HETATM 1 C ACE A 0 9.053 -6.950 1.052 1.00 0.00 C HETATM 2 O ACE A 0 10.119 -7.208 0.497 1.00 0.00 O HETATM 3 CH3 ACE A 0 7.747 -7.492 0.483 1.00 0.00 C HETATM 4 H1 ACE A 0 7.014 -6.692 0.396 1.00 0.00 H HETATM 5 H2 ACE A 0 7.923 -7.927 -0.501 1.00 0.00 H HETATM 6 H3 ACE A 0 7.356 -8.263 1.148 1.00 0.00 H ATOM 7 N ASN A 1 8.954 -6.206 2.161 1.00 0.00 N ATOM 8 CA ASN A 1 10.079 -5.653 2.907 1.00 0.00 C ATOM 9 C ASN A 1 10.924 -4.728 2.025 1.00 0.00 C ATOM 10 O ASN A 1 11.997 -5.108 1.556 1.00 0.00 O ATOM 11 CB ASN A 1 10.890 -6.783 3.564 1.00 0.00 C ATOM 12 CG ASN A 1 11.880 -6.255 4.603 1.00 0.00 C ATOM 13 OD1 ASN A 1 11.631 -6.346 5.802 1.00 0.00 O ATOM 14 ND2 ASN A 1 13.009 -5.707 4.151 1.00 0.00 N ATOM 15 H ASN A 1 8.029 -6.020 2.526 1.00 0.00 H ATOM 16 HA ASN A 1 9.657 -5.052 3.715 1.00 0.00 H ATOM 17 HB2 ASN A 1 10.197 -7.454 4.073 1.00 0.00 H ATOM 18 HB3 ASN A 1 11.428 -7.361 2.812 1.00 0.00 H ATOM 19 HD21 ASN A 1 13.160 -5.632 3.153 1.00 0.00 H ATOM 20 HD22 ASN A 1 13.695 -5.355 4.803 1.00 0.00 H ATOM 21 N LEU A 2 10.431 -3.505 1.808 1.00 0.00 N ATOM 22 CA LEU A 2 11.093 -2.481 1.012 1.00 0.00 C ATOM 23 C LEU A 2 10.596 -1.121 1.519 1.00 0.00 C ATOM 24 O LEU A 2 9.400 -0.997 1.775 1.00 0.00 O ATOM 25 CB LEU A 2 10.721 -2.699 -0.465 1.00 0.00 C ATOM 26 CG LEU A 2 11.538 -1.864 -1.462 1.00 0.00 C ATOM 27 CD1 LEU A 2 12.957 -2.422 -1.630 1.00 0.00 C ATOM 28 CD2 LEU A 2 10.843 -1.884 -2.828 1.00 0.00 C ATOM 29 H LEU A 2 9.537 -3.258 2.214 1.00 0.00 H ATOM 30 HA LEU A 2 12.168 -2.582 1.152 1.00 0.00 H ATOM 31 HB2 LEU A 2 10.843 -3.753 -0.722 1.00 0.00 H ATOM 32 HB3 LEU A 2 9.669 -2.445 -0.577 1.00 0.00 H ATOM 33 HG LEU A 2 11.583 -0.828 -1.128 1.00 0.00 H ATOM 34 HD11 LEU A 2 12.913 -3.438 -2.026 1.00 0.00 H ATOM 35 HD12 LEU A 2 13.516 -1.796 -2.326 1.00 0.00 H ATOM 36 HD13 LEU A 2 13.487 -2.442 -0.680 1.00 0.00 H ATOM 37 HD21 LEU A 2 10.770 -2.908 -3.196 1.00 0.00 H ATOM 38 HD22 LEU A 2 9.842 -1.464 -2.739 1.00 0.00 H ATOM 39 HD23 LEU A 2 11.413 -1.288 -3.541 1.00 0.00 H ATOM 40 N PRO A 3 11.461 -0.103 1.686 1.00 0.00 N ATOM 41 CA PRO A 3 11.065 1.203 2.199 1.00 0.00 C ATOM 42 C PRO A 3 10.350 2.023 1.116 1.00 0.00 C ATOM 43 O PRO A 3 10.870 3.026 0.630 1.00 0.00 O ATOM 44 CB PRO A 3 12.367 1.848 2.686 1.00 0.00 C ATOM 45 CG PRO A 3 13.406 1.271 1.728 1.00 0.00 C ATOM 46 CD PRO A 3 12.905 -0.157 1.511 1.00 0.00 C ATOM 47 HA PRO A 3 10.394 1.094 3.053 1.00 0.00 H ATOM 48 HB2 PRO A 3 12.347 2.938 2.682 1.00 0.00 H ATOM 49 HB3 PRO A 3 12.584 1.491 3.694 1.00 0.00 H ATOM 50 HG2 PRO A 3 13.375 1.818 0.784 1.00 0.00 H ATOM 51 HG3 PRO A 3 14.414 1.298 2.145 1.00 0.00 H ATOM 52 HD2 PRO A 3 13.191 -0.494 0.517 1.00 0.00 H ATOM 53 HD3 PRO A 3 13.336 -0.811 2.270 1.00 0.00 H ATOM 54 N ARG A 4 9.139 1.585 0.754 1.00 0.00 N ATOM 55 CA ARG A 4 8.230 2.245 -0.167 1.00 0.00 C ATOM 56 C ARG A 4 6.807 1.928 0.284 1.00 0.00 C ATOM 57 O ARG A 4 6.548 0.830 0.779 1.00 0.00 O ATOM 58 CB ARG A 4 8.453 1.754 -1.604 1.00 0.00 C ATOM 59 CG ARG A 4 9.835 2.147 -2.143 1.00 0.00 C ATOM 60 CD ARG A 4 9.972 1.790 -3.626 1.00 0.00 C ATOM 61 NE ARG A 4 9.051 2.575 -4.457 1.00 0.00 N ATOM 62 CZ ARG A 4 8.891 2.416 -5.780 1.00 0.00 C ATOM 63 NH1 ARG A 4 9.597 1.494 -6.452 1.00 0.00 N ATOM 64 NH2 ARG A 4 8.015 3.187 -6.438 1.00 0.00 N ATOM 65 H ARG A 4 8.791 0.740 1.190 1.00 0.00 H ATOM 66 HA ARG A 4 8.383 3.325 -0.124 1.00 0.00 H ATOM 67 HB2 ARG A 4 8.345 0.669 -1.641 1.00 0.00 H ATOM 68 HB3 ARG A 4 7.682 2.201 -2.232 1.00 0.00 H ATOM 69 HG2 ARG A 4 9.991 3.219 -2.017 1.00 0.00 H ATOM 70 HG3 ARG A 4 10.606 1.611 -1.588 1.00 0.00 H ATOM 71 HD2 ARG A 4 10.996 1.996 -3.941 1.00 0.00 H ATOM 72 HD3 ARG A 4 9.767 0.728 -3.758 1.00 0.00 H ATOM 73 HE ARG A 4 8.509 3.286 -3.987 1.00 0.00 H ATOM 74 HH11 ARG A 4 10.261 0.912 -5.962 1.00 0.00 H ATOM 75 HH12 ARG A 4 9.469 1.381 -7.447 1.00 0.00 H ATOM 76 HH21 ARG A 4 7.480 3.883 -5.940 1.00 0.00 H ATOM 77 HH22 ARG A 4 7.888 3.075 -7.433 1.00 0.00 H ATOM 78 N CYS A 5 5.892 2.892 0.121 1.00 0.00 N ATOM 79 CA CYS A 5 4.506 2.769 0.549 1.00 0.00 C ATOM 80 C CYS A 5 3.575 3.374 -0.498 1.00 0.00 C ATOM 81 O CYS A 5 4.013 4.131 -1.363 1.00 0.00 O ATOM 82 CB CYS A 5 4.303 3.444 1.916 1.00 0.00 C ATOM 83 SG CYS A 5 5.521 3.067 3.212 1.00 0.00 S ATOM 84 H CYS A 5 6.163 3.761 -0.317 1.00 0.00 H ATOM 85 HA CYS A 5 4.245 1.716 0.613 1.00 0.00 H ATOM 86 HB2 CYS A 5 4.342 4.524 1.763 1.00 0.00 H ATOM 87 HB3 CYS A 5 3.311 3.198 2.292 1.00 0.00 H ATOM 88 N THR A 6 2.287 3.027 -0.410 1.00 0.00 N ATOM 89 CA THR A 6 1.254 3.480 -1.330 1.00 0.00 C ATOM 90 C THR A 6 -0.077 3.601 -0.588 1.00 0.00 C ATOM 91 O THR A 6 -0.305 2.903 0.399 1.00 0.00 O ATOM 92 CB THR A 6 1.165 2.521 -2.530 1.00 0.00 C ATOM 93 OG1 THR A 6 0.232 3.005 -3.475 1.00 0.00 O ATOM 94 CG2 THR A 6 0.779 1.092 -2.128 1.00 0.00 C ATOM 95 H THR A 6 2.003 2.395 0.330 1.00 0.00 H ATOM 96 HA THR A 6 1.519 4.470 -1.704 1.00 0.00 H ATOM 97 HB THR A 6 2.141 2.489 -3.017 1.00 0.00 H ATOM 98 HG1 THR A 6 -0.652 2.930 -3.108 1.00 0.00 H ATOM 99 HG21 THR A 6 1.501 0.687 -1.419 1.00 0.00 H ATOM 100 HG22 THR A 6 -0.214 1.072 -1.679 1.00 0.00 H ATOM 101 HG23 THR A 6 0.773 0.459 -3.016 1.00 0.00 H ATOM 102 N GLU A 7 -0.953 4.489 -1.077 1.00 0.00 N ATOM 103 CA GLU A 7 -2.292 4.676 -0.545 1.00 0.00 C ATOM 104 C GLU A 7 -3.182 3.532 -1.031 1.00 0.00 C ATOM 105 O GLU A 7 -3.737 3.599 -2.126 1.00 0.00 O ATOM 106 CB GLU A 7 -2.826 6.053 -0.959 1.00 0.00 C ATOM 107 CG GLU A 7 -4.121 6.382 -0.208 1.00 0.00 C ATOM 108 CD GLU A 7 -4.542 7.826 -0.454 1.00 0.00 C ATOM 109 OE1 GLU A 7 -4.058 8.696 0.303 1.00 0.00 O ATOM 110 OE2 GLU A 7 -5.338 8.037 -1.395 1.00 0.00 O ATOM 111 H GLU A 7 -0.691 5.032 -1.887 1.00 0.00 H ATOM 112 HA GLU A 7 -2.246 4.670 0.542 1.00 0.00 H ATOM 113 HB2 GLU A 7 -2.081 6.806 -0.709 1.00 0.00 H ATOM 114 HB3 GLU A 7 -3.001 6.090 -2.036 1.00 0.00 H ATOM 115 HG2 GLU A 7 -4.918 5.712 -0.534 1.00 0.00 H ATOM 116 HG3 GLU A 7 -3.969 6.243 0.863 1.00 0.00 H ATOM 117 N GLY A 8 -3.305 2.476 -0.219 1.00 0.00 N ATOM 118 CA GLY A 8 -4.099 1.304 -0.552 1.00 0.00 C ATOM 119 C GLY A 8 -5.592 1.543 -0.301 1.00 0.00 C ATOM 120 O GLY A 8 -5.971 2.599 0.206 1.00 0.00 O ATOM 121 H GLY A 8 -2.844 2.485 0.681 1.00 0.00 H ATOM 122 HA2 GLY A 8 -3.924 1.052 -1.598 1.00 0.00 H ATOM 123 HA3 GLY A 8 -3.767 0.473 0.069 1.00 0.00 H ATOM 124 N PRO A 9 -6.450 0.565 -0.645 1.00 0.00 N ATOM 125 CA PRO A 9 -7.890 0.631 -0.429 1.00 0.00 C ATOM 126 C PRO A 9 -8.243 0.910 1.034 1.00 0.00 C ATOM 127 O PRO A 9 -9.120 1.725 1.313 1.00 0.00 O ATOM 128 CB PRO A 9 -8.447 -0.722 -0.886 1.00 0.00 C ATOM 129 CG PRO A 9 -7.400 -1.224 -1.877 1.00 0.00 C ATOM 130 CD PRO A 9 -6.094 -0.685 -1.296 1.00 0.00 C ATOM 131 HA PRO A 9 -8.298 1.417 -1.066 1.00 0.00 H ATOM 132 HB2 PRO A 9 -8.496 -1.418 -0.049 1.00 0.00 H ATOM 133 HB3 PRO A 9 -9.432 -0.627 -1.343 1.00 0.00 H ATOM 134 HG2 PRO A 9 -7.398 -2.311 -1.965 1.00 0.00 H ATOM 135 HG3 PRO A 9 -7.579 -0.766 -2.851 1.00 0.00 H ATOM 136 HD2 PRO A 9 -5.703 -1.380 -0.551 1.00 0.00 H ATOM 137 HD3 PRO A 9 -5.371 -0.553 -2.101 1.00 0.00 H ATOM 138 N TRP A 10 -7.548 0.236 1.958 1.00 0.00 N ATOM 139 CA TRP A 10 -7.774 0.330 3.394 1.00 0.00 C ATOM 140 C TRP A 10 -6.744 1.277 4.014 1.00 0.00 C ATOM 141 O TRP A 10 -6.127 0.957 5.029 1.00 0.00 O ATOM 142 CB TRP A 10 -7.694 -1.080 3.992 1.00 0.00 C ATOM 143 CG TRP A 10 -8.556 -2.097 3.312 1.00 0.00 C ATOM 144 CD1 TRP A 10 -9.877 -2.294 3.517 1.00 0.00 C ATOM 145 CD2 TRP A 10 -8.174 -3.030 2.264 1.00 0.00 C ATOM 146 NE1 TRP A 10 -10.339 -3.286 2.676 1.00 0.00 N ATOM 147 CE2 TRP A 10 -9.327 -3.767 1.868 1.00 0.00 C ATOM 148 CE3 TRP A 10 -6.965 -3.312 1.597 1.00 0.00 C ATOM 149 CZ2 TRP A 10 -9.281 -4.737 0.855 1.00 0.00 C ATOM 150 CZ3 TRP A 10 -6.908 -4.278 0.574 1.00 0.00 C ATOM 151 CH2 TRP A 10 -8.063 -4.989 0.203 1.00 0.00 C ATOM 152 H TRP A 10 -6.833 -0.406 1.648 1.00 0.00 H ATOM 153 HA TRP A 10 -8.772 0.723 3.597 1.00 0.00 H ATOM 154 HB2 TRP A 10 -6.662 -1.427 3.924 1.00 0.00 H ATOM 155 HB3 TRP A 10 -7.961 -1.049 5.045 1.00 0.00 H ATOM 156 HD1 TRP A 10 -10.484 -1.747 4.224 1.00 0.00 H ATOM 157 HE1 TRP A 10 -11.290 -3.621 2.630 1.00 0.00 H ATOM 158 HE3 TRP A 10 -6.079 -2.768 1.888 1.00 0.00 H ATOM 159 HZ2 TRP A 10 -10.172 -5.280 0.578 1.00 0.00 H ATOM 160 HZ3 TRP A 10 -5.971 -4.473 0.073 1.00 0.00 H ATOM 161 HH2 TRP A 10 -8.013 -5.729 -0.582 1.00 0.00 H ATOM 162 N GLY A 11 -6.556 2.446 3.390 1.00 0.00 N ATOM 163 CA GLY A 11 -5.584 3.436 3.822 1.00 0.00 C ATOM 164 C GLY A 11 -4.176 3.067 3.356 1.00 0.00 C ATOM 165 O GLY A 11 -3.987 2.125 2.587 1.00 0.00 O ATOM 166 H GLY A 11 -7.087 2.644 2.553 1.00 0.00 H ATOM 167 HA2 GLY A 11 -5.854 4.399 3.387 1.00 0.00 H ATOM 168 HA3 GLY A 11 -5.600 3.528 4.909 1.00 0.00 H ATOM 169 N TRP A 12 -3.181 3.824 3.831 1.00 0.00 N ATOM 170 CA TRP A 12 -1.789 3.624 3.461 1.00 0.00 C ATOM 171 C TRP A 12 -1.260 2.277 3.947 1.00 0.00 C ATOM 172 O TRP A 12 -1.557 1.846 5.060 1.00 0.00 O ATOM 173 CB TRP A 12 -0.932 4.788 3.964 1.00 0.00 C ATOM 174 CG TRP A 12 -1.025 6.020 3.123 1.00 0.00 C ATOM 175 CD1 TRP A 12 -2.004 6.947 3.185 1.00 0.00 C ATOM 176 CD2 TRP A 12 -0.135 6.450 2.050 1.00 0.00 C ATOM 177 NE1 TRP A 12 -1.784 7.924 2.238 1.00 0.00 N ATOM 178 CE2 TRP A 12 -0.639 7.668 1.510 1.00 0.00 C ATOM 179 CE3 TRP A 12 1.046 5.931 1.476 1.00 0.00 C ATOM 180 CZ2 TRP A 12 -0.005 8.339 0.454 1.00 0.00 C ATOM 181 CZ3 TRP A 12 1.694 6.599 0.420 1.00 0.00 C ATOM 182 CH2 TRP A 12 1.168 7.797 -0.095 1.00 0.00 C ATOM 183 H TRP A 12 -3.397 4.573 4.471 1.00 0.00 H ATOM 184 HA TRP A 12 -1.730 3.623 2.377 1.00 0.00 H ATOM 185 HB2 TRP A 12 -1.205 5.032 4.992 1.00 0.00 H ATOM 186 HB3 TRP A 12 0.113 4.478 3.960 1.00 0.00 H ATOM 187 HD1 TRP A 12 -2.842 6.923 3.866 1.00 0.00 H ATOM 188 HE1 TRP A 12 -2.379 8.723 2.074 1.00 0.00 H ATOM 189 HE3 TRP A 12 1.454 5.005 1.852 1.00 0.00 H ATOM 190 HZ2 TRP A 12 -0.417 9.258 0.064 1.00 0.00 H ATOM 191 HZ3 TRP A 12 2.603 6.191 0.003 1.00 0.00 H ATOM 192 HH2 TRP A 12 1.668 8.301 -0.910 1.00 0.00 H ATOM 193 N VAL A 13 -0.473 1.628 3.082 1.00 0.00 N ATOM 194 CA VAL A 13 0.156 0.341 3.320 1.00 0.00 C ATOM 195 C VAL A 13 1.577 0.397 2.757 1.00 0.00 C ATOM 196 O VAL A 13 1.804 0.996 1.706 1.00 0.00 O ATOM 197 CB VAL A 13 -0.698 -0.783 2.704 1.00 0.00 C ATOM 198 CG1 VAL A 13 -0.892 -0.632 1.188 1.00 0.00 C ATOM 199 CG2 VAL A 13 -0.102 -2.162 3.011 1.00 0.00 C ATOM 200 H VAL A 13 -0.282 2.061 2.186 1.00 0.00 H ATOM 201 HA VAL A 13 0.222 0.171 4.396 1.00 0.00 H ATOM 202 HB VAL A 13 -1.684 -0.741 3.170 1.00 0.00 H ATOM 203 HG11 VAL A 13 -1.341 0.333 0.954 1.00 0.00 H ATOM 204 HG12 VAL A 13 0.061 -0.720 0.667 1.00 0.00 H ATOM 205 HG13 VAL A 13 -1.558 -1.417 0.829 1.00 0.00 H ATOM 206 HG21 VAL A 13 0.044 -2.271 4.086 1.00 0.00 H ATOM 207 HG22 VAL A 13 -0.786 -2.939 2.670 1.00 0.00 H ATOM 208 HG23 VAL A 13 0.855 -2.289 2.504 1.00 0.00 H ATOM 209 N CYS A 14 2.527 -0.214 3.475 1.00 0.00 N ATOM 210 CA CYS A 14 3.940 -0.225 3.129 1.00 0.00 C ATOM 211 C CYS A 14 4.375 -1.631 2.730 1.00 0.00 C ATOM 212 O CYS A 14 3.873 -2.618 3.265 1.00 0.00 O ATOM 213 CB CYS A 14 4.767 0.307 4.300 1.00 0.00 C ATOM 214 SG CYS A 14 4.495 2.059 4.679 1.00 0.00 S ATOM 215 H CYS A 14 2.258 -0.704 4.316 1.00 0.00 H ATOM 216 HA CYS A 14 4.125 0.430 2.286 1.00 0.00 H ATOM 217 HB2 CYS A 14 4.537 -0.279 5.189 1.00 0.00 H ATOM 218 HB3 CYS A 14 5.826 0.180 4.072 1.00 0.00 H ATOM 219 N MET A 15 5.310 -1.708 1.776 1.00 0.00 N ATOM 220 CA MET A 15 5.806 -2.962 1.231 1.00 0.00 C ATOM 221 C MET A 15 6.686 -3.682 2.257 1.00 0.00 C ATOM 222 O MET A 15 7.652 -3.051 2.738 1.00 0.00 O ATOM 223 CB MET A 15 6.552 -2.677 -0.080 1.00 0.00 C ATOM 224 CG MET A 15 7.073 -3.964 -0.727 1.00 0.00 C ATOM 225 SD MET A 15 7.734 -3.747 -2.399 1.00 0.00 S ATOM 226 CE MET A 15 8.419 -5.402 -2.663 1.00 0.00 C ATOM 227 OXT MET A 15 6.380 -4.860 2.541 1.00 0.00 O ATOM 228 H MET A 15 5.683 -0.848 1.393 1.00 0.00 H ATOM 229 HA MET A 15 4.950 -3.596 0.995 1.00 0.00 H ATOM 230 HB2 MET A 15 5.861 -2.194 -0.773 1.00 0.00 H ATOM 231 HB3 MET A 15 7.387 -2.001 0.105 1.00 0.00 H ATOM 232 HG2 MET A 15 7.865 -4.377 -0.104 1.00 0.00 H ATOM 233 HG3 MET A 15 6.257 -4.684 -0.786 1.00 0.00 H ATOM 234 HE1 MET A 15 8.861 -5.453 -3.658 1.00 0.00 H ATOM 235 HE2 MET A 15 9.188 -5.604 -1.917 1.00 0.00 H ATOM 236 HE3 MET A 15 7.626 -6.144 -2.580 1.00 0.00 H TER 237 MET A 15