 -11.026 -6.758 1.00 0.00 H HETATM 207 H72 DKA A 1 5.862 -12.519 -7.154 1.00 0.00 H HETATM 208 H81 DKA A 1 4.063 -11.160 -8.329 1.00 0.00 H HETATM 209 H82 DKA A 1 4.943 -9.677 -7.950 1.00 0.00 H HETATM 210 H91 DKA A 1 6.903 -10.438 -9.317 1.00 0.00 H HETATM 211 H92 DKA A 1 5.429 -10.409 -10.287 1.00 0.00 H HETATM 212 H101 DKA A 1 5.291 -13.033 -9.495 1.00 0.00 H HETATM 213 H102 DKA A 1 6.242 -12.519 -10.909 1.00 0.00 H HETATM 214 H103 DKA A 1 7.056 -12.806 -9.353 1.00 0.00 H