ATOM 1 N THR A 1 -5.439 -8.010 6.082 1.00 0.00 N ATOM 2 CA THR A 1 -5.386 -7.428 4.763 1.00 0.00 C ATOM 3 C THR A 1 -5.372 -5.888 4.891 1.00 0.00 C ATOM 4 O THR A 1 -6.035 -5.331 5.775 1.00 0.00 O ATOM 5 CB THR A 1 -6.598 -7.934 3.971 1.00 0.00 C ATOM 6 OG1 THR A 1 -6.646 -9.360 4.122 1.00 0.00 O ATOM 7 CG2 THR A 1 -6.466 -7.608 2.503 1.00 0.00 C ATOM 8 H1 THR A 1 -4.575 -7.798 6.617 1.00 0.00 H ATOM 9 H2 THR A 1 -5.575 -9.035 5.992 1.00 0.00 H ATOM 10 H3 THR A 1 -6.250 -7.605 6.588 1.00 0.00 H ATOM 11 HA THR A 1 -4.476 -7.753 4.279 1.00 0.00 H ATOM 12 HB THR A 1 -7.505 -7.506 4.368 1.00 0.00 H ATOM 13 HG1 THR A 1 -7.050 -9.759 3.340 1.00 0.00 H ATOM 14 HG21 THR A 1 -5.571 -8.069 2.112 1.00 0.00 H ATOM 15 HG22 THR A 1 -6.403 -6.538 2.374 1.00 0.00 H ATOM 16 HG23 THR A 1 -7.325 -7.989 1.972 1.00 0.00 H ATOM 17 N GLN A 2 -4.619 -5.209 4.043 1.00 0.00 N ATOM 18 CA GLN A 2 -4.461 -3.773 4.170 1.00 0.00 C ATOM 19 C GLN A 2 -5.558 -3.048 3.349 1.00 0.00 C ATOM 20 O GLN A 2 -5.831 -3.406 2.198 1.00 0.00 O ATOM 21 CB GLN A 2 -3.026 -3.386 3.754 1.00 0.00 C ATOM 22 CG GLN A 2 -2.445 -2.176 4.502 1.00 0.00 C ATOM 23 CD GLN A 2 -3.063 -0.865 4.113 1.00 0.00 C ATOM 24 OE1 GLN A 2 -3.214 0.041 4.934 1.00 0.00 O ATOM 25 NE2 GLN A 2 -3.335 -0.706 2.858 1.00 0.00 N ATOM 26 H GLN A 2 -4.164 -5.664 3.295 1.00 0.00 H ATOM 27 HA GLN A 2 -4.610 -3.532 5.211 1.00 0.00 H ATOM 28 HB2 GLN A 2 -2.380 -4.233 3.931 1.00 0.00 H ATOM 29 HB3 GLN A 2 -3.016 -3.178 2.696 1.00 0.00 H ATOM 30 HG2 GLN A 2 -2.605 -2.317 5.561 1.00 0.00 H ATOM 31 HG3 GLN A 2 -1.383 -2.130 4.310 1.00 0.00 H ATOM 32 HE21 GLN A 2 -3.118 -1.417 2.220 1.00 0.00 H ATOM 33 HE22 GLN A 2 -3.794 0.112 2.583 1.00 0.00 H ATOM 34 N SER A 3 -6.167 -2.056 3.958 1.00 0.00 N ATOM 35 CA SER A 3 -7.321 -1.351 3.406 1.00 0.00 C ATOM 36 C SER A 3 -6.970 -0.295 2.320 1.00 0.00 C ATOM 37 O SER A 3 -5.805 0.053 2.085 1.00 0.00 O ATOM 38 CB SER A 3 -8.077 -0.699 4.554 1.00 0.00 C ATOM 39 OG SER A 3 -8.386 -1.663 5.552 1.00 0.00 O ATOM 40 H SER A 3 -5.839 -1.768 4.836 1.00 0.00 H ATOM 41 HA SER A 3 -7.975 -2.089 2.967 1.00 0.00 H ATOM 42 HB2 SER A 3 -7.461 0.073 4.990 1.00 0.00 H ATOM 43 HB3 SER A 3 -8.995 -0.266 4.188 1.00 0.00 H ATOM 44 HG SER A 3 -8.119 -1.310 6.407 1.00 0.00 H ATOM 45 N HIS A 4 -8.005 0.225 1.691 1.00 0.00 N ATOM 46 CA HIS A 4 -7.892 1.197 0.623 1.00 0.00 C ATOM 47 C HIS A 4 -7.300 2.497 1.171 1.00 0.00 C ATOM 48 O HIS A 4 -7.706 2.962 2.229 1.00 0.00 O ATOM 49 CB HIS A 4 -9.291 1.450 0.033 1.00 0.00 C ATOM 50 CG HIS A 4 -9.322 2.117 -1.313 1.00 0.00 C ATOM 51 ND1 HIS A 4 -10.467 2.616 -1.870 1.00 0.00 N ATOM 52 CD2 HIS A 4 -8.367 2.261 -2.250 1.00 0.00 C ATOM 53 CE1 HIS A 4 -10.219 3.026 -3.088 1.00 0.00 C ATOM 54 NE2 HIS A 4 -8.945 2.819 -3.348 1.00 0.00 N ATOM 55 H HIS A 4 -8.905 -0.054 1.971 1.00 0.00 H ATOM 56 HA HIS A 4 -7.249 0.797 -0.147 1.00 0.00 H ATOM 57 HB2 HIS A 4 -9.802 0.505 -0.070 1.00 0.00 H ATOM 58 HB3 HIS A 4 -9.847 2.068 0.723 1.00 0.00 H ATOM 59 HD1 HIS A 4 -11.346 2.663 -1.429 1.00 0.00 H ATOM 60 HD2 HIS A 4 -7.328 1.984 -2.148 1.00 0.00 H ATOM 61 HE1 HIS A 4 -10.939 3.464 -3.761 1.00 0.00 H ATOM 62 HE2 HIS A 4 -8.642 2.514 -4.236 1.00 0.00 H ATOM 63 N TYR A 5 -6.312 3.031 0.454 1.00 0.00 N ATOM 64 CA TYR A 5 -5.609 4.286 0.785 1.00 0.00 C ATOM 65 C TYR A 5 -4.587 4.140 1.910 1.00 0.00 C ATOM 66 O TYR A 5 -3.987 5.127 2.349 1.00 0.00 O ATOM 67 CB TYR A 5 -6.557 5.484 1.018 1.00 0.00 C ATOM 68 CG TYR A 5 -7.332 5.889 -0.218 1.00 0.00 C ATOM 69 CD1 TYR A 5 -6.681 6.425 -1.319 1.00 0.00 C ATOM 70 CD2 TYR A 5 -8.708 5.740 -0.281 1.00 0.00 C ATOM 71 CE1 TYR A 5 -7.376 6.797 -2.449 1.00 0.00 C ATOM 72 CE2 TYR A 5 -9.412 6.111 -1.409 1.00 0.00 C ATOM 73 CZ TYR A 5 -8.739 6.638 -2.491 1.00 0.00 C ATOM 74 OH TYR A 5 -9.439 7.010 -3.628 1.00 0.00 O ATOM 75 H TYR A 5 -6.004 2.563 -0.356 1.00 0.00 H ATOM 76 HA TYR A 5 -5.026 4.495 -0.100 1.00 0.00 H ATOM 77 HB2 TYR A 5 -7.266 5.223 1.788 1.00 0.00 H ATOM 78 HB3 TYR A 5 -5.979 6.335 1.346 1.00 0.00 H ATOM 79 HD1 TYR A 5 -5.608 6.549 -1.285 1.00 0.00 H ATOM 80 HD2 TYR A 5 -9.232 5.328 0.569 1.00 0.00 H ATOM 81 HE1 TYR A 5 -6.850 7.213 -3.295 1.00 0.00 H ATOM 82 HE2 TYR A 5 -10.484 5.985 -1.437 1.00 0.00 H ATOM 83 HH TYR A 5 -9.034 6.574 -4.389 1.00 0.00 H ATOM 84 N GLY A 6 -4.346 2.932 2.335 1.00 0.00 N ATOM 85 CA GLY A 6 -3.312 2.705 3.315 1.00 0.00 C ATOM 86 C GLY A 6 -2.027 2.298 2.634 1.00 0.00 C ATOM 87 O GLY A 6 -2.033 2.031 1.414 1.00 0.00 O ATOM 88 H GLY A 6 -4.877 2.183 1.995 1.00 0.00 H ATOM 89 HA2 GLY A 6 -3.150 3.614 3.878 1.00 0.00 H ATOM 90 HA3 GLY A 6 -3.618 1.916 3.985 1.00 0.00 H ATOM 91 N GLN A 7 -0.945 2.232 3.380 1.00 0.00 N ATOM 92 CA GLN A 7 0.335 1.847 2.828 1.00 0.00 C ATOM 93 C GLN A 7 0.446 0.332 2.824 1.00 0.00 C ATOM 94 O GLN A 7 0.353 -0.303 3.864 1.00 0.00 O ATOM 95 CB GLN A 7 1.494 2.499 3.610 1.00 0.00 C ATOM 96 CG GLN A 7 2.904 2.116 3.129 1.00 0.00 C ATOM 97 CD GLN A 7 3.995 2.864 3.881 1.00 0.00 C ATOM 98 OE1 GLN A 7 3.819 3.240 5.036 1.00 0.00 O ATOM 99 NE2 GLN A 7 5.133 3.073 3.256 1.00 0.00 N ATOM 100 H GLN A 7 -1.010 2.402 4.346 1.00 0.00 H ATOM 101 HA GLN A 7 0.362 2.185 1.803 1.00 0.00 H ATOM 102 HB2 GLN A 7 1.402 3.574 3.536 1.00 0.00 H ATOM 103 HB3 GLN A 7 1.405 2.217 4.648 1.00 0.00 H ATOM 104 HG2 GLN A 7 3.045 1.058 3.297 1.00 0.00 H ATOM 105 HG3 GLN A 7 2.993 2.324 2.073 1.00 0.00 H ATOM 106 HE21 GLN A 7 5.283 2.765 2.338 1.00 0.00 H ATOM 107 HE22 GLN A 7 5.846 3.540 3.747 1.00 0.00 H ATOM 108 N CYS A 8 0.618 -0.223 1.649 1.00 0.00 N ATOM 109 CA CYS A 8 0.692 -1.664 1.465 1.00 0.00 C ATOM 110 C CYS A 8 2.066 -2.213 1.784 1.00 0.00 C ATOM 111 O CYS A 8 2.205 -3.155 2.542 1.00 0.00 O ATOM 112 CB CYS A 8 0.293 -2.018 0.039 1.00 0.00 C ATOM 113 SG CYS A 8 1.023 -0.908 -1.223 1.00 0.00 S ATOM 114 H CYS A 8 0.703 0.356 0.860 1.00 0.00 H ATOM 115 HA CYS A 8 -0.021 -2.124 2.135 1.00 0.00 H ATOM 116 HB2 CYS A 8 0.618 -3.023 -0.180 1.00 0.00 H ATOM 117 HB3 CYS A 8 -0.781 -1.960 -0.058 1.00 0.00 H ATOM 118 N GLY A 9 3.079 -1.629 1.219 1.00 0.00 N ATOM 119 CA GLY A 9 4.388 -2.128 1.454 1.00 0.00 C ATOM 120 C GLY A 9 5.408 -1.389 0.676 1.00 0.00 C ATOM 121 O GLY A 9 5.716 -1.745 -0.451 1.00 0.00 O ATOM 122 H GLY A 9 2.932 -0.871 0.617 1.00 0.00 H ATOM 123 HA2 GLY A 9 4.617 -2.037 2.504 1.00 0.00 H ATOM 124 HA3 GLY A 9 4.417 -3.171 1.176 1.00 0.00 H ATOM 125 N GLY A 10 5.881 -0.329 1.250 1.00 0.00 N ATOM 126 CA GLY A 10 6.948 0.419 0.664 1.00 0.00 C ATOM 127 C GLY A 10 8.173 0.233 1.500 1.00 0.00 C ATOM 128 O GLY A 10 8.132 -0.536 2.482 1.00 0.00 O ATOM 129 H GLY A 10 5.524 -0.054 2.116 1.00 0.00 H ATOM 130 HA2 GLY A 10 7.125 0.063 -0.340 1.00 0.00 H ATOM 131 HA3 GLY A 10 6.691 1.467 0.646 1.00 0.00 H ATOM 132 N ILE A 11 9.240 0.903 1.163 1.00 0.00 N ATOM 133 CA ILE A 11 10.464 0.813 1.936 1.00 0.00 C ATOM 134 C ILE A 11 10.220 1.388 3.341 1.00 0.00 C ATOM 135 O ILE A 11 9.696 2.497 3.488 1.00 0.00 O ATOM 136 CB ILE A 11 11.635 1.574 1.252 1.00 0.00 C ATOM 137 CG1 ILE A 11 11.836 1.074 -0.187 1.00 0.00 C ATOM 138 CG2 ILE A 11 12.928 1.392 2.057 1.00 0.00 C ATOM 139 CD1 ILE A 11 12.884 1.847 -0.968 1.00 0.00 C ATOM 140 H ILE A 11 9.210 1.479 0.371 1.00 0.00 H ATOM 141 HA ILE A 11 10.719 -0.233 2.028 1.00 0.00 H ATOM 142 HB ILE A 11 11.394 2.626 1.229 1.00 0.00 H ATOM 143 HG12 ILE A 11 12.143 0.040 -0.164 1.00 0.00 H ATOM 144 HG13 ILE A 11 10.901 1.151 -0.721 1.00 0.00 H ATOM 145 HG21 ILE A 11 13.731 1.933 1.578 1.00 0.00 H ATOM 146 HG22 ILE A 11 13.177 0.342 2.099 1.00 0.00 H ATOM 147 HG23 ILE A 11 12.783 1.770 3.058 1.00 0.00 H ATOM 148 HD11 ILE A 11 13.833 1.787 -0.454 1.00 0.00 H ATOM 149 HD12 ILE A 11 12.584 2.881 -1.048 1.00 0.00 H ATOM 150 HD13 ILE A 11 12.983 1.426 -1.957 1.00 0.00 H ATOM 151 N GLY A 12 10.526 0.600 4.344 1.00 0.00 N ATOM 152 CA GLY A 12 10.346 1.019 5.716 1.00 0.00 C ATOM 153 C GLY A 12 9.077 0.453 6.330 1.00 0.00 C ATOM 154 O GLY A 12 8.866 0.538 7.549 1.00 0.00 O ATOM 155 H GLY A 12 10.893 -0.288 4.150 1.00 0.00 H ATOM 156 HA2 GLY A 12 11.195 0.692 6.298 1.00 0.00 H ATOM 157 HA3 GLY A 12 10.294 2.097 5.747 1.00 0.00 H ATOM 158 N TYR A 13 8.237 -0.129 5.502 1.00 0.00 N ATOM 159 CA TYR A 13 6.979 -0.684 5.954 1.00 0.00 C ATOM 160 C TYR A 13 7.058 -2.200 5.930 1.00 0.00 C ATOM 161 O TYR A 13 7.673 -2.786 5.031 1.00 0.00 O ATOM 162 CB TYR A 13 5.824 -0.200 5.045 1.00 0.00 C ATOM 163 CG TYR A 13 4.421 -0.636 5.477 1.00 0.00 C ATOM 164 CD1 TYR A 13 3.602 0.218 6.201 1.00 0.00 C ATOM 165 CD2 TYR A 13 3.920 -1.896 5.155 1.00 0.00 C ATOM 166 CE1 TYR A 13 2.336 -0.163 6.587 1.00 0.00 C ATOM 167 CE2 TYR A 13 2.655 -2.284 5.544 1.00 0.00 C ATOM 168 CZ TYR A 13 1.868 -1.413 6.256 1.00 0.00 C ATOM 169 OH TYR A 13 0.599 -1.790 6.639 1.00 0.00 O ATOM 170 H TYR A 13 8.474 -0.200 4.550 1.00 0.00 H ATOM 171 HA TYR A 13 6.800 -0.344 6.962 1.00 0.00 H ATOM 172 HB2 TYR A 13 5.830 0.879 5.013 1.00 0.00 H ATOM 173 HB3 TYR A 13 5.994 -0.578 4.047 1.00 0.00 H ATOM 174 HD1 TYR A 13 3.968 1.199 6.463 1.00 0.00 H ATOM 175 HD2 TYR A 13 4.541 -2.579 4.595 1.00 0.00 H ATOM 176 HE1 TYR A 13 1.715 0.519 7.148 1.00 0.00 H ATOM 177 HE2 TYR A 13 2.289 -3.266 5.284 1.00 0.00 H ATOM 178 HH TYR A 13 0.017 -1.167 6.183 1.00 0.00 H ATOM 179 N SER A 14 6.458 -2.821 6.896 1.00 0.00 N ATOM 180 CA SER A 14 6.357 -4.250 6.949 1.00 0.00 C ATOM 181 C SER A 14 5.014 -4.566 7.573 1.00 0.00 C ATOM 182 O SER A 14 4.571 -3.836 8.476 1.00 0.00 O ATOM 183 CB SER A 14 7.520 -4.831 7.767 1.00 0.00 C ATOM 184 OG SER A 14 7.453 -4.395 9.144 1.00 0.00 O ATOM 185 H SER A 14 6.030 -2.320 7.624 1.00 0.00 H ATOM 186 HA SER A 14 6.385 -4.631 5.938 1.00 0.00 H ATOM 187 HB2 SER A 14 7.473 -5.910 7.736 1.00 0.00 H ATOM 188 HB3 SER A 14 8.453 -4.497 7.336 1.00 0.00 H ATOM 189 N GLY A 15 4.334 -5.561 7.073 1.00 0.00 N ATOM 190 CA GLY A 15 3.044 -5.897 7.600 1.00 0.00 C ATOM 191 C GLY A 15 2.174 -6.512 6.540 1.00 0.00 C ATOM 192 O GLY A 15 2.648 -7.377 5.796 1.00 0.00 O ATOM 193 H GLY A 15 4.684 -6.098 6.328 1.00 0.00 H ATOM 194 HA2 GLY A 15 3.162 -6.593 8.417 1.00 0.00 H ATOM 195 HA3 GLY A 15 2.580 -4.992 7.959 1.00 0.00 H ATOM 196 N PRO A 16 0.911 -6.092 6.426 1.00 0.00 N ATOM 197 CA PRO A 16 0.011 -6.615 5.426 1.00 0.00 C ATOM 198 C PRO A 16 0.246 -5.948 4.086 1.00 0.00 C ATOM 199 O PRO A 16 -0.223 -4.843 3.843 1.00 0.00 O ATOM 200 CB PRO A 16 -1.391 -6.273 5.952 1.00 0.00 C ATOM 201 CG PRO A 16 -1.186 -5.457 7.192 1.00 0.00 C ATOM 202 CD PRO A 16 0.261 -5.066 7.239 1.00 0.00 C ATOM 203 HA PRO A 16 0.117 -7.685 5.332 1.00 0.00 H ATOM 204 HB2 PRO A 16 -1.931 -5.719 5.200 1.00 0.00 H ATOM 205 HB3 PRO A 16 -1.928 -7.183 6.171 1.00 0.00 H ATOM 206 HG2 PRO A 16 -1.811 -4.577 7.163 1.00 0.00 H ATOM 207 HG3 PRO A 16 -1.435 -6.063 8.047 1.00 0.00 H ATOM 208 HD2 PRO A 16 0.400 -4.084 6.810 1.00 0.00 H ATOM 209 HD3 PRO A 16 0.612 -5.093 8.260 1.00 0.00 H ATOM 210 N THR A 17 1.006 -6.595 3.251 1.00 0.00 N ATOM 211 CA THR A 17 1.331 -6.062 1.957 1.00 0.00 C ATOM 212 C THR A 17 0.215 -6.325 0.948 1.00 0.00 C ATOM 213 O THR A 17 0.118 -5.659 -0.093 1.00 0.00 O ATOM 214 CB THR A 17 2.677 -6.626 1.469 1.00 0.00 C ATOM 215 OG1 THR A 17 2.652 -8.070 1.526 1.00 0.00 O ATOM 216 CG2 THR A 17 3.805 -6.112 2.354 1.00 0.00 C ATOM 217 H THR A 17 1.393 -7.457 3.513 1.00 0.00 H ATOM 218 HA THR A 17 1.434 -4.992 2.070 1.00 0.00 H ATOM 219 HB THR A 17 2.851 -6.303 0.453 1.00 0.00 H ATOM 220 HG1 THR A 17 3.270 -8.404 0.861 1.00 0.00 H ATOM 221 HG21 THR A 17 3.837 -5.034 2.303 1.00 0.00 H ATOM 222 HG22 THR A 17 4.748 -6.523 2.028 1.00 0.00 H ATOM 223 HG23 THR A 17 3.616 -6.413 3.374 1.00 0.00 H ATOM 224 N VAL A 18 -0.633 -7.284 1.265 1.00 0.00 N ATOM 225 CA VAL A 18 -1.756 -7.612 0.423 1.00 0.00 C ATOM 226 C VAL A 18 -2.896 -6.642 0.708 1.00 0.00 C ATOM 227 O VAL A 18 -3.359 -6.515 1.862 1.00 0.00 O ATOM 228 CB VAL A 18 -2.238 -9.076 0.637 1.00 0.00 C ATOM 229 CG1 VAL A 18 -3.407 -9.413 -0.286 1.00 0.00 C ATOM 230 CG2 VAL A 18 -1.092 -10.059 0.417 1.00 0.00 C ATOM 231 H VAL A 18 -0.492 -7.770 2.103 1.00 0.00 H ATOM 232 HA VAL A 18 -1.445 -7.490 -0.605 1.00 0.00 H ATOM 233 HB VAL A 18 -2.580 -9.173 1.656 1.00 0.00 H ATOM 234 HG11 VAL A 18 -4.225 -8.737 -0.088 1.00 0.00 H ATOM 235 HG12 VAL A 18 -3.726 -10.428 -0.104 1.00 0.00 H ATOM 236 HG13 VAL A 18 -3.093 -9.311 -1.314 1.00 0.00 H ATOM 237 HG21 VAL A 18 -0.724 -9.963 -0.593 1.00 0.00 H ATOM 238 HG22 VAL A 18 -1.448 -11.066 0.579 1.00 0.00 H ATOM 239 HG23 VAL A 18 -0.295 -9.844 1.114 1.00 0.00 H ATOM 240 N CYS A 19 -3.324 -5.958 -0.317 1.00 0.00 N ATOM 241 CA CYS A 19 -4.390 -4.999 -0.218 1.00 0.00 C ATOM 242 C CYS A 19 -5.718 -5.709 -0.362 1.00 0.00 C ATOM 243 O CYS A 19 -5.762 -6.866 -0.813 1.00 0.00 O ATOM 244 CB CYS A 19 -4.252 -3.951 -1.320 1.00 0.00 C ATOM 245 SG CYS A 19 -2.654 -3.083 -1.339 1.00 0.00 S ATOM 246 H CYS A 19 -2.925 -6.108 -1.198 1.00 0.00 H ATOM 247 HA CYS A 19 -4.337 -4.510 0.743 1.00 0.00 H ATOM 248 HB2 CYS A 19 -4.383 -4.425 -2.282 1.00 0.00 H ATOM 249 HB3 CYS A 19 -5.029 -3.211 -1.190 1.00 0.00 H ATOM 250 N ALA A 20 -6.785 -5.045 0.030 1.00 0.00 N ATOM 251 CA ALA A 20 -8.118 -5.595 -0.096 1.00 0.00 C ATOM 252 C ALA A 20 -8.448 -5.825 -1.564 1.00 0.00 C ATOM 253 O ALA A 20 -7.913 -5.118 -2.451 1.00 0.00 O ATOM 254 CB ALA A 20 -9.136 -4.661 0.533 1.00 0.00 C ATOM 255 H ALA A 20 -6.664 -4.156 0.431 1.00 0.00 H ATOM 256 HA ALA A 20 -8.138 -6.537 0.428 1.00 0.00 H ATOM 257 HB1 ALA A 20 -8.903 -4.518 1.578 1.00 0.00 H ATOM 258 HB2 ALA A 20 -10.121 -5.092 0.432 1.00 0.00 H ATOM 259 HB3 ALA A 20 -9.111 -3.709 0.023 1.00 0.00 H ATOM 260 N SER A 21 -9.281 -6.805 -1.832 1.00 0.00 N ATOM 261 CA SER A 21 -9.682 -7.123 -3.171 1.00 0.00 C ATOM 262 C SER A 21 -10.315 -5.913 -3.844 1.00 0.00 C ATOM 263 O SER A 21 -11.252 -5.295 -3.306 1.00 0.00 O ATOM 264 CB SER A 21 -10.609 -8.340 -3.155 1.00 0.00 C ATOM 265 OG SER A 21 -11.560 -8.245 -2.097 1.00 0.00 O ATOM 266 H SER A 21 -9.660 -7.341 -1.101 1.00 0.00 H ATOM 267 HA SER A 21 -8.785 -7.379 -3.714 1.00 0.00 H ATOM 268 HB2 SER A 21 -11.141 -8.394 -4.093 1.00 0.00 H ATOM 269 HB3 SER A 21 -10.020 -9.235 -3.013 1.00 0.00 H ATOM 270 HG SER A 21 -12.117 -7.469 -2.245 1.00 0.00 H ATOM 271 N GLY A 22 -9.748 -5.527 -4.961 1.00 0.00 N ATOM 272 CA GLY A 22 -10.226 -4.375 -5.674 1.00 0.00 C ATOM 273 C GLY A 22 -9.242 -3.235 -5.599 1.00 0.00 C ATOM 274 O GLY A 22 -9.271 -2.324 -6.413 1.00 0.00 O ATOM 275 H GLY A 22 -8.981 -6.033 -5.311 1.00 0.00 H ATOM 276 HA2 GLY A 22 -10.381 -4.642 -6.708 1.00 0.00 H ATOM 277 HA3 GLY A 22 -11.164 -4.055 -5.244 1.00 0.00 H ATOM 278 N THR A 23 -8.360 -3.285 -4.628 1.00 0.00 N ATOM 279 CA THR A 23 -7.363 -2.255 -4.476 1.00 0.00 C ATOM 280 C THR A 23 -5.996 -2.824 -4.816 1.00 0.00 C ATOM 281 O THR A 23 -5.723 -3.997 -4.534 1.00 0.00 O ATOM 282 CB THR A 23 -7.376 -1.645 -3.045 1.00 0.00 C ATOM 283 OG1 THR A 23 -7.026 -2.624 -2.065 1.00 0.00 O ATOM 284 CG2 THR A 23 -8.761 -1.123 -2.720 1.00 0.00 C ATOM 285 H THR A 23 -8.371 -4.045 -4.005 1.00 0.00 H ATOM 286 HA THR A 23 -7.590 -1.477 -5.192 1.00 0.00 H ATOM 287 HB THR A 23 -6.680 -0.821 -2.996 1.00 0.00 H ATOM 288 HG1 THR A 23 -7.319 -3.497 -2.364 1.00 0.00 H ATOM 289 HG21 THR A 23 -8.768 -0.711 -1.723 1.00 0.00 H ATOM 290 HG22 THR A 23 -9.465 -1.939 -2.778 1.00 0.00 H ATOM 291 HG23 THR A 23 -9.032 -0.357 -3.432 1.00 0.00 H ATOM 292 N THR A 24 -5.168 -2.037 -5.435 1.00 0.00 N ATOM 293 CA THR A 24 -3.874 -2.482 -5.865 1.00 0.00 C ATOM 294 C THR A 24 -2.768 -1.719 -5.156 1.00 0.00 C ATOM 295 O THR A 24 -2.905 -0.527 -4.908 1.00 0.00 O ATOM 296 CB THR A 24 -3.740 -2.338 -7.403 1.00 0.00 C ATOM 297 OG1 THR A 24 -4.163 -1.009 -7.839 1.00 0.00 O ATOM 298 CG2 THR A 24 -4.569 -3.395 -8.117 1.00 0.00 C ATOM 299 H THR A 24 -5.422 -1.098 -5.611 1.00 0.00 H ATOM 300 HA THR A 24 -3.790 -3.530 -5.619 1.00 0.00 H ATOM 301 HB THR A 24 -2.700 -2.471 -7.663 1.00 0.00 H ATOM 302 HG1 THR A 24 -4.802 -0.634 -7.210 1.00 0.00 H ATOM 303 HG21 THR A 24 -5.606 -3.287 -7.835 1.00 0.00 H ATOM 304 HG22 THR A 24 -4.218 -4.377 -7.840 1.00 0.00 H ATOM 305 HG23 THR A 24 -4.471 -3.269 -9.185 1.00 0.00 H ATOM 306 N CYS A 25 -1.705 -2.405 -4.803 1.00 0.00 N ATOM 307 CA CYS A 25 -0.576 -1.777 -4.155 1.00 0.00 C ATOM 308 C CYS A 25 0.195 -0.981 -5.190 1.00 0.00 C ATOM 309 O CYS A 25 0.855 -1.550 -6.073 1.00 0.00 O ATOM 310 CB CYS A 25 0.329 -2.831 -3.487 1.00 0.00 C ATOM 311 SG CYS A 25 1.796 -2.158 -2.620 1.00 0.00 S ATOM 312 H CYS A 25 -1.663 -3.366 -5.000 1.00 0.00 H ATOM 313 HA CYS A 25 -0.953 -1.099 -3.405 1.00 0.00 H ATOM 314 HB2 CYS A 25 -0.253 -3.371 -2.755 1.00 0.00 H ATOM 315 HB3 CYS A 25 0.680 -3.521 -4.240 1.00 0.00 H ATOM 316 N GLN A 26 0.047 0.317 -5.145 1.00 0.00 N ATOM 317 CA GLN A 26 0.697 1.171 -6.080 1.00 0.00 C ATOM 318 C GLN A 26 1.776 1.975 -5.412 1.00 0.00 C ATOM 319 O GLN A 26 1.550 2.622 -4.384 1.00 0.00 O ATOM 320 CB GLN A 26 -0.302 2.066 -6.807 1.00 0.00 C ATOM 321 CG GLN A 26 -1.308 1.289 -7.642 1.00 0.00 C ATOM 322 CD GLN A 26 -2.202 2.177 -8.473 1.00 0.00 C ATOM 323 OE1 GLN A 26 -1.804 3.264 -8.914 1.00 0.00 O ATOM 324 NE2 GLN A 26 -3.413 1.734 -8.696 1.00 0.00 N ATOM 325 H GLN A 26 -0.522 0.729 -4.453 1.00 0.00 H ATOM 326 HA GLN A 26 1.165 0.525 -6.806 1.00 0.00 H ATOM 327 HB2 GLN A 26 -0.843 2.643 -6.073 1.00 0.00 H ATOM 328 HB3 GLN A 26 0.236 2.740 -7.455 1.00 0.00 H ATOM 329 HG2 GLN A 26 -0.774 0.628 -8.308 1.00 0.00 H ATOM 330 HG3 GLN A 26 -1.925 0.700 -6.979 1.00 0.00 H ATOM 331 HE21 GLN A 26 -3.660 0.863 -8.312 1.00 0.00 H ATOM 332 HE22 GLN A 26 -4.028 2.286 -9.220 1.00 0.00 H ATOM 333 N VAL A 27 2.943 1.916 -5.978 1.00 0.00 N ATOM 334 CA VAL A 27 4.083 2.621 -5.462 1.00 0.00 C ATOM 335 C VAL A 27 4.005 4.064 -5.934 1.00 0.00 C ATOM 336 O VAL A 27 4.142 4.344 -7.127 1.00 0.00 O ATOM 337 CB VAL A 27 5.405 1.964 -5.944 1.00 0.00 C ATOM 338 CG1 VAL A 27 6.622 2.661 -5.360 1.00 0.00 C ATOM 339 CG2 VAL A 27 5.419 0.483 -5.593 1.00 0.00 C ATOM 340 H VAL A 27 3.036 1.388 -6.798 1.00 0.00 H ATOM 341 HA VAL A 27 4.039 2.589 -4.383 1.00 0.00 H ATOM 342 HB VAL A 27 5.454 2.054 -7.019 1.00 0.00 H ATOM 343 HG11 VAL A 27 6.618 3.699 -5.657 1.00 0.00 H ATOM 344 HG12 VAL A 27 7.522 2.186 -5.722 1.00 0.00 H ATOM 345 HG13 VAL A 27 6.587 2.596 -4.282 1.00 0.00 H ATOM 346 HG21 VAL A 27 5.325 0.366 -4.524 1.00 0.00 H ATOM 347 HG22 VAL A 27 6.350 0.045 -5.923 1.00 0.00 H ATOM 348 HG23 VAL A 27 4.592 -0.008 -6.084 1.00 0.00 H ATOM 349 N LEU A 28 3.727 4.958 -5.022 1.00 0.00 N ATOM 350 CA LEU A 28 3.579 6.359 -5.357 1.00 0.00 C ATOM 351 C LEU A 28 4.922 7.040 -5.256 1.00 0.00 C ATOM 352 O LEU A 28 5.366 7.726 -6.185 1.00 0.00 O ATOM 353 CB LEU A 28 2.559 7.033 -4.431 1.00 0.00 C ATOM 354 CG LEU A 28 1.139 6.450 -4.448 1.00 0.00 C ATOM 355 CD1 LEU A 28 0.238 7.207 -3.502 1.00 0.00 C ATOM 356 CD2 LEU A 28 0.561 6.476 -5.847 1.00 0.00 C ATOM 357 H LEU A 28 3.651 4.665 -4.088 1.00 0.00 H ATOM 358 HA LEU A 28 3.231 6.423 -6.376 1.00 0.00 H ATOM 359 HB2 LEU A 28 2.935 6.968 -3.420 1.00 0.00 H ATOM 360 HB3 LEU A 28 2.497 8.077 -4.702 1.00 0.00 H ATOM 361 HG LEU A 28 1.177 5.423 -4.117 1.00 0.00 H ATOM 362 HD11 LEU A 28 -0.760 6.794 -3.540 1.00 0.00 H ATOM 363 HD12 LEU A 28 0.210 8.250 -3.782 1.00 0.00 H ATOM 364 HD13 LEU A 28 0.628 7.110 -2.500 1.00 0.00 H ATOM 365 HD21 LEU A 28 0.556 7.495 -6.205 1.00 0.00 H ATOM 366 HD22 LEU A 28 -0.449 6.096 -5.813 1.00 0.00 H ATOM 367 HD23 LEU A 28 1.160 5.859 -6.498 1.00 0.00 H ATOM 368 N ASN A 29 5.583 6.796 -4.159 1.00 0.00 N ATOM 369 CA ASN A 29 6.896 7.338 -3.891 1.00 0.00 C ATOM 370 C ASN A 29 7.777 6.144 -3.648 1.00 0.00 C ATOM 371 O ASN A 29 7.247 5.072 -3.415 1.00 0.00 O ATOM 372 CB ASN A 29 6.910 8.222 -2.621 1.00 0.00 C ATOM 373 CG ASN A 29 5.972 9.409 -2.639 1.00 0.00 C ATOM 374 OD1 ASN A 29 5.656 9.964 -3.687 1.00 0.00 O ATOM 375 ND2 ASN A 29 5.558 9.839 -1.469 1.00 0.00 N ATOM 376 H ASN A 29 5.211 6.160 -3.509 1.00 0.00 H ATOM 377 HA ASN A 29 7.234 7.897 -4.750 1.00 0.00 H ATOM 378 HB2 ASN A 29 6.680 7.619 -1.756 1.00 0.00 H ATOM 379 HB3 ASN A 29 7.918 8.596 -2.516 1.00 0.00 H ATOM 380 HD21 ASN A 29 5.880 9.383 -0.663 1.00 0.00 H ATOM 381 HD22 ASN A 29 4.938 10.597 -1.435 1.00 0.00 H ATOM 382 N PRO A 30 9.116 6.282 -3.675 1.00 0.00 N ATOM 383 CA PRO A 30 10.030 5.148 -3.442 1.00 0.00 C ATOM 384 C PRO A 30 9.739 4.399 -2.133 1.00 0.00 C ATOM 385 O PRO A 30 9.859 3.174 -2.064 1.00 0.00 O ATOM 386 CB PRO A 30 11.400 5.820 -3.380 1.00 0.00 C ATOM 387 CG PRO A 30 11.251 7.008 -4.253 1.00 0.00 C ATOM 388 CD PRO A 30 9.871 7.523 -3.981 1.00 0.00 C ATOM 389 HA PRO A 30 10.006 4.445 -4.260 1.00 0.00 H ATOM 390 HB2 PRO A 30 11.620 6.097 -2.359 1.00 0.00 H ATOM 391 HB3 PRO A 30 12.155 5.146 -3.752 1.00 0.00 H ATOM 392 HG2 PRO A 30 11.994 7.749 -3.996 1.00 0.00 H ATOM 393 HG3 PRO A 30 11.344 6.720 -5.289 1.00 0.00 H ATOM 394 HD2 PRO A 30 9.885 8.186 -3.131 1.00 0.00 H ATOM 395 HD3 PRO A 30 9.458 8.018 -4.846 1.00 0.00 H ATOM 396 N TYR A 31 9.347 5.129 -1.106 1.00 0.00 N ATOM 397 CA TYR A 31 9.059 4.502 0.170 1.00 0.00 C ATOM 398 C TYR A 31 7.541 4.384 0.383 1.00 0.00 C ATOM 399 O TYR A 31 7.068 3.510 1.112 1.00 0.00 O ATOM 400 CB TYR A 31 9.664 5.343 1.318 1.00 0.00 C ATOM 401 CG TYR A 31 11.177 5.573 1.250 1.00 0.00 C ATOM 402 CD1 TYR A 31 12.045 4.888 2.087 1.00 0.00 C ATOM 403 CD2 TYR A 31 11.725 6.482 0.355 1.00 0.00 C ATOM 404 CE1 TYR A 31 13.414 5.106 2.030 1.00 0.00 C ATOM 405 CE2 TYR A 31 13.081 6.701 0.292 1.00 0.00 C ATOM 406 CZ TYR A 31 13.921 6.016 1.125 1.00 0.00 C ATOM 407 OH TYR A 31 15.282 6.242 1.059 1.00 0.00 O ATOM 408 H TYR A 31 9.276 6.100 -1.217 1.00 0.00 H ATOM 409 HA TYR A 31 9.511 3.522 0.184 1.00 0.00 H ATOM 410 HB2 TYR A 31 9.192 6.313 1.318 1.00 0.00 H ATOM 411 HB3 TYR A 31 9.443 4.853 2.255 1.00 0.00 H ATOM 412 HD1 TYR A 31 11.643 4.176 2.793 1.00 0.00 H ATOM 413 HD2 TYR A 31 11.070 7.025 -0.307 1.00 0.00 H ATOM 414 HE1 TYR A 31 14.075 4.565 2.689 1.00 0.00 H ATOM 415 HE2 TYR A 31 13.483 7.410 -0.417 1.00 0.00 H ATOM 416 HH TYR A 31 15.679 5.367 0.952 1.00 0.00 H ATOM 417 N TYR A 32 6.783 5.256 -0.251 1.00 0.00 N ATOM 418 CA TYR A 32 5.342 5.256 -0.068 1.00 0.00 C ATOM 419 C TYR A 32 4.609 4.440 -1.134 1.00 0.00 C ATOM 420 O TYR A 32 4.566 4.829 -2.305 1.00 0.00 O ATOM 421 CB TYR A 32 4.794 6.681 0.013 1.00 0.00 C ATOM 422 CG TYR A 32 3.344 6.761 0.443 1.00 0.00 C ATOM 423 CD1 TYR A 32 2.360 7.275 -0.396 1.00 0.00 C ATOM 424 CD2 TYR A 32 2.963 6.321 1.704 1.00 0.00 C ATOM 425 CE1 TYR A 32 1.046 7.350 0.023 1.00 0.00 C ATOM 426 CE2 TYR A 32 1.652 6.390 2.117 1.00 0.00 C ATOM 427 CZ TYR A 32 0.704 6.907 1.276 1.00 0.00 C ATOM 428 OH TYR A 32 -0.601 6.984 1.691 1.00 0.00 O ATOM 429 H TYR A 32 7.199 5.872 -0.886 1.00 0.00 H ATOM 430 HA TYR A 32 5.159 4.775 0.883 1.00 0.00 H ATOM 431 HB2 TYR A 32 5.379 7.250 0.720 1.00 0.00 H ATOM 432 HB3 TYR A 32 4.872 7.142 -0.962 1.00 0.00 H ATOM 433 HD1 TYR A 32 2.621 7.623 -1.386 1.00 0.00 H ATOM 434 HD2 TYR A 32 3.713 5.915 2.366 1.00 0.00 H ATOM 435 HE1 TYR A 32 0.283 7.748 -0.629 1.00 0.00 H ATOM 436 HE2 TYR A 32 1.376 6.043 3.101 1.00 0.00 H ATOM 437 HH TYR A 32 -1.166 6.874 0.917 1.00 0.00 H ATOM 438 N SER A 33 3.985 3.381 -0.718 1.00 0.00 N ATOM 439 CA SER A 33 3.194 2.559 -1.595 1.00 0.00 C ATOM 440 C SER A 33 1.804 2.464 -0.986 1.00 0.00 C ATOM 441 O SER A 33 1.677 2.156 0.192 1.00 0.00 O ATOM 442 CB SER A 33 3.840 1.182 -1.726 1.00 0.00 C ATOM 443 OG SER A 33 5.214 1.311 -2.068 1.00 0.00 O ATOM 444 H SER A 33 4.050 3.112 0.219 1.00 0.00 H ATOM 445 HA SER A 33 3.132 3.038 -2.560 1.00 0.00 H ATOM 446 HB2 SER A 33 3.759 0.652 -0.788 1.00 0.00 H ATOM 447 HB3 SER A 33 3.338 0.626 -2.504 1.00 0.00 H ATOM 448 HG SER A 33 5.462 0.606 -2.673 1.00 0.00 H ATOM 449 N GLN A 34 0.792 2.736 -1.759 1.00 0.00 N ATOM 450 CA GLN A 34 -0.565 2.817 -1.255 1.00 0.00 C ATOM 451 C GLN A 34 -1.514 1.931 -2.055 1.00 0.00 C ATOM 452 O GLN A 34 -1.356 1.775 -3.258 1.00 0.00 O ATOM 453 CB GLN A 34 -1.012 4.294 -1.268 1.00 0.00 C ATOM 454 CG GLN A 34 -2.496 4.534 -1.055 1.00 0.00 C ATOM 455 CD GLN A 34 -2.833 6.002 -1.018 1.00 0.00 C ATOM 456 OE1 GLN A 34 -3.070 6.615 -2.037 1.00 0.00 O ATOM 457 NE2 GLN A 34 -2.931 6.557 0.156 1.00 0.00 N ATOM 458 H GLN A 34 0.937 2.853 -2.726 1.00 0.00 H ATOM 459 HA GLN A 34 -0.555 2.476 -0.231 1.00 0.00 H ATOM 460 HB2 GLN A 34 -0.487 4.811 -0.478 1.00 0.00 H ATOM 461 HB3 GLN A 34 -0.724 4.746 -2.206 1.00 0.00 H ATOM 462 HG2 GLN A 34 -3.042 4.074 -1.865 1.00 0.00 H ATOM 463 HG3 GLN A 34 -2.785 4.083 -0.117 1.00 0.00 H ATOM 464 HE21 GLN A 34 -2.798 6.018 0.967 1.00 0.00 H ATOM 465 HE22 GLN A 34 -3.152 7.515 0.187 1.00 0.00 H ATOM 466 N CYS A 35 -2.465 1.321 -1.366 1.00 0.00 N ATOM 467 CA CYS A 35 -3.455 0.499 -2.007 1.00 0.00 C ATOM 468 C CYS A 35 -4.525 1.366 -2.648 1.00 0.00 C ATOM 469 O CYS A 35 -5.347 1.991 -1.947 1.00 0.00 O ATOM 470 CB CYS A 35 -4.105 -0.438 -1.002 1.00 0.00 C ATOM 471 SG CYS A 35 -2.946 -1.504 -0.102 1.00 0.00 S ATOM 472 H CYS A 35 -2.494 1.411 -0.389 1.00 0.00 H ATOM 473 HA CYS A 35 -2.970 -0.091 -2.770 1.00 0.00 H ATOM 474 HB2 CYS A 35 -4.669 0.140 -0.287 1.00 0.00 H ATOM 475 HB3 CYS A 35 -4.786 -1.073 -1.543 1.00 0.00 H ATOM 476 N LEU A 36 -4.496 1.427 -3.945 1.00 0.00 N ATOM 477 CA LEU A 36 -5.441 2.159 -4.728 1.00 0.00 C ATOM 478 C LEU A 36 -6.343 1.182 -5.426 1.00 0.00 C ATOM 479 O LEU A 36 -5.857 0.418 -6.288 1.00 0.00 O ATOM 480 CB LEU A 36 -4.738 3.075 -5.735 1.00 0.00 C ATOM 481 CG LEU A 36 -3.912 4.221 -5.141 1.00 0.00 C ATOM 482 CD1 LEU A 36 -3.220 5.008 -6.238 1.00 0.00 C ATOM 483 CD2 LEU A 36 -4.796 5.142 -4.324 1.00 0.00 C ATOM 484 OXT LEU A 36 -7.539 1.143 -5.102 1.00 0.00 O ATOM 485 H LEU A 36 -3.795 0.924 -4.423 1.00 0.00 H ATOM 486 HA LEU A 36 -6.038 2.757 -4.057 1.00 0.00 H ATOM 487 HB2 LEU A 36 -4.082 2.462 -6.336 1.00 0.00 H ATOM 488 HB3 LEU A 36 -5.492 3.502 -6.381 1.00 0.00 H ATOM 489 HG LEU A 36 -3.154 3.813 -4.487 1.00 0.00 H ATOM 490 HD11 LEU A 36 -2.554 4.356 -6.785 1.00 0.00 H ATOM 491 HD12 LEU A 36 -2.655 5.816 -5.794 1.00 0.00 H ATOM 492 HD13 LEU A 36 -3.959 5.416 -6.911 1.00 0.00 H ATOM 493 HD21 LEU A 36 -5.588 5.533 -4.945 1.00 0.00 H ATOM 494 HD22 LEU A 36 -4.201 5.960 -3.947 1.00 0.00 H ATOM 495 HD23 LEU A 36 -5.221 4.602 -3.491 1.00 0.00 H TER 496 LEU A 36 HETATM 497 C1 MAN A 101 8.625 -4.658 9.843 1.00 0.00 C HETATM 498 C2 MAN A 101 8.356 -4.609 11.377 1.00 0.00 C HETATM 499 C3 MAN A 101 8.593 -3.208 11.954 1.00 0.00 C HETATM 500 C4 MAN A 101 8.339 -2.116 10.911 1.00 0.00 C HETATM 501 C5 MAN A 101 9.266 -2.327 9.675 1.00 0.00 C HETATM 502 C6 MAN A 101 10.545 -1.511 9.752 1.00 0.00 C HETATM 503 O2 MAN A 101 9.278 -5.476 12.034 1.00 0.00 O HETATM 504 O3 MAN A 101 9.915 -3.168 12.458 1.00 0.00 O HETATM 505 O4 MAN A 101 6.959 -2.104 10.519 1.00 0.00 O HETATM 506 O5 MAN A 101 9.653 -3.738 9.530 1.00 0.00 O HETATM 507 O6 MAN A 101 10.265 -0.115 9.820 1.00 0.00 O HETATM 508 H1 MAN A 101 8.945 -5.690 9.634 1.00 0.00 H HETATM 509 H2 MAN A 101 7.316 -4.913 11.569 1.00 0.00 H HETATM 510 H3 MAN A 101 7.888 -3.114 12.792 1.00 0.00 H HETATM 511 H4 MAN A 101 8.592 -1.148 11.368 1.00 0.00 H HETATM 512 H5 MAN A 101 8.714 -2.045 8.766 1.00 0.00 H HETATM 513 H61 MAN A 101 11.122 -1.725 8.842 1.00 0.00 H HETATM 514 H62 MAN A 101 11.138 -1.837 10.618 1.00 0.00 H HETATM 515 HO2 MAN A 101 9.113 -6.367 11.705 1.00 0.00 H HETATM 516 HO3 MAN A 101 9.947 -3.988 12.970 1.00 0.00 H HETATM 517 HO4 MAN A 101 6.762 -2.964 10.128 1.00 0.00 H HETATM 518 HO6 MAN A 101 9.715 0.122 9.060 1.00 0.00 H