ATOM 1 N GLY A 1 -8.946 -1.871 -2.666 1.00 1.00 N ATOM 2 CA GLY A 1 -8.060 -0.704 -2.386 1.00 1.00 C ATOM 3 C GLY A 1 -6.923 -1.135 -1.466 1.00 1.00 C ATOM 4 O GLY A 1 -7.119 -1.327 -0.266 1.00 1.00 O ATOM 5 H1 GLY A 1 -8.373 -2.732 -2.759 1.00 1.00 H ATOM 6 H2 GLY A 1 -9.466 -1.707 -3.553 1.00 1.00 H ATOM 7 H3 GLY A 1 -9.624 -1.987 -1.888 1.00 1.00 H ATOM 8 HA2 GLY A 1 -7.652 -0.333 -3.315 1.00 1.00 H ATOM 9 HA3 GLY A 1 -8.625 0.076 -1.906 1.00 1.00 H HETATM 10 N ABA A 2 -5.737 -1.292 -2.039 1.00 1.00 N HETATM 11 CA ABA A 2 -4.563 -1.715 -1.274 1.00 1.00 C HETATM 12 C ABA A 2 -4.005 -0.579 -0.421 1.00 1.00 C HETATM 13 O ABA A 2 -3.112 -0.790 0.398 1.00 1.00 O HETATM 14 CB ABA A 2 -3.474 -2.217 -2.232 1.00 1.00 C HETATM 15 CG ABA A 2 -3.124 -3.592 -1.909 1.00 1.00 C HETATM 16 H ABA A 2 -5.652 -1.126 -3.001 1.00 1.00 H HETATM 17 HA ABA A 2 -4.849 -2.521 -0.618 1.00 1.00 H HETATM 18 HB3 ABA A 2 -2.598 -1.590 -2.144 1.00 1.00 H HETATM 19 HB2 ABA A 2 -3.839 -2.181 -3.244 1.00 1.00 H HETATM 20 HG1 ABA A 2 -3.860 -4.250 -1.471 1.00 1.00 H ATOM 21 N CYS A 3 -4.532 0.622 -0.613 1.00 1.00 N ATOM 22 CA CYS A 3 -4.066 1.786 0.150 1.00 1.00 C ATOM 23 C CYS A 3 -3.826 1.430 1.615 1.00 1.00 C ATOM 24 O CYS A 3 -2.936 1.983 2.258 1.00 1.00 O ATOM 25 CB CYS A 3 -5.105 2.906 0.078 1.00 1.00 C ATOM 26 SG CYS A 3 -4.392 4.336 -0.772 1.00 1.00 S ATOM 27 H CYS A 3 -5.240 0.735 -1.284 1.00 1.00 H ATOM 28 HA CYS A 3 -3.142 2.140 -0.279 1.00 1.00 H ATOM 29 HB2 CYS A 3 -5.971 2.557 -0.463 1.00 1.00 H ATOM 30 HB3 CYS A 3 -5.399 3.193 1.077 1.00 1.00 H ATOM 31 N SER A 4 -4.634 0.514 2.136 1.00 1.00 N ATOM 32 CA SER A 4 -4.510 0.098 3.536 1.00 1.00 C ATOM 33 C SER A 4 -4.173 -1.396 3.677 1.00 1.00 C ATOM 34 O SER A 4 -4.275 -1.949 4.775 1.00 1.00 O ATOM 35 CB SER A 4 -5.818 0.391 4.273 1.00 1.00 C ATOM 36 OG SER A 4 -5.664 0.081 5.654 1.00 1.00 O ATOM 37 H SER A 4 -5.331 0.117 1.573 1.00 1.00 H ATOM 38 HA SER A 4 -3.723 0.672 4.003 1.00 1.00 H ATOM 39 HB2 SER A 4 -6.066 1.434 4.168 1.00 1.00 H ATOM 40 HB3 SER A 4 -6.613 -0.209 3.844 1.00 1.00 H ATOM 41 HG SER A 4 -5.071 -0.683 5.726 1.00 1.00 H ATOM 42 N ASP A 5 -3.769 -2.044 2.582 1.00 1.00 N ATOM 43 CA ASP A 5 -3.425 -3.470 2.634 1.00 1.00 C ATOM 44 C ASP A 5 -1.909 -3.662 2.796 1.00 1.00 C ATOM 45 O ASP A 5 -1.132 -3.408 1.868 1.00 1.00 O ATOM 46 CB ASP A 5 -3.911 -4.166 1.354 1.00 1.00 C ATOM 47 CG ASP A 5 -4.205 -5.640 1.611 1.00 1.00 C ATOM 48 OD1 ASP A 5 -4.114 -6.062 2.749 1.00 1.00 O ATOM 49 OD2 ASP A 5 -4.520 -6.330 0.661 1.00 1.00 O ATOM 50 H ASP A 5 -3.695 -1.563 1.730 1.00 1.00 H ATOM 51 HA ASP A 5 -3.925 -3.914 3.480 1.00 1.00 H ATOM 52 HB2 ASP A 5 -4.810 -3.687 1.012 1.00 1.00 H ATOM 53 HB3 ASP A 5 -3.151 -4.084 0.593 1.00 1.00 H ATOM 54 N PRO A 6 -1.477 -4.099 3.957 1.00 1.00 N ATOM 55 CA PRO A 6 -0.025 -4.315 4.253 1.00 1.00 C ATOM 56 C PRO A 6 0.549 -5.520 3.511 1.00 1.00 C ATOM 57 O PRO A 6 1.757 -5.772 3.545 1.00 1.00 O ATOM 58 CB PRO A 6 0.002 -4.527 5.769 1.00 1.00 C ATOM 59 CG PRO A 6 -1.348 -5.057 6.115 1.00 1.00 C ATOM 60 CD PRO A 6 -2.325 -4.449 5.110 1.00 1.00 C ATOM 61 HA PRO A 6 0.539 -3.429 4.006 1.00 1.00 H ATOM 62 HB2 PRO A 6 0.770 -5.243 6.034 1.00 1.00 H ATOM 63 HB3 PRO A 6 0.172 -3.589 6.275 1.00 1.00 H ATOM 64 HG2 PRO A 6 -1.353 -6.136 6.034 1.00 1.00 H ATOM 65 HG3 PRO A 6 -1.622 -4.758 7.114 1.00 1.00 H ATOM 66 HD2 PRO A 6 -3.076 -5.176 4.829 1.00 1.00 H ATOM 67 HD3 PRO A 6 -2.785 -3.566 5.517 1.00 1.00 H ATOM 68 N ARG A 7 -0.322 -6.264 2.843 1.00 1.00 N ATOM 69 CA ARG A 7 0.107 -7.442 2.092 1.00 1.00 C ATOM 70 C ARG A 7 0.265 -7.112 0.608 1.00 1.00 C ATOM 71 O ARG A 7 0.784 -7.921 -0.165 1.00 1.00 O ATOM 72 CB ARG A 7 -0.919 -8.565 2.258 1.00 1.00 C ATOM 73 CG ARG A 7 -2.261 -8.131 1.667 1.00 1.00 C ATOM 74 CD ARG A 7 -2.604 -8.997 0.459 1.00 1.00 C ATOM 75 NE ARG A 7 -1.548 -8.898 -0.554 1.00 1.00 N ATOM 76 CZ ARG A 7 -1.806 -8.942 -1.845 1.00 1.00 C ATOM 77 NH1 ARG A 7 -3.010 -9.089 -2.269 1.00 1.00 N ATOM 78 NH2 ARG A 7 -0.841 -8.846 -2.685 1.00 1.00 N ATOM 79 H ARG A 7 -1.273 -6.017 2.854 1.00 1.00 H ATOM 80 HA ARG A 7 1.059 -7.780 2.477 1.00 1.00 H ATOM 81 HB2 ARG A 7 -0.567 -9.445 1.747 1.00 1.00 H ATOM 82 HB3 ARG A 7 -1.049 -8.787 3.304 1.00 1.00 H ATOM 83 HG2 ARG A 7 -3.034 -8.242 2.416 1.00 1.00 H ATOM 84 HG3 ARG A 7 -2.206 -7.098 1.360 1.00 1.00 H ATOM 85 HD2 ARG A 7 -2.710 -10.026 0.773 1.00 1.00 H ATOM 86 HD3 ARG A 7 -3.539 -8.656 0.046 1.00 1.00 H ATOM 87 HE ARG A 7 -0.615 -8.793 -0.265 1.00 1.00 H ATOM 88 HH11 ARG A 7 -3.761 -9.172 -1.619 1.00 1.00 H ATOM 89 HH12 ARG A 7 -3.192 -9.127 -3.251 1.00 1.00 H ATOM 90 HH21 ARG A 7 0.096 -8.745 -2.357 1.00 1.00 H ATOM 91 HH22 ARG A 7 -1.030 -8.866 -3.666 1.00 1.00 H HETATM 92 N ABA A 8 -0.205 -5.935 0.210 1.00 1.00 N HETATM 93 CA ABA A 8 -0.125 -5.521 -1.188 1.00 1.00 C HETATM 94 C ABA A 8 0.643 -4.202 -1.330 1.00 1.00 C HETATM 95 O ABA A 8 1.316 -3.974 -2.339 1.00 1.00 O HETATM 96 CB ABA A 8 -1.548 -5.402 -1.757 1.00 1.00 C HETATM 97 CG ABA A 8 -1.871 -4.020 -2.078 1.00 1.00 C HETATM 98 H ABA A 8 -0.626 -5.339 0.863 1.00 1.00 H HETATM 99 HA ABA A 8 0.404 -6.281 -1.744 1.00 1.00 H HETATM 100 HB3 ABA A 8 -2.258 -5.775 -1.032 1.00 1.00 H HETATM 101 HB2 ABA A 8 -1.619 -5.990 -2.652 1.00 1.00 H HETATM 102 HG1 ABA A 8 -1.169 -3.422 -2.639 1.00 1.00 H ATOM 103 N ASN A 9 0.543 -3.346 -0.318 1.00 1.00 N ATOM 104 CA ASN A 9 1.238 -2.056 -0.334 1.00 1.00 C ATOM 105 C ASN A 9 2.697 -2.231 -0.774 1.00 1.00 C ATOM 106 O ASN A 9 3.333 -3.242 -0.465 1.00 1.00 O ATOM 107 CB ASN A 9 1.191 -1.429 1.062 1.00 1.00 C ATOM 108 CG ASN A 9 2.136 -2.169 2.000 1.00 1.00 C ATOM 109 OD1 ASN A 9 1.984 -3.365 2.219 1.00 1.00 O ATOM 110 ND2 ASN A 9 3.118 -1.534 2.559 1.00 1.00 N ATOM 111 H ASN A 9 -0.007 -3.587 0.459 1.00 1.00 H ATOM 112 HA ASN A 9 0.739 -1.398 -1.031 1.00 1.00 H ATOM 113 HB2 ASN A 9 1.485 -0.392 1.001 1.00 1.00 H ATOM 114 HB3 ASN A 9 0.185 -1.493 1.448 1.00 1.00 H ATOM 115 HD21 ASN A 9 3.251 -0.582 2.378 1.00 1.00 H ATOM 116 HD22 ASN A 9 3.725 -2.010 3.160 1.00 1.00 H ATOM 117 N TYR A 10 3.217 -1.251 -1.502 1.00 1.00 N ATOM 118 CA TYR A 10 4.588 -1.316 -1.986 1.00 1.00 C ATOM 119 C TYR A 10 5.565 -0.714 -0.975 1.00 1.00 C ATOM 120 O TYR A 10 5.196 -0.377 0.148 1.00 1.00 O ATOM 121 CB TYR A 10 4.710 -0.577 -3.325 1.00 1.00 C ATOM 122 CG TYR A 10 3.347 -0.189 -3.843 1.00 1.00 C ATOM 123 CD1 TYR A 10 2.402 -1.178 -4.135 1.00 1.00 C ATOM 124 CD2 TYR A 10 3.034 1.158 -4.040 1.00 1.00 C ATOM 125 CE1 TYR A 10 1.140 -0.817 -4.624 1.00 1.00 C ATOM 126 CE2 TYR A 10 1.773 1.518 -4.533 1.00 1.00 C ATOM 127 CZ TYR A 10 0.827 0.529 -4.824 1.00 1.00 C ATOM 128 OH TYR A 10 -0.409 0.882 -5.314 1.00 1.00 O ATOM 129 H TYR A 10 2.671 -0.477 -1.730 1.00 1.00 H ATOM 130 HA TYR A 10 4.848 -2.350 -2.141 1.00 1.00 H ATOM 131 HB2 TYR A 10 5.305 0.313 -3.191 1.00 1.00 H ATOM 132 HB3 TYR A 10 5.190 -1.221 -4.042 1.00 1.00 H ATOM 133 HD1 TYR A 10 2.646 -2.218 -3.980 1.00 1.00 H ATOM 134 HD2 TYR A 10 3.767 1.919 -3.815 1.00 1.00 H ATOM 135 HE1 TYR A 10 0.409 -1.579 -4.849 1.00 1.00 H ATOM 136 HE2 TYR A 10 1.529 2.558 -4.686 1.00 1.00 H ATOM 137 HH TYR A 10 -0.343 0.918 -6.275 1.00 1.00 H ATOM 138 N ASP A 11 6.814 -0.590 -1.399 1.00 1.00 N ATOM 139 CA ASP A 11 7.869 -0.038 -0.546 1.00 1.00 C ATOM 140 C ASP A 11 7.686 1.465 -0.326 1.00 1.00 C ATOM 141 O ASP A 11 8.407 2.085 0.456 1.00 1.00 O ATOM 142 CB ASP A 11 9.227 -0.302 -1.203 1.00 1.00 C ATOM 143 CG ASP A 11 10.058 -1.239 -0.346 1.00 1.00 C ATOM 144 OD1 ASP A 11 10.282 -0.917 0.804 1.00 1.00 O ATOM 145 OD2 ASP A 11 10.462 -2.266 -0.852 1.00 1.00 O ATOM 146 H ASP A 11 7.036 -0.879 -2.307 1.00 1.00 H ATOM 147 HA ASP A 11 7.840 -0.531 0.410 1.00 1.00 H ATOM 148 HB2 ASP A 11 9.074 -0.751 -2.174 1.00 1.00 H ATOM 149 HB3 ASP A 11 9.753 0.633 -1.324 1.00 1.00 H ATOM 150 N HIS A 12 6.726 2.040 -1.026 1.00 1.00 N ATOM 151 CA HIS A 12 6.459 3.474 -0.917 1.00 1.00 C ATOM 152 C HIS A 12 5.081 3.814 -1.498 1.00 1.00 C ATOM 153 O HIS A 12 4.970 4.368 -2.592 1.00 1.00 O ATOM 154 CB HIS A 12 7.556 4.256 -1.653 1.00 1.00 C ATOM 155 CG HIS A 12 7.724 3.721 -3.045 1.00 1.00 C ATOM 156 ND1 HIS A 12 8.745 4.140 -3.881 1.00 1.00 N ATOM 157 CD2 HIS A 12 7.002 2.811 -3.766 1.00 1.00 C ATOM 158 CE1 HIS A 12 8.606 3.491 -5.050 1.00 1.00 C ATOM 159 NE2 HIS A 12 7.557 2.667 -5.033 1.00 1.00 N ATOM 160 H HIS A 12 6.188 1.492 -1.630 1.00 1.00 H ATOM 161 HA HIS A 12 6.473 3.754 0.126 1.00 1.00 H ATOM 162 HB2 HIS A 12 7.285 5.301 -1.701 1.00 1.00 H ATOM 163 HB3 HIS A 12 8.486 4.151 -1.119 1.00 1.00 H ATOM 164 HD2 HIS A 12 6.135 2.289 -3.402 1.00 1.00 H ATOM 165 HE1 HIS A 12 9.261 3.624 -5.899 1.00 1.00 H ATOM 166 HE2 HIS A 12 7.236 2.095 -5.762 1.00 1.00 H ATOM 167 N PRO A 13 4.036 3.482 -0.791 1.00 1.00 N ATOM 168 CA PRO A 13 2.637 3.744 -1.247 1.00 1.00 C ATOM 169 C PRO A 13 2.219 5.208 -1.067 1.00 1.00 C ATOM 170 O PRO A 13 1.029 5.519 -1.004 1.00 1.00 O ATOM 171 CB PRO A 13 1.804 2.815 -0.360 1.00 1.00 C ATOM 172 CG PRO A 13 2.592 2.662 0.901 1.00 1.00 C ATOM 173 CD PRO A 13 4.069 2.821 0.527 1.00 1.00 C ATOM 174 HA PRO A 13 2.523 3.452 -2.279 1.00 1.00 H ATOM 175 HB2 PRO A 13 0.841 3.261 -0.151 1.00 1.00 H ATOM 176 HB3 PRO A 13 1.678 1.855 -0.836 1.00 1.00 H ATOM 177 HG2 PRO A 13 2.301 3.424 1.612 1.00 1.00 H ATOM 178 HG3 PRO A 13 2.429 1.682 1.321 1.00 1.00 H ATOM 179 HD2 PRO A 13 4.577 3.441 1.254 1.00 1.00 H ATOM 180 HD3 PRO A 13 4.545 1.857 0.448 1.00 1.00 H ATOM 181 N GLU A 14 3.202 6.102 -0.986 1.00 1.00 N ATOM 182 CA GLU A 14 2.922 7.530 -0.816 1.00 1.00 C ATOM 183 C GLU A 14 2.125 7.779 0.470 1.00 1.00 C ATOM 184 O GLU A 14 1.474 8.818 0.625 1.00 1.00 O ATOM 185 CB GLU A 14 2.136 8.041 -2.030 1.00 1.00 C ATOM 186 CG GLU A 14 3.105 8.418 -3.158 1.00 1.00 C ATOM 187 CD GLU A 14 2.360 8.611 -4.477 1.00 1.00 C ATOM 188 OE1 GLU A 14 1.242 8.134 -4.593 1.00 1.00 O ATOM 189 OE2 GLU A 14 2.922 9.231 -5.359 1.00 1.00 O ATOM 190 H GLU A 14 4.131 5.797 -1.044 1.00 1.00 H ATOM 191 HA GLU A 14 3.856 8.069 -0.754 1.00 1.00 H ATOM 192 HB2 GLU A 14 1.473 7.263 -2.375 1.00 1.00 H ATOM 193 HB3 GLU A 14 1.557 8.910 -1.749 1.00 1.00 H ATOM 194 HG2 GLU A 14 3.607 9.338 -2.899 1.00 1.00 H ATOM 195 HG3 GLU A 14 3.838 7.634 -3.277 1.00 1.00 H ATOM 196 N ILE A 15 2.185 6.813 1.387 1.00 1.00 N ATOM 197 CA ILE A 15 1.475 6.905 2.661 1.00 1.00 C ATOM 198 C ILE A 15 -0.001 7.231 2.438 1.00 1.00 C ATOM 199 O ILE A 15 -0.413 8.393 2.418 1.00 1.00 O ATOM 200 CB ILE A 15 2.129 7.964 3.550 1.00 1.00 C ATOM 201 CG1 ILE A 15 3.536 7.505 3.955 1.00 1.00 C ATOM 202 CG2 ILE A 15 1.283 8.180 4.806 1.00 1.00 C ATOM 203 CD1 ILE A 15 3.447 6.260 4.841 1.00 1.00 C ATOM 204 H ILE A 15 2.722 6.020 1.203 1.00 1.00 H ATOM 205 HA ILE A 15 1.534 5.949 3.161 1.00 1.00 H ATOM 206 HB ILE A 15 2.196 8.885 3.000 1.00 1.00 H ATOM 207 HG12 ILE A 15 4.108 7.274 3.069 1.00 1.00 H ATOM 208 HG13 ILE A 15 4.026 8.297 4.502 1.00 1.00 H ATOM 209 HG21 ILE A 15 0.453 8.830 4.575 1.00 1.00 H ATOM 210 HG22 ILE A 15 1.891 8.631 5.576 1.00 1.00 H ATOM 211 HG23 ILE A 15 0.909 7.228 5.155 1.00 1.00 H ATOM 212 HD11 ILE A 15 2.535 6.288 5.417 1.00 1.00 H ATOM 213 HD12 ILE A 15 4.293 6.234 5.511 1.00 1.00 H ATOM 214 HD13 ILE A 15 3.453 5.377 4.220 1.00 1.00 H ATOM 215 N CYS A 16 -0.787 6.182 2.268 1.00 1.00 N ATOM 216 CA CYS A 16 -2.224 6.323 2.042 1.00 1.00 C ATOM 217 C CYS A 16 -2.917 6.942 3.254 1.00 1.00 C ATOM 218 O CYS A 16 -2.427 6.841 4.376 1.00 1.00 O ATOM 219 CB CYS A 16 -2.826 4.953 1.757 1.00 1.00 C ATOM 220 SG CYS A 16 -2.542 4.513 0.022 1.00 1.00 S ATOM 221 H CYS A 16 -0.389 5.288 2.296 1.00 1.00 H ATOM 222 HA CYS A 16 -2.384 6.953 1.185 1.00 1.00 H ATOM 223 HB2 CYS A 16 -2.349 4.226 2.394 1.00 1.00 H ATOM 224 HB3 CYS A 16 -3.887 4.971 1.958 1.00 1.00 H HETATM 225 N NH2 A 17 -4.035 7.578 3.099 1.00 1.00 N HETATM 226 HN1 NH2 A 17 -4.482 7.972 3.874 1.00 1.00 H HETATM 227 HN2 NH2 A 17 -4.431 7.663 2.209 1.00 1.00 H TER 228 NH2 A 17