ATOM 1 N PHE A 5 -1.063 -9.648 -10.606 1.00 0.00 N ATOM 2 CA PHE A 5 0.312 -9.992 -10.143 1.00 0.00 C ATOM 3 C PHE A 5 0.293 -10.374 -8.661 1.00 0.00 C ATOM 4 O PHE A 5 1.142 -9.967 -7.893 1.00 0.00 O ATOM 5 CB PHE A 5 1.133 -8.719 -10.358 1.00 0.00 C ATOM 6 CG PHE A 5 1.986 -8.872 -11.594 1.00 0.00 C ATOM 7 CD1 PHE A 5 3.187 -9.589 -11.531 1.00 0.00 C ATOM 8 CD2 PHE A 5 1.576 -8.297 -12.803 1.00 0.00 C ATOM 9 CE1 PHE A 5 3.977 -9.731 -12.679 1.00 0.00 C ATOM 10 CE2 PHE A 5 2.367 -8.439 -13.949 1.00 0.00 C ATOM 11 CZ PHE A 5 3.568 -9.156 -13.887 1.00 0.00 C ATOM 12 H PHE A 5 -1.441 -10.093 -11.393 1.00 0.00 H ATOM 13 HA PHE A 5 0.719 -10.796 -10.735 1.00 0.00 H ATOM 14 HB2 PHE A 5 0.467 -7.878 -10.481 1.00 0.00 H ATOM 15 HB3 PHE A 5 1.770 -8.552 -9.500 1.00 0.00 H ATOM 16 HD1 PHE A 5 3.503 -10.032 -10.599 1.00 0.00 H ATOM 17 HD2 PHE A 5 0.650 -7.745 -12.851 1.00 0.00 H ATOM 18 HE1 PHE A 5 4.904 -10.282 -12.630 1.00 0.00 H ATOM 19 HE2 PHE A 5 2.051 -7.995 -14.881 1.00 0.00 H ATOM 20 HZ PHE A 5 4.178 -9.264 -14.771 1.00 0.00 H ATOM 21 N GLU A 6 -0.670 -11.155 -8.252 1.00 0.00 N ATOM 22 CA GLU A 6 -0.743 -11.563 -6.819 1.00 0.00 C ATOM 23 C GLU A 6 0.589 -12.175 -6.377 1.00 0.00 C ATOM 24 O GLU A 6 1.167 -12.993 -7.065 1.00 0.00 O ATOM 25 CB GLU A 6 -1.858 -12.607 -6.762 1.00 0.00 C ATOM 26 CG GLU A 6 -3.202 -11.937 -7.055 1.00 0.00 C ATOM 27 CD GLU A 6 -4.158 -12.958 -7.672 1.00 0.00 C ATOM 28 OE1 GLU A 6 -3.715 -13.722 -8.514 1.00 0.00 O ATOM 29 OE2 GLU A 6 -5.318 -12.961 -7.291 1.00 0.00 O ATOM 30 H GLU A 6 -1.345 -11.473 -8.888 1.00 0.00 H ATOM 31 HA GLU A 6 -0.995 -10.718 -6.199 1.00 0.00 H ATOM 32 HB2 GLU A 6 -1.670 -13.377 -7.498 1.00 0.00 H ATOM 33 HB3 GLU A 6 -1.886 -13.050 -5.776 1.00 0.00 H ATOM 34 HG2 GLU A 6 -3.623 -11.558 -6.134 1.00 0.00 H ATOM 35 HG3 GLU A 6 -3.053 -11.122 -7.746 1.00 0.00 H ATOM 36 N ILE A 7 1.082 -11.785 -5.233 1.00 0.00 N ATOM 37 CA ILE A 7 2.376 -12.345 -4.749 1.00 0.00 C ATOM 38 C ILE A 7 2.131 -13.642 -3.962 1.00 0.00 C ATOM 39 O ILE A 7 1.367 -13.651 -3.017 1.00 0.00 O ATOM 40 CB ILE A 7 2.955 -11.262 -3.838 1.00 0.00 C ATOM 41 CG1 ILE A 7 3.271 -10.016 -4.667 1.00 0.00 C ATOM 42 CG2 ILE A 7 4.239 -11.778 -3.184 1.00 0.00 C ATOM 43 CD1 ILE A 7 3.817 -8.917 -3.753 1.00 0.00 C ATOM 44 H ILE A 7 0.601 -11.124 -4.692 1.00 0.00 H ATOM 45 HA ILE A 7 3.040 -12.516 -5.580 1.00 0.00 H ATOM 46 HB ILE A 7 2.235 -11.014 -3.071 1.00 0.00 H ATOM 47 HG12 ILE A 7 4.010 -10.260 -5.417 1.00 0.00 H ATOM 48 HG13 ILE A 7 2.370 -9.668 -5.151 1.00 0.00 H ATOM 49 HG21 ILE A 7 4.954 -12.036 -3.952 1.00 0.00 H ATOM 50 HG22 ILE A 7 4.014 -12.652 -2.593 1.00 0.00 H ATOM 51 HG23 ILE A 7 4.654 -11.010 -2.549 1.00 0.00 H ATOM 52 HD11 ILE A 7 2.994 -8.381 -3.305 1.00 0.00 H ATOM 53 HD12 ILE A 7 4.421 -8.234 -4.334 1.00 0.00 H ATOM 54 HD13 ILE A 7 4.423 -9.361 -2.978 1.00 0.00 H ATOM 55 N PRO A 8 2.785 -14.706 -4.374 1.00 0.00 N ATOM 56 CA PRO A 8 2.616 -16.010 -3.685 1.00 0.00 C ATOM 57 C PRO A 8 3.361 -16.015 -2.346 1.00 0.00 C ATOM 58 O PRO A 8 3.082 -16.813 -1.472 1.00 0.00 O ATOM 59 CB PRO A 8 3.246 -17.011 -4.648 1.00 0.00 C ATOM 60 CG PRO A 8 4.232 -16.215 -5.445 1.00 0.00 C ATOM 61 CD PRO A 8 3.725 -14.798 -5.502 1.00 0.00 C ATOM 62 HA PRO A 8 1.573 -16.237 -3.545 1.00 0.00 H ATOM 63 HB2 PRO A 8 3.751 -17.793 -4.100 1.00 0.00 H ATOM 64 HB3 PRO A 8 2.492 -17.432 -5.296 1.00 0.00 H ATOM 65 HG2 PRO A 8 5.200 -16.243 -4.962 1.00 0.00 H ATOM 66 HG3 PRO A 8 4.306 -16.615 -6.444 1.00 0.00 H ATOM 67 HD2 PRO A 8 4.538 -14.099 -5.373 1.00 0.00 H ATOM 68 HD3 PRO A 8 3.214 -14.618 -6.436 1.00 0.00 H ATOM 69 N ASP A 9 4.312 -15.135 -2.179 1.00 0.00 N ATOM 70 CA ASP A 9 5.084 -15.093 -0.900 1.00 0.00 C ATOM 71 C ASP A 9 4.139 -15.117 0.308 1.00 0.00 C ATOM 72 O ASP A 9 4.488 -15.592 1.370 1.00 0.00 O ATOM 73 CB ASP A 9 5.858 -13.776 -0.945 1.00 0.00 C ATOM 74 CG ASP A 9 6.834 -13.794 -2.126 1.00 0.00 C ATOM 75 OD1 ASP A 9 6.637 -14.600 -3.020 1.00 0.00 O ATOM 76 OD2 ASP A 9 7.761 -13.002 -2.113 1.00 0.00 O ATOM 77 H ASP A 9 4.527 -14.506 -2.899 1.00 0.00 H ATOM 78 HA ASP A 9 5.773 -15.920 -0.850 1.00 0.00 H ATOM 79 HB2 ASP A 9 5.166 -12.956 -1.062 1.00 0.00 H ATOM 80 HB3 ASP A 9 6.411 -13.652 -0.025 1.00 0.00 H ATOM 81 N ASP A 10 2.946 -14.609 0.156 1.00 0.00 N ATOM 82 CA ASP A 10 1.990 -14.607 1.302 1.00 0.00 C ATOM 83 C ASP A 10 0.612 -14.116 0.851 1.00 0.00 C ATOM 84 O ASP A 10 -0.267 -14.898 0.548 1.00 0.00 O ATOM 85 CB ASP A 10 2.603 -13.653 2.328 1.00 0.00 C ATOM 86 CG ASP A 10 3.199 -14.460 3.484 1.00 0.00 C ATOM 87 OD1 ASP A 10 2.474 -15.256 4.059 1.00 0.00 O ATOM 88 OD2 ASP A 10 4.369 -14.268 3.773 1.00 0.00 O ATOM 89 H ASP A 10 2.679 -14.230 -0.707 1.00 0.00 H ATOM 90 HA ASP A 10 1.912 -15.592 1.723 1.00 0.00 H ATOM 91 HB2 ASP A 10 3.380 -13.070 1.858 1.00 0.00 H ATOM 92 HB3 ASP A 10 1.836 -12.994 2.708 1.00 0.00 H ATOM 93 N VAL A 11 0.417 -12.831 0.810 1.00 0.00 N ATOM 94 CA VAL A 11 -0.905 -12.290 0.384 1.00 0.00 C ATOM 95 C VAL A 11 -0.730 -11.314 -0.788 1.00 0.00 C ATOM 96 O VAL A 11 0.246 -10.593 -0.847 1.00 0.00 O ATOM 97 CB VAL A 11 -1.450 -11.559 1.612 1.00 0.00 C ATOM 98 CG1 VAL A 11 -2.777 -10.886 1.260 1.00 0.00 C ATOM 99 CG2 VAL A 11 -1.670 -12.564 2.745 1.00 0.00 C ATOM 100 H VAL A 11 1.138 -12.221 1.060 1.00 0.00 H ATOM 101 HA VAL A 11 -1.571 -13.094 0.110 1.00 0.00 H ATOM 102 HB VAL A 11 -0.738 -10.810 1.929 1.00 0.00 H ATOM 103 HG11 VAL A 11 -3.547 -11.638 1.166 1.00 0.00 H ATOM 104 HG12 VAL A 11 -2.675 -10.355 0.326 1.00 0.00 H ATOM 105 HG13 VAL A 11 -3.046 -10.191 2.042 1.00 0.00 H ATOM 106 HG21 VAL A 11 -0.792 -13.182 2.855 1.00 0.00 H ATOM 107 HG22 VAL A 11 -2.523 -13.186 2.513 1.00 0.00 H ATOM 108 HG23 VAL A 11 -1.854 -12.031 3.667 1.00 0.00 H ATOM 109 N PRO A 12 -1.685 -11.321 -1.688 1.00 0.00 N ATOM 110 CA PRO A 12 -1.620 -10.419 -2.864 1.00 0.00 C ATOM 111 C PRO A 12 -1.905 -8.972 -2.446 1.00 0.00 C ATOM 112 O PRO A 12 -1.845 -8.629 -1.282 1.00 0.00 O ATOM 113 CB PRO A 12 -2.720 -10.942 -3.782 1.00 0.00 C ATOM 114 CG PRO A 12 -3.687 -11.633 -2.874 1.00 0.00 C ATOM 115 CD PRO A 12 -2.898 -12.154 -1.699 1.00 0.00 C ATOM 116 HA PRO A 12 -0.663 -10.495 -3.352 1.00 0.00 H ATOM 117 HB2 PRO A 12 -3.204 -10.124 -4.293 1.00 0.00 H ATOM 118 HB3 PRO A 12 -2.311 -11.642 -4.497 1.00 0.00 H ATOM 119 HG2 PRO A 12 -4.436 -10.935 -2.532 1.00 0.00 H ATOM 120 HG3 PRO A 12 -4.157 -12.455 -3.394 1.00 0.00 H ATOM 121 HD2 PRO A 12 -3.454 -12.027 -0.784 1.00 0.00 H ATOM 122 HD3 PRO A 12 -2.641 -13.193 -1.848 1.00 0.00 H ATOM 123 N LEU A 13 -2.211 -8.124 -3.389 1.00 0.00 N ATOM 124 CA LEU A 13 -2.499 -6.701 -3.050 1.00 0.00 C ATOM 125 C LEU A 13 -3.788 -6.601 -2.225 1.00 0.00 C ATOM 126 O LEU A 13 -4.647 -7.455 -2.321 1.00 0.00 O ATOM 127 CB LEU A 13 -2.676 -6.004 -4.400 1.00 0.00 C ATOM 128 CG LEU A 13 -1.781 -4.764 -4.460 1.00 0.00 C ATOM 129 CD1 LEU A 13 -0.813 -4.890 -5.638 1.00 0.00 C ATOM 130 CD2 LEU A 13 -2.652 -3.518 -4.643 1.00 0.00 C ATOM 131 H LEU A 13 -2.253 -8.423 -4.322 1.00 0.00 H ATOM 132 HA LEU A 13 -1.671 -6.265 -2.514 1.00 0.00 H ATOM 133 HB2 LEU A 13 -2.401 -6.684 -5.194 1.00 0.00 H ATOM 134 HB3 LEU A 13 -3.708 -5.710 -4.520 1.00 0.00 H ATOM 135 HG LEU A 13 -1.221 -4.678 -3.540 1.00 0.00 H ATOM 136 HD11 LEU A 13 -1.362 -4.808 -6.564 1.00 0.00 H ATOM 137 HD12 LEU A 13 -0.320 -5.849 -5.596 1.00 0.00 H ATOM 138 HD13 LEU A 13 -0.078 -4.103 -5.585 1.00 0.00 H ATOM 139 HD21 LEU A 13 -3.376 -3.463 -3.845 1.00 0.00 H ATOM 140 HD22 LEU A 13 -3.166 -3.577 -5.592 1.00 0.00 H ATOM 141 HD23 LEU A 13 -2.027 -2.637 -4.627 1.00 0.00 H ATOM 142 N PRO A 14 -3.886 -5.556 -1.439 1.00 0.00 N ATOM 143 CA PRO A 14 -5.095 -5.354 -0.594 1.00 0.00 C ATOM 144 C PRO A 14 -6.335 -5.110 -1.465 1.00 0.00 C ATOM 145 O PRO A 14 -6.272 -4.477 -2.501 1.00 0.00 O ATOM 146 CB PRO A 14 -4.734 -4.134 0.254 1.00 0.00 C ATOM 147 CG PRO A 14 -3.692 -3.414 -0.539 1.00 0.00 C ATOM 148 CD PRO A 14 -2.903 -4.474 -1.256 1.00 0.00 C ATOM 149 HA PRO A 14 -5.253 -6.204 0.044 1.00 0.00 H ATOM 150 HB2 PRO A 14 -5.598 -3.510 0.401 1.00 0.00 H ATOM 151 HB3 PRO A 14 -4.330 -4.447 1.206 1.00 0.00 H ATOM 152 HG2 PRO A 14 -4.158 -2.754 -1.255 1.00 0.00 H ATOM 153 HG3 PRO A 14 -3.046 -2.852 0.119 1.00 0.00 H ATOM 154 HD2 PRO A 14 -2.546 -4.105 -2.207 1.00 0.00 H ATOM 155 HD3 PRO A 14 -2.080 -4.812 -0.645 1.00 0.00 H ATOM 156 N ALA A 15 -7.462 -5.640 -1.055 1.00 0.00 N ATOM 157 CA ALA A 15 -8.720 -5.486 -1.853 1.00 0.00 C ATOM 158 C ALA A 15 -9.336 -4.098 -1.680 1.00 0.00 C ATOM 159 O ALA A 15 -9.561 -3.641 -0.578 1.00 0.00 O ATOM 160 CB ALA A 15 -9.661 -6.536 -1.283 1.00 0.00 C ATOM 161 H ALA A 15 -7.475 -6.162 -0.227 1.00 0.00 H ATOM 162 HA ALA A 15 -8.534 -5.690 -2.895 1.00 0.00 H ATOM 163 HB1 ALA A 15 -9.399 -7.504 -1.675 1.00 0.00 H ATOM 164 HB2 ALA A 15 -10.676 -6.294 -1.562 1.00 0.00 H ATOM 165 HB3 ALA A 15 -9.576 -6.544 -0.207 1.00 0.00 H ATOM 166 N GLY A 16 -9.626 -3.435 -2.767 1.00 0.00 N ATOM 167 CA GLY A 16 -10.233 -2.078 -2.677 1.00 0.00 C ATOM 168 C GLY A 16 -9.109 -1.058 -2.544 1.00 0.00 C ATOM 169 O GLY A 16 -9.254 -0.026 -1.920 1.00 0.00 O ATOM 170 H GLY A 16 -9.446 -3.832 -3.645 1.00 0.00 H ATOM 171 HA2 GLY A 16 -10.805 -1.875 -3.570 1.00 0.00 H ATOM 172 HA3 GLY A 16 -10.877 -2.025 -1.811 1.00 0.00 H ATOM 173 N TRP A 17 -7.976 -1.356 -3.117 1.00 0.00 N ATOM 174 CA TRP A 17 -6.821 -0.425 -3.019 1.00 0.00 C ATOM 175 C TRP A 17 -6.351 0.003 -4.411 1.00 0.00 C ATOM 176 O TRP A 17 -6.962 -0.315 -5.412 1.00 0.00 O ATOM 177 CB TRP A 17 -5.741 -1.240 -2.310 1.00 0.00 C ATOM 178 CG TRP A 17 -6.028 -1.268 -0.844 1.00 0.00 C ATOM 179 CD1 TRP A 17 -7.135 -1.802 -0.274 1.00 0.00 C ATOM 180 CD2 TRP A 17 -5.213 -0.758 0.246 1.00 0.00 C ATOM 181 NE1 TRP A 17 -7.055 -1.632 1.097 1.00 0.00 N ATOM 182 CE2 TRP A 17 -5.888 -0.993 1.466 1.00 0.00 C ATOM 183 CE3 TRP A 17 -3.968 -0.112 0.292 1.00 0.00 C ATOM 184 CZ2 TRP A 17 -5.342 -0.600 2.688 1.00 0.00 C ATOM 185 CZ3 TRP A 17 -3.416 0.281 1.519 1.00 0.00 C ATOM 186 CH2 TRP A 17 -4.102 0.039 2.716 1.00 0.00 C ATOM 187 H TRP A 17 -7.882 -2.202 -3.603 1.00 0.00 H ATOM 188 HA TRP A 17 -7.080 0.437 -2.425 1.00 0.00 H ATOM 189 HB2 TRP A 17 -5.736 -2.248 -2.698 1.00 0.00 H ATOM 190 HB3 TRP A 17 -4.776 -0.783 -2.480 1.00 0.00 H ATOM 191 HD1 TRP A 17 -7.945 -2.281 -0.802 1.00 0.00 H ATOM 192 HE1 TRP A 17 -7.735 -1.920 1.743 1.00 0.00 H ATOM 193 HE3 TRP A 17 -3.430 0.082 -0.624 1.00 0.00 H ATOM 194 HZ2 TRP A 17 -5.873 -0.787 3.605 1.00 0.00 H ATOM 195 HZ3 TRP A 17 -2.458 0.773 1.541 1.00 0.00 H ATOM 196 HH2 TRP A 17 -3.671 0.344 3.657 1.00 0.00 H ATOM 197 N GLU A 18 -5.269 0.727 -4.475 1.00 0.00 N ATOM 198 CA GLU A 18 -4.746 1.187 -5.790 1.00 0.00 C ATOM 199 C GLU A 18 -3.397 1.881 -5.599 1.00 0.00 C ATOM 200 O GLU A 18 -3.307 3.092 -5.638 1.00 0.00 O ATOM 201 CB GLU A 18 -5.783 2.182 -6.307 1.00 0.00 C ATOM 202 CG GLU A 18 -5.553 2.430 -7.799 1.00 0.00 C ATOM 203 CD GLU A 18 -6.617 1.683 -8.609 1.00 0.00 C ATOM 204 OE1 GLU A 18 -6.682 0.472 -8.489 1.00 0.00 O ATOM 205 OE2 GLU A 18 -7.345 2.338 -9.337 1.00 0.00 O ATOM 206 H GLU A 18 -4.797 0.969 -3.651 1.00 0.00 H ATOM 207 HA GLU A 18 -4.653 0.358 -6.474 1.00 0.00 H ATOM 208 HB2 GLU A 18 -6.776 1.782 -6.156 1.00 0.00 H ATOM 209 HB3 GLU A 18 -5.685 3.116 -5.769 1.00 0.00 H ATOM 210 HG2 GLU A 18 -5.623 3.488 -8.004 1.00 0.00 H ATOM 211 HG3 GLU A 18 -4.574 2.072 -8.076 1.00 0.00 H ATOM 212 N MET A 19 -2.350 1.120 -5.387 1.00 0.00 N ATOM 213 CA MET A 19 -0.991 1.720 -5.188 1.00 0.00 C ATOM 214 C MET A 19 -0.741 2.854 -6.194 1.00 0.00 C ATOM 215 O MET A 19 -1.334 2.892 -7.254 1.00 0.00 O ATOM 216 CB MET A 19 -0.014 0.552 -5.386 1.00 0.00 C ATOM 217 CG MET A 19 0.179 0.212 -6.876 1.00 0.00 C ATOM 218 SD MET A 19 -1.302 -0.593 -7.537 1.00 0.00 S ATOM 219 CE MET A 19 -0.981 -2.242 -6.868 1.00 0.00 C ATOM 220 H MET A 19 -2.462 0.147 -5.351 1.00 0.00 H ATOM 221 HA MET A 19 -0.900 2.089 -4.176 1.00 0.00 H ATOM 222 HB2 MET A 19 0.942 0.815 -4.961 1.00 0.00 H ATOM 223 HB3 MET A 19 -0.404 -0.306 -4.868 1.00 0.00 H ATOM 224 HG2 MET A 19 0.376 1.115 -7.432 1.00 0.00 H ATOM 225 HG3 MET A 19 1.020 -0.458 -6.976 1.00 0.00 H ATOM 226 HE1 MET A 19 -1.901 -2.809 -6.856 1.00 0.00 H ATOM 227 HE2 MET A 19 -0.603 -2.156 -5.862 1.00 0.00 H ATOM 228 HE3 MET A 19 -0.249 -2.745 -7.484 1.00 0.00 H ATOM 229 N ALA A 20 0.112 3.784 -5.867 1.00 0.00 N ATOM 230 CA ALA A 20 0.362 4.914 -6.810 1.00 0.00 C ATOM 231 C ALA A 20 1.802 5.424 -6.692 1.00 0.00 C ATOM 232 O ALA A 20 2.127 6.496 -7.162 1.00 0.00 O ATOM 233 CB ALA A 20 -0.622 5.995 -6.366 1.00 0.00 C ATOM 234 H ALA A 20 0.572 3.751 -5.002 1.00 0.00 H ATOM 235 HA ALA A 20 0.146 4.616 -7.822 1.00 0.00 H ATOM 236 HB1 ALA A 20 -1.445 5.536 -5.839 1.00 0.00 H ATOM 237 HB2 ALA A 20 -0.996 6.520 -7.232 1.00 0.00 H ATOM 238 HB3 ALA A 20 -0.119 6.690 -5.710 1.00 0.00 H ATOM 239 N LYS A 21 2.666 4.670 -6.068 1.00 0.00 N ATOM 240 CA LYS A 21 4.079 5.127 -5.920 1.00 0.00 C ATOM 241 C LYS A 21 4.118 6.508 -5.258 1.00 0.00 C ATOM 242 O LYS A 21 3.098 7.127 -5.031 1.00 0.00 O ATOM 243 CB LYS A 21 4.635 5.196 -7.345 1.00 0.00 C ATOM 244 CG LYS A 21 4.442 3.842 -8.033 1.00 0.00 C ATOM 245 CD LYS A 21 3.769 4.053 -9.391 1.00 0.00 C ATOM 246 CE LYS A 21 3.039 2.771 -9.802 1.00 0.00 C ATOM 247 NZ LYS A 21 4.072 1.950 -10.492 1.00 0.00 N ATOM 248 H LYS A 21 2.387 3.812 -5.691 1.00 0.00 H ATOM 249 HA LYS A 21 4.643 4.418 -5.338 1.00 0.00 H ATOM 250 HB2 LYS A 21 4.113 5.960 -7.899 1.00 0.00 H ATOM 251 HB3 LYS A 21 5.687 5.434 -7.307 1.00 0.00 H ATOM 252 HG2 LYS A 21 5.403 3.372 -8.177 1.00 0.00 H ATOM 253 HG3 LYS A 21 3.820 3.210 -7.417 1.00 0.00 H ATOM 254 HD2 LYS A 21 3.060 4.864 -9.320 1.00 0.00 H ATOM 255 HD3 LYS A 21 4.519 4.294 -10.130 1.00 0.00 H ATOM 256 HE2 LYS A 21 2.668 2.255 -8.930 1.00 0.00 H ATOM 257 HE3 LYS A 21 2.229 3.001 -10.478 1.00 0.00 H ATOM 258 HZ1 LYS A 21 3.616 1.142 -10.963 1.00 0.00 H ATOM 259 HZ2 LYS A 21 4.761 1.602 -9.794 1.00 0.00 H ATOM 260 HZ3 LYS A 21 4.561 2.529 -11.203 1.00 0.00 H ATOM 261 N THR A 22 5.287 6.993 -4.944 1.00 0.00 N ATOM 262 CA THR A 22 5.386 8.332 -4.295 1.00 0.00 C ATOM 263 C THR A 22 6.067 9.327 -5.238 1.00 0.00 C ATOM 264 O THR A 22 7.127 9.845 -4.950 1.00 0.00 O ATOM 265 CB THR A 22 6.239 8.105 -3.046 1.00 0.00 C ATOM 266 OG1 THR A 22 7.348 7.278 -3.377 1.00 0.00 O ATOM 267 CG2 THR A 22 5.397 7.426 -1.966 1.00 0.00 C ATOM 268 H THR A 22 6.101 6.478 -5.132 1.00 0.00 H ATOM 269 HA THR A 22 4.408 8.686 -4.012 1.00 0.00 H ATOM 270 HB THR A 22 6.595 9.054 -2.675 1.00 0.00 H ATOM 271 HG1 THR A 22 8.134 7.830 -3.395 1.00 0.00 H ATOM 272 HG21 THR A 22 5.027 8.169 -1.277 1.00 0.00 H ATOM 273 HG22 THR A 22 6.005 6.710 -1.432 1.00 0.00 H ATOM 274 HG23 THR A 22 4.564 6.916 -2.428 1.00 0.00 H ATOM 275 N SER A 23 5.464 9.599 -6.365 1.00 0.00 N ATOM 276 CA SER A 23 6.075 10.561 -7.330 1.00 0.00 C ATOM 277 C SER A 23 7.534 10.187 -7.608 1.00 0.00 C ATOM 278 O SER A 23 8.419 11.017 -7.552 1.00 0.00 O ATOM 279 CB SER A 23 5.986 11.924 -6.640 1.00 0.00 C ATOM 280 OG SER A 23 7.123 12.114 -5.808 1.00 0.00 O ATOM 281 H SER A 23 4.610 9.168 -6.578 1.00 0.00 H ATOM 282 HA SER A 23 5.509 10.578 -8.249 1.00 0.00 H ATOM 283 HB2 SER A 23 5.955 12.704 -7.388 1.00 0.00 H ATOM 284 HB3 SER A 23 5.090 11.965 -6.040 1.00 0.00 H ATOM 285 HG SER A 23 7.141 13.035 -5.538 1.00 0.00 H HETATM 286 N ESD A 24 7.791 8.943 -7.907 1.00 0.00 N HETATM 287 CG ESD A 24 9.920 8.657 -6.849 1.00 0.00 C HETATM 288 SB ESD A 24 9.915 7.063 -5.991 1.00 0.00 S HETATM 289 CD ESD A 24 9.190 8.517 -8.188 1.00 0.00 C HETATM 290 CA ESD A 24 11.734 6.824 -5.939 1.00 0.00 C HETATM 291 C ESD A 24 12.293 5.735 -5.089 1.00 0.00 C HETATM 292 O ESD A 24 13.209 5.944 -4.318 1.00 0.00 O HETATM 293 H ESD A 24 7.062 8.288 -7.947 1.00 0.00 H HETATM 294 HG1 ESD A 24 9.421 9.395 -6.241 1.00 0.00 H HETATM 295 HG2 ESD A 24 10.939 8.967 -7.026 1.00 0.00 H HETATM 296 HD2 ESD A 24 9.641 9.165 -8.928 1.00 0.00 H HETATM 297 HD1 ESD A 24 9.205 7.491 -8.520 1.00 0.00 H HETATM 298 HA2 ESD A 24 12.220 7.897 -5.933 1.00 0.00 H HETATM 299 HA1 ESD A 24 12.030 6.274 -6.688 1.00 0.00 H ATOM 300 N GLY A 25 11.762 4.548 -5.204 1.00 0.00 N ATOM 301 CA GLY A 25 12.278 3.419 -4.380 1.00 0.00 C ATOM 302 C GLY A 25 11.432 3.285 -3.112 1.00 0.00 C ATOM 303 O GLY A 25 11.944 3.065 -2.033 1.00 0.00 O ATOM 304 H GLY A 25 11.025 4.400 -5.832 1.00 0.00 H ATOM 305 HA2 GLY A 25 12.222 2.504 -4.949 1.00 0.00 H ATOM 306 HA3 GLY A 25 13.305 3.612 -4.107 1.00 0.00 H ATOM 307 N GLN A 26 10.139 3.414 -3.235 1.00 0.00 N ATOM 308 CA GLN A 26 9.261 3.292 -2.037 1.00 0.00 C ATOM 309 C GLN A 26 7.987 2.519 -2.389 1.00 0.00 C ATOM 310 O GLN A 26 7.727 1.457 -1.859 1.00 0.00 O ATOM 311 CB GLN A 26 8.923 4.731 -1.647 1.00 0.00 C ATOM 312 CG GLN A 26 8.890 4.852 -0.121 1.00 0.00 C ATOM 313 CD GLN A 26 10.318 4.996 0.410 1.00 0.00 C ATOM 314 OE1 GLN A 26 10.846 6.087 0.481 1.00 0.00 O ATOM 315 NE2 GLN A 26 10.969 3.931 0.789 1.00 0.00 N ATOM 316 H GLN A 26 9.745 3.590 -4.115 1.00 0.00 H ATOM 317 HA GLN A 26 9.787 2.805 -1.231 1.00 0.00 H ATOM 318 HB2 GLN A 26 9.675 5.398 -2.044 1.00 0.00 H ATOM 319 HB3 GLN A 26 7.957 4.997 -2.050 1.00 0.00 H ATOM 320 HG2 GLN A 26 8.313 5.722 0.159 1.00 0.00 H ATOM 321 HG3 GLN A 26 8.436 3.967 0.301 1.00 0.00 H ATOM 322 HE21 GLN A 26 10.544 3.048 0.732 1.00 0.00 H ATOM 323 HE22 GLN A 26 11.884 4.011 1.131 1.00 0.00 H ATOM 324 N ARG A 27 7.192 3.045 -3.287 1.00 0.00 N ATOM 325 CA ARG A 27 5.929 2.347 -3.683 1.00 0.00 C ATOM 326 C ARG A 27 5.014 2.164 -2.470 1.00 0.00 C ATOM 327 O ARG A 27 5.462 2.126 -1.340 1.00 0.00 O ATOM 328 CB ARG A 27 6.368 0.988 -4.237 1.00 0.00 C ATOM 329 CG ARG A 27 5.526 0.643 -5.468 1.00 0.00 C ATOM 330 CD ARG A 27 6.042 -0.655 -6.091 1.00 0.00 C ATOM 331 NE ARG A 27 4.812 -1.408 -6.478 1.00 0.00 N ATOM 332 CZ ARG A 27 4.869 -2.393 -7.343 1.00 0.00 C ATOM 333 NH1 ARG A 27 6.006 -2.746 -7.893 1.00 0.00 N ATOM 334 NH2 ARG A 27 3.777 -3.033 -7.661 1.00 0.00 N ATOM 335 H ARG A 27 7.426 3.901 -3.701 1.00 0.00 H ATOM 336 HA ARG A 27 5.421 2.905 -4.452 1.00 0.00 H ATOM 337 HB2 ARG A 27 7.411 1.031 -4.515 1.00 0.00 H ATOM 338 HB3 ARG A 27 6.227 0.230 -3.481 1.00 0.00 H ATOM 339 HG2 ARG A 27 4.495 0.517 -5.175 1.00 0.00 H ATOM 340 HG3 ARG A 27 5.601 1.442 -6.190 1.00 0.00 H ATOM 341 HD2 ARG A 27 6.641 -0.441 -6.962 1.00 0.00 H ATOM 342 HD3 ARG A 27 6.614 -1.218 -5.368 1.00 0.00 H ATOM 343 HE ARG A 27 3.951 -1.162 -6.080 1.00 0.00 H ATOM 344 HH11 ARG A 27 6.851 -2.266 -7.659 1.00 0.00 H ATOM 345 HH12 ARG A 27 6.027 -3.498 -8.550 1.00 0.00 H ATOM 346 HH21 ARG A 27 2.906 -2.772 -7.247 1.00 0.00 H ATOM 347 HH22 ARG A 27 3.811 -3.784 -8.319 1.00 0.00 H ATOM 348 N TYR A 28 3.733 2.040 -2.692 1.00 0.00 N ATOM 349 CA TYR A 28 2.797 1.848 -1.547 1.00 0.00 C ATOM 350 C TYR A 28 1.390 1.542 -2.036 1.00 0.00 C ATOM 351 O TYR A 28 0.990 1.929 -3.113 1.00 0.00 O ATOM 352 CB TYR A 28 2.832 3.165 -0.740 1.00 0.00 C ATOM 353 CG TYR A 28 1.997 4.277 -1.379 1.00 0.00 C ATOM 354 CD1 TYR A 28 1.879 4.392 -2.775 1.00 0.00 C ATOM 355 CD2 TYR A 28 1.370 5.232 -0.558 1.00 0.00 C ATOM 356 CE1 TYR A 28 1.151 5.449 -3.335 1.00 0.00 C ATOM 357 CE2 TYR A 28 0.637 6.280 -1.126 1.00 0.00 C ATOM 358 CZ TYR A 28 0.532 6.389 -2.513 1.00 0.00 C ATOM 359 OH TYR A 28 -0.178 7.432 -3.070 1.00 0.00 O ATOM 360 H TYR A 28 3.390 2.065 -3.609 1.00 0.00 H ATOM 361 HA TYR A 28 3.144 1.034 -0.926 1.00 0.00 H ATOM 362 HB2 TYR A 28 2.456 2.974 0.254 1.00 0.00 H ATOM 363 HB3 TYR A 28 3.857 3.498 -0.667 1.00 0.00 H ATOM 364 HD1 TYR A 28 2.338 3.667 -3.420 1.00 0.00 H ATOM 365 HD2 TYR A 28 1.433 5.149 0.515 1.00 0.00 H ATOM 366 HE1 TYR A 28 1.063 5.532 -4.404 1.00 0.00 H ATOM 367 HE2 TYR A 28 0.159 7.011 -0.492 1.00 0.00 H ATOM 368 HH TYR A 28 -0.167 8.164 -2.449 1.00 0.00 H ATOM 369 N PHE A 29 0.632 0.858 -1.238 1.00 0.00 N ATOM 370 CA PHE A 29 -0.756 0.541 -1.640 1.00 0.00 C ATOM 371 C PHE A 29 -1.657 1.660 -1.154 1.00 0.00 C ATOM 372 O PHE A 29 -1.647 2.033 0.001 1.00 0.00 O ATOM 373 CB PHE A 29 -1.081 -0.792 -0.974 1.00 0.00 C ATOM 374 CG PHE A 29 -0.043 -1.792 -1.410 1.00 0.00 C ATOM 375 CD1 PHE A 29 0.028 -2.188 -2.752 1.00 0.00 C ATOM 376 CD2 PHE A 29 0.870 -2.292 -0.482 1.00 0.00 C ATOM 377 CE1 PHE A 29 1.016 -3.090 -3.160 1.00 0.00 C ATOM 378 CE2 PHE A 29 1.856 -3.197 -0.886 1.00 0.00 C ATOM 379 CZ PHE A 29 1.930 -3.596 -2.226 1.00 0.00 C ATOM 380 H PHE A 29 0.972 0.563 -0.367 1.00 0.00 H ATOM 381 HA PHE A 29 -0.823 0.446 -2.713 1.00 0.00 H ATOM 382 HB2 PHE A 29 -1.051 -0.681 0.100 1.00 0.00 H ATOM 383 HB3 PHE A 29 -2.061 -1.125 -1.281 1.00 0.00 H ATOM 384 HD1 PHE A 29 -0.682 -1.797 -3.471 1.00 0.00 H ATOM 385 HD2 PHE A 29 0.809 -1.981 0.549 1.00 0.00 H ATOM 386 HE1 PHE A 29 1.075 -3.392 -4.192 1.00 0.00 H ATOM 387 HE2 PHE A 29 2.562 -3.582 -0.165 1.00 0.00 H ATOM 388 HZ PHE A 29 2.693 -4.292 -2.541 1.00 0.00 H ATOM 389 N LEU A 30 -2.406 2.220 -2.038 1.00 0.00 N ATOM 390 CA LEU A 30 -3.290 3.344 -1.666 1.00 0.00 C ATOM 391 C LEU A 30 -4.741 2.853 -1.686 1.00 0.00 C ATOM 392 O LEU A 30 -5.028 1.808 -2.231 1.00 0.00 O ATOM 393 CB LEU A 30 -3.007 4.378 -2.763 1.00 0.00 C ATOM 394 CG LEU A 30 -2.736 5.766 -2.159 1.00 0.00 C ATOM 395 CD1 LEU A 30 -2.751 6.806 -3.282 1.00 0.00 C ATOM 396 CD2 LEU A 30 -3.816 6.127 -1.134 1.00 0.00 C ATOM 397 H LEU A 30 -2.373 1.916 -2.968 1.00 0.00 H ATOM 398 HA LEU A 30 -3.025 3.734 -0.695 1.00 0.00 H ATOM 399 HB2 LEU A 30 -2.137 4.057 -3.331 1.00 0.00 H ATOM 400 HB3 LEU A 30 -3.843 4.438 -3.420 1.00 0.00 H ATOM 401 HG LEU A 30 -1.769 5.768 -1.681 1.00 0.00 H ATOM 402 HD11 LEU A 30 -2.093 6.488 -4.075 1.00 0.00 H ATOM 403 HD12 LEU A 30 -2.416 7.757 -2.895 1.00 0.00 H ATOM 404 HD13 LEU A 30 -3.756 6.906 -3.666 1.00 0.00 H ATOM 405 HD21 LEU A 30 -3.709 7.165 -0.850 1.00 0.00 H ATOM 406 HD22 LEU A 30 -3.706 5.503 -0.260 1.00 0.00 H ATOM 407 HD23 LEU A 30 -4.792 5.973 -1.568 1.00 0.00 H ATOM 408 N ASN A 31 -5.656 3.563 -1.080 1.00 0.00 N ATOM 409 CA ASN A 31 -7.064 3.067 -1.076 1.00 0.00 C ATOM 410 C ASN A 31 -8.072 4.201 -0.896 1.00 0.00 C ATOM 411 O ASN A 31 -7.865 5.125 -0.134 1.00 0.00 O ATOM 412 CB ASN A 31 -7.131 2.106 0.113 1.00 0.00 C ATOM 413 CG ASN A 31 -6.679 2.820 1.387 1.00 0.00 C ATOM 414 OD1 ASN A 31 -6.335 3.985 1.359 1.00 0.00 O ATOM 415 ND2 ASN A 31 -6.666 2.161 2.515 1.00 0.00 N ATOM 416 H ASN A 31 -5.422 4.394 -0.620 1.00 0.00 H ATOM 417 HA ASN A 31 -7.272 2.528 -1.985 1.00 0.00 H ATOM 418 HB2 ASN A 31 -8.143 1.754 0.238 1.00 0.00 H ATOM 419 HB3 ASN A 31 -6.481 1.270 -0.072 1.00 0.00 H ATOM 420 HD21 ASN A 31 -6.945 1.222 2.535 1.00 0.00 H ATOM 421 HD22 ASN A 31 -6.373 2.602 3.339 1.00 0.00 H ATOM 422 N HIS A 32 -9.183 4.114 -1.577 1.00 0.00 N ATOM 423 CA HIS A 32 -10.236 5.157 -1.436 1.00 0.00 C ATOM 424 C HIS A 32 -11.286 4.671 -0.430 1.00 0.00 C ATOM 425 O HIS A 32 -12.421 5.101 -0.436 1.00 0.00 O ATOM 426 CB HIS A 32 -10.846 5.301 -2.831 1.00 0.00 C ATOM 427 CG HIS A 32 -11.970 6.300 -2.786 1.00 0.00 C ATOM 428 ND1 HIS A 32 -12.027 7.307 -1.833 1.00 0.00 N ATOM 429 CD2 HIS A 32 -13.087 6.461 -3.568 1.00 0.00 C ATOM 430 CE1 HIS A 32 -13.144 8.020 -2.065 1.00 0.00 C ATOM 431 NE2 HIS A 32 -13.827 7.547 -3.111 1.00 0.00 N ATOM 432 H HIS A 32 -9.333 3.345 -2.167 1.00 0.00 H ATOM 433 HA HIS A 32 -9.806 6.092 -1.116 1.00 0.00 H ATOM 434 HB2 HIS A 32 -10.087 5.643 -3.520 1.00 0.00 H ATOM 435 HB3 HIS A 32 -11.226 4.346 -3.159 1.00 0.00 H ATOM 436 HD1 HIS A 32 -11.373 7.467 -1.122 1.00 0.00 H ATOM 437 HD2 HIS A 32 -13.351 5.838 -4.410 1.00 0.00 H ATOM 438 HE1 HIS A 32 -13.450 8.873 -1.477 1.00 0.00 H ATOM 439 N ILE A 33 -10.897 3.779 0.445 1.00 0.00 N ATOM 440 CA ILE A 33 -11.848 3.252 1.473 1.00 0.00 C ATOM 441 C ILE A 33 -11.425 3.804 2.826 1.00 0.00 C ATOM 442 O ILE A 33 -12.107 4.606 3.436 1.00 0.00 O ATOM 443 CB ILE A 33 -11.720 1.708 1.498 1.00 0.00 C ATOM 444 CG1 ILE A 33 -11.099 1.154 0.208 1.00 0.00 C ATOM 445 CG2 ILE A 33 -13.109 1.095 1.674 1.00 0.00 C ATOM 446 CD1 ILE A 33 -10.919 -0.357 0.348 1.00 0.00 C ATOM 447 H ILE A 33 -9.974 3.459 0.435 1.00 0.00 H ATOM 448 HA ILE A 33 -12.860 3.544 1.242 1.00 0.00 H ATOM 449 HB ILE A 33 -11.104 1.419 2.340 1.00 0.00 H ATOM 450 HG12 ILE A 33 -11.748 1.368 -0.626 1.00 0.00 H ATOM 451 HG13 ILE A 33 -10.137 1.612 0.047 1.00 0.00 H ATOM 452 HG21 ILE A 33 -13.577 1.510 2.555 1.00 0.00 H ATOM 453 HG22 ILE A 33 -13.020 0.024 1.784 1.00 0.00 H ATOM 454 HG23 ILE A 33 -13.714 1.319 0.807 1.00 0.00 H ATOM 455 HD11 ILE A 33 -9.906 -0.625 0.085 1.00 0.00 H ATOM 456 HD12 ILE A 33 -11.607 -0.866 -0.310 1.00 0.00 H ATOM 457 HD13 ILE A 33 -11.114 -0.650 1.369 1.00 0.00 H ATOM 458 N ASP A 34 -10.280 3.387 3.281 1.00 0.00 N ATOM 459 CA ASP A 34 -9.761 3.882 4.582 1.00 0.00 C ATOM 460 C ASP A 34 -9.035 5.224 4.377 1.00 0.00 C ATOM 461 O ASP A 34 -8.622 5.863 5.324 1.00 0.00 O ATOM 462 CB ASP A 34 -8.791 2.794 5.048 1.00 0.00 C ATOM 463 CG ASP A 34 -8.030 3.271 6.287 1.00 0.00 C ATOM 464 OD1 ASP A 34 -8.580 4.074 7.023 1.00 0.00 O ATOM 465 OD2 ASP A 34 -6.910 2.826 6.480 1.00 0.00 O ATOM 466 H ASP A 34 -9.752 2.753 2.750 1.00 0.00 H ATOM 467 HA ASP A 34 -10.565 3.992 5.294 1.00 0.00 H ATOM 468 HB2 ASP A 34 -9.346 1.900 5.289 1.00 0.00 H ATOM 469 HB3 ASP A 34 -8.091 2.577 4.255 1.00 0.00 H ATOM 470 N GLN A 35 -8.884 5.656 3.148 1.00 0.00 N ATOM 471 CA GLN A 35 -8.195 6.952 2.884 1.00 0.00 C ATOM 472 C GLN A 35 -6.803 6.964 3.520 1.00 0.00 C ATOM 473 O GLN A 35 -6.443 7.892 4.215 1.00 0.00 O ATOM 474 CB GLN A 35 -9.087 8.016 3.525 1.00 0.00 C ATOM 475 CG GLN A 35 -10.143 8.471 2.517 1.00 0.00 C ATOM 476 CD GLN A 35 -11.539 8.163 3.066 1.00 0.00 C ATOM 477 OE1 GLN A 35 -11.720 7.206 3.793 1.00 0.00 O ATOM 478 NE2 GLN A 35 -12.538 8.938 2.747 1.00 0.00 N ATOM 479 H GLN A 35 -9.225 5.131 2.398 1.00 0.00 H ATOM 480 HA GLN A 35 -8.122 7.127 1.822 1.00 0.00 H ATOM 481 HB2 GLN A 35 -9.574 7.600 4.395 1.00 0.00 H ATOM 482 HB3 GLN A 35 -8.484 8.861 3.820 1.00 0.00 H ATOM 483 HG2 GLN A 35 -10.048 9.533 2.351 1.00 0.00 H ATOM 484 HG3 GLN A 35 -10.000 7.946 1.584 1.00 0.00 H ATOM 485 HE21 GLN A 35 -12.393 9.709 2.160 1.00 0.00 H ATOM 486 HE22 GLN A 35 -13.435 8.749 3.094 1.00 0.00 H ATOM 487 N THR A 36 -6.014 5.950 3.282 1.00 0.00 N ATOM 488 CA THR A 36 -4.646 5.923 3.878 1.00 0.00 C ATOM 489 C THR A 36 -3.826 4.780 3.281 1.00 0.00 C ATOM 490 O THR A 36 -4.363 3.820 2.763 1.00 0.00 O ATOM 491 CB THR A 36 -4.846 5.700 5.383 1.00 0.00 C ATOM 492 OG1 THR A 36 -6.106 5.085 5.620 1.00 0.00 O ATOM 493 CG2 THR A 36 -4.780 7.040 6.116 1.00 0.00 C ATOM 494 H THR A 36 -6.319 5.210 2.712 1.00 0.00 H ATOM 495 HA THR A 36 -4.148 6.866 3.712 1.00 0.00 H ATOM 496 HB THR A 36 -4.060 5.057 5.754 1.00 0.00 H ATOM 497 HG1 THR A 36 -6.147 4.280 5.100 1.00 0.00 H ATOM 498 HG21 THR A 36 -5.780 7.417 6.268 1.00 0.00 H ATOM 499 HG22 THR A 36 -4.215 7.746 5.526 1.00 0.00 H ATOM 500 HG23 THR A 36 -4.299 6.903 7.074 1.00 0.00 H ATOM 501 N THR A 37 -2.528 4.869 3.363 1.00 0.00 N ATOM 502 CA THR A 37 -1.670 3.783 2.812 1.00 0.00 C ATOM 503 C THR A 37 -1.045 2.998 3.964 1.00 0.00 C ATOM 504 O THR A 37 -0.451 3.559 4.864 1.00 0.00 O ATOM 505 CB THR A 37 -0.595 4.489 1.983 1.00 0.00 C ATOM 506 OG1 THR A 37 0.238 5.253 2.841 1.00 0.00 O ATOM 507 CG2 THR A 37 -1.266 5.408 0.964 1.00 0.00 C ATOM 508 H THR A 37 -2.116 5.647 3.795 1.00 0.00 H ATOM 509 HA THR A 37 -2.251 3.127 2.184 1.00 0.00 H ATOM 510 HB THR A 37 0.001 3.753 1.459 1.00 0.00 H ATOM 511 HG1 THR A 37 -0.263 6.014 3.142 1.00 0.00 H ATOM 512 HG21 THR A 37 -2.325 5.460 1.167 1.00 0.00 H ATOM 513 HG22 THR A 37 -1.110 5.016 -0.029 1.00 0.00 H ATOM 514 HG23 THR A 37 -0.838 6.397 1.034 1.00 0.00 H ATOM 515 N THR A 38 -1.190 1.706 3.950 1.00 0.00 N ATOM 516 CA THR A 38 -0.621 0.878 5.054 1.00 0.00 C ATOM 517 C THR A 38 0.897 0.731 4.906 1.00 0.00 C ATOM 518 O THR A 38 1.568 0.287 5.814 1.00 0.00 O ATOM 519 CB THR A 38 -1.315 -0.483 4.942 1.00 0.00 C ATOM 520 OG1 THR A 38 -0.747 -1.378 5.888 1.00 0.00 O ATOM 521 CG2 THR A 38 -1.134 -1.050 3.532 1.00 0.00 C ATOM 522 H THR A 38 -1.682 1.285 3.217 1.00 0.00 H ATOM 523 HA THR A 38 -0.856 1.325 6.007 1.00 0.00 H ATOM 524 HB THR A 38 -2.368 -0.367 5.144 1.00 0.00 H ATOM 525 HG1 THR A 38 0.188 -1.467 5.689 1.00 0.00 H ATOM 526 HG21 THR A 38 -2.101 -1.282 3.112 1.00 0.00 H ATOM 527 HG22 THR A 38 -0.539 -1.950 3.580 1.00 0.00 H ATOM 528 HG23 THR A 38 -0.637 -0.322 2.910 1.00 0.00 H ATOM 529 N TRP A 39 1.447 1.106 3.774 1.00 0.00 N ATOM 530 CA TRP A 39 2.930 0.990 3.567 1.00 0.00 C ATOM 531 C TRP A 39 3.355 -0.485 3.565 1.00 0.00 C ATOM 532 O TRP A 39 3.735 -1.027 2.547 1.00 0.00 O ATOM 533 CB TRP A 39 3.580 1.744 4.736 1.00 0.00 C ATOM 534 CG TRP A 39 4.842 2.400 4.277 1.00 0.00 C ATOM 535 CD1 TRP A 39 6.056 2.231 4.850 1.00 0.00 C ATOM 536 CD2 TRP A 39 5.037 3.326 3.169 1.00 0.00 C ATOM 537 NE1 TRP A 39 6.983 2.993 4.165 1.00 0.00 N ATOM 538 CE2 TRP A 39 6.405 3.686 3.120 1.00 0.00 C ATOM 539 CE3 TRP A 39 4.172 3.883 2.211 1.00 0.00 C ATOM 540 CZ2 TRP A 39 6.897 4.567 2.155 1.00 0.00 C ATOM 541 CZ3 TRP A 39 4.662 4.770 1.239 1.00 0.00 C ATOM 542 CH2 TRP A 39 6.022 5.110 1.212 1.00 0.00 C ATOM 543 H TRP A 39 0.886 1.468 3.056 1.00 0.00 H ATOM 544 HA TRP A 39 3.210 1.455 2.634 1.00 0.00 H ATOM 545 HB2 TRP A 39 2.896 2.497 5.101 1.00 0.00 H ATOM 546 HB3 TRP A 39 3.805 1.052 5.532 1.00 0.00 H ATOM 547 HD1 TRP A 39 6.265 1.604 5.704 1.00 0.00 H ATOM 548 HE1 TRP A 39 7.938 3.049 4.379 1.00 0.00 H ATOM 549 HE3 TRP A 39 3.123 3.627 2.223 1.00 0.00 H ATOM 550 HZ2 TRP A 39 7.943 4.826 2.138 1.00 0.00 H ATOM 551 HZ3 TRP A 39 3.989 5.190 0.507 1.00 0.00 H ATOM 552 HH2 TRP A 39 6.392 5.792 0.460 1.00 0.00 H ATOM 553 N GLN A 40 3.286 -1.138 4.693 1.00 0.00 N ATOM 554 CA GLN A 40 3.677 -2.574 4.753 1.00 0.00 C ATOM 555 C GLN A 40 2.544 -3.390 5.381 1.00 0.00 C ATOM 556 O GLN A 40 2.102 -3.112 6.478 1.00 0.00 O ATOM 557 CB GLN A 40 4.920 -2.612 5.642 1.00 0.00 C ATOM 558 CG GLN A 40 6.145 -2.194 4.823 1.00 0.00 C ATOM 559 CD GLN A 40 7.210 -1.620 5.756 1.00 0.00 C ATOM 560 OE1 GLN A 40 7.089 -0.503 6.222 1.00 0.00 O ATOM 561 NE2 GLN A 40 8.258 -2.338 6.054 1.00 0.00 N ATOM 562 H GLN A 40 2.970 -0.683 5.502 1.00 0.00 H ATOM 563 HA GLN A 40 3.911 -2.945 3.770 1.00 0.00 H ATOM 564 HB2 GLN A 40 4.793 -1.930 6.470 1.00 0.00 H ATOM 565 HB3 GLN A 40 5.065 -3.613 6.018 1.00 0.00 H ATOM 566 HG2 GLN A 40 6.544 -3.056 4.309 1.00 0.00 H ATOM 567 HG3 GLN A 40 5.857 -1.446 4.100 1.00 0.00 H ATOM 568 HE21 GLN A 40 8.356 -3.239 5.679 1.00 0.00 H ATOM 569 HE22 GLN A 40 8.947 -1.979 6.651 1.00 0.00 H ATOM 570 N ASP A 41 2.066 -4.394 4.695 1.00 0.00 N ATOM 571 CA ASP A 41 0.957 -5.222 5.259 1.00 0.00 C ATOM 572 C ASP A 41 0.597 -6.366 4.301 1.00 0.00 C ATOM 573 O ASP A 41 0.677 -7.520 4.670 1.00 0.00 O ATOM 574 CB ASP A 41 -0.226 -4.264 5.420 1.00 0.00 C ATOM 575 CG ASP A 41 -0.571 -4.125 6.904 1.00 0.00 C ATOM 576 OD1 ASP A 41 0.322 -4.292 7.718 1.00 0.00 O ATOM 577 OD2 ASP A 41 -1.724 -3.855 7.202 1.00 0.00 O ATOM 578 H ASP A 41 2.437 -4.604 3.813 1.00 0.00 H ATOM 579 HA ASP A 41 1.241 -5.617 6.221 1.00 0.00 H ATOM 580 HB2 ASP A 41 0.037 -3.295 5.019 1.00 0.00 H ATOM 581 HB3 ASP A 41 -1.080 -4.654 4.886 1.00 0.00 H ATOM 582 N PRO A 42 0.202 -6.016 3.098 1.00 0.00 N ATOM 583 CA PRO A 42 -0.174 -7.050 2.103 1.00 0.00 C ATOM 584 C PRO A 42 1.058 -7.837 1.643 1.00 0.00 C ATOM 585 O PRO A 42 1.115 -9.043 1.774 1.00 0.00 O ATOM 586 CB PRO A 42 -0.787 -6.247 0.958 1.00 0.00 C ATOM 587 CG PRO A 42 -0.199 -4.879 1.086 1.00 0.00 C ATOM 588 CD PRO A 42 0.070 -4.653 2.551 1.00 0.00 C ATOM 589 HA PRO A 42 -0.912 -7.718 2.517 1.00 0.00 H ATOM 590 HB2 PRO A 42 -0.520 -6.684 0.008 1.00 0.00 H ATOM 591 HB3 PRO A 42 -1.862 -6.203 1.063 1.00 0.00 H ATOM 592 HG2 PRO A 42 0.723 -4.819 0.528 1.00 0.00 H ATOM 593 HG3 PRO A 42 -0.897 -4.140 0.725 1.00 0.00 H ATOM 594 HD2 PRO A 42 0.983 -4.096 2.683 1.00 0.00 H ATOM 595 HD3 PRO A 42 -0.760 -4.139 3.013 1.00 0.00 H ATOM 596 N ARG A 43 2.047 -7.172 1.107 1.00 0.00 N ATOM 597 CA ARG A 43 3.269 -7.898 0.647 1.00 0.00 C ATOM 598 C ARG A 43 4.312 -6.914 0.111 1.00 0.00 C ATOM 599 O ARG A 43 4.912 -7.134 -0.923 1.00 0.00 O ATOM 600 CB ARG A 43 2.791 -8.827 -0.472 1.00 0.00 C ATOM 601 CG ARG A 43 3.103 -10.279 -0.100 1.00 0.00 C ATOM 602 CD ARG A 43 4.608 -10.438 0.128 1.00 0.00 C ATOM 603 NE ARG A 43 4.729 -11.099 1.461 1.00 0.00 N ATOM 604 CZ ARG A 43 5.889 -11.538 1.893 1.00 0.00 C ATOM 605 NH1 ARG A 43 6.972 -11.409 1.167 1.00 0.00 N ATOM 606 NH2 ARG A 43 5.962 -12.110 3.062 1.00 0.00 N ATOM 607 H ARG A 43 1.990 -6.199 1.010 1.00 0.00 H ATOM 608 HA ARG A 43 3.684 -8.481 1.453 1.00 0.00 H ATOM 609 HB2 ARG A 43 1.726 -8.709 -0.606 1.00 0.00 H ATOM 610 HB3 ARG A 43 3.299 -8.575 -1.390 1.00 0.00 H ATOM 611 HG2 ARG A 43 2.571 -10.539 0.804 1.00 0.00 H ATOM 612 HG3 ARG A 43 2.789 -10.931 -0.902 1.00 0.00 H ATOM 613 HD2 ARG A 43 5.040 -11.060 -0.641 1.00 0.00 H ATOM 614 HD3 ARG A 43 5.088 -9.471 0.143 1.00 0.00 H ATOM 615 HE ARG A 43 3.933 -11.207 2.021 1.00 0.00 H ATOM 616 HH11 ARG A 43 6.932 -10.972 0.270 1.00 0.00 H ATOM 617 HH12 ARG A 43 7.846 -11.750 1.515 1.00 0.00 H ATOM 618 HH21 ARG A 43 5.140 -12.212 3.623 1.00 0.00 H ATOM 619 HH22 ARG A 43 6.842 -12.447 3.400 1.00 0.00 H ATOM 620 N LYS A 44 4.536 -5.830 0.803 1.00 0.00 N ATOM 621 CA LYS A 44 5.543 -4.837 0.327 1.00 0.00 C ATOM 622 C LYS A 44 5.696 -3.708 1.348 1.00 0.00 C ATOM 623 O LYS A 44 4.728 -3.091 1.746 1.00 0.00 O ATOM 624 CB LYS A 44 4.981 -4.297 -0.988 1.00 0.00 C ATOM 625 CG LYS A 44 5.787 -4.864 -2.160 1.00 0.00 C ATOM 626 CD LYS A 44 4.847 -5.601 -3.116 1.00 0.00 C ATOM 627 CE LYS A 44 4.584 -4.730 -4.346 1.00 0.00 C ATOM 628 NZ LYS A 44 5.813 -4.865 -5.178 1.00 0.00 N ATOM 629 H LYS A 44 4.043 -5.669 1.635 1.00 0.00 H ATOM 630 HA LYS A 44 6.492 -5.318 0.152 1.00 0.00 H ATOM 631 HB2 LYS A 44 3.947 -4.593 -1.087 1.00 0.00 H ATOM 632 HB3 LYS A 44 5.049 -3.219 -0.994 1.00 0.00 H ATOM 633 HG2 LYS A 44 6.276 -4.057 -2.685 1.00 0.00 H ATOM 634 HG3 LYS A 44 6.530 -5.552 -1.783 1.00 0.00 H ATOM 635 HD2 LYS A 44 5.304 -6.530 -3.424 1.00 0.00 H ATOM 636 HD3 LYS A 44 3.914 -5.808 -2.614 1.00 0.00 H ATOM 637 HE2 LYS A 44 3.724 -5.092 -4.885 1.00 0.00 H ATOM 638 HE3 LYS A 44 4.441 -3.700 -4.052 1.00 0.00 H ATOM 639 HZ1 LYS A 44 6.650 -4.648 -4.601 1.00 0.00 H ATOM 640 HZ2 LYS A 44 5.762 -4.205 -5.981 1.00 0.00 H ATOM 641 HZ3 LYS A 44 5.885 -5.840 -5.535 1.00 0.00 H HETATM 642 N NH2 A 45 6.885 -3.407 1.794 1.00 0.00 N HETATM 643 HN1 NH2 A 45 7.667 -3.903 1.475 1.00 0.00 H HETATM 644 HN2 NH2 A 45 6.995 -2.686 2.448 1.00 0.00 H TER 645 NH2 A 45 ATOM 646 N GLY B 45 13.936 10.384 7.763 1.00 0.00 N ATOM 647 CA GLY B 45 13.021 11.300 7.024 1.00 0.00 C ATOM 648 C GLY B 45 12.060 10.479 6.163 1.00 0.00 C ATOM 649 O GLY B 45 12.242 10.345 4.969 1.00 0.00 O ATOM 650 H GLY B 45 14.268 9.570 7.331 1.00 0.00 H ATOM 651 HA2 GLY B 45 12.457 11.892 7.733 1.00 0.00 H ATOM 652 HA3 GLY B 45 13.601 11.953 6.389 1.00 0.00 H ATOM 653 N THR B 46 11.039 9.926 6.759 1.00 0.00 N ATOM 654 CA THR B 46 10.067 9.114 5.973 1.00 0.00 C ATOM 655 C THR B 46 8.630 9.541 6.300 1.00 0.00 C ATOM 656 O THR B 46 7.951 8.883 7.064 1.00 0.00 O ATOM 657 CB THR B 46 10.311 7.669 6.413 1.00 0.00 C ATOM 658 OG1 THR B 46 10.471 7.628 7.825 1.00 0.00 O ATOM 659 CG2 THR B 46 11.575 7.134 5.738 1.00 0.00 C ATOM 660 H THR B 46 10.911 10.045 7.724 1.00 0.00 H ATOM 661 HA THR B 46 10.260 9.213 4.917 1.00 0.00 H ATOM 662 HB THR B 46 9.469 7.058 6.128 1.00 0.00 H ATOM 663 HG1 THR B 46 10.133 6.786 8.137 1.00 0.00 H ATOM 664 HG21 THR B 46 12.260 7.949 5.559 1.00 0.00 H ATOM 665 HG22 THR B 46 11.312 6.670 4.800 1.00 0.00 H ATOM 666 HG23 THR B 46 12.044 6.404 6.382 1.00 0.00 H ATOM 667 N PRO B 47 8.210 10.635 5.711 1.00 0.00 N ATOM 668 CA PRO B 47 6.837 11.143 5.954 1.00 0.00 C ATOM 669 C PRO B 47 5.805 10.248 5.256 1.00 0.00 C ATOM 670 O PRO B 47 6.115 9.599 4.277 1.00 0.00 O ATOM 671 CB PRO B 47 6.854 12.538 5.334 1.00 0.00 C ATOM 672 CG PRO B 47 7.933 12.488 4.299 1.00 0.00 C ATOM 673 CD PRO B 47 8.958 11.493 4.778 1.00 0.00 C ATOM 674 HA PRO B 47 6.635 11.210 7.010 1.00 0.00 H ATOM 675 HB2 PRO B 47 5.902 12.756 4.875 1.00 0.00 H ATOM 676 HB3 PRO B 47 7.087 13.279 6.085 1.00 0.00 H ATOM 677 HG2 PRO B 47 7.521 12.168 3.353 1.00 0.00 H ATOM 678 HG3 PRO B 47 8.386 13.462 4.193 1.00 0.00 H ATOM 679 HD2 PRO B 47 9.336 10.912 3.951 1.00 0.00 H ATOM 680 HD3 PRO B 47 9.764 11.997 5.289 1.00 0.00 H ATOM 681 N PRO B 48 4.603 10.238 5.784 1.00 0.00 N ATOM 682 CA PRO B 48 3.526 9.408 5.192 1.00 0.00 C ATOM 683 C PRO B 48 3.048 10.016 3.865 1.00 0.00 C ATOM 684 O PRO B 48 2.991 11.223 3.727 1.00 0.00 O ATOM 685 CB PRO B 48 2.418 9.454 6.241 1.00 0.00 C ATOM 686 CG PRO B 48 2.655 10.723 6.998 1.00 0.00 C ATOM 687 CD PRO B 48 4.138 10.987 6.962 1.00 0.00 C ATOM 688 HA PRO B 48 3.860 8.393 5.051 1.00 0.00 H ATOM 689 HB2 PRO B 48 1.450 9.479 5.763 1.00 0.00 H ATOM 690 HB3 PRO B 48 2.491 8.603 6.901 1.00 0.00 H ATOM 691 HG2 PRO B 48 2.124 11.538 6.528 1.00 0.00 H ATOM 692 HG3 PRO B 48 2.327 10.609 8.021 1.00 0.00 H ATOM 693 HD2 PRO B 48 4.332 12.043 6.841 1.00 0.00 H ATOM 694 HD3 PRO B 48 4.612 10.614 7.859 1.00 0.00 H ATOM 695 N PRO B 49 2.719 9.161 2.926 1.00 0.00 N ATOM 696 CA PRO B 49 2.243 9.635 1.602 1.00 0.00 C ATOM 697 C PRO B 49 0.810 10.179 1.711 1.00 0.00 C ATOM 698 O PRO B 49 -0.115 9.425 1.938 1.00 0.00 O ATOM 699 CB PRO B 49 2.279 8.378 0.737 1.00 0.00 C ATOM 700 CG PRO B 49 2.156 7.240 1.697 1.00 0.00 C ATOM 701 CD PRO B 49 2.756 7.694 3.004 1.00 0.00 C ATOM 702 HA PRO B 49 2.912 10.379 1.201 1.00 0.00 H ATOM 703 HB2 PRO B 49 1.450 8.378 0.042 1.00 0.00 H ATOM 704 HB3 PRO B 49 3.216 8.313 0.207 1.00 0.00 H ATOM 705 HG2 PRO B 49 1.116 6.988 1.838 1.00 0.00 H ATOM 706 HG3 PRO B 49 2.694 6.383 1.323 1.00 0.00 H ATOM 707 HD2 PRO B 49 2.162 7.338 3.835 1.00 0.00 H ATOM 708 HD3 PRO B 49 3.776 7.352 3.091 1.00 0.00 H ATOM 709 N PRO B 50 0.666 11.473 1.547 1.00 0.00 N ATOM 710 CA PRO B 50 -0.678 12.097 1.633 1.00 0.00 C ATOM 711 C PRO B 50 -1.507 11.757 0.390 1.00 0.00 C ATOM 712 O PRO B 50 -1.851 12.621 -0.392 1.00 0.00 O ATOM 713 CB PRO B 50 -0.378 13.592 1.692 1.00 0.00 C ATOM 714 CG PRO B 50 0.956 13.746 1.038 1.00 0.00 C ATOM 715 CD PRO B 50 1.716 12.467 1.271 1.00 0.00 C ATOM 716 HA PRO B 50 -1.188 11.786 2.530 1.00 0.00 H ATOM 717 HB2 PRO B 50 -1.132 14.147 1.150 1.00 0.00 H ATOM 718 HB3 PRO B 50 -0.327 13.926 2.717 1.00 0.00 H ATOM 719 HG2 PRO B 50 0.829 13.915 -0.022 1.00 0.00 H ATOM 720 HG3 PRO B 50 1.491 14.572 1.481 1.00 0.00 H ATOM 721 HD2 PRO B 50 2.275 12.192 0.388 1.00 0.00 H ATOM 722 HD3 PRO B 50 2.375 12.568 2.121 1.00 0.00 H ATOM 723 N TYR B 51 -1.828 10.506 0.203 1.00 0.00 N ATOM 724 CA TYR B 51 -2.634 10.115 -0.991 1.00 0.00 C ATOM 725 C TYR B 51 -1.976 10.642 -2.269 1.00 0.00 C ATOM 726 O TYR B 51 -0.857 11.115 -2.254 1.00 0.00 O ATOM 727 CB TYR B 51 -4.000 10.769 -0.779 1.00 0.00 C ATOM 728 CG TYR B 51 -5.090 9.784 -1.129 1.00 0.00 C ATOM 729 CD1 TYR B 51 -5.431 8.768 -0.228 1.00 0.00 C ATOM 730 CD2 TYR B 51 -5.759 9.888 -2.355 1.00 0.00 C ATOM 731 CE1 TYR B 51 -6.442 7.857 -0.553 1.00 0.00 C ATOM 732 CE2 TYR B 51 -6.770 8.975 -2.680 1.00 0.00 C ATOM 733 CZ TYR B 51 -7.112 7.960 -1.780 1.00 0.00 C ATOM 734 OH TYR B 51 -8.106 7.060 -2.100 1.00 0.00 O ATOM 735 H TYR B 51 -1.540 9.825 0.844 1.00 0.00 H ATOM 736 HA TYR B 51 -2.741 9.043 -1.037 1.00 0.00 H ATOM 737 HB2 TYR B 51 -4.100 11.065 0.254 1.00 0.00 H ATOM 738 HB3 TYR B 51 -4.083 11.640 -1.414 1.00 0.00 H ATOM 739 HD1 TYR B 51 -4.916 8.689 0.717 1.00 0.00 H ATOM 740 HD2 TYR B 51 -5.496 10.672 -3.050 1.00 0.00 H ATOM 741 HE1 TYR B 51 -6.706 7.073 0.142 1.00 0.00 H ATOM 742 HE2 TYR B 51 -7.286 9.055 -3.624 1.00 0.00 H ATOM 743 HH TYR B 51 -8.775 7.525 -2.607 1.00 0.00 H ATOM 744 N THR B 52 -2.663 10.564 -3.376 1.00 0.00 N ATOM 745 CA THR B 52 -2.077 11.061 -4.655 1.00 0.00 C ATOM 746 C THR B 52 -2.765 12.361 -5.082 1.00 0.00 C ATOM 747 O THR B 52 -3.802 12.347 -5.713 1.00 0.00 O ATOM 748 CB THR B 52 -2.347 9.952 -5.672 1.00 0.00 C ATOM 749 OG1 THR B 52 -3.631 9.394 -5.432 1.00 0.00 O ATOM 750 CG2 THR B 52 -1.282 8.862 -5.538 1.00 0.00 C ATOM 751 H THR B 52 -3.564 10.178 -3.368 1.00 0.00 H ATOM 752 HA THR B 52 -1.014 11.214 -4.548 1.00 0.00 H ATOM 753 HB THR B 52 -2.312 10.362 -6.669 1.00 0.00 H ATOM 754 HG1 THR B 52 -4.240 9.763 -6.076 1.00 0.00 H ATOM 755 HG21 THR B 52 -0.700 8.814 -6.447 1.00 0.00 H ATOM 756 HG22 THR B 52 -1.760 7.910 -5.367 1.00 0.00 H ATOM 757 HG23 THR B 52 -0.632 9.095 -4.706 1.00 0.00 H ATOM 758 N VAL B 53 -2.194 13.485 -4.741 1.00 0.00 N ATOM 759 CA VAL B 53 -2.815 14.783 -5.128 1.00 0.00 C ATOM 760 C VAL B 53 -2.246 15.265 -6.465 1.00 0.00 C ATOM 761 O VAL B 53 -1.752 16.368 -6.579 1.00 0.00 O ATOM 762 CB VAL B 53 -2.441 15.751 -4.005 1.00 0.00 C ATOM 763 CG1 VAL B 53 -2.996 15.234 -2.677 1.00 0.00 C ATOM 764 CG2 VAL B 53 -0.918 15.859 -3.912 1.00 0.00 C ATOM 765 H VAL B 53 -1.357 13.475 -4.231 1.00 0.00 H ATOM 766 HA VAL B 53 -3.887 14.686 -5.187 1.00 0.00 H ATOM 767 HB VAL B 53 -2.858 16.726 -4.216 1.00 0.00 H ATOM 768 HG11 VAL B 53 -3.674 14.414 -2.867 1.00 0.00 H ATOM 769 HG12 VAL B 53 -3.526 16.029 -2.175 1.00 0.00 H ATOM 770 HG13 VAL B 53 -2.183 14.892 -2.055 1.00 0.00 H ATOM 771 HG21 VAL B 53 -0.620 16.889 -4.049 1.00 0.00 H ATOM 772 HG22 VAL B 53 -0.466 15.251 -4.682 1.00 0.00 H ATOM 773 HG23 VAL B 53 -0.590 15.516 -2.942 1.00 0.00 H ATOM 774 N GLY B 54 -2.310 14.444 -7.478 1.00 0.00 N ATOM 775 CA GLY B 54 -1.772 14.856 -8.805 1.00 0.00 C ATOM 776 C GLY B 54 -2.885 15.511 -9.627 1.00 0.00 C ATOM 777 O GLY B 54 -4.041 15.305 -9.291 1.00 0.00 O ATOM 778 OXT GLY B 54 -2.563 16.207 -10.575 1.00 0.00 O ATOM 779 H GLY B 54 -2.713 13.558 -7.366 1.00 0.00 H ATOM 780 HA2 GLY B 54 -0.966 15.561 -8.664 1.00 0.00 H ATOM 781 HA3 GLY B 54 -1.402 13.986 -9.329 1.00 0.00 H TER 782 GLY B 54