ATOM 1 N ASP A 1 -0.532 -1.061 0.465 1.00 0.00 N ATOM 2 CA ASP A 1 0.340 -0.255 -0.419 1.00 0.00 C ATOM 3 C ASP A 1 -0.366 0.030 -1.742 1.00 0.00 C ATOM 4 O ASP A 1 -1.283 -0.699 -2.134 1.00 0.00 O ATOM 5 CB ASP A 1 1.697 -0.938 -0.664 1.00 0.00 C ATOM 6 CG ASP A 1 2.530 -0.976 0.621 1.00 0.00 C ATOM 7 OD1 ASP A 1 2.028 -1.506 1.642 1.00 0.00 O ATOM 8 OD2 ASP A 1 3.678 -0.472 0.623 1.00 0.00 O ATOM 9 H1 ASP A 1 -0.809 -1.903 -0.016 1.00 0.00 H ATOM 10 H2 ASP A 1 -1.363 -0.541 0.696 1.00 0.00 H ATOM 11 H3 ASP A 1 -0.033 -1.305 1.309 1.00 0.00 H ATOM 12 HA ASP A 1 0.538 0.697 0.076 1.00 0.00 H ATOM 13 HB2 ASP A 1 1.540 -1.954 -1.032 1.00 0.00 H ATOM 14 HB3 ASP A 1 2.245 -0.384 -1.430 1.00 0.00 H ATOM 15 N TRP A 2 0.062 1.081 -2.450 1.00 0.00 N ATOM 16 CA TRP A 2 -0.472 1.485 -3.747 1.00 0.00 C ATOM 17 C TRP A 2 0.663 2.131 -4.545 1.00 0.00 C ATOM 18 O TRP A 2 1.323 3.050 -4.051 1.00 0.00 O ATOM 19 CB TRP A 2 -1.675 2.416 -3.548 1.00 0.00 C ATOM 20 CG TRP A 2 -2.448 2.735 -4.791 1.00 0.00 C ATOM 21 CD1 TRP A 2 -3.495 2.035 -5.281 1.00 0.00 C ATOM 22 CD2 TRP A 2 -2.260 3.851 -5.707 1.00 0.00 C ATOM 23 NE1 TRP A 2 -3.973 2.646 -6.423 1.00 0.00 N ATOM 24 CE2 TRP A 2 -3.256 3.786 -6.726 1.00 0.00 C ATOM 25 CE3 TRP A 2 -1.344 4.919 -5.765 1.00 0.00 C ATOM 26 CZ2 TRP A 2 -3.349 4.754 -7.739 1.00 0.00 C ATOM 27 CZ3 TRP A 2 -1.435 5.902 -6.770 1.00 0.00 C ATOM 28 CH2 TRP A 2 -2.437 5.818 -7.755 1.00 0.00 C ATOM 29 H TRP A 2 0.837 1.631 -2.099 1.00 0.00 H ATOM 30 HA TRP A 2 -0.823 0.613 -4.291 1.00 0.00 H ATOM 31 HB2 TRP A 2 -2.365 1.954 -2.840 1.00 0.00 H ATOM 32 HB3 TRP A 2 -1.331 3.351 -3.102 1.00 0.00 H ATOM 33 HD1 TRP A 2 -3.909 1.138 -4.836 1.00 0.00 H ATOM 34 HE1 TRP A 2 -4.766 2.292 -6.947 1.00 0.00 H ATOM 35 HE3 TRP A 2 -0.562 4.959 -5.019 1.00 0.00 H ATOM 36 HZ2 TRP A 2 -4.112 4.693 -8.500 1.00 0.00 H ATOM 37 HZ3 TRP A 2 -0.733 6.723 -6.788 1.00 0.00 H ATOM 38 HH2 TRP A 2 -2.512 6.566 -8.531 1.00 0.00 H ATOM 39 N GLU A 3 0.921 1.615 -5.749 1.00 0.00 N ATOM 40 CA GLU A 3 2.030 2.030 -6.598 1.00 0.00 C ATOM 41 C GLU A 3 1.601 3.247 -7.422 1.00 0.00 C ATOM 42 O GLU A 3 0.495 3.271 -7.971 1.00 0.00 O ATOM 43 CB GLU A 3 2.461 0.849 -7.473 1.00 0.00 C ATOM 44 CG GLU A 3 3.769 1.109 -8.232 1.00 0.00 C ATOM 45 CD GLU A 3 4.215 -0.136 -9.016 1.00 0.00 C ATOM 46 OE1 GLU A 3 3.762 -0.329 -10.170 1.00 0.00 O ATOM 47 OE2 GLU A 3 5.033 -0.928 -8.489 1.00 0.00 O ATOM 48 H GLU A 3 0.316 0.894 -6.113 1.00 0.00 H ATOM 49 HA GLU A 3 2.877 2.290 -5.971 1.00 0.00 H ATOM 50 HB2 GLU A 3 2.596 -0.026 -6.835 1.00 0.00 H ATOM 51 HB3 GLU A 3 1.667 0.639 -8.181 1.00 0.00 H ATOM 52 HG2 GLU A 3 3.631 1.941 -8.922 1.00 0.00 H ATOM 53 HG3 GLU A 3 4.546 1.389 -7.518 1.00 0.00 H ATOM 54 N TYR A 4 2.473 4.256 -7.513 1.00 0.00 N ATOM 55 CA TYR A 4 2.204 5.484 -8.258 1.00 0.00 C ATOM 56 C TYR A 4 2.242 5.249 -9.774 1.00 0.00 C ATOM 57 O TYR A 4 2.628 4.179 -10.256 1.00 0.00 O ATOM 58 CB TYR A 4 3.178 6.595 -7.842 1.00 0.00 C ATOM 59 CG TYR A 4 2.534 7.955 -7.636 1.00 0.00 C ATOM 60 CD1 TYR A 4 1.659 8.162 -6.554 1.00 0.00 C ATOM 61 CD2 TYR A 4 2.813 9.014 -8.521 1.00 0.00 C ATOM 62 CE1 TYR A 4 1.044 9.413 -6.366 1.00 0.00 C ATOM 63 CE2 TYR A 4 2.205 10.269 -8.342 1.00 0.00 C ATOM 64 CZ TYR A 4 1.313 10.474 -7.264 1.00 0.00 C ATOM 65 OH TYR A 4 0.726 11.694 -7.094 1.00 0.00 O ATOM 66 H TYR A 4 3.377 4.173 -7.072 1.00 0.00 H ATOM 67 HA TYR A 4 1.206 5.827 -8.006 1.00 0.00 H ATOM 68 HB2 TYR A 4 3.688 6.322 -6.918 1.00 0.00 H ATOM 69 HB3 TYR A 4 3.913 6.681 -8.635 1.00 0.00 H ATOM 70 HD1 TYR A 4 1.455 7.357 -5.861 1.00 0.00 H ATOM 71 HD2 TYR A 4 3.510 8.875 -9.332 1.00 0.00 H ATOM 72 HE1 TYR A 4 0.369 9.559 -5.533 1.00 0.00 H ATOM 73 HE2 TYR A 4 2.428 11.079 -9.023 1.00 0.00 H ATOM 74 HH TYR A 4 0.135 11.736 -6.326 1.00 0.00 H ATOM 75 N HIS A 5 1.880 6.297 -10.512 1.00 0.00 N ATOM 76 CA HIS A 5 1.854 6.319 -11.968 1.00 0.00 C ATOM 77 C HIS A 5 3.052 7.152 -12.446 1.00 0.00 C ATOM 78 O HIS A 5 4.024 6.620 -12.985 1.00 0.00 O ATOM 79 CB HIS A 5 0.500 6.876 -12.466 1.00 0.00 C ATOM 80 CG HIS A 5 -0.141 6.010 -13.523 1.00 0.00 C ATOM 81 ND1 HIS A 5 -0.138 6.237 -14.890 1.00 0.00 N ATOM 82 CD2 HIS A 5 -0.843 4.857 -13.294 1.00 0.00 C ATOM 83 CE1 HIS A 5 -0.824 5.237 -15.477 1.00 0.00 C ATOM 84 NE2 HIS A 5 -1.261 4.386 -14.527 1.00 0.00 N ATOM 85 H HIS A 5 1.724 7.163 -10.018 1.00 0.00 H ATOM 86 HA HIS A 5 1.961 5.305 -12.349 1.00 0.00 H ATOM 87 HB2 HIS A 5 -0.189 6.963 -11.628 1.00 0.00 H ATOM 88 HB3 HIS A 5 0.615 7.881 -12.875 1.00 0.00 H ATOM 89 HD1 HIS A 5 0.290 7.020 -15.370 1.00 0.00 H ATOM 90 HD2 HIS A 5 -1.041 4.397 -12.333 1.00 0.00 H ATOM 91 HE1 HIS A 5 -0.999 5.138 -16.541 1.00 0.00 H ATOM 92 HE2 HIS A 5 -1.809 3.547 -14.692 1.00 0.00 H ATOM 93 N ALA A 6 3.015 8.464 -12.183 1.00 0.00 N ATOM 94 CA ALA A 6 4.022 9.443 -12.593 1.00 0.00 C ATOM 95 C ALA A 6 5.111 9.521 -11.521 1.00 0.00 C ATOM 96 O ALA A 6 5.302 10.546 -10.864 1.00 0.00 O ATOM 97 CB ALA A 6 3.346 10.796 -12.856 1.00 0.00 C ATOM 98 H ALA A 6 2.227 8.802 -11.650 1.00 0.00 H ATOM 99 HA ALA A 6 4.492 9.099 -13.521 1.00 0.00 H ATOM 100 HB1 ALA A 6 2.596 10.692 -13.640 1.00 0.00 H ATOM 101 HB2 ALA A 6 2.874 11.167 -11.945 1.00 0.00 H ATOM 102 HB3 ALA A 6 4.097 11.519 -13.181 1.00 0.00 H ATOM 103 N HIS A 7 5.761 8.380 -11.313 1.00 0.00 N ATOM 104 CA HIS A 7 6.817 8.158 -10.349 1.00 0.00 C ATOM 105 C HIS A 7 7.956 9.196 -10.437 1.00 0.00 C ATOM 106 O HIS A 7 8.198 9.772 -11.510 1.00 0.00 O ATOM 107 CB HIS A 7 7.380 6.739 -10.528 1.00 0.00 C ATOM 108 CG HIS A 7 7.653 6.331 -11.960 1.00 0.00 C ATOM 109 ND1 HIS A 7 6.805 5.614 -12.790 1.00 0.00 N ATOM 110 CD2 HIS A 7 8.740 6.706 -12.704 1.00 0.00 C ATOM 111 CE1 HIS A 7 7.354 5.584 -14.018 1.00 0.00 C ATOM 112 NE2 HIS A 7 8.541 6.223 -13.986 1.00 0.00 N ATOM 113 H HIS A 7 5.474 7.579 -11.850 1.00 0.00 H ATOM 114 HA HIS A 7 6.350 8.213 -9.369 1.00 0.00 H ATOM 115 HB2 HIS A 7 8.319 6.687 -9.992 1.00 0.00 H ATOM 116 HB3 HIS A 7 6.723 6.034 -10.025 1.00 0.00 H ATOM 117 HD1 HIS A 7 5.895 5.238 -12.549 1.00 0.00 H ATOM 118 HD2 HIS A 7 9.576 7.309 -12.372 1.00 0.00 H ATOM 119 HE1 HIS A 7 6.890 5.156 -14.897 1.00 0.00 H ATOM 120 HE2 HIS A 7 9.162 6.356 -14.779 1.00 0.00 H ATOM 121 N PRO A 8 8.699 9.373 -9.325 1.00 0.00 N ATOM 122 CA PRO A 8 9.843 10.265 -9.227 1.00 0.00 C ATOM 123 C PRO A 8 11.029 9.753 -10.049 1.00 0.00 C ATOM 124 O PRO A 8 11.112 8.573 -10.397 1.00 0.00 O ATOM 125 CB PRO A 8 10.174 10.333 -7.735 1.00 0.00 C ATOM 126 CG PRO A 8 9.699 8.996 -7.183 1.00 0.00 C ATOM 127 CD PRO A 8 8.490 8.689 -8.054 1.00 0.00 C ATOM 128 HA PRO A 8 9.567 11.260 -9.581 1.00 0.00 H ATOM 129 HB2 PRO A 8 11.237 10.441 -7.558 1.00 0.00 H ATOM 130 HB3 PRO A 8 9.617 11.151 -7.276 1.00 0.00 H ATOM 131 HG2 PRO A 8 10.467 8.238 -7.343 1.00 0.00 H ATOM 132 HG3 PRO A 8 9.434 9.061 -6.127 1.00 0.00 H ATOM 133 HD2 PRO A 8 8.395 7.612 -8.184 1.00 0.00 H ATOM 134 HD3 PRO A 8 7.593 9.085 -7.591 1.00 0.00 H ATOM 135 N LYS A 9 11.945 10.669 -10.368 1.00 0.00 N ATOM 136 CA LYS A 9 13.106 10.446 -11.216 1.00 0.00 C ATOM 137 C LYS A 9 14.379 10.373 -10.347 1.00 0.00 C ATOM 138 O LYS A 9 14.373 10.878 -9.220 1.00 0.00 O ATOM 139 CB LYS A 9 13.174 11.607 -12.224 1.00 0.00 C ATOM 140 CG LYS A 9 12.294 11.436 -13.479 1.00 0.00 C ATOM 141 CD LYS A 9 10.792 11.373 -13.167 1.00 0.00 C ATOM 142 CE LYS A 9 9.933 11.346 -14.434 1.00 0.00 C ATOM 143 NZ LYS A 9 8.489 11.304 -14.096 1.00 0.00 N ATOM 144 H LYS A 9 11.859 11.611 -10.014 1.00 0.00 H ATOM 145 HA LYS A 9 12.991 9.505 -11.755 1.00 0.00 H ATOM 146 HB2 LYS A 9 12.914 12.536 -11.722 1.00 0.00 H ATOM 147 HB3 LYS A 9 14.202 11.720 -12.543 1.00 0.00 H ATOM 148 HG2 LYS A 9 12.478 12.285 -14.139 1.00 0.00 H ATOM 149 HG3 LYS A 9 12.591 10.527 -14.003 1.00 0.00 H ATOM 150 HD2 LYS A 9 10.586 10.460 -12.612 1.00 0.00 H ATOM 151 HD3 LYS A 9 10.516 12.237 -12.559 1.00 0.00 H ATOM 152 HE2 LYS A 9 10.144 12.232 -15.036 1.00 0.00 H ATOM 153 HE3 LYS A 9 10.196 10.461 -15.018 1.00 0.00 H ATOM 154 HZ1 LYS A 9 8.296 10.558 -13.437 1.00 0.00 H ATOM 155 HZ2 LYS A 9 7.933 11.159 -14.928 1.00 0.00 H ATOM 156 HZ3 LYS A 9 8.198 12.173 -13.672 1.00 0.00 H HETATM 157 N HYP A 10 15.472 9.767 -10.847 1.00 0.00 N HETATM 158 CA HYP A 10 16.695 9.549 -10.084 1.00 0.00 C HETATM 159 C HYP A 10 17.522 10.843 -10.026 1.00 0.00 C HETATM 160 O HYP A 10 17.269 11.705 -9.185 1.00 0.00 O HETATM 161 CB HYP A 10 17.385 8.366 -10.776 1.00 0.00 C HETATM 162 CG HYP A 10 16.950 8.490 -12.238 1.00 0.00 C HETATM 163 CD HYP A 10 15.570 9.144 -12.161 1.00 0.00 C HETATM 164 OD1 HYP A 10 16.883 7.232 -12.877 1.00 0.00 O HETATM 165 HA HYP A 10 16.450 9.257 -9.061 1.00 0.00 H HETATM 166 HB2 HYP A 10 18.470 8.385 -10.662 1.00 0.00 H HETATM 167 HB3 HYP A 10 16.995 7.442 -10.355 1.00 0.00 H HETATM 168 HG HYP A 10 17.632 9.153 -12.769 1.00 0.00 H HETATM 169 HD22 HYP A 10 14.783 8.396 -12.265 1.00 0.00 H HETATM 170 HD23 HYP A 10 15.482 9.893 -12.950 1.00 0.00 H HETATM 171 HD1 HYP A 10 17.799 6.922 -13.007 1.00 0.00 H ATOM 172 N ASN A 11 18.494 11.009 -10.926 1.00 0.00 N ATOM 173 CA ASN A 11 19.434 12.135 -10.983 1.00 0.00 C ATOM 174 C ASN A 11 18.813 13.389 -11.617 1.00 0.00 C ATOM 175 O ASN A 11 19.444 14.102 -12.396 1.00 0.00 O ATOM 176 CB ASN A 11 20.729 11.704 -11.691 1.00 0.00 C ATOM 177 CG ASN A 11 20.584 11.526 -13.208 1.00 0.00 C ATOM 178 OD1 ASN A 11 19.666 10.858 -13.682 1.00 0.00 O ATOM 179 ND2 ASN A 11 21.483 12.106 -13.996 1.00 0.00 N ATOM 180 H ASN A 11 18.618 10.287 -11.622 1.00 0.00 H ATOM 181 HA ASN A 11 19.692 12.395 -9.955 1.00 0.00 H ATOM 182 HB2 ASN A 11 21.476 12.470 -11.490 1.00 0.00 H ATOM 183 HB3 ASN A 11 21.085 10.774 -11.249 1.00 0.00 H ATOM 184 HD21 ASN A 11 22.230 12.658 -13.588 1.00 0.00 H ATOM 185 HD22 ASN A 11 21.396 12.023 -15.004 1.00 0.00 H ATOM 186 N SER A 12 17.562 13.673 -11.267 1.00 0.00 N ATOM 187 CA SER A 12 16.780 14.773 -11.817 1.00 0.00 C ATOM 188 C SER A 12 17.493 16.118 -11.604 1.00 0.00 C ATOM 189 O SER A 12 17.487 16.985 -12.483 1.00 0.00 O ATOM 190 CB SER A 12 15.384 14.731 -11.174 1.00 0.00 C ATOM 191 OG SER A 12 14.440 15.527 -11.871 1.00 0.00 O ATOM 192 H SER A 12 17.141 13.090 -10.557 1.00 0.00 H ATOM 193 HA SER A 12 16.695 14.609 -12.881 1.00 0.00 H ATOM 194 HB2 SER A 12 15.025 13.701 -11.177 1.00 0.00 H ATOM 195 HB3 SER A 12 15.455 15.064 -10.137 1.00 0.00 H ATOM 196 HG SER A 12 13.576 15.462 -11.417 1.00 0.00 H HETATM 197 N DPN A 13 18.183 16.235 -10.465 1.00 0.00 N HETATM 198 CA DPN A 13 18.880 17.418 -9.952 1.00 0.00 C HETATM 199 C DPN A 13 20.074 17.883 -10.805 1.00 0.00 C HETATM 200 O DPN A 13 20.674 18.927 -10.540 1.00 0.00 O HETATM 201 CB DPN A 13 17.873 18.542 -9.749 1.00 0.00 C HETATM 202 CG DPN A 13 16.837 18.244 -8.681 1.00 0.00 C HETATM 203 CD1 DPN A 13 17.191 18.298 -7.320 1.00 0.00 C HETATM 204 CD2 DPN A 13 15.537 17.845 -9.049 1.00 0.00 C HETATM 205 CE1 DPN A 13 16.252 17.951 -6.332 1.00 0.00 C HETATM 206 CE2 DPN A 13 14.600 17.496 -8.061 1.00 0.00 C HETATM 207 CZ DPN A 13 14.956 17.550 -6.702 1.00 0.00 C HETATM 208 H DPN A 13 18.123 15.443 -9.852 1.00 0.00 H HETATM 209 HA DPN A 13 19.288 17.153 -8.975 1.00 0.00 H HETATM 210 HB2 DPN A 13 17.377 18.753 -10.692 1.00 0.00 H HETATM 211 HB3 DPN A 13 18.447 19.418 -9.485 1.00 0.00 H HETATM 212 HD1 DPN A 13 18.191 18.593 -7.029 1.00 0.00 H HETATM 213 HD2 DPN A 13 15.260 17.789 -10.093 1.00 0.00 H HETATM 214 HE1 DPN A 13 16.533 17.981 -5.288 1.00 0.00 H HETATM 215 HE2 DPN A 13 13.608 17.176 -8.349 1.00 0.00 H HETATM 216 HZ DPN A 13 14.236 17.277 -5.942 1.00 0.00 H ATOM 217 N TRP A 14 20.428 17.097 -11.813 1.00 0.00 N ATOM 218 CA TRP A 14 21.566 17.275 -12.695 1.00 0.00 C ATOM 219 C TRP A 14 21.142 17.705 -14.109 1.00 0.00 C ATOM 220 O TRP A 14 22.005 17.905 -14.969 1.00 0.00 O ATOM 221 CB TRP A 14 22.319 15.941 -12.723 1.00 0.00 C ATOM 222 CG TRP A 14 22.905 15.500 -11.411 1.00 0.00 C ATOM 223 CD1 TRP A 14 22.230 14.953 -10.375 1.00 0.00 C ATOM 224 CD2 TRP A 14 24.292 15.587 -10.968 1.00 0.00 C ATOM 225 NE1 TRP A 14 23.099 14.678 -9.338 1.00 0.00 N ATOM 226 CE2 TRP A 14 24.390 15.050 -9.649 1.00 0.00 C ATOM 227 CE3 TRP A 14 25.478 16.076 -11.553 1.00 0.00 C ATOM 228 CZ2 TRP A 14 25.608 14.991 -8.953 1.00 0.00 C ATOM 229 CZ3 TRP A 14 26.706 16.023 -10.866 1.00 0.00 C ATOM 230 CH2 TRP A 14 26.774 15.480 -9.569 1.00 0.00 C ATOM 231 H TRP A 14 19.885 16.265 -11.947 1.00 0.00 H ATOM 232 HA TRP A 14 22.220 18.048 -12.295 1.00 0.00 H ATOM 233 HB2 TRP A 14 21.653 15.160 -13.097 1.00 0.00 H ATOM 234 HB3 TRP A 14 23.133 16.047 -13.434 1.00 0.00 H ATOM 235 HD1 TRP A 14 21.165 14.766 -10.356 1.00 0.00 H ATOM 236 HE1 TRP A 14 22.801 14.265 -8.461 1.00 0.00 H ATOM 237 HE3 TRP A 14 25.429 16.500 -12.546 1.00 0.00 H ATOM 238 HZ2 TRP A 14 25.650 14.578 -7.955 1.00 0.00 H ATOM 239 HZ3 TRP A 14 27.603 16.403 -11.337 1.00 0.00 H ATOM 240 HH2 TRP A 14 27.720 15.442 -9.046 1.00 0.00 H ATOM 241 N THR A 15 19.837 17.826 -14.365 1.00 0.00 N ATOM 242 CA THR A 15 19.298 18.267 -15.648 1.00 0.00 C ATOM 243 C THR A 15 19.682 19.741 -15.859 1.00 0.00 C ATOM 244 O THR A 15 19.503 20.555 -14.922 1.00 0.00 O ATOM 245 CB THR A 15 17.775 18.032 -15.699 1.00 0.00 C ATOM 246 OG1 THR A 15 17.446 16.730 -15.239 1.00 0.00 O ATOM 247 CG2 THR A 15 17.228 18.174 -17.125 1.00 0.00 C ATOM 248 OXT THR A 15 20.194 20.080 -16.950 1.00 0.00 O ATOM 249 H THR A 15 19.186 17.682 -13.605 1.00 0.00 H ATOM 250 HA THR A 15 19.765 17.671 -16.433 1.00 0.00 H ATOM 251 HB THR A 15 17.277 18.762 -15.058 1.00 0.00 H ATOM 252 HG1 THR A 15 17.407 16.775 -14.263 1.00 0.00 H ATOM 253 HG21 THR A 15 16.154 17.987 -17.129 1.00 0.00 H ATOM 254 HG22 THR A 15 17.720 17.463 -17.790 1.00 0.00 H ATOM 255 HG23 THR A 15 17.403 19.186 -17.491 1.00 0.00 H TER 256 THR A 15