ATOM 1 N PHE A 5 3.023 -13.194 11.785 1.00 0.00 N ATOM 2 CA PHE A 5 3.304 -12.501 10.495 1.00 0.00 C ATOM 3 C PHE A 5 3.832 -13.500 9.462 1.00 0.00 C ATOM 4 O PHE A 5 5.002 -13.832 9.446 1.00 0.00 O ATOM 5 CB PHE A 5 4.372 -11.460 10.829 1.00 0.00 C ATOM 6 CG PHE A 5 3.752 -10.343 11.635 1.00 0.00 C ATOM 7 CD1 PHE A 5 3.646 -10.460 13.026 1.00 0.00 C ATOM 8 CD2 PHE A 5 3.284 -9.191 10.991 1.00 0.00 C ATOM 9 CE1 PHE A 5 3.072 -9.424 13.773 1.00 0.00 C ATOM 10 CE2 PHE A 5 2.710 -8.155 11.738 1.00 0.00 C ATOM 11 CZ PHE A 5 2.604 -8.273 13.129 1.00 0.00 C ATOM 12 H PHE A 5 3.747 -13.345 12.428 1.00 0.00 H ATOM 13 HA PHE A 5 2.415 -12.013 10.128 1.00 0.00 H ATOM 14 HB2 PHE A 5 5.160 -11.925 11.403 1.00 0.00 H ATOM 15 HB3 PHE A 5 4.782 -11.058 9.914 1.00 0.00 H ATOM 16 HD1 PHE A 5 4.008 -11.348 13.522 1.00 0.00 H ATOM 17 HD2 PHE A 5 3.367 -9.102 9.917 1.00 0.00 H ATOM 18 HE1 PHE A 5 2.990 -9.515 14.846 1.00 0.00 H ATOM 19 HE2 PHE A 5 2.349 -7.268 11.241 1.00 0.00 H ATOM 20 HZ PHE A 5 2.161 -7.475 13.706 1.00 0.00 H ATOM 21 N GLU A 6 2.980 -13.983 8.599 1.00 0.00 N ATOM 22 CA GLU A 6 3.434 -14.960 7.568 1.00 0.00 C ATOM 23 C GLU A 6 2.767 -14.659 6.223 1.00 0.00 C ATOM 24 O GLU A 6 1.584 -14.873 6.044 1.00 0.00 O ATOM 25 CB GLU A 6 2.990 -16.326 8.093 1.00 0.00 C ATOM 26 CG GLU A 6 3.944 -16.782 9.199 1.00 0.00 C ATOM 27 CD GLU A 6 3.208 -17.724 10.153 1.00 0.00 C ATOM 28 OE1 GLU A 6 2.755 -18.762 9.698 1.00 0.00 O ATOM 29 OE2 GLU A 6 3.108 -17.391 11.323 1.00 0.00 O ATOM 30 H GLU A 6 2.042 -13.703 8.628 1.00 0.00 H ATOM 31 HA GLU A 6 4.508 -14.935 7.472 1.00 0.00 H ATOM 32 HB2 GLU A 6 1.988 -16.249 8.492 1.00 0.00 H ATOM 33 HB3 GLU A 6 3.002 -17.043 7.287 1.00 0.00 H ATOM 34 HG2 GLU A 6 4.783 -17.302 8.758 1.00 0.00 H ATOM 35 HG3 GLU A 6 4.300 -15.922 9.746 1.00 0.00 H ATOM 36 N ILE A 7 3.516 -14.165 5.277 1.00 0.00 N ATOM 37 CA ILE A 7 2.924 -13.851 3.945 1.00 0.00 C ATOM 38 C ILE A 7 3.867 -14.310 2.824 1.00 0.00 C ATOM 39 O ILE A 7 5.065 -14.376 3.014 1.00 0.00 O ATOM 40 CB ILE A 7 2.772 -12.331 3.927 1.00 0.00 C ATOM 41 CG1 ILE A 7 4.133 -11.681 4.192 1.00 0.00 C ATOM 42 CG2 ILE A 7 1.784 -11.902 5.014 1.00 0.00 C ATOM 43 CD1 ILE A 7 3.981 -10.158 4.181 1.00 0.00 C ATOM 44 H ILE A 7 4.469 -14.000 5.440 1.00 0.00 H ATOM 45 HA ILE A 7 1.959 -14.319 3.840 1.00 0.00 H ATOM 46 HB ILE A 7 2.403 -12.016 2.962 1.00 0.00 H ATOM 47 HG12 ILE A 7 4.503 -11.999 5.153 1.00 0.00 H ATOM 48 HG13 ILE A 7 4.829 -11.977 3.421 1.00 0.00 H ATOM 49 HG21 ILE A 7 2.326 -11.456 5.836 1.00 0.00 H ATOM 50 HG22 ILE A 7 1.243 -12.766 5.367 1.00 0.00 H ATOM 51 HG23 ILE A 7 1.091 -11.183 4.606 1.00 0.00 H ATOM 52 HD11 ILE A 7 4.371 -9.751 5.103 1.00 0.00 H ATOM 53 HD12 ILE A 7 2.937 -9.901 4.088 1.00 0.00 H ATOM 54 HD13 ILE A 7 4.530 -9.747 3.346 1.00 0.00 H ATOM 55 N PRO A 8 3.294 -14.615 1.681 1.00 0.00 N ATOM 56 CA PRO A 8 4.098 -15.069 0.524 1.00 0.00 C ATOM 57 C PRO A 8 4.610 -13.878 -0.300 1.00 0.00 C ATOM 58 O PRO A 8 4.735 -13.964 -1.505 1.00 0.00 O ATOM 59 CB PRO A 8 3.102 -15.887 -0.288 1.00 0.00 C ATOM 60 CG PRO A 8 1.744 -15.348 0.067 1.00 0.00 C ATOM 61 CD PRO A 8 1.863 -14.575 1.361 1.00 0.00 C ATOM 62 HA PRO A 8 4.914 -15.696 0.846 1.00 0.00 H ATOM 63 HB2 PRO A 8 3.290 -15.758 -1.345 1.00 0.00 H ATOM 64 HB3 PRO A 8 3.171 -16.930 -0.023 1.00 0.00 H ATOM 65 HG2 PRO A 8 1.397 -14.693 -0.717 1.00 0.00 H ATOM 66 HG3 PRO A 8 1.050 -16.165 0.195 1.00 0.00 H ATOM 67 HD2 PRO A 8 1.536 -13.554 1.222 1.00 0.00 H ATOM 68 HD3 PRO A 8 1.289 -15.054 2.141 1.00 0.00 H ATOM 69 N ASP A 9 4.917 -12.775 0.335 1.00 0.00 N ATOM 70 CA ASP A 9 5.427 -11.587 -0.412 1.00 0.00 C ATOM 71 C ASP A 9 4.577 -11.312 -1.659 1.00 0.00 C ATOM 72 O ASP A 9 5.085 -11.209 -2.757 1.00 0.00 O ATOM 73 CB ASP A 9 6.850 -11.971 -0.800 1.00 0.00 C ATOM 74 CG ASP A 9 7.552 -10.770 -1.434 1.00 0.00 C ATOM 75 OD1 ASP A 9 7.150 -9.654 -1.150 1.00 0.00 O ATOM 76 OD2 ASP A 9 8.482 -10.985 -2.193 1.00 0.00 O ATOM 77 H ASP A 9 4.822 -12.727 1.303 1.00 0.00 H ATOM 78 HA ASP A 9 5.445 -10.721 0.230 1.00 0.00 H ATOM 79 HB2 ASP A 9 7.386 -12.278 0.086 1.00 0.00 H ATOM 80 HB3 ASP A 9 6.821 -12.788 -1.503 1.00 0.00 H ATOM 81 N ASP A 10 3.289 -11.192 -1.495 1.00 0.00 N ATOM 82 CA ASP A 10 2.409 -10.924 -2.670 1.00 0.00 C ATOM 83 C ASP A 10 0.975 -10.650 -2.206 1.00 0.00 C ATOM 84 O ASP A 10 0.055 -11.362 -2.552 1.00 0.00 O ATOM 85 CB ASP A 10 2.467 -12.202 -3.507 1.00 0.00 C ATOM 86 CG ASP A 10 2.245 -11.856 -4.981 1.00 0.00 C ATOM 87 OD1 ASP A 10 2.838 -10.893 -5.438 1.00 0.00 O ATOM 88 OD2 ASP A 10 1.487 -12.562 -5.626 1.00 0.00 O ATOM 89 H ASP A 10 2.899 -11.278 -0.600 1.00 0.00 H ATOM 90 HA ASP A 10 2.787 -10.091 -3.240 1.00 0.00 H ATOM 91 HB2 ASP A 10 3.435 -12.667 -3.388 1.00 0.00 H ATOM 92 HB3 ASP A 10 1.697 -12.883 -3.178 1.00 0.00 H ATOM 93 N VAL A 11 0.782 -9.625 -1.422 1.00 0.00 N ATOM 94 CA VAL A 11 -0.590 -9.308 -0.934 1.00 0.00 C ATOM 95 C VAL A 11 -1.307 -8.376 -1.925 1.00 0.00 C ATOM 96 O VAL A 11 -0.794 -7.327 -2.261 1.00 0.00 O ATOM 97 CB VAL A 11 -0.374 -8.598 0.401 1.00 0.00 C ATOM 98 CG1 VAL A 11 -1.723 -8.150 0.965 1.00 0.00 C ATOM 99 CG2 VAL A 11 0.299 -9.560 1.383 1.00 0.00 C ATOM 100 H VAL A 11 1.538 -9.064 -1.152 1.00 0.00 H ATOM 101 HA VAL A 11 -1.150 -10.214 -0.781 1.00 0.00 H ATOM 102 HB VAL A 11 0.259 -7.736 0.253 1.00 0.00 H ATOM 103 HG11 VAL A 11 -1.813 -7.078 0.875 1.00 0.00 H ATOM 104 HG12 VAL A 11 -1.787 -8.430 2.007 1.00 0.00 H ATOM 105 HG13 VAL A 11 -2.519 -8.627 0.415 1.00 0.00 H ATOM 106 HG21 VAL A 11 1.368 -9.548 1.225 1.00 0.00 H ATOM 107 HG22 VAL A 11 -0.077 -10.560 1.223 1.00 0.00 H ATOM 108 HG23 VAL A 11 0.081 -9.253 2.395 1.00 0.00 H ATOM 109 N PRO A 12 -2.477 -8.785 -2.367 1.00 0.00 N ATOM 110 CA PRO A 12 -3.252 -7.957 -3.327 1.00 0.00 C ATOM 111 C PRO A 12 -3.911 -6.762 -2.621 1.00 0.00 C ATOM 112 O PRO A 12 -4.593 -5.974 -3.243 1.00 0.00 O ATOM 113 CB PRO A 12 -4.318 -8.915 -3.848 1.00 0.00 C ATOM 114 CG PRO A 12 -4.488 -9.935 -2.765 1.00 0.00 C ATOM 115 CD PRO A 12 -3.177 -10.033 -2.028 1.00 0.00 C ATOM 116 HA PRO A 12 -2.625 -7.627 -4.139 1.00 0.00 H ATOM 117 HB2 PRO A 12 -5.244 -8.388 -4.016 1.00 0.00 H ATOM 118 HB3 PRO A 12 -3.983 -9.388 -4.758 1.00 0.00 H ATOM 119 HG2 PRO A 12 -5.267 -9.622 -2.087 1.00 0.00 H ATOM 120 HG3 PRO A 12 -4.739 -10.892 -3.198 1.00 0.00 H ATOM 121 HD2 PRO A 12 -3.347 -10.093 -0.964 1.00 0.00 H ATOM 122 HD3 PRO A 12 -2.614 -10.888 -2.371 1.00 0.00 H ATOM 123 N LEU A 13 -3.724 -6.629 -1.329 1.00 0.00 N ATOM 124 CA LEU A 13 -4.347 -5.490 -0.588 1.00 0.00 C ATOM 125 C LEU A 13 -5.873 -5.509 -0.777 1.00 0.00 C ATOM 126 O LEU A 13 -6.378 -6.200 -1.640 1.00 0.00 O ATOM 127 CB LEU A 13 -3.729 -4.221 -1.186 1.00 0.00 C ATOM 128 CG LEU A 13 -2.342 -3.993 -0.575 1.00 0.00 C ATOM 129 CD1 LEU A 13 -1.311 -4.856 -1.308 1.00 0.00 C ATOM 130 CD2 LEU A 13 -1.956 -2.519 -0.714 1.00 0.00 C ATOM 131 H LEU A 13 -3.179 -7.281 -0.844 1.00 0.00 H ATOM 132 HA LEU A 13 -4.104 -5.556 0.462 1.00 0.00 H ATOM 133 HB2 LEU A 13 -3.635 -4.327 -2.253 1.00 0.00 H ATOM 134 HB3 LEU A 13 -4.362 -3.374 -0.963 1.00 0.00 H ATOM 135 HG LEU A 13 -2.359 -4.264 0.470 1.00 0.00 H ATOM 136 HD11 LEU A 13 -1.671 -5.084 -2.300 1.00 0.00 H ATOM 137 HD12 LEU A 13 -1.157 -5.774 -0.761 1.00 0.00 H ATOM 138 HD13 LEU A 13 -0.376 -4.318 -1.380 1.00 0.00 H ATOM 139 HD21 LEU A 13 -0.914 -2.393 -0.459 1.00 0.00 H ATOM 140 HD22 LEU A 13 -2.562 -1.923 -0.048 1.00 0.00 H ATOM 141 HD23 LEU A 13 -2.118 -2.197 -1.733 1.00 0.00 H ATOM 142 N PRO A 14 -6.566 -4.757 0.046 1.00 0.00 N ATOM 143 CA PRO A 14 -8.045 -4.713 -0.042 1.00 0.00 C ATOM 144 C PRO A 14 -8.496 -3.873 -1.242 1.00 0.00 C ATOM 145 O PRO A 14 -7.692 -3.311 -1.955 1.00 0.00 O ATOM 146 CB PRO A 14 -8.466 -4.069 1.277 1.00 0.00 C ATOM 147 CG PRO A 14 -7.283 -3.267 1.722 1.00 0.00 C ATOM 148 CD PRO A 14 -6.049 -3.893 1.117 1.00 0.00 C ATOM 149 HA PRO A 14 -8.448 -5.707 -0.106 1.00 0.00 H ATOM 150 HB2 PRO A 14 -9.318 -3.425 1.121 1.00 0.00 H ATOM 151 HB3 PRO A 14 -8.698 -4.831 2.006 1.00 0.00 H ATOM 152 HG2 PRO A 14 -7.383 -2.248 1.384 1.00 0.00 H ATOM 153 HG3 PRO A 14 -7.214 -3.289 2.799 1.00 0.00 H ATOM 154 HD2 PRO A 14 -5.401 -3.131 0.709 1.00 0.00 H ATOM 155 HD3 PRO A 14 -5.524 -4.480 1.855 1.00 0.00 H ATOM 156 N ALA A 15 -9.779 -3.797 -1.473 1.00 0.00 N ATOM 157 CA ALA A 15 -10.285 -3.006 -2.633 1.00 0.00 C ATOM 158 C ALA A 15 -10.004 -1.514 -2.433 1.00 0.00 C ATOM 159 O ALA A 15 -9.767 -1.059 -1.333 1.00 0.00 O ATOM 160 CB ALA A 15 -11.791 -3.267 -2.660 1.00 0.00 C ATOM 161 H ALA A 15 -10.410 -4.267 -0.889 1.00 0.00 H ATOM 162 HA ALA A 15 -9.837 -3.354 -3.550 1.00 0.00 H ATOM 163 HB1 ALA A 15 -12.261 -2.591 -3.360 1.00 0.00 H ATOM 164 HB2 ALA A 15 -12.202 -3.108 -1.675 1.00 0.00 H ATOM 165 HB3 ALA A 15 -11.975 -4.287 -2.966 1.00 0.00 H ATOM 166 N GLY A 16 -10.031 -0.752 -3.493 1.00 0.00 N ATOM 167 CA GLY A 16 -9.768 0.710 -3.371 1.00 0.00 C ATOM 168 C GLY A 16 -8.271 0.946 -3.150 1.00 0.00 C ATOM 169 O GLY A 16 -7.865 1.977 -2.651 1.00 0.00 O ATOM 170 H GLY A 16 -10.227 -1.141 -4.370 1.00 0.00 H ATOM 171 HA2 GLY A 16 -10.081 1.209 -4.275 1.00 0.00 H ATOM 172 HA3 GLY A 16 -10.322 1.106 -2.531 1.00 0.00 H ATOM 173 N TRP A 17 -7.449 0.000 -3.511 1.00 0.00 N ATOM 174 CA TRP A 17 -5.981 0.173 -3.314 1.00 0.00 C ATOM 175 C TRP A 17 -5.225 -0.045 -4.625 1.00 0.00 C ATOM 176 O TRP A 17 -5.583 -0.887 -5.424 1.00 0.00 O ATOM 177 CB TRP A 17 -5.602 -0.903 -2.306 1.00 0.00 C ATOM 178 CG TRP A 17 -5.751 -0.359 -0.930 1.00 0.00 C ATOM 179 CD1 TRP A 17 -6.855 -0.472 -0.163 1.00 0.00 C ATOM 180 CD2 TRP A 17 -4.781 0.387 -0.150 1.00 0.00 C ATOM 181 NE1 TRP A 17 -6.624 0.158 1.049 1.00 0.00 N ATOM 182 CE2 TRP A 17 -5.353 0.702 1.104 1.00 0.00 C ATOM 183 CE3 TRP A 17 -3.472 0.812 -0.409 1.00 0.00 C ATOM 184 CZ2 TRP A 17 -4.640 1.418 2.068 1.00 0.00 C ATOM 185 CZ3 TRP A 17 -2.754 1.530 0.555 1.00 0.00 C ATOM 186 CH2 TRP A 17 -3.333 1.832 1.789 1.00 0.00 C ATOM 187 H TRP A 17 -7.794 -0.827 -3.903 1.00 0.00 H ATOM 188 HA TRP A 17 -5.764 1.150 -2.908 1.00 0.00 H ATOM 189 HB2 TRP A 17 -6.249 -1.757 -2.430 1.00 0.00 H ATOM 190 HB3 TRP A 17 -4.575 -1.202 -2.466 1.00 0.00 H ATOM 191 HD1 TRP A 17 -7.769 -0.976 -0.450 1.00 0.00 H ATOM 192 HE1 TRP A 17 -7.267 0.221 1.787 1.00 0.00 H ATOM 193 HE3 TRP A 17 -3.015 0.585 -1.361 1.00 0.00 H ATOM 194 HZ2 TRP A 17 -5.094 1.648 3.022 1.00 0.00 H ATOM 195 HZ3 TRP A 17 -1.750 1.853 0.344 1.00 0.00 H ATOM 196 HH2 TRP A 17 -2.768 2.384 2.522 1.00 0.00 H ATOM 197 N GLU A 18 -4.177 0.701 -4.853 1.00 0.00 N ATOM 198 CA GLU A 18 -3.406 0.519 -6.115 1.00 0.00 C ATOM 199 C GLU A 18 -1.899 0.553 -5.853 1.00 0.00 C ATOM 200 O GLU A 18 -1.295 1.611 -5.842 1.00 0.00 O ATOM 201 CB GLU A 18 -3.797 1.702 -7.001 1.00 0.00 C ATOM 202 CG GLU A 18 -4.527 1.194 -8.244 1.00 0.00 C ATOM 203 CD GLU A 18 -5.960 0.804 -7.871 1.00 0.00 C ATOM 204 OE1 GLU A 18 -6.495 1.400 -6.950 1.00 0.00 O ATOM 205 OE2 GLU A 18 -6.497 -0.084 -8.512 1.00 0.00 O ATOM 206 H GLU A 18 -3.900 1.379 -4.195 1.00 0.00 H ATOM 207 HA GLU A 18 -3.684 -0.404 -6.597 1.00 0.00 H ATOM 208 HB2 GLU A 18 -4.438 2.370 -6.449 1.00 0.00 H ATOM 209 HB3 GLU A 18 -2.906 2.233 -7.303 1.00 0.00 H ATOM 210 HG2 GLU A 18 -4.549 1.974 -8.991 1.00 0.00 H ATOM 211 HG3 GLU A 18 -4.009 0.332 -8.636 1.00 0.00 H ATOM 212 N MET A 19 -1.271 -0.584 -5.667 1.00 0.00 N ATOM 213 CA MET A 19 0.196 -0.561 -5.449 1.00 0.00 C ATOM 214 C MET A 19 0.852 0.034 -6.686 1.00 0.00 C ATOM 215 O MET A 19 0.713 -0.469 -7.785 1.00 0.00 O ATOM 216 CB MET A 19 0.650 -2.003 -5.253 1.00 0.00 C ATOM 217 CG MET A 19 0.168 -2.879 -6.415 1.00 0.00 C ATOM 218 SD MET A 19 -0.293 -4.514 -5.792 1.00 0.00 S ATOM 219 CE MET A 19 -1.625 -3.980 -4.688 1.00 0.00 C ATOM 220 H MET A 19 -1.753 -1.432 -5.691 1.00 0.00 H ATOM 221 HA MET A 19 0.439 0.025 -4.580 1.00 0.00 H ATOM 222 HB2 MET A 19 1.721 -2.017 -5.225 1.00 0.00 H ATOM 223 HB3 MET A 19 0.266 -2.385 -4.318 1.00 0.00 H ATOM 224 HG2 MET A 19 -0.683 -2.421 -6.892 1.00 0.00 H ATOM 225 HG3 MET A 19 0.966 -2.982 -7.135 1.00 0.00 H ATOM 226 HE1 MET A 19 -2.235 -3.244 -5.193 1.00 0.00 H ATOM 227 HE2 MET A 19 -1.203 -3.543 -3.798 1.00 0.00 H ATOM 228 HE3 MET A 19 -2.230 -4.833 -4.416 1.00 0.00 H ATOM 229 N ALA A 20 1.550 1.105 -6.517 1.00 0.00 N ATOM 230 CA ALA A 20 2.209 1.758 -7.675 1.00 0.00 C ATOM 231 C ALA A 20 3.597 2.232 -7.261 1.00 0.00 C ATOM 232 O ALA A 20 4.131 1.794 -6.260 1.00 0.00 O ATOM 233 CB ALA A 20 1.296 2.936 -8.023 1.00 0.00 C ATOM 234 H ALA A 20 1.639 1.487 -5.621 1.00 0.00 H ATOM 235 HA ALA A 20 2.272 1.077 -8.509 1.00 0.00 H ATOM 236 HB1 ALA A 20 1.893 3.774 -8.350 1.00 0.00 H ATOM 237 HB2 ALA A 20 0.725 3.220 -7.150 1.00 0.00 H ATOM 238 HB3 ALA A 20 0.618 2.646 -8.813 1.00 0.00 H ATOM 239 N LYS A 21 4.195 3.118 -8.007 1.00 0.00 N ATOM 240 CA LYS A 21 5.551 3.588 -7.618 1.00 0.00 C ATOM 241 C LYS A 21 5.581 5.104 -7.466 1.00 0.00 C ATOM 242 O LYS A 21 5.026 5.837 -8.263 1.00 0.00 O ATOM 243 CB LYS A 21 6.479 3.131 -8.742 1.00 0.00 C ATOM 244 CG LYS A 21 6.027 3.754 -10.063 1.00 0.00 C ATOM 245 CD LYS A 21 7.028 3.400 -11.165 1.00 0.00 C ATOM 246 CE LYS A 21 6.653 2.050 -11.781 1.00 0.00 C ATOM 247 NZ LYS A 21 6.422 2.341 -13.224 1.00 0.00 N ATOM 248 H LYS A 21 3.760 3.465 -8.814 1.00 0.00 H ATOM 249 HA LYS A 21 5.835 3.128 -6.691 1.00 0.00 H ATOM 250 HB2 LYS A 21 7.490 3.444 -8.524 1.00 0.00 H ATOM 251 HB3 LYS A 21 6.446 2.054 -8.821 1.00 0.00 H ATOM 252 HG2 LYS A 21 5.053 3.371 -10.327 1.00 0.00 H ATOM 253 HG3 LYS A 21 5.974 4.828 -9.957 1.00 0.00 H ATOM 254 HD2 LYS A 21 7.009 4.163 -11.929 1.00 0.00 H ATOM 255 HD3 LYS A 21 8.021 3.339 -10.743 1.00 0.00 H ATOM 256 HE2 LYS A 21 7.464 1.346 -11.665 1.00 0.00 H ATOM 257 HE3 LYS A 21 5.752 1.666 -11.326 1.00 0.00 H ATOM 258 HZ1 LYS A 21 6.468 1.456 -13.768 1.00 0.00 H ATOM 259 HZ2 LYS A 21 7.153 2.998 -13.567 1.00 0.00 H ATOM 260 HZ3 LYS A 21 5.484 2.772 -13.345 1.00 0.00 H ATOM 261 N THR A 22 6.224 5.576 -6.437 1.00 0.00 N ATOM 262 CA THR A 22 6.290 7.046 -6.212 1.00 0.00 C ATOM 263 C THR A 22 7.732 7.479 -5.951 1.00 0.00 C ATOM 264 O THR A 22 8.668 6.765 -6.240 1.00 0.00 O ATOM 265 CB THR A 22 5.436 7.287 -4.971 1.00 0.00 C ATOM 266 OG1 THR A 22 5.442 8.674 -4.660 1.00 0.00 O ATOM 267 CG2 THR A 22 6.019 6.494 -3.797 1.00 0.00 C ATOM 268 H THR A 22 6.661 4.960 -5.805 1.00 0.00 H ATOM 269 HA THR A 22 5.879 7.578 -7.055 1.00 0.00 H ATOM 270 HB THR A 22 4.425 6.961 -5.159 1.00 0.00 H ATOM 271 HG1 THR A 22 5.165 9.155 -5.444 1.00 0.00 H ATOM 272 HG21 THR A 22 7.032 6.819 -3.615 1.00 0.00 H ATOM 273 HG22 THR A 22 6.018 5.442 -4.034 1.00 0.00 H ATOM 274 HG23 THR A 22 5.423 6.664 -2.910 1.00 0.00 H ATOM 275 N SER A 23 7.903 8.648 -5.395 1.00 0.00 N ATOM 276 CA SER A 23 9.277 9.160 -5.092 1.00 0.00 C ATOM 277 C SER A 23 10.224 8.938 -6.286 1.00 0.00 C ATOM 278 O SER A 23 10.316 9.766 -7.170 1.00 0.00 O ATOM 279 CB SER A 23 9.733 8.364 -3.867 1.00 0.00 C ATOM 280 OG SER A 23 11.087 8.679 -3.577 1.00 0.00 O ATOM 281 H SER A 23 7.119 9.192 -5.170 1.00 0.00 H ATOM 282 HA SER A 23 9.233 10.208 -4.845 1.00 0.00 H ATOM 283 HB2 SER A 23 9.115 8.619 -3.021 1.00 0.00 H ATOM 284 HB3 SER A 23 9.645 7.307 -4.071 1.00 0.00 H ATOM 285 HG SER A 23 11.630 7.935 -3.847 1.00 0.00 H ATOM 286 N SER A 24 10.929 7.835 -6.322 1.00 0.00 N ATOM 287 CA SER A 24 11.857 7.583 -7.462 1.00 0.00 C ATOM 288 C SER A 24 12.064 6.080 -7.651 1.00 0.00 C ATOM 289 O SER A 24 12.078 5.576 -8.758 1.00 0.00 O ATOM 290 CB SER A 24 13.169 8.261 -7.066 1.00 0.00 C ATOM 291 OG SER A 24 13.123 9.631 -7.438 1.00 0.00 O ATOM 292 H SER A 24 10.847 7.173 -5.608 1.00 0.00 H ATOM 293 HA SER A 24 11.472 8.020 -8.362 1.00 0.00 H ATOM 294 HB2 SER A 24 13.307 8.182 -5.999 1.00 0.00 H ATOM 295 HB3 SER A 24 13.991 7.778 -7.572 1.00 0.00 H ATOM 296 HG SER A 24 13.505 9.713 -8.315 1.00 0.00 H ATOM 297 N GLY A 25 12.220 5.367 -6.578 1.00 0.00 N ATOM 298 CA GLY A 25 12.425 3.893 -6.677 1.00 0.00 C ATOM 299 C GLY A 25 11.786 3.207 -5.468 1.00 0.00 C ATOM 300 O GLY A 25 12.458 2.581 -4.672 1.00 0.00 O ATOM 301 H GLY A 25 12.201 5.800 -5.704 1.00 0.00 H ATOM 302 HA2 GLY A 25 11.966 3.527 -7.585 1.00 0.00 H ATOM 303 HA3 GLY A 25 13.483 3.678 -6.699 1.00 0.00 H ATOM 304 N GLN A 26 10.494 3.319 -5.325 1.00 0.00 N ATOM 305 CA GLN A 26 9.812 2.673 -4.165 1.00 0.00 C ATOM 306 C GLN A 26 8.339 2.419 -4.493 1.00 0.00 C ATOM 307 O GLN A 26 7.642 3.296 -4.980 1.00 0.00 O ATOM 308 CB GLN A 26 9.943 3.678 -3.021 1.00 0.00 C ATOM 309 CG GLN A 26 9.775 2.953 -1.683 1.00 0.00 C ATOM 310 CD GLN A 26 10.733 3.554 -0.653 1.00 0.00 C ATOM 311 OE1 GLN A 26 10.352 4.410 0.120 1.00 0.00 O ATOM 312 NE2 GLN A 26 11.969 3.138 -0.609 1.00 0.00 N ATOM 313 H GLN A 26 9.971 3.828 -5.979 1.00 0.00 H ATOM 314 HA GLN A 26 10.306 1.750 -3.905 1.00 0.00 H ATOM 315 HB2 GLN A 26 10.917 4.141 -3.057 1.00 0.00 H ATOM 316 HB3 GLN A 26 9.180 4.437 -3.118 1.00 0.00 H ATOM 317 HG2 GLN A 26 8.758 3.067 -1.338 1.00 0.00 H ATOM 318 HG3 GLN A 26 9.997 1.904 -1.813 1.00 0.00 H ATOM 319 HE21 GLN A 26 12.276 2.447 -1.234 1.00 0.00 H ATOM 320 HE22 GLN A 26 12.591 3.517 0.047 1.00 0.00 H ATOM 321 N ARG A 27 7.854 1.233 -4.233 1.00 0.00 N ATOM 322 CA ARG A 27 6.425 0.941 -4.536 1.00 0.00 C ATOM 323 C ARG A 27 5.527 1.452 -3.424 1.00 0.00 C ATOM 324 O ARG A 27 5.644 1.053 -2.281 1.00 0.00 O ATOM 325 CB ARG A 27 6.294 -0.579 -4.623 1.00 0.00 C ATOM 326 CG ARG A 27 6.089 -0.970 -6.086 1.00 0.00 C ATOM 327 CD ARG A 27 7.449 -1.082 -6.780 1.00 0.00 C ATOM 328 NE ARG A 27 7.183 -1.880 -8.013 1.00 0.00 N ATOM 329 CZ ARG A 27 8.042 -1.891 -9.006 1.00 0.00 C ATOM 330 NH1 ARG A 27 9.157 -1.204 -8.944 1.00 0.00 N ATOM 331 NH2 ARG A 27 7.783 -2.600 -10.071 1.00 0.00 N ATOM 332 H ARG A 27 8.427 0.541 -3.842 1.00 0.00 H ATOM 333 HA ARG A 27 6.143 1.387 -5.476 1.00 0.00 H ATOM 334 HB2 ARG A 27 7.180 -1.050 -4.235 1.00 0.00 H ATOM 335 HB3 ARG A 27 5.435 -0.901 -4.045 1.00 0.00 H ATOM 336 HG2 ARG A 27 5.577 -1.918 -6.139 1.00 0.00 H ATOM 337 HG3 ARG A 27 5.495 -0.208 -6.574 1.00 0.00 H ATOM 338 HD2 ARG A 27 7.820 -0.101 -7.039 1.00 0.00 H ATOM 339 HD3 ARG A 27 8.155 -1.596 -6.144 1.00 0.00 H ATOM 340 HE ARG A 27 6.356 -2.401 -8.084 1.00 0.00 H ATOM 341 HH11 ARG A 27 9.370 -0.658 -8.135 1.00 0.00 H ATOM 342 HH12 ARG A 27 9.799 -1.228 -9.711 1.00 0.00 H ATOM 343 HH21 ARG A 27 6.936 -3.127 -10.127 1.00 0.00 H ATOM 344 HH22 ARG A 27 8.432 -2.615 -10.832 1.00 0.00 H ATOM 345 N TYR A 28 4.603 2.297 -3.755 1.00 0.00 N ATOM 346 CA TYR A 28 3.666 2.789 -2.720 1.00 0.00 C ATOM 347 C TYR A 28 2.312 2.156 -2.970 1.00 0.00 C ATOM 348 O TYR A 28 2.150 1.346 -3.863 1.00 0.00 O ATOM 349 CB TYR A 28 3.621 4.324 -2.849 1.00 0.00 C ATOM 350 CG TYR A 28 2.830 4.737 -4.073 1.00 0.00 C ATOM 351 CD1 TYR A 28 3.432 4.713 -5.332 1.00 0.00 C ATOM 352 CD2 TYR A 28 1.491 5.136 -3.944 1.00 0.00 C ATOM 353 CE1 TYR A 28 2.702 5.088 -6.463 1.00 0.00 C ATOM 354 CE2 TYR A 28 0.765 5.511 -5.078 1.00 0.00 C ATOM 355 CZ TYR A 28 1.374 5.484 -6.338 1.00 0.00 C ATOM 356 OH TYR A 28 0.672 5.851 -7.462 1.00 0.00 O ATOM 357 H TYR A 28 4.504 2.575 -4.692 1.00 0.00 H ATOM 358 HA TYR A 28 4.017 2.508 -1.738 1.00 0.00 H ATOM 359 HB2 TYR A 28 3.156 4.740 -1.969 1.00 0.00 H ATOM 360 HB3 TYR A 28 4.627 4.701 -2.931 1.00 0.00 H ATOM 361 HD1 TYR A 28 4.459 4.409 -5.429 1.00 0.00 H ATOM 362 HD2 TYR A 28 1.021 5.159 -2.969 1.00 0.00 H ATOM 363 HE1 TYR A 28 3.160 5.070 -7.435 1.00 0.00 H ATOM 364 HE2 TYR A 28 -0.264 5.815 -4.982 1.00 0.00 H ATOM 365 HH TYR A 28 0.788 6.796 -7.590 1.00 0.00 H ATOM 366 N PHE A 29 1.353 2.497 -2.186 1.00 0.00 N ATOM 367 CA PHE A 29 0.022 1.899 -2.369 1.00 0.00 C ATOM 368 C PHE A 29 -1.017 2.998 -2.444 1.00 0.00 C ATOM 369 O PHE A 29 -1.555 3.460 -1.455 1.00 0.00 O ATOM 370 CB PHE A 29 -0.121 0.962 -1.173 1.00 0.00 C ATOM 371 CG PHE A 29 0.922 -0.116 -1.371 1.00 0.00 C ATOM 372 CD1 PHE A 29 2.250 0.076 -0.949 1.00 0.00 C ATOM 373 CD2 PHE A 29 0.571 -1.285 -2.043 1.00 0.00 C ATOM 374 CE1 PHE A 29 3.210 -0.914 -1.200 1.00 0.00 C ATOM 375 CE2 PHE A 29 1.530 -2.269 -2.297 1.00 0.00 C ATOM 376 CZ PHE A 29 2.848 -2.085 -1.876 1.00 0.00 C ATOM 377 H PHE A 29 1.509 3.142 -1.466 1.00 0.00 H ATOM 378 HA PHE A 29 0.003 1.326 -3.279 1.00 0.00 H ATOM 379 HB2 PHE A 29 0.052 1.495 -0.248 1.00 0.00 H ATOM 380 HB3 PHE A 29 -1.105 0.521 -1.166 1.00 0.00 H ATOM 381 HD1 PHE A 29 2.533 0.984 -0.427 1.00 0.00 H ATOM 382 HD2 PHE A 29 -0.444 -1.426 -2.365 1.00 0.00 H ATOM 383 HE1 PHE A 29 4.229 -0.770 -0.881 1.00 0.00 H ATOM 384 HE2 PHE A 29 1.250 -3.172 -2.826 1.00 0.00 H ATOM 385 HZ PHE A 29 3.589 -2.844 -2.081 1.00 0.00 H ATOM 386 N LEU A 30 -1.266 3.430 -3.649 1.00 0.00 N ATOM 387 CA LEU A 30 -2.237 4.520 -3.885 1.00 0.00 C ATOM 388 C LEU A 30 -3.582 4.141 -3.264 1.00 0.00 C ATOM 389 O LEU A 30 -4.350 3.377 -3.818 1.00 0.00 O ATOM 390 CB LEU A 30 -2.306 4.621 -5.422 1.00 0.00 C ATOM 391 CG LEU A 30 -2.696 6.029 -5.948 1.00 0.00 C ATOM 392 CD1 LEU A 30 -2.458 7.159 -4.932 1.00 0.00 C ATOM 393 CD2 LEU A 30 -1.896 6.330 -7.210 1.00 0.00 C ATOM 394 H LEU A 30 -0.788 3.033 -4.411 1.00 0.00 H ATOM 395 HA LEU A 30 -1.866 5.433 -3.459 1.00 0.00 H ATOM 396 HB2 LEU A 30 -1.339 4.359 -5.828 1.00 0.00 H ATOM 397 HB3 LEU A 30 -3.034 3.907 -5.781 1.00 0.00 H ATOM 398 HG LEU A 30 -3.722 6.014 -6.206 1.00 0.00 H ATOM 399 HD11 LEU A 30 -2.941 6.915 -4.000 1.00 0.00 H ATOM 400 HD12 LEU A 30 -2.870 8.078 -5.319 1.00 0.00 H ATOM 401 HD13 LEU A 30 -1.400 7.285 -4.771 1.00 0.00 H ATOM 402 HD21 LEU A 30 -2.547 6.759 -7.957 1.00 0.00 H ATOM 403 HD22 LEU A 30 -1.466 5.414 -7.590 1.00 0.00 H ATOM 404 HD23 LEU A 30 -1.106 7.028 -6.977 1.00 0.00 H ATOM 405 N ASN A 31 -3.848 4.666 -2.101 1.00 0.00 N ATOM 406 CA ASN A 31 -5.120 4.358 -1.392 1.00 0.00 C ATOM 407 C ASN A 31 -6.283 5.122 -2.035 1.00 0.00 C ATOM 408 O ASN A 31 -6.437 6.311 -1.841 1.00 0.00 O ATOM 409 CB ASN A 31 -4.864 4.838 0.043 1.00 0.00 C ATOM 410 CG ASN A 31 -6.159 4.827 0.853 1.00 0.00 C ATOM 411 OD1 ASN A 31 -7.142 5.419 0.463 1.00 0.00 O ATOM 412 ND2 ASN A 31 -6.191 4.181 1.983 1.00 0.00 N ATOM 413 H ASN A 31 -3.195 5.264 -1.682 1.00 0.00 H ATOM 414 HA ASN A 31 -5.311 3.297 -1.399 1.00 0.00 H ATOM 415 HB2 ASN A 31 -4.151 4.183 0.518 1.00 0.00 H ATOM 416 HB3 ASN A 31 -4.467 5.843 0.019 1.00 0.00 H ATOM 417 HD21 ASN A 31 -5.391 3.713 2.303 1.00 0.00 H ATOM 418 HD22 ASN A 31 -7.010 4.164 2.512 1.00 0.00 H ATOM 419 N HIS A 32 -7.106 4.446 -2.788 1.00 0.00 N ATOM 420 CA HIS A 32 -8.261 5.136 -3.429 1.00 0.00 C ATOM 421 C HIS A 32 -9.413 5.250 -2.429 1.00 0.00 C ATOM 422 O HIS A 32 -10.201 6.172 -2.471 1.00 0.00 O ATOM 423 CB HIS A 32 -8.656 4.244 -4.607 1.00 0.00 C ATOM 424 CG HIS A 32 -8.735 5.075 -5.859 1.00 0.00 C ATOM 425 ND1 HIS A 32 -9.723 6.029 -6.050 1.00 0.00 N ATOM 426 CD2 HIS A 32 -7.959 5.105 -6.990 1.00 0.00 C ATOM 427 CE1 HIS A 32 -9.515 6.588 -7.256 1.00 0.00 C ATOM 428 NE2 HIS A 32 -8.453 6.062 -7.872 1.00 0.00 N ATOM 429 H HIS A 32 -6.969 3.486 -2.926 1.00 0.00 H ATOM 430 HA HIS A 32 -7.972 6.108 -3.779 1.00 0.00 H ATOM 431 HB2 HIS A 32 -7.914 3.469 -4.736 1.00 0.00 H ATOM 432 HB3 HIS A 32 -9.617 3.793 -4.411 1.00 0.00 H ATOM 433 HD1 HIS A 32 -10.440 6.254 -5.422 1.00 0.00 H ATOM 434 HD2 HIS A 32 -7.095 4.481 -7.170 1.00 0.00 H ATOM 435 HE1 HIS A 32 -10.133 7.369 -7.676 1.00 0.00 H ATOM 436 N ILE A 33 -9.505 4.313 -1.530 1.00 0.00 N ATOM 437 CA ILE A 33 -10.599 4.351 -0.514 1.00 0.00 C ATOM 438 C ILE A 33 -10.641 5.718 0.174 1.00 0.00 C ATOM 439 O ILE A 33 -11.696 6.275 0.411 1.00 0.00 O ATOM 440 CB ILE A 33 -10.255 3.245 0.493 1.00 0.00 C ATOM 441 CG1 ILE A 33 -8.834 3.437 1.040 1.00 0.00 C ATOM 442 CG2 ILE A 33 -10.358 1.885 -0.197 1.00 0.00 C ATOM 443 CD1 ILE A 33 -8.504 2.306 2.017 1.00 0.00 C ATOM 444 H ILE A 33 -8.854 3.584 -1.524 1.00 0.00 H ATOM 445 HA ILE A 33 -11.548 4.137 -0.980 1.00 0.00 H ATOM 446 HB ILE A 33 -10.955 3.285 1.309 1.00 0.00 H ATOM 447 HG12 ILE A 33 -8.123 3.429 0.227 1.00 0.00 H ATOM 448 HG13 ILE A 33 -8.775 4.381 1.560 1.00 0.00 H ATOM 449 HG21 ILE A 33 -10.472 1.111 0.547 1.00 0.00 H ATOM 450 HG22 ILE A 33 -9.460 1.703 -0.770 1.00 0.00 H ATOM 451 HG23 ILE A 33 -11.213 1.879 -0.858 1.00 0.00 H ATOM 452 HD11 ILE A 33 -9.011 2.481 2.955 1.00 0.00 H ATOM 453 HD12 ILE A 33 -7.437 2.275 2.186 1.00 0.00 H ATOM 454 HD13 ILE A 33 -8.830 1.364 1.603 1.00 0.00 H ATOM 455 N ASP A 34 -9.502 6.261 0.488 1.00 0.00 N ATOM 456 CA ASP A 34 -9.459 7.594 1.157 1.00 0.00 C ATOM 457 C ASP A 34 -8.568 8.563 0.368 1.00 0.00 C ATOM 458 O ASP A 34 -8.160 9.592 0.870 1.00 0.00 O ATOM 459 CB ASP A 34 -8.865 7.325 2.539 1.00 0.00 C ATOM 460 CG ASP A 34 -9.938 7.536 3.608 1.00 0.00 C ATOM 461 OD1 ASP A 34 -10.103 8.666 4.039 1.00 0.00 O ATOM 462 OD2 ASP A 34 -10.580 6.565 3.976 1.00 0.00 O ATOM 463 H ASP A 34 -8.671 5.790 0.284 1.00 0.00 H ATOM 464 HA ASP A 34 -10.456 7.997 1.258 1.00 0.00 H ATOM 465 HB2 ASP A 34 -8.507 6.306 2.584 1.00 0.00 H ATOM 466 HB3 ASP A 34 -8.042 8.002 2.716 1.00 0.00 H ATOM 467 N GLN A 35 -8.266 8.246 -0.864 1.00 0.00 N ATOM 468 CA GLN A 35 -7.407 9.150 -1.687 1.00 0.00 C ATOM 469 C GLN A 35 -6.085 9.451 -0.971 1.00 0.00 C ATOM 470 O GLN A 35 -5.893 10.517 -0.422 1.00 0.00 O ATOM 471 CB GLN A 35 -8.226 10.430 -1.856 1.00 0.00 C ATOM 472 CG GLN A 35 -9.195 10.264 -3.029 1.00 0.00 C ATOM 473 CD GLN A 35 -8.792 11.209 -4.161 1.00 0.00 C ATOM 474 OE1 GLN A 35 -7.644 11.250 -4.556 1.00 0.00 O ATOM 475 NE2 GLN A 35 -9.695 11.979 -4.705 1.00 0.00 N ATOM 476 H GLN A 35 -8.608 7.415 -1.252 1.00 0.00 H ATOM 477 HA GLN A 35 -7.217 8.709 -2.652 1.00 0.00 H ATOM 478 HB2 GLN A 35 -8.785 10.622 -0.953 1.00 0.00 H ATOM 479 HB3 GLN A 35 -7.563 11.259 -2.052 1.00 0.00 H ATOM 480 HG2 GLN A 35 -9.160 9.243 -3.383 1.00 0.00 H ATOM 481 HG3 GLN A 35 -10.198 10.499 -2.704 1.00 0.00 H ATOM 482 HE21 GLN A 35 -10.621 11.948 -4.388 1.00 0.00 H ATOM 483 HE22 GLN A 35 -9.446 12.589 -5.432 1.00 0.00 H ATOM 484 N THR A 36 -5.166 8.521 -0.985 1.00 0.00 N ATOM 485 CA THR A 36 -3.849 8.751 -0.317 1.00 0.00 C ATOM 486 C THR A 36 -2.803 7.790 -0.891 1.00 0.00 C ATOM 487 O THR A 36 -3.069 7.063 -1.825 1.00 0.00 O ATOM 488 CB THR A 36 -4.082 8.454 1.168 1.00 0.00 C ATOM 489 OG1 THR A 36 -5.425 8.767 1.515 1.00 0.00 O ATOM 490 CG2 THR A 36 -3.128 9.297 2.013 1.00 0.00 C ATOM 491 H THR A 36 -5.340 7.672 -1.442 1.00 0.00 H ATOM 492 HA THR A 36 -3.534 9.774 -0.446 1.00 0.00 H ATOM 493 HB THR A 36 -3.895 7.409 1.358 1.00 0.00 H ATOM 494 HG1 THR A 36 -5.518 9.722 1.506 1.00 0.00 H ATOM 495 HG21 THR A 36 -2.896 10.213 1.490 1.00 0.00 H ATOM 496 HG22 THR A 36 -2.216 8.743 2.187 1.00 0.00 H ATOM 497 HG23 THR A 36 -3.593 9.531 2.959 1.00 0.00 H ATOM 498 N THR A 37 -1.619 7.774 -0.339 1.00 0.00 N ATOM 499 CA THR A 37 -0.569 6.845 -0.854 1.00 0.00 C ATOM 500 C THR A 37 0.191 6.214 0.314 1.00 0.00 C ATOM 501 O THR A 37 1.069 6.820 0.895 1.00 0.00 O ATOM 502 CB THR A 37 0.377 7.705 -1.697 1.00 0.00 C ATOM 503 OG1 THR A 37 0.945 8.717 -0.879 1.00 0.00 O ATOM 504 CG2 THR A 37 -0.394 8.353 -2.848 1.00 0.00 C ATOM 505 H THR A 37 -1.424 8.364 0.419 1.00 0.00 H ATOM 506 HA THR A 37 -1.015 6.078 -1.470 1.00 0.00 H ATOM 507 HB THR A 37 1.163 7.083 -2.103 1.00 0.00 H ATOM 508 HG1 THR A 37 1.425 8.288 -0.167 1.00 0.00 H ATOM 509 HG21 THR A 37 -1.389 7.939 -2.892 1.00 0.00 H ATOM 510 HG22 THR A 37 0.119 8.156 -3.779 1.00 0.00 H ATOM 511 HG23 THR A 37 -0.454 9.419 -2.687 1.00 0.00 H ATOM 512 N THR A 38 -0.134 5.000 0.657 1.00 0.00 N ATOM 513 CA THR A 38 0.575 4.327 1.783 1.00 0.00 C ATOM 514 C THR A 38 1.791 3.576 1.224 1.00 0.00 C ATOM 515 O THR A 38 1.677 2.833 0.280 1.00 0.00 O ATOM 516 CB THR A 38 -0.492 3.380 2.384 1.00 0.00 C ATOM 517 OG1 THR A 38 -1.095 4.015 3.502 1.00 0.00 O ATOM 518 CG2 THR A 38 0.111 2.038 2.837 1.00 0.00 C ATOM 519 H THR A 38 -0.844 4.526 0.169 1.00 0.00 H ATOM 520 HA THR A 38 0.886 5.051 2.521 1.00 0.00 H ATOM 521 HB THR A 38 -1.249 3.191 1.639 1.00 0.00 H ATOM 522 HG1 THR A 38 -1.973 4.303 3.242 1.00 0.00 H ATOM 523 HG21 THR A 38 0.194 1.376 1.986 1.00 0.00 H ATOM 524 HG22 THR A 38 -0.526 1.588 3.582 1.00 0.00 H ATOM 525 HG23 THR A 38 1.092 2.207 3.256 1.00 0.00 H ATOM 526 N TRP A 39 2.948 3.754 1.799 1.00 0.00 N ATOM 527 CA TRP A 39 4.143 3.028 1.275 1.00 0.00 C ATOM 528 C TRP A 39 4.071 1.555 1.680 1.00 0.00 C ATOM 529 O TRP A 39 4.263 0.668 0.871 1.00 0.00 O ATOM 530 CB TRP A 39 5.361 3.693 1.926 1.00 0.00 C ATOM 531 CG TRP A 39 5.359 5.175 1.693 1.00 0.00 C ATOM 532 CD1 TRP A 39 4.701 6.081 2.456 1.00 0.00 C ATOM 533 CD2 TRP A 39 6.057 5.941 0.664 1.00 0.00 C ATOM 534 NE1 TRP A 39 4.948 7.348 1.960 1.00 0.00 N ATOM 535 CE2 TRP A 39 5.777 7.314 0.861 1.00 0.00 C ATOM 536 CE3 TRP A 39 6.896 5.587 -0.410 1.00 0.00 C ATOM 537 CZ2 TRP A 39 6.310 8.296 0.028 1.00 0.00 C ATOM 538 CZ3 TRP A 39 7.434 6.575 -1.248 1.00 0.00 C ATOM 539 CH2 TRP A 39 7.142 7.926 -1.030 1.00 0.00 C ATOM 540 H TRP A 39 3.027 4.352 2.570 1.00 0.00 H ATOM 541 HA TRP A 39 4.195 3.118 0.200 1.00 0.00 H ATOM 542 HB2 TRP A 39 5.343 3.500 2.988 1.00 0.00 H ATOM 543 HB3 TRP A 39 6.260 3.269 1.504 1.00 0.00 H ATOM 544 HD1 TRP A 39 4.082 5.851 3.309 1.00 0.00 H ATOM 545 HE1 TRP A 39 4.588 8.181 2.330 1.00 0.00 H ATOM 546 HE3 TRP A 39 7.124 4.551 -0.598 1.00 0.00 H ATOM 547 HZ2 TRP A 39 6.082 9.336 0.203 1.00 0.00 H ATOM 548 HZ3 TRP A 39 8.078 6.291 -2.066 1.00 0.00 H ATOM 549 HH2 TRP A 39 7.561 8.681 -1.678 1.00 0.00 H ATOM 550 N GLN A 40 3.798 1.285 2.927 1.00 0.00 N ATOM 551 CA GLN A 40 3.715 -0.131 3.385 1.00 0.00 C ATOM 552 C GLN A 40 3.267 -0.188 4.848 1.00 0.00 C ATOM 553 O GLN A 40 3.791 0.508 5.696 1.00 0.00 O ATOM 554 CB GLN A 40 5.134 -0.680 3.237 1.00 0.00 C ATOM 555 CG GLN A 40 5.111 -1.912 2.328 1.00 0.00 C ATOM 556 CD GLN A 40 6.062 -2.972 2.885 1.00 0.00 C ATOM 557 OE1 GLN A 40 5.768 -4.150 2.845 1.00 0.00 O ATOM 558 NE2 GLN A 40 7.200 -2.603 3.406 1.00 0.00 N ATOM 559 H GLN A 40 3.647 2.015 3.564 1.00 0.00 H ATOM 560 HA GLN A 40 3.035 -0.691 2.761 1.00 0.00 H ATOM 561 HB2 GLN A 40 5.768 0.077 2.802 1.00 0.00 H ATOM 562 HB3 GLN A 40 5.516 -0.956 4.208 1.00 0.00 H ATOM 563 HG2 GLN A 40 4.109 -2.311 2.289 1.00 0.00 H ATOM 564 HG3 GLN A 40 5.427 -1.631 1.335 1.00 0.00 H ATOM 565 HE21 GLN A 40 7.438 -1.652 3.438 1.00 0.00 H ATOM 566 HE22 GLN A 40 7.816 -3.275 3.765 1.00 0.00 H ATOM 567 N ASP A 41 2.304 -1.016 5.152 1.00 0.00 N ATOM 568 CA ASP A 41 1.822 -1.124 6.561 1.00 0.00 C ATOM 569 C ASP A 41 0.729 -2.196 6.668 1.00 0.00 C ATOM 570 O ASP A 41 0.883 -3.157 7.394 1.00 0.00 O ATOM 571 CB ASP A 41 1.264 0.259 6.912 1.00 0.00 C ATOM 572 CG ASP A 41 2.210 0.958 7.892 1.00 0.00 C ATOM 573 OD1 ASP A 41 2.311 0.498 9.016 1.00 0.00 O ATOM 574 OD2 ASP A 41 2.817 1.941 7.499 1.00 0.00 O ATOM 575 H ASP A 41 1.900 -1.571 4.453 1.00 0.00 H ATOM 576 HA ASP A 41 2.644 -1.364 7.219 1.00 0.00 H ATOM 577 HB2 ASP A 41 1.177 0.851 6.012 1.00 0.00 H ATOM 578 HB3 ASP A 41 0.291 0.150 7.368 1.00 0.00 H ATOM 579 N PRO A 42 -0.348 -2.005 5.938 1.00 0.00 N ATOM 580 CA PRO A 42 -1.457 -2.988 5.968 1.00 0.00 C ATOM 581 C PRO A 42 -1.057 -4.264 5.222 1.00 0.00 C ATOM 582 O PRO A 42 -1.065 -4.312 4.008 1.00 0.00 O ATOM 583 CB PRO A 42 -2.595 -2.273 5.246 1.00 0.00 C ATOM 584 CG PRO A 42 -1.922 -1.277 4.357 1.00 0.00 C ATOM 585 CD PRO A 42 -0.633 -0.882 5.033 1.00 0.00 C ATOM 586 HA PRO A 42 -1.744 -3.212 6.983 1.00 0.00 H ATOM 587 HB2 PRO A 42 -3.167 -2.975 4.659 1.00 0.00 H ATOM 588 HB3 PRO A 42 -3.234 -1.769 5.958 1.00 0.00 H ATOM 589 HG2 PRO A 42 -1.713 -1.723 3.396 1.00 0.00 H ATOM 590 HG3 PRO A 42 -2.553 -0.410 4.231 1.00 0.00 H ATOM 591 HD2 PRO A 42 0.155 -0.770 4.302 1.00 0.00 H ATOM 592 HD3 PRO A 42 -0.766 0.032 5.591 1.00 0.00 H ATOM 593 N ARG A 43 -0.704 -5.297 5.938 1.00 0.00 N ATOM 594 CA ARG A 43 -0.299 -6.566 5.267 1.00 0.00 C ATOM 595 C ARG A 43 0.809 -6.292 4.248 1.00 0.00 C ATOM 596 O ARG A 43 0.552 -5.942 3.114 1.00 0.00 O ATOM 597 CB ARG A 43 -1.564 -7.065 4.564 1.00 0.00 C ATOM 598 CG ARG A 43 -2.055 -8.343 5.246 1.00 0.00 C ATOM 599 CD ARG A 43 -3.548 -8.218 5.550 1.00 0.00 C ATOM 600 NE ARG A 43 -4.019 -9.621 5.741 1.00 0.00 N ATOM 601 CZ ARG A 43 -4.184 -10.423 4.714 1.00 0.00 C ATOM 602 NH1 ARG A 43 -3.941 -10.014 3.493 1.00 0.00 N ATOM 603 NH2 ARG A 43 -4.597 -11.645 4.913 1.00 0.00 N ATOM 604 H ARG A 43 -0.702 -5.238 6.915 1.00 0.00 H ATOM 605 HA ARG A 43 0.028 -7.290 5.995 1.00 0.00 H ATOM 606 HB2 ARG A 43 -2.331 -6.307 4.624 1.00 0.00 H ATOM 607 HB3 ARG A 43 -1.341 -7.272 3.527 1.00 0.00 H ATOM 608 HG2 ARG A 43 -1.890 -9.188 4.590 1.00 0.00 H ATOM 609 HG3 ARG A 43 -1.509 -8.493 6.166 1.00 0.00 H ATOM 610 HD2 ARG A 43 -3.700 -7.646 6.453 1.00 0.00 H ATOM 611 HD3 ARG A 43 -4.064 -7.758 4.720 1.00 0.00 H ATOM 612 HE ARG A 43 -4.207 -9.951 6.645 1.00 0.00 H ATOM 613 HH11 ARG A 43 -3.626 -9.082 3.324 1.00 0.00 H ATOM 614 HH12 ARG A 43 -4.075 -10.641 2.724 1.00 0.00 H ATOM 615 HH21 ARG A 43 -4.784 -11.965 5.841 1.00 0.00 H ATOM 616 HH22 ARG A 43 -4.726 -12.262 4.135 1.00 0.00 H ATOM 617 N LYS A 44 2.045 -6.448 4.644 1.00 0.00 N ATOM 618 CA LYS A 44 3.171 -6.195 3.698 1.00 0.00 C ATOM 619 C LYS A 44 2.963 -6.982 2.401 1.00 0.00 C ATOM 620 O LYS A 44 3.765 -6.816 1.496 1.00 0.00 O ATOM 621 CB LYS A 44 4.420 -6.690 4.429 1.00 0.00 C ATOM 622 CG LYS A 44 4.658 -5.829 5.671 1.00 0.00 C ATOM 623 CD LYS A 44 5.966 -6.256 6.342 1.00 0.00 C ATOM 624 CE LYS A 44 5.754 -6.354 7.854 1.00 0.00 C ATOM 625 NZ LYS A 44 6.940 -7.103 8.357 1.00 0.00 N ATOM 626 OXT LYS A 44 2.007 -7.736 2.335 1.00 0.00 O ATOM 627 H LYS A 44 2.231 -6.732 5.563 1.00 0.00 H ATOM 628 HA LYS A 44 3.260 -5.141 3.490 1.00 0.00 H ATOM 629 HB2 LYS A 44 4.279 -7.720 4.726 1.00 0.00 H ATOM 630 HB3 LYS A 44 5.273 -6.618 3.771 1.00 0.00 H ATOM 631 HG2 LYS A 44 4.725 -4.790 5.382 1.00 0.00 H ATOM 632 HG3 LYS A 44 3.840 -5.959 6.363 1.00 0.00 H ATOM 633 HD2 LYS A 44 6.271 -7.218 5.959 1.00 0.00 H ATOM 634 HD3 LYS A 44 6.734 -5.524 6.133 1.00 0.00 H ATOM 635 HE2 LYS A 44 5.718 -5.367 8.294 1.00 0.00 H ATOM 636 HE3 LYS A 44 4.847 -6.897 8.073 1.00 0.00 H ATOM 637 HZ1 LYS A 44 6.819 -8.117 8.162 1.00 0.00 H ATOM 638 HZ2 LYS A 44 7.033 -6.955 9.384 1.00 0.00 H ATOM 639 HZ3 LYS A 44 7.795 -6.760 7.877 1.00 0.00 H TER 640 LYS A 44 HETATM 641 C ACE B 45 7.006 13.064 3.684 1.00 0.00 C HETATM 642 O ACE B 45 5.964 12.956 4.299 1.00 0.00 O HETATM 643 CH3 ACE B 45 7.816 14.361 3.742 1.00 0.00 C HETATM 644 H1 ACE B 45 8.548 14.293 4.533 1.00 0.00 H HETATM 645 H2 ACE B 45 7.154 15.191 3.935 1.00 0.00 H HETATM 646 H3 ACE B 45 8.319 14.514 2.798 1.00 0.00 H ATOM 647 N PRO B 46 7.517 12.122 2.940 1.00 0.00 N ATOM 648 CA PRO B 46 7.598 12.325 1.469 1.00 0.00 C ATOM 649 C PRO B 46 6.384 11.700 0.776 1.00 0.00 C ATOM 650 O PRO B 46 6.413 11.410 -0.404 1.00 0.00 O ATOM 651 CB PRO B 46 8.881 11.604 1.067 1.00 0.00 C ATOM 652 CG PRO B 46 9.091 10.575 2.127 1.00 0.00 C ATOM 653 CD PRO B 46 8.498 11.126 3.396 1.00 0.00 C ATOM 654 HA PRO B 46 7.674 13.375 1.234 1.00 0.00 H ATOM 655 HB2 PRO B 46 8.758 11.134 0.101 1.00 0.00 H ATOM 656 HB3 PRO B 46 9.711 12.292 1.050 1.00 0.00 H ATOM 657 HG2 PRO B 46 8.592 9.655 1.851 1.00 0.00 H ATOM 658 HG3 PRO B 46 10.145 10.397 2.267 1.00 0.00 H ATOM 659 HD2 PRO B 46 8.009 10.340 3.955 1.00 0.00 H ATOM 660 HD3 PRO B 46 9.258 11.601 3.995 1.00 0.00 H ATOM 661 N LEU B 47 5.317 11.491 1.499 1.00 0.00 N ATOM 662 CA LEU B 47 4.102 10.884 0.882 1.00 0.00 C ATOM 663 C LEU B 47 3.711 11.654 -0.392 1.00 0.00 C ATOM 664 O LEU B 47 3.575 12.861 -0.360 1.00 0.00 O ATOM 665 CB LEU B 47 3.012 11.020 1.946 1.00 0.00 C ATOM 666 CG LEU B 47 1.682 10.518 1.381 1.00 0.00 C ATOM 667 CD1 LEU B 47 1.292 9.215 2.082 1.00 0.00 C ATOM 668 CD2 LEU B 47 0.598 11.571 1.619 1.00 0.00 C ATOM 669 H LEU B 47 5.315 11.733 2.449 1.00 0.00 H ATOM 670 HA LEU B 47 4.273 9.844 0.665 1.00 0.00 H ATOM 671 HB2 LEU B 47 3.280 10.433 2.812 1.00 0.00 H ATOM 672 HB3 LEU B 47 2.914 12.058 2.229 1.00 0.00 H ATOM 673 HG LEU B 47 1.784 10.340 0.320 1.00 0.00 H ATOM 674 HD11 LEU B 47 2.065 8.478 1.928 1.00 0.00 H ATOM 675 HD12 LEU B 47 0.360 8.852 1.671 1.00 0.00 H ATOM 676 HD13 LEU B 47 1.173 9.397 3.140 1.00 0.00 H ATOM 677 HD21 LEU B 47 1.051 12.549 1.668 1.00 0.00 H ATOM 678 HD22 LEU B 47 0.090 11.362 2.549 1.00 0.00 H ATOM 679 HD23 LEU B 47 -0.113 11.544 0.807 1.00 0.00 H ATOM 680 N PRO B 48 3.543 10.936 -1.479 1.00 0.00 N ATOM 681 CA PRO B 48 3.166 11.584 -2.761 1.00 0.00 C ATOM 682 C PRO B 48 1.724 12.108 -2.694 1.00 0.00 C ATOM 683 O PRO B 48 0.854 11.442 -2.164 1.00 0.00 O ATOM 684 CB PRO B 48 3.289 10.456 -3.784 1.00 0.00 C ATOM 685 CG PRO B 48 3.112 9.203 -2.990 1.00 0.00 C ATOM 686 CD PRO B 48 3.682 9.479 -1.624 1.00 0.00 C ATOM 687 HA PRO B 48 3.854 12.377 -3.001 1.00 0.00 H ATOM 688 HB2 PRO B 48 2.512 10.538 -4.531 1.00 0.00 H ATOM 689 HB3 PRO B 48 4.263 10.474 -4.249 1.00 0.00 H ATOM 690 HG2 PRO B 48 2.064 8.962 -2.911 1.00 0.00 H ATOM 691 HG3 PRO B 48 3.646 8.389 -3.457 1.00 0.00 H ATOM 692 HD2 PRO B 48 3.114 8.965 -0.864 1.00 0.00 H ATOM 693 HD3 PRO B 48 4.722 9.191 -1.583 1.00 0.00 H ATOM 694 N PRO B 49 1.510 13.285 -3.232 1.00 0.00 N ATOM 695 CA PRO B 49 0.152 13.882 -3.221 1.00 0.00 C ATOM 696 C PRO B 49 -0.756 13.163 -4.222 1.00 0.00 C ATOM 697 O PRO B 49 -0.332 12.778 -5.294 1.00 0.00 O ATOM 698 CB PRO B 49 0.390 15.328 -3.647 1.00 0.00 C ATOM 699 CG PRO B 49 1.661 15.295 -4.435 1.00 0.00 C ATOM 700 CD PRO B 49 2.491 14.161 -3.892 1.00 0.00 C ATOM 701 HA PRO B 49 -0.270 13.854 -2.229 1.00 0.00 H ATOM 702 HB2 PRO B 49 -0.425 15.677 -4.264 1.00 0.00 H ATOM 703 HB3 PRO B 49 0.503 15.961 -2.780 1.00 0.00 H ATOM 704 HG2 PRO B 49 1.444 15.123 -5.479 1.00 0.00 H ATOM 705 HG3 PRO B 49 2.191 16.228 -4.318 1.00 0.00 H ATOM 706 HD2 PRO B 49 2.987 13.636 -4.695 1.00 0.00 H ATOM 707 HD3 PRO B 49 3.212 14.529 -3.175 1.00 0.00 H ATOM 708 N TYR B 50 -2.002 12.979 -3.882 1.00 0.00 N ATOM 709 CA TYR B 50 -2.935 12.285 -4.815 1.00 0.00 C ATOM 710 C TYR B 50 -3.553 13.292 -5.789 1.00 0.00 C ATOM 711 O TYR B 50 -3.244 13.213 -6.966 1.00 0.00 O ATOM 712 CB TYR B 50 -4.012 11.675 -3.917 1.00 0.00 C ATOM 713 CG TYR B 50 -4.619 10.474 -4.602 1.00 0.00 C ATOM 714 CD1 TYR B 50 -5.169 10.603 -5.884 1.00 0.00 C ATOM 715 CD2 TYR B 50 -4.631 9.232 -3.957 1.00 0.00 C ATOM 716 CE1 TYR B 50 -5.733 9.489 -6.517 1.00 0.00 C ATOM 717 CE2 TYR B 50 -5.196 8.119 -4.591 1.00 0.00 C ATOM 718 CZ TYR B 50 -5.746 8.247 -5.872 1.00 0.00 C ATOM 719 OH TYR B 50 -6.301 7.149 -6.497 1.00 0.00 O ATOM 720 OXT TYR B 50 -4.324 14.124 -5.340 1.00 0.00 O ATOM 721 H TYR B 50 -2.324 13.297 -3.013 1.00 0.00 H ATOM 722 HA TYR B 50 -2.419 11.505 -5.353 1.00 0.00 H ATOM 723 HB2 TYR B 50 -3.570 11.371 -2.980 1.00 0.00 H ATOM 724 HB3 TYR B 50 -4.782 12.409 -3.729 1.00 0.00 H ATOM 725 HD1 TYR B 50 -5.159 11.560 -6.382 1.00 0.00 H ATOM 726 HD2 TYR B 50 -4.207 9.132 -2.969 1.00 0.00 H ATOM 727 HE1 TYR B 50 -6.158 9.588 -7.506 1.00 0.00 H ATOM 728 HE2 TYR B 50 -5.205 7.161 -4.093 1.00 0.00 H ATOM 729 HH TYR B 50 -7.077 7.444 -6.980 1.00 0.00 H TER 730 TYR B 50