ATOM 1 N GLY A 1 -5.413 3.426 -2.141 1.00 1.00 N ATOM 2 CA GLY A 1 -5.369 1.966 -2.455 1.00 1.00 C ATOM 3 C GLY A 1 -4.565 1.234 -1.386 1.00 1.00 C ATOM 4 O GLY A 1 -3.863 1.858 -0.591 1.00 1.00 O ATOM 5 H1 GLY A 1 -5.224 3.575 -1.129 1.00 1.00 H ATOM 6 H2 GLY A 1 -6.353 3.805 -2.376 1.00 1.00 H ATOM 7 H3 GLY A 1 -4.694 3.925 -2.699 1.00 1.00 H ATOM 8 HA2 GLY A 1 -6.375 1.572 -2.480 1.00 1.00 H ATOM 9 HA3 GLY A 1 -4.903 1.815 -3.414 1.00 1.00 H HETATM 10 N ABA A 2 -4.672 -0.092 -1.387 1.00 1.00 N HETATM 11 CA ABA A 2 -3.956 -0.940 -0.434 1.00 1.00 C HETATM 12 C ABA A 2 -3.857 -0.317 0.970 1.00 1.00 C HETATM 13 O ABA A 2 -2.847 -0.468 1.656 1.00 1.00 O HETATM 14 CB ABA A 2 -2.560 -1.245 -0.979 1.00 1.00 C HETATM 15 CG ABA A 2 -2.366 -2.685 -0.996 1.00 1.00 C HETATM 16 H ABA A 2 -5.237 -0.519 -2.060 1.00 1.00 H HETATM 17 HA ABA A 2 -4.491 -1.873 -0.347 1.00 1.00 H HETATM 18 HB3 ABA A 2 -1.819 -0.783 -0.353 1.00 1.00 H HETATM 19 HB2 ABA A 2 -2.473 -0.863 -1.986 1.00 1.00 H HETATM 20 HG1 ABA A 2 -2.625 -3.268 -0.126 1.00 1.00 H ATOM 21 N CYS A 3 -4.915 0.361 1.401 1.00 1.00 N ATOM 22 CA CYS A 3 -4.926 0.976 2.733 1.00 1.00 C ATOM 23 C CYS A 3 -5.143 -0.088 3.806 1.00 1.00 C ATOM 24 O CYS A 3 -4.537 -0.044 4.878 1.00 1.00 O ATOM 25 CB CYS A 3 -6.036 2.030 2.824 1.00 1.00 C ATOM 26 SG CYS A 3 -5.299 3.661 3.106 1.00 1.00 S ATOM 27 H CYS A 3 -5.702 0.441 0.823 1.00 1.00 H ATOM 28 HA CYS A 3 -3.975 1.454 2.907 1.00 1.00 H ATOM 29 HB2 CYS A 3 -6.596 2.042 1.900 1.00 1.00 H ATOM 30 HB3 CYS A 3 -6.701 1.789 3.641 1.00 1.00 H ATOM 31 N SER A 4 -6.015 -1.046 3.504 1.00 1.00 N ATOM 32 CA SER A 4 -6.319 -2.129 4.445 1.00 1.00 C ATOM 33 C SER A 4 -5.648 -3.440 4.032 1.00 1.00 C ATOM 34 O SER A 4 -6.105 -4.521 4.404 1.00 1.00 O ATOM 35 CB SER A 4 -7.831 -2.333 4.531 1.00 1.00 C ATOM 36 OG SER A 4 -8.448 -1.078 4.809 1.00 1.00 O ATOM 37 H SER A 4 -6.466 -1.023 2.635 1.00 1.00 H ATOM 38 HA SER A 4 -5.957 -1.851 5.423 1.00 1.00 H ATOM 39 HB2 SER A 4 -8.200 -2.715 3.593 1.00 1.00 H ATOM 40 HB3 SER A 4 -8.054 -3.041 5.319 1.00 1.00 H ATOM 41 HG SER A 4 -9.352 -1.099 4.461 1.00 1.00 H ATOM 42 N ASP A 5 -4.560 -3.342 3.270 1.00 1.00 N ATOM 43 CA ASP A 5 -3.831 -4.532 2.823 1.00 1.00 C ATOM 44 C ASP A 5 -2.321 -4.267 2.800 1.00 1.00 C ATOM 45 O ASP A 5 -1.739 -3.961 1.757 1.00 1.00 O ATOM 46 CB ASP A 5 -4.315 -4.951 1.427 1.00 1.00 C ATOM 47 CG ASP A 5 -3.885 -6.378 1.126 1.00 1.00 C ATOM 48 OD1 ASP A 5 -4.577 -7.278 1.555 1.00 1.00 O ATOM 49 OD2 ASP A 5 -2.874 -6.553 0.467 1.00 1.00 O ATOM 50 H ASP A 5 -4.235 -2.455 3.009 1.00 1.00 H ATOM 51 HA ASP A 5 -4.029 -5.341 3.514 1.00 1.00 H ATOM 52 HB2 ASP A 5 -5.390 -4.892 1.393 1.00 1.00 H ATOM 53 HB3 ASP A 5 -3.897 -4.288 0.685 1.00 1.00 H ATOM 54 N PRO A 6 -1.675 -4.389 3.930 1.00 1.00 N ATOM 55 CA PRO A 6 -0.204 -4.167 4.040 1.00 1.00 C ATOM 56 C PRO A 6 0.579 -5.177 3.206 1.00 1.00 C ATOM 57 O PRO A 6 1.809 -5.157 3.175 1.00 1.00 O ATOM 58 CB PRO A 6 0.100 -4.323 5.535 1.00 1.00 C ATOM 59 CG PRO A 6 -1.222 -4.296 6.233 1.00 1.00 C ATOM 60 CD PRO A 6 -2.266 -4.760 5.220 1.00 1.00 C ATOM 61 HA PRO A 6 0.042 -3.163 3.727 1.00 1.00 H ATOM 62 HB2 PRO A 6 0.604 -5.262 5.714 1.00 1.00 H ATOM 63 HB3 PRO A 6 0.713 -3.502 5.878 1.00 1.00 H ATOM 64 HG2 PRO A 6 -1.205 -4.965 7.084 1.00 1.00 H ATOM 65 HG3 PRO A 6 -1.453 -3.292 6.556 1.00 1.00 H ATOM 66 HD2 PRO A 6 -2.409 -5.830 5.287 1.00 1.00 H ATOM 67 HD3 PRO A 6 -3.199 -4.239 5.369 1.00 1.00 H ATOM 68 N ARG A 7 -0.148 -6.067 2.538 1.00 1.00 N ATOM 69 CA ARG A 7 0.480 -7.087 1.703 1.00 1.00 C ATOM 70 C ARG A 7 0.636 -6.590 0.258 1.00 1.00 C ATOM 71 O ARG A 7 1.511 -7.052 -0.476 1.00 1.00 O ATOM 72 CB ARG A 7 -0.351 -8.380 1.755 1.00 1.00 C ATOM 73 CG ARG A 7 0.187 -9.391 0.737 1.00 1.00 C ATOM 74 CD ARG A 7 -0.886 -9.719 -0.300 1.00 1.00 C ATOM 75 NE ARG A 7 -1.594 -8.502 -0.710 1.00 1.00 N ATOM 76 CZ ARG A 7 -2.233 -8.425 -1.857 1.00 1.00 C ATOM 77 NH1 ARG A 7 -2.209 -9.405 -2.682 1.00 1.00 N ATOM 78 NH2 ARG A 7 -2.892 -7.366 -2.142 1.00 1.00 N ATOM 79 H ARG A 7 -1.125 -6.036 2.608 1.00 1.00 H ATOM 80 HA ARG A 7 1.461 -7.298 2.093 1.00 1.00 H ATOM 81 HB2 ARG A 7 -0.281 -8.808 2.743 1.00 1.00 H ATOM 82 HB3 ARG A 7 -1.384 -8.160 1.541 1.00 1.00 H ATOM 83 HG2 ARG A 7 1.051 -8.980 0.239 1.00 1.00 H ATOM 84 HG3 ARG A 7 0.471 -10.297 1.248 1.00 1.00 H ATOM 85 HD2 ARG A 7 -0.412 -10.165 -1.156 1.00 1.00 H ATOM 86 HD3 ARG A 7 -1.589 -10.424 0.124 1.00 1.00 H ATOM 87 HE ARG A 7 -1.612 -7.724 -0.108 1.00 1.00 H ATOM 88 HH11 ARG A 7 -1.709 -10.237 -2.456 1.00 1.00 H ATOM 89 HH12 ARG A 7 -2.694 -9.336 -3.550 1.00 1.00 H ATOM 90 HH21 ARG A 7 -2.927 -6.615 -1.488 1.00 1.00 H ATOM 91 HH22 ARG A 7 -3.354 -7.287 -3.025 1.00 1.00 H HETATM 92 N ABA A 8 -0.199 -5.634 -0.145 1.00 1.00 N HETATM 93 CA ABA A 8 -0.116 -5.082 -1.501 1.00 1.00 C HETATM 94 C ABA A 8 0.817 -3.866 -1.535 1.00 1.00 C HETATM 95 O ABA A 8 1.493 -3.611 -2.532 1.00 1.00 O HETATM 96 CB ABA A 8 -1.521 -4.701 -1.995 1.00 1.00 C HETATM 97 CG ABA A 8 -1.691 -3.256 -1.997 1.00 1.00 C HETATM 98 H ABA A 8 -0.873 -5.287 0.480 1.00 1.00 H HETATM 99 HA ABA A 8 0.285 -5.836 -2.161 1.00 1.00 H HETATM 100 HB3 ABA A 8 -2.257 -5.142 -1.343 1.00 1.00 H HETATM 101 HB2 ABA A 8 -1.661 -5.071 -2.993 1.00 1.00 H HETATM 102 HG1 ABA A 8 -1.060 -2.651 -2.625 1.00 1.00 H ATOM 103 N ASN A 9 0.841 -3.122 -0.436 1.00 1.00 N ATOM 104 CA ASN A 9 1.686 -1.932 -0.335 1.00 1.00 C ATOM 105 C ASN A 9 3.135 -2.245 -0.736 1.00 1.00 C ATOM 106 O ASN A 9 3.711 -3.237 -0.295 1.00 1.00 O ATOM 107 CB ASN A 9 1.638 -1.395 1.107 1.00 1.00 C ATOM 108 CG ASN A 9 2.851 -1.875 1.895 1.00 1.00 C ATOM 109 OD1 ASN A 9 2.879 -3.006 2.361 1.00 1.00 O ATOM 110 ND2 ASN A 9 3.863 -1.083 2.069 1.00 1.00 N ATOM 111 H ASN A 9 0.273 -3.377 0.321 1.00 1.00 H ATOM 112 HA ASN A 9 1.300 -1.174 -0.999 1.00 1.00 H ATOM 113 HB2 ASN A 9 1.627 -0.317 1.089 1.00 1.00 H ATOM 114 HB3 ASN A 9 0.740 -1.751 1.588 1.00 1.00 H ATOM 115 HD21 ASN A 9 3.850 -0.178 1.698 1.00 1.00 H ATOM 116 HD22 ASN A 9 4.644 -1.395 2.571 1.00 1.00 H ATOM 117 N TYR A 10 3.718 -1.389 -1.569 1.00 1.00 N ATOM 118 CA TYR A 10 5.092 -1.582 -2.008 1.00 1.00 C ATOM 119 C TYR A 10 6.065 -0.881 -1.056 1.00 1.00 C ATOM 120 O TYR A 10 5.685 -0.435 0.028 1.00 1.00 O ATOM 121 CB TYR A 10 5.285 -1.035 -3.434 1.00 1.00 C ATOM 122 CG TYR A 10 3.988 -0.495 -3.994 1.00 1.00 C ATOM 123 CD1 TYR A 10 2.870 -1.327 -4.123 1.00 1.00 C ATOM 124 CD2 TYR A 10 3.913 0.842 -4.392 1.00 1.00 C ATOM 125 CE1 TYR A 10 1.677 -0.816 -4.651 1.00 1.00 C ATOM 126 CE2 TYR A 10 2.722 1.349 -4.919 1.00 1.00 C ATOM 127 CZ TYR A 10 1.606 0.521 -5.048 1.00 1.00 C ATOM 128 OH TYR A 10 0.437 1.031 -5.562 1.00 1.00 O ATOM 129 H TYR A 10 3.223 -0.617 -1.891 1.00 1.00 H ATOM 130 HA TYR A 10 5.312 -2.638 -2.011 1.00 1.00 H ATOM 131 HB2 TYR A 10 6.014 -0.243 -3.417 1.00 1.00 H ATOM 132 HB3 TYR A 10 5.641 -1.826 -4.069 1.00 1.00 H ATOM 133 HD1 TYR A 10 2.928 -2.363 -3.818 1.00 1.00 H ATOM 134 HD2 TYR A 10 4.777 1.483 -4.291 1.00 1.00 H ATOM 135 HE1 TYR A 10 0.811 -1.455 -4.752 1.00 1.00 H ATOM 136 HE2 TYR A 10 2.663 2.381 -5.228 1.00 1.00 H ATOM 137 HH TYR A 10 0.216 1.821 -5.055 1.00 1.00 H ATOM 138 N ASP A 11 7.318 -0.779 -1.477 1.00 1.00 N ATOM 139 CA ASP A 11 8.345 -0.126 -0.671 1.00 1.00 C ATOM 140 C ASP A 11 8.002 1.346 -0.436 1.00 1.00 C ATOM 141 O ASP A 11 8.583 2.013 0.425 1.00 1.00 O ATOM 142 CB ASP A 11 9.683 -0.233 -1.410 1.00 1.00 C ATOM 143 CG ASP A 11 10.819 -0.444 -0.428 1.00 1.00 C ATOM 144 OD1 ASP A 11 10.775 -1.414 0.303 1.00 1.00 O ATOM 145 OD2 ASP A 11 11.724 0.363 -0.428 1.00 1.00 O ATOM 146 H ASP A 11 7.559 -1.144 -2.355 1.00 1.00 H ATOM 147 HA ASP A 11 8.421 -0.625 0.279 1.00 1.00 H ATOM 148 HB2 ASP A 11 9.643 -1.064 -2.095 1.00 1.00 H ATOM 149 HB3 ASP A 11 9.859 0.675 -1.966 1.00 1.00 H ATOM 150 N HIS A 12 7.068 1.841 -1.232 1.00 1.00 N ATOM 151 CA HIS A 12 6.648 3.239 -1.152 1.00 1.00 C ATOM 152 C HIS A 12 5.352 3.461 -1.941 1.00 1.00 C ATOM 153 O HIS A 12 5.373 3.990 -3.052 1.00 1.00 O ATOM 154 CB HIS A 12 7.764 4.120 -1.717 1.00 1.00 C ATOM 155 CG HIS A 12 8.403 3.423 -2.883 1.00 1.00 C ATOM 156 ND1 HIS A 12 9.723 3.632 -3.247 1.00 1.00 N ATOM 157 CD2 HIS A 12 7.909 2.508 -3.769 1.00 1.00 C ATOM 158 CE1 HIS A 12 9.976 2.851 -4.315 1.00 1.00 C ATOM 159 NE2 HIS A 12 8.900 2.143 -4.675 1.00 1.00 N ATOM 160 H HIS A 12 6.665 1.253 -1.901 1.00 1.00 H ATOM 161 HA HIS A 12 6.482 3.505 -0.119 1.00 1.00 H ATOM 162 HB2 HIS A 12 7.356 5.065 -2.037 1.00 1.00 H ATOM 163 HB3 HIS A 12 8.503 4.284 -0.956 1.00 1.00 H ATOM 164 HD2 HIS A 12 6.903 2.121 -3.753 1.00 1.00 H ATOM 165 HE1 HIS A 12 10.932 2.803 -4.821 1.00 1.00 H ATOM 166 HE2 HIS A 12 8.827 1.501 -5.417 1.00 1.00 H ATOM 167 N PRO A 13 4.239 3.046 -1.401 1.00 1.00 N ATOM 168 CA PRO A 13 2.916 3.183 -2.067 1.00 1.00 C ATOM 169 C PRO A 13 2.176 4.482 -1.707 1.00 1.00 C ATOM 170 O PRO A 13 0.982 4.617 -1.983 1.00 1.00 O ATOM 171 CB PRO A 13 2.167 1.957 -1.548 1.00 1.00 C ATOM 172 CG PRO A 13 2.761 1.654 -0.199 1.00 1.00 C ATOM 173 CD PRO A 13 4.106 2.387 -0.100 1.00 1.00 C ATOM 174 HA PRO A 13 3.032 3.106 -3.137 1.00 1.00 H ATOM 175 HB2 PRO A 13 1.112 2.177 -1.455 1.00 1.00 H ATOM 176 HB3 PRO A 13 2.317 1.119 -2.212 1.00 1.00 H ATOM 177 HG2 PRO A 13 2.095 2.001 0.582 1.00 1.00 H ATOM 178 HG3 PRO A 13 2.924 0.593 -0.097 1.00 1.00 H ATOM 179 HD2 PRO A 13 4.084 3.115 0.699 1.00 1.00 H ATOM 180 HD3 PRO A 13 4.910 1.685 0.046 1.00 1.00 H ATOM 181 N GLU A 14 2.889 5.425 -1.098 1.00 1.00 N ATOM 182 CA GLU A 14 2.301 6.709 -0.703 1.00 1.00 C ATOM 183 C GLU A 14 1.304 6.543 0.448 1.00 1.00 C ATOM 184 O GLU A 14 0.775 5.455 0.692 1.00 1.00 O ATOM 185 CB GLU A 14 1.607 7.373 -1.898 1.00 1.00 C ATOM 186 CG GLU A 14 1.210 8.809 -1.523 1.00 1.00 C ATOM 187 CD GLU A 14 1.301 9.718 -2.736 1.00 1.00 C ATOM 188 OE1 GLU A 14 2.402 10.080 -3.098 1.00 1.00 O ATOM 189 OE2 GLU A 14 0.269 10.053 -3.282 1.00 1.00 O ATOM 190 H GLU A 14 3.833 5.259 -0.911 1.00 1.00 H ATOM 191 HA GLU A 14 3.096 7.359 -0.370 1.00 1.00 H ATOM 192 HB2 GLU A 14 2.284 7.391 -2.741 1.00 1.00 H ATOM 193 HB3 GLU A 14 0.719 6.814 -2.161 1.00 1.00 H ATOM 194 HG2 GLU A 14 0.198 8.818 -1.150 1.00 1.00 H ATOM 195 HG3 GLU A 14 1.875 9.177 -0.756 1.00 1.00 H ATOM 196 N ILE A 15 1.050 7.635 1.154 1.00 1.00 N ATOM 197 CA ILE A 15 0.115 7.619 2.281 1.00 1.00 C ATOM 198 C ILE A 15 -1.330 7.472 1.784 1.00 1.00 C ATOM 199 O ILE A 15 -2.201 8.282 2.105 1.00 1.00 O ATOM 200 CB ILE A 15 0.264 8.916 3.091 1.00 1.00 C ATOM 201 CG1 ILE A 15 1.741 9.138 3.440 1.00 1.00 C ATOM 202 CG2 ILE A 15 -0.550 8.817 4.383 1.00 1.00 C ATOM 203 CD1 ILE A 15 2.280 7.941 4.223 1.00 1.00 C ATOM 204 H ILE A 15 1.501 8.470 0.916 1.00 1.00 H ATOM 205 HA ILE A 15 0.348 6.782 2.921 1.00 1.00 H ATOM 206 HB ILE A 15 -0.098 9.751 2.506 1.00 1.00 H ATOM 207 HG12 ILE A 15 2.310 9.256 2.530 1.00 1.00 H ATOM 208 HG13 ILE A 15 1.838 10.030 4.040 1.00 1.00 H ATOM 209 HG21 ILE A 15 -1.341 9.551 4.367 1.00 1.00 H ATOM 210 HG22 ILE A 15 0.094 9.001 5.230 1.00 1.00 H ATOM 211 HG23 ILE A 15 -0.977 7.830 4.465 1.00 1.00 H ATOM 212 HD11 ILE A 15 1.572 7.664 4.991 1.00 1.00 H ATOM 213 HD12 ILE A 15 3.219 8.208 4.682 1.00 1.00 H ATOM 214 HD13 ILE A 15 2.431 7.108 3.554 1.00 1.00 H ATOM 215 N CYS A 16 -1.575 6.431 0.994 1.00 1.00 N ATOM 216 CA CYS A 16 -2.913 6.184 0.451 1.00 1.00 C ATOM 217 C CYS A 16 -3.421 7.395 -0.331 1.00 1.00 C ATOM 218 O CYS A 16 -4.624 7.638 -0.405 1.00 1.00 O ATOM 219 CB CYS A 16 -3.889 5.864 1.583 1.00 1.00 C ATOM 220 SG CYS A 16 -4.657 4.250 1.283 1.00 1.00 S ATOM 221 H CYS A 16 -0.842 5.818 0.769 1.00 1.00 H ATOM 222 HA CYS A 16 -2.868 5.337 -0.215 1.00 1.00 H ATOM 223 HB2 CYS A 16 -3.356 5.840 2.521 1.00 1.00 H ATOM 224 HB3 CYS A 16 -4.653 6.625 1.623 1.00 1.00 H HETATM 225 N NH2 A 17 -2.573 8.168 -0.931 1.00 1.00 N HETATM 226 HN1 NH2 A 17 -2.891 8.936 -1.449 1.00 1.00 H HETATM 227 HN2 NH2 A 17 -1.619 7.977 -0.873 1.00 1.00 H TER 228 NH2 A 17