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ID	2381	NAME	PN-AMP2   Blast NCBI-PROT
LENGTH	40	DISULFIDE BRIDGE	4		View PDB REMARK YASARA ************************************************************* REMARK YASARA * * REMARK YASARA * Y A S A R A * REMARK YASARA * * REMARK YASARA * Yet Another Scientific Artificial Reality Application * REMARK YASARA * * REMARK YASARA * MOLECULE STRUCTURE FILE, PDB FORMAT * REMARK YASARA * * REMARK YASARA * Just use YASARA every day to make your questions go away! * REMARK YASARA * * REMARK YASARA * www.YASARA.org * REMARK YASARA * * REMARK YASARA ************************************************************* REMARK YASARA REMARK YASARA Original filename: C:\Users\federica\Favorites\Dropbox\lab13\Lucia\pdb_yadamp\pdb_HM_final\QQCGRQASGRLCGNRLCCSQWGYCGSTASYCGAGCQSQCR.pdb REMARK YASARA Written on: Wed May 14 19:00:23 2014 REMARK YASARA Number of models: 1 REMARK YASARA Number of atoms: 547 REMARK YASARA Please address questions or suggestions to: Eliza@yasara.org REMARK YASARA REMARK 2 RESOLUTION. 1.70 ANGSTROMS. REMARK 290 CRYSTALLOGRAPHIC SYMMETRY TRANSFORMATIONS REMARK 290 THE FOLLOWING TRANSFORMATIONS OPERATE ON THE ATOM/HETATM REMARK 290 RECORDS IN THIS ENTRY TO PRODUCE CRYSTALLOGRAPHICALLY REMARK 290 RELATED MOLECULES. REMARK 290 SMTRY1 1 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 1 0.000000 1.000000 0.000000 0.00000 REMARK 290 SMTRY3 1 0.000000 0.000000 1.000000 0.00000 REMARK 290 SMTRY1 2 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 2 0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 2 0.000000 0.000000 1.000000 16.26333 REMARK 290 SMTRY1 3 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 3 -0.866025 -0.500000 0.000000 0.00000 REMARK 290 SMTRY3 3 0.000000 0.000000 1.000000 32.52667 REMARK 290 SMTRY1 4 -0.500000 0.866025 0.000000 0.00000 REMARK 290 SMTRY2 4 0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 4 0.000000 0.000000 -1.000000 0.00000 REMARK 290 SMTRY1 5 1.000000 0.000000 0.000000 0.00000 REMARK 290 SMTRY2 5 0.000000 -1.000000 0.000000 0.00000 REMARK 290 SMTRY3 5 0.000000 0.000000 -1.000000 32.52667 REMARK 290 SMTRY1 6 -0.500000 -0.866025 0.000000 0.00000 REMARK 290 SMTRY2 6 -0.866025 0.500000 0.000000 0.00000 REMARK 290 SMTRY3 6 0.000000 0.000000 -1.000000 16.26333 COMPND MOL_ID: 1; COMPND 2 MOLECULE: HEVEIN ISOFORM 2; COMPND 3 CHAIN: A; COMPND 4 MOL_ID: 2; COMPND 5 MOLECULE: `NOTE:` This template has been downloaded from PDB_REDO (www.cmbi.ru.nl/pdb_redo), since re-refinement improved the structure quality Z-score by 0.200.; SEQRES 1 A 40 GLN GLN CYS GLY ARG GLN ALA SER GLY ARG LEU CYS GLY SEQRES 2 A 40 ASN ARG LEU CYS CYS SER GLN TRP GLY TYR CYS GLY SER SEQRES 3 A 40 THR ALA SER TYR CYS GLY ALA GLY CYS GLN SER GLN CYS SEQRES 4 A 40 ARG CRYST1 37.200 37.200 48.790 90.00 90.00 120.00 P 31 2 1 6 ORIGX1 1.000000 0.000000 0.000000 0.00000 ORIGX2 0.000000 1.000000 0.000000 0.00000 ORIGX3 0.000000 0.000000 1.000000 0.00000 SCALE1 0.026880 0.015520 0.000000 0.00000 SCALE2 0.000000 0.031040 0.000000 0.00000 SCALE3 0.000000 0.000000 0.020500 0.00000 SSBOND 1 CYS A 3 CYS A 18 2.03 SSBOND 3 CYS A 12 CYS A 24 2.03 SSBOND 5 CYS A 17 CYS A 31 2.03 SSBOND 7 CYS A 35 CYS A 39 2.03 ATOM 1 N GLN A 1 1.753 10.838 54.657 1.00 6.72 N ATOM 2 1H GLN A 1 0.941 10.884 55.257 1.00 6.72 H ATOM 3 2H GLN A 1 1.510 10.343 53.809 1.00 6.72 H ATOM 4 3H GLN A 1 2.058 11.772 54.424 1.00 6.72 H ATOM 5 CA GLN A 1 2.851 10.115 55.361 1.00 6.72 C ATOM 6 HA GLN A 1 3.022 10.597 56.323 1.00 6.72 H ATOM 7 C GLN A 1 4.128 10.187 54.551 1.00 6.72 C ATOM 8 O GLN A 1 4.165 10.952 53.595 1.00 6.72 O ATOM 9 CB GLN A 1 2.418 8.672 55.597 1.00 6.72 C ATOM 10 1HB GLN A 1 1.405 8.572 55.232 1.00 6.72 H ATOM 11 2HB GLN A 1 3.045 7.996 55.020 1.00 6.72 H ATOM 12 CG GLN A 1 2.421 8.252 57.047 1.00 6.72 C ATOM 13 1HG GLN A 1 2.434 7.172 57.087 1.00 6.72 H ATOM 14 2HG GLN A 1 3.318 8.626 57.536 1.00 6.72 H ATOM 15 CD GLN A 1 1.197 8.736 57.784 1.00 6.72 C ATOM 16 OE1 GLN A 1 0.796 9.881 57.636 1.00 6.72 O ATOM 17 NE2 GLN A 1 0.572 7.873 58.529 1.00 6.72 N ATOM 18 1HE2 GLN A 1 -0.241 8.176 59.037 1.00 6.72 H ATOM 19 2HE2 GLN A 1 0.920 6.921 58.600 1.00 6.72 H ATOM 20 N GLN A 2 5.171 9.448 54.913 1.00 -9.30 N ATOM 21 H GLN A 2 5.104 8.789 55.686 1.00 -9.30 H ATOM 22 CA GLN A 2 6.433 9.508 54.177 1.00 -9.30 C ATOM 23 HA GLN A 2 6.591 10.519 53.800 1.00 -9.30 H ATOM 24 C GLN A 2 6.428 8.547 52.995 1.00 -9.30 C ATOM 25 O GLN A 2 6.920 8.881 51.921 1.00 -9.30 O ATOM 26 CB GLN A 2 7.601 9.121 55.086 1.00 -9.30 C ATOM 27 1HB GLN A 2 7.422 8.119 55.472 1.00 -9.30 H ATOM 28 2HB GLN A 2 8.510 9.096 54.484 1.00 -9.30 H ATOM 29 CG GLN A 2 7.831 10.064 56.258 1.00 -9.30 C ATOM 30 1HG GLN A 2 8.011 11.069 55.877 1.00 -9.30 H ATOM 31 2HG GLN A 2 6.945 10.079 56.891 1.00 -9.30 H ATOM 32 CD GLN A 2 9.014 9.633 57.094 1.00 -9.30 C ATOM 33 OE1 GLN A 2 9.095 8.494 57.517 1.00 -9.30 O ATOM 34 NE2 GLN A 2 9.941 10.521 57.326 1.00 -9.30 N ATOM 35 1HE2 GLN A 2 10.730 10.246 57.888 1.00 -9.30 H ATOM 36 2HE2 GLN A 2 9.869 11.451 56.954 1.00 -9.30 H ATOM 37 N CYS A 3 5.884 7.356 53.202 1.00 7.37 N ATOM 38 H CYS A 3 5.440 7.139 54.090 1.00 7.37 H ATOM 39 CA CYS A 3 5.951 6.288 52.212 1.00 7.37 C ATOM 40 HA CYS A 3 6.077 6.710 51.218 1.00 7.37 H ATOM 41 C CYS A 3 4.687 5.429 52.211 1.00 7.37 C ATOM 42 O CYS A 3 3.834 5.537 53.097 1.00 7.37 O ATOM 43 CB CYS A 3 7.168 5.423 52.538 1.00 7.37 C ATOM 44 1HB CYS A 3 7.289 4.655 51.774 1.00 7.37 H ATOM 45 2HB CYS A 3 8.055 6.057 52.532 1.00 7.37 H ATOM 46 SG CYS A 3 7.024 4.638 54.174 1.00 7.37 S ATOM 47 N GLY A 4 4.597 4.552 51.224 1.00 -4.21 N ATOM 48 H GLY A 4 5.286 4.572 50.470 1.00 -4.21 H ATOM 49 CA GLY A 4 3.571 3.532 51.183 1.00 -4.21 C ATOM 50 1HA GLY A 4 3.894 2.733 50.516 1.00 -4.21 H ATOM 51 2HA GLY A 4 3.477 3.118 52.184 1.00 -4.21 H ATOM 52 C GLY A 4 2.202 3.994 50.740 1.00 -4.21 C ATOM 53 O GLY A 4 2.043 5.041 50.111 1.00 -4.21 O ATOM 54 N ARG A 5 1.201 3.210 51.114 1.00 -7.29 N ATOM 55 H ARG A 5 1.433 2.367 51.642 1.00 -7.29 H ATOM 56 CA ARG A 5 -0.214 3.474 50.827 1.00 -7.29 C ATOM 57 HA ARG A 5 -0.398 3.420 49.753 1.00 -7.29 H ATOM 58 C ARG A 5 -0.608 4.863 51.308 1.00 -7.29 C ATOM 59 O ARG A 5 -1.315 5.601 50.638 1.00 -7.29 O ATOM 60 CB ARG A 5 -1.064 2.431 51.575 1.00 -7.29 C ATOM 61 1HB ARG A 5 -0.787 2.479 52.626 1.00 -7.29 H ATOM 62 2HB ARG A 5 -2.115 2.709 51.493 1.00 -7.29 H ATOM 63 CG ARG A 5 -0.910 0.976 51.103 1.00 -7.29 C ATOM 64 1HG ARG A 5 -1.415 0.868 50.143 1.00 -7.29 H ATOM 65 2HG ARG A 5 0.140 0.736 50.963 1.00 -7.29 H ATOM 66 CD ARG A 5 -1.512 -0.025 52.109 1.00 -7.29 C ATOM 67 1HD ARG A 5 -2.527 0.296 52.344 1.00 -7.29 H ATOM 68 2HD ARG A 5 -1.575 -1.003 51.633 1.00 -7.29 H ATOM 69 NE ARG A 5 -0.745 -0.151 53.368 1.00 -7.29 N ATOM 70 HE ARG A 5 -0.934 0.539 54.076 1.00 -7.29 H ATOM 71 CZ ARG A 5 0.158 -1.083 53.665 1.00 -7.29 C ATOM 72 NH1 ARG A 5 0.728 -1.068 54.840 1.00 -7.29 N ATOM 73 1HH1 ARG A 5 0.515 -0.342 55.510 1.00 -7.29 H ATOM 74 2HH1 ARG A 5 1.422 -1.777 55.068 1.00 -7.29 H ATOM 75 NH2 ARG A 5 0.525 -2.038 52.848 1.00 -7.29 N ATOM 76 1HH2 ARG A 5 0.138 -2.079 51.923 1.00 -7.29 H ATOM 77 2HH2 ARG A 5 1.208 -2.720 53.143 1.00 -7.29 H ATOM 78 N GLN A 6 -0.098 5.222 52.473 1.00 16.01 N ATOM 79 H GLN A 6 0.518 4.575 52.955 1.00 16.01 H ATOM 80 CA GLN A 6 -0.414 6.482 53.136 1.00 16.01 C ATOM 81 HA GLN A 6 -1.479 6.684 53.011 1.00 16.01 H ATOM 82 C GLN A 6 0.351 7.684 52.569 1.00 16.01 C ATOM 83 O GLN A 6 0.200 8.815 53.039 1.00 16.01 O ATOM 84 CB GLN A 6 -0.130 6.319 54.632 1.00 16.01 C ATOM 85 1HB GLN A 6 0.933 6.130 54.776 1.00 16.01 H ATOM 86 2HB GLN A 6 -0.384 7.255 55.128 1.00 16.01 H ATOM 87 CG GLN A 6 -0.928 5.210 55.309 1.00 16.01 C ATOM 88 1HG GLN A 6 -1.217 5.560 56.300 1.00 16.01 H ATOM 89 2HG GLN A 6 -1.839 5.021 54.741 1.00 16.01 H ATOM 90 CD GLN A 6 -0.168 3.905 55.481 1.00 16.01 C ATOM 91 OE1 GLN A 6 0.642 3.491 54.651 1.00 16.01 O ATOM 92 NE2 GLN A 6 -0.449 3.231 56.556 1.00 16.01 N ATOM 93 1HE2 GLN A 6 0.056 2.370 56.741 1.00 16.01 H ATOM 94 2HE2 GLN A 6 -1.134 3.575 57.205 1.00 16.01 H ATOM 95 N ALA A 7 1.168 7.454 51.552 1.00 32.16 N ATOM 96 H ALA A 7 1.304 6.503 51.222 1.00 32.16 H ATOM 97 CA ALA A 7 1.864 8.520 50.840 1.00 32.16 C ATOM 98 HA ALA A 7 1.364 9.468 51.037 1.00 32.16 H ATOM 99 C ALA A 7 1.811 8.266 49.332 1.00 32.16 C ATOM 100 O ALA A 7 2.761 8.584 48.617 1.00 32.16 O ATOM 101 CB ALA A 7 3.297 8.609 51.317 1.00 32.16 C ATOM 102 1HB ALA A 7 3.331 8.560 52.402 1.00 32.16 H ATOM 103 2HB ALA A 7 3.737 9.548 50.983 1.00 32.16 H ATOM 104 3HB ALA A 7 3.868 7.781 50.902 1.00 32.16 H ATOM 105 N SER A 8 0.720 7.661 48.882 1.00 12.49 N ATOM 106 H SER A 8 0.001 7.389 49.539 1.00 12.49 H ATOM 107 CA SER A 8 0.462 7.403 47.462 1.00 12.49 C ATOM 108 HA SER A 8 -0.407 6.747 47.413 1.00 12.49 H ATOM 109 C SER A 8 1.581 6.715 46.676 1.00 12.49 C ATOM 110 O SER A 8 1.847 7.057 45.528 1.00 12.49 O ATOM 111 CB SER A 8 0.076 8.714 46.775 1.00 12.49 C ATOM 112 1HB SER A 8 0.955 9.355 46.699 1.00 12.49 H ATOM 113 2HB SER A 8 -0.303 8.503 45.774 1.00 12.49 H ATOM 114 OG SER A 8 -0.922 9.377 47.537 1.00 12.49 O ATOM 115 HG SER A 8 -1.293 10.085 47.003 1.00 12.49 H ATOM 116 N GLY A 9 2.232 5.735 47.288 1.00 -4.58 N ATOM 117 H GLY A 9 2.020 5.518 48.257 1.00 -4.58 H ATOM 118 CA GLY A 9 3.217 4.925 46.584 1.00 -4.58 C ATOM 119 1HA GLY A 9 3.169 3.914 46.985 1.00 -4.58 H ATOM 120 2HA GLY A 9 2.943 4.875 45.530 1.00 -4.58 H ATOM 121 C GLY A 9 4.662 5.375 46.665 1.00 -4.58 C ATOM 122 O GLY A 9 5.526 4.767 46.039 1.00 -4.58 O ATOM 123 N ARG A 10 4.962 6.402 47.450 1.00 -9.22 N ATOM 124 H ARG A 10 4.218 6.904 47.919 1.00 -9.22 H ATOM 125 CA ARG A 10 6.365 6.773 47.690 1.00 -9.22 C ATOM 126 HA ARG A 10 6.872 6.918 46.736 1.00 -9.22 H ATOM 127 C ARG A 10 7.043 5.624 48.425 1.00 -9.22 C ATOM 128 O ARG A 10 6.382 4.883 49.144 1.00 -9.22 O ATOM 129 CB ARG A 10 6.461 8.044 48.532 1.00 -9.22 C ATOM 130 1HB ARG A 10 5.870 7.904 49.434 1.00 -9.22 H ATOM 131 2HB ARG A 10 7.501 8.198 48.821 1.00 -9.22 H ATOM 132 CG ARG A 10 5.976 9.289 47.822 1.00 -9.22 C ATOM 133 1HG ARG A 10 6.626 9.503 46.975 1.00 -9.22 H ATOM 134 2HG ARG A 10 4.962 9.133 47.461 1.00 -9.22 H ATOM 135 CD ARG A 10 5.984 10.462 48.780 1.00 -9.22 C ATOM 136 1HD ARG A 10 5.413 10.193 49.669 1.00 -9.22 H ATOM 137 2HD ARG A 10 7.013 10.676 49.072 1.00 -9.22 H ATOM 138 NE ARG A 10 5.384 11.654 48.164 1.00 -9.22 N ATOM 139 HE ARG A 10 5.044 11.541 47.223 1.00 -9.22 H ATOM 140 CZ ARG A 10 5.241 12.842 48.734 1.00 -9.22 C ATOM 141 NH1 ARG A 10 4.690 13.806 48.050 1.00 -9.22 N ATOM 142 1HH1 ARG A 10 4.377 13.643 47.108 1.00 -9.22 H ATOM 143 2HH1 ARG A 10 4.580 14.716 48.461 1.00 -9.22 H ATOM 144 NH2 ARG A 10 5.619 13.103 49.961 1.00 -9.22 N ATOM 145 1HH2 ARG A 10 6.035 12.369 50.513 1.00 -9.22 H ATOM 146 2HH2 ARG A 10 5.502 14.023 50.346 1.00 -9.22 H ATOM 147 N LEU A 11 8.348 5.468 48.275 1.00-17.70 N ATOM 148 H LEU A 11 8.882 6.136 47.743 1.00-17.70 H ATOM 149 CA LEU A 11 9.062 4.338 48.866 1.00-17.70 C ATOM 150 HA LEU A 11 8.396 3.756 49.500 1.00-17.70 H ATOM 151 C LEU A 11 10.201 4.890 49.707 1.00-17.70 C ATOM 152 O LEU A 11 10.674 5.992 49.445 1.00-17.70 O ATOM 153 CB LEU A 11 9.624 3.435 47.760 1.00-17.70 C ATOM 154 1HB LEU A 11 10.375 4.014 47.222 1.00-17.70 H ATOM 155 2HB LEU A 11 10.134 2.598 48.235 1.00-17.70 H ATOM 156 CG LEU A 11 8.649 2.874 46.708 1.00-17.70 C ATOM 157 HG LEU A 11 8.176 3.715 46.203 1.00-17.70 H ATOM 158 CD1 LEU A 11 9.439 2.089 45.662 1.00-17.70 C ATOM 159 1HD1 LEU A 11 8.762 1.745 44.878 1.00-17.70 H ATOM 160 2HD1 LEU A 11 9.929 1.229 46.118 1.00-17.70 H ATOM 161 3HD1 LEU A 11 10.189 2.735 45.204 1.00-17.70 H ATOM 162 CD2 LEU A 11 7.542 1.982 47.269 1.00-17.70 C ATOM 163 1HD2 LEU A 11 6.850 1.726 46.465 1.00-17.70 H ATOM 164 2HD2 LEU A 11 6.979 2.519 48.031 1.00-17.70 H ATOM 165 3HD2 LEU A 11 7.956 1.070 47.685 1.00-17.70 H ATOM 166 N CYS A 12 10.657 4.128 50.688 1.00 3.01 N ATOM 167 H CYS A 12 10.240 3.225 50.858 1.00 3.01 H ATOM 168 CA CYS A 12 11.838 4.505 51.459 1.00 3.01 C ATOM 169 HA CYS A 12 11.913 5.590 51.544 1.00 3.01 H ATOM 170 C CYS A 12 13.052 3.962 50.711 1.00 3.01 C ATOM 171 O CYS A 12 12.908 3.155 49.789 1.00 3.01 O ATOM 172 CB CYS A 12 11.787 3.892 52.857 1.00 3.01 C ATOM 173 1HB CYS A 12 11.733 2.808 52.754 1.00 3.01 H ATOM 174 2HB CYS A 12 12.705 4.133 53.395 1.00 3.01 H ATOM 175 SG CYS A 12 10.371 4.442 53.854 1.00 3.01 S ATOM 176 N GLY A 13 14.244 4.347 51.144 1.00 3.15 N ATOM 177 H GLY A 13 14.317 4.978 51.929 1.00 3.15 H ATOM 178 CA GLY A 13 15.475 3.846 50.558 1.00 3.15 C ATOM 179 1HA GLY A 13 15.269 2.986 49.923 1.00 3.15 H ATOM 180 2HA GLY A 13 15.932 4.629 49.952 1.00 3.15 H ATOM 181 C GLY A 13 16.442 3.430 51.646 1.00 3.15 C ATOM 182 O GLY A 13 16.118 3.525 52.828 1.00 3.15 O ATOM 183 N ASN A 14 17.627 2.990 51.239 1.00 5.63 N ATOM 184 H ASN A 14 17.780 2.879 50.248 1.00 5.63 H ATOM 185 CA ASN A 14 18.744 2.679 52.142 1.00 5.63 C ATOM 186 HA ASN A 14 19.508 2.182 51.545 1.00 5.63 H ATOM 187 C ASN A 14 18.404 1.741 53.309 1.00 5.63 C ATOM 188 O ASN A 14 18.865 1.947 54.431 1.00 5.63 O ATOM 189 CB ASN A 14 19.348 3.994 52.662 1.00 5.63 C ATOM 190 1HB ASN A 14 19.396 4.711 51.843 1.00 5.63 H ATOM 191 2HB ASN A 14 18.703 4.399 53.441 1.00 5.63 H ATOM 192 CG ASN A 14 20.742 3.821 53.221 1.00 5.63 C ATOM 193 OD1 ASN A 14 21.535 3.023 52.732 1.00 5.63 O ATOM 194 ND2 ASN A 14 21.062 4.578 54.234 1.00 5.63 N ATOM 195 1HD2 ASN A 14 21.995 4.530 54.602 1.00 5.63 H ATOM 196 2HD2 ASN A 14 20.381 5.204 54.628 1.00 5.63 H ATOM 197 N ARG A 15 17.591 0.722 53.033 1.00 6.79 N ATOM 198 H ARG A 15 17.208 0.645 52.092 1.00 6.79 H ATOM 199 CA ARG A 15 17.183 -0.323 53.994 1.00 6.79 C ATOM 200 HA ARG A 15 16.521 -1.012 53.469 1.00 6.79 H ATOM 201 C ARG A 15 16.396 0.198 55.195 1.00 6.79 C ATOM 202 O ARG A 15 16.206 -0.533 56.169 1.00 6.79 O ATOM 203 CB ARG A 15 18.393 -1.140 54.475 1.00 6.79 C ATOM 204 1HB ARG A 15 19.005 -0.481 55.085 1.00 6.79 H ATOM 205 2HB ARG A 15 18.051 -1.952 55.111 1.00 6.79 H ATOM 206 CG ARG A 15 19.247 -1.738 53.349 1.00 6.79 C ATOM 207 1HG ARG A 15 18.708 -2.567 52.888 1.00 6.79 H ATOM 208 2HG ARG A 15 19.423 -0.981 52.589 1.00 6.79 H ATOM 209 CD ARG A 15 20.617 -2.222 53.840 1.00 6.79 C ATOM 210 1HD ARG A 15 20.474 -3.037 54.551 1.00 6.79 H ATOM 211 2HD ARG A 15 21.187 -2.598 52.989 1.00 6.79 H ATOM 212 NE ARG A 15 21.362 -1.133 54.498 1.00 6.79 N ATOM 213 HE ARG A 15 21.403 -1.170 55.503 1.00 6.79 H ATOM 214 CZ ARG A 15 21.921 -0.083 53.910 1.00 6.79 C ATOM 215 NH1 ARG A 15 22.385 0.875 54.658 1.00 6.79 N ATOM 216 1HH1 ARG A 15 22.371 0.801 55.658 1.00 6.79 H ATOM 217 2HH1 ARG A 15 22.722 1.718 54.215 1.00 6.79 H ATOM 218 NH2 ARG A 15 22.010 0.077 52.615 1.00 6.79 N ATOM 219 1HH2 ARG A 15 21.737 -0.663 51.997 1.00 6.79 H ATOM 220 2HH2 ARG A 15 22.333 0.965 52.251 1.00 6.79 H ATOM 221 N LEU A 16 15.911 1.428 55.135 1.00 1.72 N ATOM 222 H LEU A 16 16.111 2.020 54.338 1.00 1.72 H ATOM 223 CA LEU A 16 14.990 1.926 56.150 1.00 1.72 C ATOM 224 HA LEU A 16 15.238 1.512 57.126 1.00 1.72 H ATOM 225 C LEU A 16 13.639 1.403 55.704 1.00 1.72 C ATOM 226 O LEU A 16 13.153 1.777 54.647 1.00 1.72 O ATOM 227 CB LEU A 16 14.978 3.455 56.207 1.00 1.72 C ATOM 228 1HB LEU A 16 14.716 3.826 55.216 1.00 1.72 H ATOM 229 2HB LEU A 16 14.189 3.754 56.895 1.00 1.72 H ATOM 230 CG LEU A 16 16.274 4.153 56.642 1.00 1.72 C ATOM 231 HG LEU A 16 17.082 3.838 55.983 1.00 1.72 H ATOM 232 CD1 LEU A 16 16.104 5.664 56.500 1.00 1.72 C ATOM 233 1HD1 LEU A 16 17.029 6.167 56.778 1.00 1.72 H ATOM 234 2HD1 LEU A 16 15.296 6.018 57.142 1.00 1.72 H ATOM 235 3HD1 LEU A 16 15.874 5.910 55.462 1.00 1.72 H ATOM 236 CD2 LEU A 16 16.663 3.816 58.084 1.00 1.72 C ATOM 237 1HD2 LEU A 16 17.564 4.364 58.357 1.00 1.72 H ATOM 238 2HD2 LEU A 16 16.869 2.750 58.170 1.00 1.72 H ATOM 239 3HD2 LEU A 16 15.856 4.088 58.764 1.00 1.72 H ATOM 240 N CYS A 17 13.069 0.489 56.465 1.00-14.13 N ATOM 241 H CYS A 17 13.469 0.268 57.368 1.00-14.13 H ATOM 242 CA CYS A 17 11.850 -0.193 56.073 1.00-14.13 C ATOM 243 HA CYS A 17 11.964 -0.615 55.078 1.00-14.13 H ATOM 244 C CYS A 17 10.692 0.796 56.092 1.00-14.13 C ATOM 245 O CYS A 17 10.551 1.561 57.045 1.00-14.13 O ATOM 246 CB CYS A 17 11.581 -1.309 57.074 1.00-14.13 C ATOM 247 1HB CYS A 17 11.434 -0.852 58.048 1.00-14.13 H ATOM 248 2HB CYS A 17 10.666 -1.827 56.793 1.00-14.13 H ATOM 249 SG CYS A 17 12.938 -2.512 57.218 1.00-14.13 S ATOM 250 N CYS A 18 9.851 0.781 55.070 1.00-26.18 N ATOM 251 H CYS A 18 10.029 0.153 54.291 1.00-26.18 H ATOM 252 CA CYS A 18 8.625 1.573 55.100 1.00-26.18 C ATOM 253 HA CYS A 18 8.802 2.526 55.597 1.00-26.18 H ATOM 254 C CYS A 18 7.631 0.758 55.896 1.00-26.18 C ATOM 255 O CYS A 18 7.163 -0.271 55.419 1.00-26.18 O ATOM 256 CB CYS A 18 8.039 1.810 53.710 1.00-26.18 C ATOM 257 1HB CYS A 18 8.759 2.357 53.107 1.00-26.18 H ATOM 258 2HB CYS A 18 7.853 0.846 53.247 1.00-26.18 H ATOM 259 SG CYS A 18 6.469 2.735 53.759 1.00-26.18 S ATOM 260 N SER A 19 7.324 1.211 57.095 1.00-13.14 N ATOM 261 H SER A 19 7.736 2.086 57.408 1.00-13.14 H ATOM 262 CA SER A 19 6.428 0.495 57.987 1.00-13.14 C ATOM 263 HA SER A 19 6.806 -0.507 58.157 1.00-13.14 H ATOM 264 C SER A 19 5.021 0.373 57.460 1.00-13.14 C ATOM 265 O SER A 19 4.583 1.122 56.589 1.00-13.14 O ATOM 266 CB SER A 19 6.345 1.233 59.315 1.00-13.14 C ATOM 267 1HB SER A 19 5.638 0.731 59.973 1.00-13.14 H ATOM 268 2HB SER A 19 7.320 1.222 59.786 1.00-13.14 H ATOM 269 OG SER A 19 5.944 2.577 59.103 1.00-13.14 O ATOM 270 HG SER A 19 6.750 3.078 58.892 1.00-13.14 H ATOM 271 N GLN A 20 4.274 -0.495 58.125 1.00 12.23 N ATOM 272 H GLN A 20 4.719 -1.079 58.819 1.00 12.23 H ATOM 273 CA GLN A 20 2.832 -0.625 57.950 1.00 12.23 C ATOM 274 HA GLN A 20 2.618 -1.076 56.985 1.00 12.23 H ATOM 275 C GLN A 20 2.116 0.724 58.027 1.00 12.23 C ATOM 276 O GLN A 20 1.131 0.953 57.322 1.00 12.23 O ATOM 277 CB GLN A 20 2.335 -1.534 59.078 1.00 12.23 C ATOM 278 1HB GLN A 20 2.920 -2.453 59.065 1.00 12.23 H ATOM 279 2HB GLN A 20 2.539 -1.026 60.017 1.00 12.23 H ATOM 280 CG GLN A 20 0.857 -1.902 59.049 1.00 12.23 C ATOM 281 1HG GLN A 20 0.258 -0.992 59.033 1.00 12.23 H ATOM 282 2HG GLN A 20 0.646 -2.479 58.150 1.00 12.23 H ATOM 283 CD GLN A 20 0.463 -2.706 60.271 1.00 12.23 C ATOM 284 OE1 GLN A 20 0.777 -2.338 61.391 1.00 12.23 O ATOM 285 NE2 GLN A 20 -0.212 -3.807 60.071 1.00 12.23 N ATOM 286 1HE2 GLN A 20 -0.481 -4.349 60.876 1.00 12.23 H ATOM 287 2HE2 GLN A 20 -0.461 -4.095 59.142 1.00 12.23 H ATOM 288 N TRP A 21 2.631 1.603 58.876 1.00 -2.91 N ATOM 289 H TRP A 21 3.456 1.348 59.399 1.00 -2.91 H ATOM 290 CA TRP A 21 2.043 2.905 59.174 1.00 -2.91 C ATOM 291 HA TRP A 21 0.959 2.800 59.182 1.00 -2.91 H ATOM 292 C TRP A 21 2.416 4.005 58.179 1.00 -2.91 C ATOM 293 O TRP A 21 1.838 5.090 58.212 1.00 -2.91 O ATOM 294 CB TRP A 21 2.497 3.316 60.578 1.00 -2.91 C ATOM 295 1HB TRP A 21 3.453 3.827 60.494 1.00 -2.91 H ATOM 296 2HB TRP A 21 1.768 4.001 61.011 1.00 -2.91 H ATOM 297 CG TRP A 21 2.690 2.123 61.482 1.00 -2.91 C ATOM 298 CD1 TRP A 21 1.773 1.168 61.812 1.00 -2.91 C ATOM 299 HD1 TRP A 21 0.733 1.191 61.511 1.00 -2.91 H ATOM 300 CD2 TRP A 21 3.908 1.720 62.137 1.00 -2.91 C ATOM 301 NE1 TRP A 21 2.345 0.152 62.526 1.00 -2.91 N ATOM 302 HE1 TRP A 21 1.851 -0.684 62.826 1.00 -2.91 H ATOM 303 CE2 TRP A 21 3.668 0.442 62.721 1.00 -2.91 C ATOM 304 CE3 TRP A 21 5.192 2.291 62.261 1.00 -2.91 C ATOM 305 HE3 TRP A 21 5.398 3.270 61.853 1.00 -2.91 H ATOM 306 CZ2 TRP A 21 4.687 -0.298 63.354 1.00 -2.91 C ATOM 307 HZ2 TRP A 21 4.486 -1.275 63.769 1.00 -2.91 H ATOM 308 CZ3 TRP A 21 6.218 1.554 62.907 1.00 -2.91 C ATOM 309 HZ3 TRP A 21 7.208 1.976 62.993 1.00 -2.91 H ATOM 310 CH2 TRP A 21 5.952 0.259 63.434 1.00 -2.91 C ATOM 311 HH2 TRP A 21 6.745 -0.293 63.907 1.00 -2.91 H ATOM 312 N GLY A 22 3.357 3.722 57.285 1.00-29.29 N ATOM 313 H GLY A 22 3.785 2.800 57.277 1.00-29.29 H ATOM 314 CA GLY A 22 3.765 4.680 56.265 1.00-29.29 C ATOM 315 1HA GLY A 22 4.070 4.118 55.382 1.00-29.29 H ATOM 316 2HA GLY A 22 2.904 5.284 55.982 1.00-29.29 H ATOM 317 C GLY A 22 4.913 5.613 56.614 1.00-29.29 C ATOM 318 O GLY A 22 5.065 6.687 56.020 1.00-29.29 O ATOM 319 N TYR A 23 5.748 5.201 57.557 1.00-16.73 N ATOM 320 H TYR A 23 5.585 4.311 58.003 1.00-16.73 H ATOM 321 CA TYR A 23 6.944 5.956 57.948 1.00-16.73 C ATOM 322 HA TYR A 23 7.054 6.844 57.330 1.00-16.73 H ATOM 323 C TYR A 23 8.165 5.068 57.753 1.00-16.73 C ATOM 324 O TYR A 23 8.039 3.850 57.865 1.00-16.73 O ATOM 325 CB TYR A 23 6.862 6.376 59.415 1.00-16.73 C ATOM 326 1HB TYR A 23 6.758 5.484 60.033 1.00-16.73 H ATOM 327 2HB TYR A 23 7.794 6.873 59.686 1.00-16.73 H ATOM 328 CG TYR A 23 5.715 7.317 59.714 1.00-16.73 C ATOM 329 CD1 TYR A 23 4.482 6.824 60.183 1.00-16.73 C ATOM 330 HD1 TYR A 23 4.348 5.762 60.317 1.00-16.73 H ATOM 331 CD2 TYR A 23 5.867 8.710 59.557 1.00-16.73 C ATOM 332 HD2 TYR A 23 6.811 9.107 59.210 1.00-16.73 H ATOM 333 CE1 TYR A 23 3.417 7.705 60.499 1.00-16.73 C ATOM 334 HE1 TYR A 23 2.478 7.318 60.866 1.00-16.73 H ATOM 335 CE2 TYR A 23 4.801 9.599 59.874 1.00-16.73 C ATOM 336 HE2 TYR A 23 4.930 10.664 59.762 1.00-16.73 H ATOM 337 CZ TYR A 23 3.589 9.082 60.347 1.00-16.73 C ATOM 338 OH TYR A 23 2.544 9.915 60.653 1.00-16.73 O ATOM 339 HH TYR A 23 2.763 10.845 60.570 1.00-16.73 H ATOM 340 N CYS A 24 9.322 5.645 57.471 1.00-12.55 N ATOM 341 H CYS A 24 9.378 6.661 57.421 1.00-12.55 H ATOM 342 CA CYS A 24 10.547 4.870 57.285 1.00-12.55 C ATOM 343 HA CYS A 24 10.305 3.923 56.812 1.00-12.55 H ATOM 344 C CYS A 24 11.205 4.624 58.645 1.00-12.55 C ATOM 345 O CYS A 24 11.132 5.487 59.516 1.00-12.55 O ATOM 346 CB CYS A 24 11.539 5.642 56.405 1.00-12.55 C ATOM 347 1HB CYS A 24 11.844 6.537 56.949 1.00-12.55 H ATOM 348 2HB CYS A 24 12.421 5.020 56.257 1.00-12.55 H ATOM 349 SG CYS A 24 10.918 6.166 54.772 1.00-12.55 S ATOM 350 N GLY A 25 11.905 3.512 58.825 1.00 -7.69 N ATOM 351 H GLY A 25 11.883 2.771 58.129 1.00 -7.69 H ATOM 352 CA GLY A 25 12.687 3.323 60.037 1.00 -7.69 C ATOM 353 1HA GLY A 25 13.339 4.187 60.159 1.00 -7.69 H ATOM 354 2HA GLY A 25 12.015 3.287 60.893 1.00 -7.69 H ATOM 355 C GLY A 25 13.550 2.078 60.040 1.00 -7.69 C ATOM 356 O GLY A 25 13.429 1.218 59.177 1.00 -7.69 O ATOM 357 N SER A 26 14.487 2.000 60.972 1.00 9.23 N ATOM 358 H SER A 26 14.569 2.718 61.676 1.00 9.23 H ATOM 359 CA SER A 26 15.492 0.937 60.954 1.00 9.23 C ATOM 360 HA SER A 26 15.657 0.620 59.925 1.00 9.23 H ATOM 361 C SER A 26 15.174 -0.309 61.778 1.00 9.23 C ATOM 362 O SER A 26 15.760 -1.369 61.543 1.00 9.23 O ATOM 363 CB SER A 26 16.791 1.533 61.487 1.00 9.23 C ATOM 364 1HB SER A 26 17.563 0.762 61.527 1.00 9.23 H ATOM 365 2HB SER A 26 17.114 2.336 60.825 1.00 9.23 H ATOM 366 OG SER A 26 16.559 2.070 62.780 1.00 9.23 O ATOM 367 HG SER A 26 17.392 2.408 63.126 1.00 9.23 H ATOM 368 N THR A 27 14.295 -0.206 62.762 1.00 -8.12 N ATOM 369 H THR A 27 13.795 0.655 62.915 1.00 -8.12 H ATOM 370 CA THR A 27 14.041 -1.328 63.665 1.00 -8.12 C ATOM 371 HA THR A 27 14.977 -1.854 63.851 1.00 -8.12 H ATOM 372 C THR A 27 13.059 -2.309 63.034 1.00 -8.12 C ATOM 373 O THR A 27 12.275 -1.943 62.166 1.00 -8.12 O ATOM 374 CB THR A 27 13.487 -0.827 65.013 1.00 -8.12 C ATOM 375 HB THR A 27 13.205 -1.678 65.633 1.00 -8.12 H ATOM 376 OG1 THR A 27 12.352 0.004 64.775 1.00 -8.12 O ATOM 377 HG1 THR A 27 11.890 0.135 65.609 1.00 -8.12 H ATOM 378 CG2 THR A 27 14.506 0.024 65.753 1.00 -8.12 C ATOM 379 1HG2 THR A 27 14.101 0.310 66.724 1.00 -8.12 H ATOM 380 2HG2 THR A 27 14.732 0.928 65.186 1.00 -8.12 H ATOM 381 3HG2 THR A 27 15.425 -0.543 65.910 1.00 -8.12 H ATOM 382 N ALA A 28 13.087 -3.558 63.486 1.00 -4.16 N ATOM 383 H ALA A 28 13.719 -3.803 64.229 1.00 -4.16 H ATOM 384 CA ALA A 28 12.271 -4.628 62.904 1.00 -4.16 C ATOM 385 HA ALA A 28 12.542 -4.717 61.850 1.00 -4.16 H ATOM 386 C ALA A 28 10.755 -4.391 62.949 1.00 -4.16 C ATOM 387 O ALA A 28 10.012 -4.955 62.154 1.00 -4.16 O ATOM 388 CB ALA A 28 12.622 -5.953 63.590 1.00 -4.16 C ATOM 389 1HB ALA A 28 13.687 -6.160 63.483 1.00 -4.16 H ATOM 390 2HB ALA A 28 12.062 -6.763 63.115 1.00 -4.16 H ATOM 391 3HB ALA A 28 12.358 -5.914 64.647 1.00 -4.16 H ATOM 392 N SER A 29 10.292 -3.509 63.823 1.00 9.27 N ATOM 393 H SER A 29 10.924 -3.037 64.447 1.00 9.27 H ATOM 394 CA SER A 29 8.877 -3.147 63.874 1.00 9.27 C ATOM 395 HA SER A 29 8.274 -4.045 64.013 1.00 9.27 H ATOM 396 C SER A 29 8.421 -2.471 62.580 1.00 9.27 C ATOM 397 O SER A 29 7.261 -2.563 62.199 1.00 9.27 O ATOM 398 CB SER A 29 8.662 -2.211 65.061 1.00 9.27 C ATOM 399 1HB SER A 29 7.629 -1.865 65.080 1.00 9.27 H ATOM 400 2HB SER A 29 8.870 -2.759 65.980 1.00 9.27 H ATOM 401 OG SER A 29 9.555 -1.110 64.983 1.00 9.27 O ATOM 402 HG SER A 29 9.105 -0.380 64.542 1.00 9.27 H ATOM 403 N TYR A 30 9.339 -1.814 61.883 1.00 18.63 N ATOM 404 H TYR A 30 10.294 -1.755 62.224 1.00 18.63 H ATOM 405 CA TYR A 30 9.028 -1.180 60.605 1.00 18.63 C ATOM 406 HA TYR A 30 8.025 -0.760 60.640 1.00 18.63 H ATOM 407 C TYR A 30 9.096 -2.204 59.474 1.00 18.63 C ATOM 408 O TYR A 30 8.572 -1.975 58.395 1.00 18.63 O ATOM 409 CB TYR A 30 10.035 -0.062 60.302 1.00 18.63 C ATOM 410 1HB TYR A 30 11.044 -0.464 60.384 1.00 18.63 H ATOM 411 2HB TYR A 30 9.884 0.261 59.274 1.00 18.63 H ATOM 412 CG TYR A 30 9.920 1.160 61.189 1.00 18.63 C ATOM 413 CD1 TYR A 30 10.379 1.144 62.521 1.00 18.63 C ATOM 414 HD1 TYR A 30 10.834 0.249 62.915 1.00 18.63 H ATOM 415 CD2 TYR A 30 9.374 2.357 60.687 1.00 18.63 C ATOM 416 HD2 TYR A 30 9.071 2.412 59.652 1.00 18.63 H ATOM 417 CE1 TYR A 30 10.246 2.289 63.352 1.00 18.63 C ATOM 418 HE1 TYR A 30 10.592 2.263 64.374 1.00 18.63 H ATOM 419 CE2 TYR A 30 9.239 3.502 61.510 1.00 18.63 C ATOM 420 HE2 TYR A 30 8.822 4.416 61.112 1.00 18.63 H ATOM 421 CZ TYR A 30 9.668 3.455 62.835 1.00 18.63 C ATOM 422 OH TYR A 30 9.521 4.567 63.620 1.00 18.63 O ATOM 423 HH TYR A 30 9.836 4.440 64.516 1.00 18.63 H ATOM 424 N CYS A 31 9.788 -3.309 59.711 1.00 18.83 N ATOM 425 H CYS A 31 10.145 -3.485 60.637 1.00 18.83 H ATOM 426 CA CYS A 31 10.126 -4.260 58.653 1.00 18.83 C ATOM 427 HA CYS A 31 10.064 -3.751 57.694 1.00 18.83 H ATOM 428 C CYS A 31 9.239 -5.500 58.579 1.00 18.83 C ATOM 429 O CYS A 31 9.179 -6.163 57.548 1.00 18.83 O ATOM 430 CB CYS A 31 11.573 -4.696 58.864 1.00 18.83 C ATOM 431 1HB CYS A 31 11.620 -5.325 59.753 1.00 18.83 H ATOM 432 2HB CYS A 31 11.887 -5.294 58.013 1.00 18.83 H ATOM 433 SG CYS A 31 12.731 -3.305 59.075 1.00 18.83 S ATOM 434 N GLY A 32 8.536 -5.801 59.664 1.00 7.93 N ATOM 435 H GLY A 32 8.618 -5.223 60.487 1.00 7.93 H ATOM 436 CA GLY A 32 7.655 -6.960 59.687 1.00 7.93 C ATOM 437 1HA GLY A 32 8.221 -7.834 59.364 1.00 7.93 H ATOM 438 2HA GLY A 32 7.294 -7.125 60.701 1.00 7.93 H ATOM 439 C GLY A 32 6.475 -6.781 58.751 1.00 7.93 C ATOM 440 O GLY A 32 6.174 -5.659 58.371 1.00 7.93 O ATOM 441 N ALA A 33 5.789 -7.867 58.408 1.00 9.17 N ATOM 442 H ALA A 33 5.906 -8.693 58.971 1.00 9.17 H ATOM 443 CA ALA A 33 5.005 -8.026 57.168 1.00 9.17 C ATOM 444 HA ALA A 33 5.731 -7.955 56.355 1.00 9.17 H ATOM 445 C ALA A 33 3.876 -7.050 56.754 1.00 9.17 C ATOM 446 O ALA A 33 3.297 -7.210 55.690 1.00 9.17 O ATOM 447 CB ALA A 33 4.465 -9.468 57.143 1.00 9.17 C ATOM 448 1HB ALA A 33 5.281 -10.177 57.288 1.00 9.17 H ATOM 449 2HB ALA A 33 4.003 -9.667 56.173 1.00 9.17 H ATOM 450 3HB ALA A 33 3.717 -9.600 57.926 1.00 9.17 H ATOM 451 N GLY A 34 3.595 -6.014 57.531 1.00 11.46 N ATOM 452 H GLY A 34 4.060 -5.933 58.425 1.00 11.46 H ATOM 453 CA GLY A 34 2.764 -4.915 57.057 1.00 11.46 C ATOM 454 1HA GLY A 34 1.956 -5.300 56.436 1.00 11.46 H ATOM 455 2HA GLY A 34 2.340 -4.399 57.916 1.00 11.46 H ATOM 456 C GLY A 34 3.588 -3.924 56.245 1.00 11.46 C ATOM 457 O GLY A 34 3.041 -3.007 55.617 1.00 11.46 O ATOM 458 N CYS A 35 4.901 -4.121 56.295 1.00 18.70 N ATOM 459 H CYS A 35 5.246 -4.898 56.846 1.00 18.70 H ATOM 460 CA CYS A 35 5.919 -3.325 55.611 1.00 18.70 C ATOM 461 HA CYS A 35 5.908 -2.315 56.014 1.00 18.70 H ATOM 462 C CYS A 35 5.709 -3.236 54.103 1.00 18.70 C ATOM 463 O CYS A 35 5.180 -4.144 53.471 1.00 18.70 O ATOM 464 CB CYS A 35 7.289 -3.950 55.897 1.00 18.70 C ATOM 465 1HB CYS A 35 7.449 -3.943 56.974 1.00 18.70 H ATOM 466 2HB CYS A 35 7.269 -4.990 55.570 1.00 18.70 H ATOM 467 SG CYS A 35 8.720 -3.150 55.107 1.00 18.70 S ATOM 468 N GLN A 36 6.085 -2.091 53.552 1.00-17.83 N ATOM 469 H GLN A 36 6.557 -1.413 54.145 1.00-17.83 H ATOM 470 CA GLN A 36 5.736 -1.717 52.184 1.00-17.83 C ATOM 471 HA GLN A 36 5.068 -2.481 51.785 1.00-17.83 H ATOM 472 C GLN A 36 6.911 -1.583 51.210 1.00-17.83 C ATOM 473 O GLN A 36 6.737 -1.726 50.005 1.00-17.83 O ATOM 474 CB GLN A 36 4.944 -0.408 52.250 1.00-17.83 C ATOM 475 1HB GLN A 36 5.632 0.411 52.435 1.00-17.83 H ATOM 476 2HB GLN A 36 4.461 -0.244 51.287 1.00-17.83 H ATOM 477 CG GLN A 36 3.891 -0.414 53.365 1.00-17.83 C ATOM 478 1HG GLN A 36 3.310 -1.331 53.290 1.00-17.83 H ATOM 479 2HG GLN A 36 4.384 -0.394 54.336 1.00-17.83 H ATOM 480 CD GLN A 36 2.942 0.748 53.307 1.00-17.83 C ATOM 481 OE1 GLN A 36 2.182 0.887 52.367 1.00-17.83 O ATOM 482 NE2 GLN A 36 2.935 1.568 54.316 1.00-17.83 N ATOM 483 1HE2 GLN A 36 2.267 2.329 54.340 1.00-17.83 H ATOM 484 2HE2 GLN A 36 3.592 1.431 55.080 1.00-17.83 H ATOM 485 N SER A 37 8.111 -1.313 51.712 1.00 1.32 N ATOM 486 H SER A 37 8.232 -1.195 52.709 1.00 1.32 H ATOM 487 CA SER A 37 9.319 -1.258 50.881 1.00 1.32 C ATOM 488 HA SER A 37 9.309 -2.092 50.178 1.00 1.32 H ATOM 489 C SER A 37 10.520 -1.391 51.805 1.00 1.32 C ATOM 490 O SER A 37 10.379 -1.115 52.993 1.00 1.32 O ATOM 491 CB SER A 37 9.418 0.056 50.093 1.00 1.32 C ATOM 492 1HB SER A 37 10.327 0.045 49.490 1.00 1.32 H ATOM 493 2HB SER A 37 8.560 0.119 49.427 1.00 1.32 H ATOM 494 OG SER A 37 9.425 1.201 50.926 1.00 1.32 O ATOM 495 HG SER A 37 8.531 1.310 51.268 1.00 1.32 H ATOM 496 N GLN A 38 11.665 -1.791 51.254 1.00 20.30 N ATOM 497 H GLN A 38 11.669 -2.004 50.269 1.00 20.30 H ATOM 498 CA GLN A 38 12.943 -1.947 51.977 1.00 20.30 C ATOM 499 HA GLN A 38 13.669 -2.363 51.278 1.00 20.30 H ATOM 500 C GLN A 38 12.880 -2.897 53.184 1.00 20.30 C ATOM 501 O GLN A 38 13.652 -2.751 54.126 1.00 20.30 O ATOM 502 CB GLN A 38 13.475 -0.586 52.455 1.00 20.30 C ATOM 503 1HB GLN A 38 12.777 -0.217 53.196 1.00 20.30 H ATOM 504 2HB GLN A 38 14.435 -0.728 52.943 1.00 20.30 H ATOM 505 CG GLN A 38 13.634 0.515 51.423 1.00 20.30 C ATOM 506 1HG GLN A 38 12.693 0.656 50.894 1.00 20.30 H ATOM 507 2HG GLN A 38 13.862 1.438 51.953 1.00 20.30 H ATOM 508 CD GLN A 38 14.740 0.278 50.421 1.00 20.30 C ATOM 509 OE1 GLN A 38 15.895 0.065 50.774 1.00 20.30 O ATOM 510 NE2 GLN A 38 14.414 0.358 49.160 1.00 20.30 N ATOM 511 1HE2 GLN A 38 15.108 0.144 48.465 1.00 20.30 H ATOM 512 2HE2 GLN A 38 13.492 0.671 48.899 1.00 20.30 H ATOM 513 N CYS A 39 11.943 -3.835 53.157 1.00 -9.94 N ATOM 514 H CYS A 39 11.367 -3.938 52.344 1.00 -9.94 H ATOM 515 CA CYS A 39 11.693 -4.735 54.282 1.00 -9.94 C ATOM 516 HA CYS A 39 11.599 -4.140 55.189 1.00 -9.94 H ATOM 517 C CYS A 39 12.836 -5.733 54.460 1.00 -9.94 C ATOM 518 O CYS A 39 13.590 -5.983 53.513 1.00 -9.94 O ATOM 519 CB CYS A 39 10.377 -5.469 54.028 1.00 -9.94 C ATOM 520 1HB CYS A 39 10.537 -6.205 53.239 1.00 -9.94 H ATOM 521 2HB CYS A 39 10.069 -5.993 54.936 1.00 -9.94 H ATOM 522 SG CYS A 39 9.062 -4.327 53.490 1.00 -9.94 S ATOM 523 N ARG A 40 12.968 -6.275 55.663 1.00-19.24 N ATOM 524 H ARG A 40 12.240 -6.168 56.364 1.00-19.24 H ATOM 525 CA ARG A 40 14.099 -7.095 56.095 1.00-19.24 C ATOM 526 HA ARG A 40 14.483 -7.720 55.290 1.00-19.24 H ATOM 527 C ARG A 40 13.503 -7.957 57.189 1.00-19.24 C ATOM 528 O ARG A 40 12.372 -7.585 57.568 1.00-19.24 O ATOM 529 OXT ARG A 40 14.143 -8.900 57.683 1.00-19.24 O ATOM 530 CB ARG A 40 15.202 -6.227 56.707 1.00-19.24 C ATOM 531 1HB ARG A 40 14.740 -5.562 57.436 1.00-19.24 H ATOM 532 2HB ARG A 40 15.899 -6.880 57.231 1.00-19.24 H ATOM 533 CG ARG A 40 15.989 -5.399 55.703 1.00-19.24 C ATOM 534 1HG ARG A 40 16.454 -6.075 54.986 1.00-19.24 H ATOM 535 2HG ARG A 40 15.317 -4.728 55.170 1.00-19.24 H ATOM 536 CD ARG A 40 17.071 -4.569 56.371 1.00-19.24 C ATOM 537 1HD ARG A 40 17.610 -5.184 57.091 1.00-19.24 H ATOM 538 2HD ARG A 40 17.773 -4.252 55.600 1.00-19.24 H ATOM 539 NE ARG A 40 16.538 -3.365 57.024 1.00-19.24 N ATOM 540 HE ARG A 40 16.306 -2.585 56.420 1.00-19.24 H ATOM 541 CZ ARG A 40 16.314 -3.182 58.316 1.00-19.24 C ATOM 542 NH1 ARG A 40 15.961 -1.996 58.699 1.00-19.24 N ATOM 543 1HH1 ARG A 40 15.852 -1.270 57.999 1.00-19.24 H ATOM 544 2HH1 ARG A 40 15.774 -1.813 59.677 1.00-19.24 H ATOM 545 NH2 ARG A 40 16.445 -4.102 59.235 1.00-19.24 N ATOM 546 1HH2 ARG A 40 16.677 -5.043 58.966 1.00-19.24 H ATOM 547 2HH2 ARG A 40 16.275 -3.869 60.197 1.00-19.24 H TER 548 ARG A 40 CONECT 46 43 259 CONECT 175 172 349 CONECT 249 246 433 CONECT 259 46 256 CONECT 349 175 346 CONECT 433 249 430 CONECT 467 464 522 CONECT 522 467 519 END
SEQUENCE	QQCGRQASGRLCGNRLCCSQWGYCGSTASYCGAGCQSQCR
HELICITY	0.00	INSTAB. INDEX	25.38	FLEXIBILITY	18.72
a HYD. MOM.	7.69	b HYD. MOM.	15.02	c HYD. MOM	2.43
a MEAN HYD. MOM.	0.19	b MEAN HYD. MOM.	0.38	c MEAN HYD. MOM.	0.06
CHARGE pH5	4.00	CHARGE pH7	3.64	CHARGE pH9	-2.94
Δ CHARGE pH5-pH9	6.94	ISOELECTRIC POINT	8.76	BOMAN INDEX	2.12
ΔG	19	CPP	-0,33	MLP	-10,02
MOLECULAR VOLUME		POLARITY
MIC E. coli		MIC P. aeruginosa		MIC S. typhimurium
MIC S. aureus		MIC M. luteus		MIC B. subtilis
MIC C. albicans		OTHER
MIC OTHER gram+
MIC OTHER gram-
PHYLUM	Tracheophyta	CLASS	Magnoliopsida	ORDER	Solanales
FAMILY	Convolvulaceae	GENUS	Ipomoea	SPECIES	Ipomoea nil
DATE	1998
TITLE PAPER	Two hevein homologs isolated from the seed of Pharbitis nil L. exhibit potent antifungal activity.