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*** fii_dps_dpe ***elNémo ID: 2206250306133848Job options:ID = 2206250306133848 JOBID = fii_dps_dpe USERID = unknown PRIVAT = 0 NMODES = 5 DQMIN = -100 DQMAX = 100 DQSTEP = 20 DOGRAPHS = on DOPROJMODS = 0 DORMSD = 0 NRBL = 0 CUTOFF = 0 CAONLY = 0 Input data for this run:HEADER fii_dps_dpe REMARK GENERATED BY CHARMM-GUI (HTTP://WWW.CHARMM-GUI.ORG) V3.7 ON JUN, 06. 2022. JOB REMARK READ PDB, MANIPULATE STRUCTURE IF NEEDED, AND GENERATE TOPOLOGY FILE REMARK DATE: 6/ 6/22 22:31: 0 CREATED BY USER: apache ATOM 1 N ALA P 1 -0.495 32.713 125.314 1.00 0.00 PROA ATOM 2 HT1 ALA P 1 0.447 32.608 125.742 1.00 0.00 PROA ATOM 3 HT2 ALA P 1 -0.522 33.583 124.745 1.00 0.00 PROA ATOM 4 HT3 ALA P 1 -0.692 31.894 124.704 1.00 0.00 PROA ATOM 5 CA ALA P 1 -1.532 32.791 126.398 1.00 0.00 PROA ATOM 6 HA ALA P 1 -1.085 33.239 127.273 1.00 0.00 PROA ATOM 7 CB ALA P 1 -2.701 33.659 125.857 1.00 0.00 PROA ATOM 8 HB1 ALA P 1 -3.132 33.193 124.945 1.00 0.00 PROA ATOM 9 HB2 ALA P 1 -2.330 34.673 125.596 1.00 0.00 PROA ATOM 10 HB3 ALA P 1 -3.499 33.739 126.625 1.00 0.00 PROA ATOM 11 C ALA P 1 -2.079 31.416 126.866 1.00 0.00 PROA ATOM 12 O ALA P 1 -2.709 30.728 126.060 1.00 0.00 PROA ATOM 13 N ASN P 2 -1.899 30.958 128.140 1.00 0.00 PROA ATOM 14 HN ASN P 2 -1.373 31.480 128.806 1.00 0.00 PROA ATOM 15 CA ASN P 2 -2.452 29.682 128.637 1.00 0.00 PROA ATOM 16 HA ASN P 2 -2.526 29.013 127.793 1.00 0.00 PROA ATOM 17 CB ASN P 2 -1.593 29.029 129.743 1.00 0.00 PROA ATOM 18 HB1 ASN P 2 -2.151 28.177 130.187 1.00 0.00 PROA ATOM 19 HB2 ASN P 2 -1.382 29.779 130.535 1.00 0.00 PROA ATOM 20 CG ASN P 2 -0.274 28.516 129.189 1.00 0.00 PROA ATOM 21 OD1 ASN P 2 -0.266 27.697 128.263 1.00 0.00 PROA ATOM 22 ND2 ASN P 2 0.858 28.945 129.784 1.00 0.00 PROA ATOM 23 HD21 ASN P 2 1.747 28.632 129.451 1.00 0.00 PROA ATOM 24 HD22 ASN P 2 0.808 29.576 130.558 1.00 0.00 PROA ATOM 25 C ASN P 2 -3.861 29.806 129.228 1.00 0.00 PROA ATOM 26 O ASN P 2 -4.314 28.947 129.997 1.00 0.00 PROA ATOM 27 N THR P 3 -4.575 30.879 128.911 1.00 0.00 PROA ATOM 28 HN THR P 3 -4.120 31.644 128.469 1.00 0.00 PROA ATOM 29 CA THR P 3 -6.014 31.117 129.128 1.00 0.00 PROA ATOM 30 HA THR P 3 -6.327 31.756 128.317 1.00 0.00 PROA ATOM 31 CB THR P 3 -6.994 29.919 129.198 1.00 0.00 PROA ATOM 32 HB THR P 3 -6.607 29.156 129.907 1.00 0.00 PROA ATOM 33 OG1 THR P 3 -7.129 29.324 127.907 1.00 0.00 PROA ATOM 34 HG1 THR P 3 -6.249 29.034 127.656 1.00 0.00 PROA ATOM 35 CG2 THR P 3 -8.435 30.239 129.678 1.00 0.00 PROA ATOM 36 HG21 THR P 3 -8.845 31.101 129.109 1.00 0.00 PROA ATOM 37 HG22 THR P 3 -8.425 30.500 130.758 1.00 0.00 PROA ATOM 38 HG23 THR P 3 -9.093 29.359 129.512 1.00 0.00 PROA ATOM 39 C THR P 3 -6.272 32.038 130.279 1.00 0.00 PROA ATOM 40 O THR P 3 -6.953 33.045 130.112 1.00 0.00 PROA ATOM 41 N PHE P 4 -5.755 31.721 131.479 1.00 0.00 PROA ATOM 42 HN PHE P 4 -5.029 31.044 131.564 1.00 0.00 PROA ATOM 43 CA PHE P 4 -6.194 32.319 132.734 1.00 0.00 PROA ATOM 44 HA PHE P 4 -7.261 32.477 132.682 1.00 0.00 PROA ATOM 45 CB PHE P 4 -5.837 31.362 133.910 1.00 0.00 PROA ATOM 46 HB1 PHE P 4 -5.960 31.903 134.872 1.00 0.00 PROA ATOM 47 HB2 PHE P 4 -4.787 31.018 133.796 1.00 0.00 PROA ATOM 48 CG PHE P 4 -6.707 30.127 133.977 1.00 0.00 PROA ATOM 49 CD1 PHE P 4 -6.131 28.863 134.189 1.00 0.00 PROA ATOM 50 HD1 PHE P 4 -5.056 28.766 134.210 1.00 0.00 PROA ATOM 51 CE1 PHE P 4 -6.929 27.726 134.374 1.00 0.00 PROA ATOM 52 HE1 PHE P 4 -6.467 26.765 134.545 1.00 0.00 PROA ATOM 53 CZ PHE P 4 -8.321 27.834 134.337 1.00 0.00 PROA ATOM 54 HZ PHE P 4 -8.937 26.956 134.465 1.00 0.00 PROA ATOM 55 CD2 PHE P 4 -8.108 30.220 133.969 1.00 0.00 PROA ATOM 56 HD2 PHE P 4 -8.575 31.184 133.833 1.00 0.00 PROA ATOM 57 CE2 PHE P 4 -8.911 29.083 134.134 1.00 0.00 PROA ATOM 58 HE2 PHE P 4 -9.987 29.173 134.104 1.00 0.00 PROA ATOM 59 C PHE P 4 -5.736 33.765 133.007 1.00 0.00 PROA ATOM 60 O PHE P 4 -6.080 34.696 132.291 1.00 0.00 PROA ATOM 61 N LEU P 5 -4.974 34.029 134.094 1.00 0.00 PROA ATOM 62 HN LEU P 5 -4.576 33.304 134.651 1.00 0.00 PROA ATOM 63 CA LEU P 5 -4.687 35.396 134.518 1.00 0.00 PROA ATOM 64 HA LEU P 5 -5.369 36.051 133.996 1.00 0.00 PROA ATOM 65 CB LEU P 5 -4.847 35.574 136.043 1.00 0.00 PROA ATOM 66 HB1 LEU P 5 -4.588 36.625 136.290 1.00 0.00 PROA ATOM 67 HB2 LEU P 5 -4.122 34.897 136.540 1.00 0.00 PROA ATOM 68 CG LEU P 5 -6.244 35.283 136.634 1.00 0.00 PROA ATOM 69 HG LEU P 5 -6.452 34.192 136.611 1.00 0.00 PROA ATOM 70 CD1 LEU P 5 -6.233 35.790 138.079 1.00 0.00 PROA ATOM 71 HD11 LEU P 5 -6.023 36.881 138.099 1.00 0.00 PROA ATOM 72 HD12 LEU P 5 -5.442 35.266 138.658 1.00 0.00 PROA ATOM 73 HD13 LEU P 5 -7.223 35.610 138.550 1.00 0.00 PROA ATOM 74 CD2 LEU P 5 -7.410 35.928 135.867 1.00 0.00 PROA ATOM 75 HD21 LEU P 5 -7.428 35.560 134.819 1.00 0.00 PROA ATOM 76 HD22 LEU P 5 -7.289 37.032 135.853 1.00 0.00 PROA ATOM 77 HD23 LEU P 5 -8.374 35.664 136.352 1.00 0.00 PROA ATOM 78 C LEU P 5 -3.313 35.918 134.094 1.00 0.00 PROA ATOM 79 O LEU P 5 -2.870 36.984 134.538 1.00 0.00 PROA ATOM 80 N CGU P 6 -2.588 35.229 133.194 1.00 0.00 PROA ATOM 81 HN CGU P 6 -2.922 34.373 132.808 1.00 0.00 PROA ATOM 82 CA CGU P 6 -1.280 35.660 132.712 1.00 0.00 PROA ATOM 83 HA CGU P 6 -0.645 35.821 133.570 1.00 0.00 PROA ATOM 84 CB CGU P 6 -0.635 34.604 131.779 1.00 0.00 PROA ATOM 85 HB1 CGU P 6 -0.895 33.597 132.167 1.00 0.00 PROA ATOM 86 HB2 CGU P 6 0.467 34.734 131.822 1.00 0.00 PROA ATOM 87 CG CGU P 6 -1.073 34.675 130.284 1.00 0.00 PROA ATOM 88 HG CGU P 6 -0.917 35.710 129.911 1.00 0.00 PROA ATOM 89 CD1 CGU P 6 -0.304 33.737 129.415 1.00 0.00 PROA ATOM 90 OE12 CGU P 6 0.014 34.196 128.279 1.00 0.00 PROA ATOM 91 OE11 CGU P 6 -0.136 32.557 129.818 1.00 0.00 PROA ATOM 92 CD2 CGU P 6 -2.552 34.630 130.083 1.00 0.00 PROA ATOM 93 OE22 CGU P 6 -3.019 35.501 129.278 1.00 0.00 PROA ATOM 94 OE21 CGU P 6 -3.234 33.742 130.644 1.00 0.00 PROA ATOM 95 C CGU P 6 -1.295 37.040 132.035 1.00 0.00 PROA ATOM 96 O CGU P 6 -0.392 37.849 132.244 1.00 0.00 PROA ATOM 97 N CGU P 7 -2.375 37.351 131.285 1.00 0.00 PROA ATOM 98 HN CGU P 7 -3.096 36.676 131.160 1.00 0.00 PROA ATOM 99 CA CGU P 7 -2.633 38.610 130.601 1.00 0.00 PROA ATOM 100 HA CGU P 7 -1.735 38.907 130.080 1.00 0.00 PROA ATOM 101 CB CGU P 7 -3.795 38.434 129.596 1.00 0.00 PROA ATOM 102 HB1 CGU P 7 -4.353 39.392 129.533 1.00 0.00 PROA ATOM 103 HB2 CGU P 7 -4.476 37.645 129.980 1.00 0.00 PROA ATOM 104 CG CGU P 7 -3.339 38.035 128.163 1.00 0.00 PROA ATOM 105 HG CGU P 7 -2.688 37.137 128.228 1.00 0.00 PROA ATOM 106 CD1 CGU P 7 -4.487 37.724 127.261 1.00 0.00 PROA ATOM 107 OE12 CGU P 7 -4.307 36.742 126.484 1.00 0.00 PROA ATOM 108 OE11 CGU P 7 -5.470 38.509 127.259 1.00 0.00 PROA ATOM 109 CD2 CGU P 7 -2.322 38.956 127.573 1.00 0.00 PROA ATOM 110 OE22 CGU P 7 -1.324 38.384 127.026 1.00 0.00 PROA ATOM 111 OE21 CGU P 7 -2.514 40.193 127.587 1.00 0.00 PROA ATOM 112 C CGU P 7 -2.891 39.814 131.513 1.00 0.00 PROA ATOM 113 O CGU P 7 -2.978 40.953 131.063 1.00 0.00 PROA ATOM 114 N VAL P 8 -2.998 39.612 132.846 1.00 0.00 PROA ATOM 115 HN VAL P 8 -3.093 38.697 133.231 1.00 0.00 PROA ATOM 116 CA VAL P 8 -2.982 40.706 133.813 1.00 0.00 PROA ATOM 117 HA VAL P 8 -3.601 41.501 133.424 1.00 0.00 PROA ATOM 118 CB VAL P 8 -3.504 40.252 135.178 1.00 0.00 PROA ATOM 119 HB VAL P 8 -2.853 39.436 135.556 1.00 0.00 PROA ATOM 120 CG1 VAL P 8 -3.528 41.391 136.221 1.00 0.00 PROA ATOM 121 HG11 VAL P 8 -4.034 42.285 135.798 1.00 0.00 PROA ATOM 122 HG12 VAL P 8 -2.490 41.670 136.500 1.00 0.00 PROA ATOM 123 HG13 VAL P 8 -4.083 41.063 137.126 1.00 0.00 PROA ATOM 124 CG2 VAL P 8 -4.926 39.689 135.007 1.00 0.00 PROA ATOM 125 HG21 VAL P 8 -4.913 38.824 134.310 1.00 0.00 PROA ATOM 126 HG22 VAL P 8 -5.595 40.471 134.589 1.00 0.00 PROA ATOM 127 HG23 VAL P 8 -5.318 39.348 135.989 1.00 0.00 PROA ATOM 128 C VAL P 8 -1.585 41.282 133.960 1.00 0.00 PROA ATOM 129 O VAL P 8 -1.392 42.455 134.288 1.00 0.00 PROA ATOM 130 N ARG P 9 -0.540 40.469 133.721 1.00 0.00 PROA ATOM 131 HN ARG P 9 -0.663 39.528 133.417 1.00 0.00 PROA ATOM 132 CA ARG P 9 0.822 40.905 133.888 1.00 0.00 PROA ATOM 133 HA ARG P 9 0.875 41.470 134.807 1.00 0.00 PROA ATOM 134 CB ARG P 9 1.810 39.714 133.941 1.00 0.00 PROA ATOM 135 HB1 ARG P 9 2.810 40.097 134.237 1.00 0.00 PROA ATOM 136 HB2 ARG P 9 1.881 39.268 132.926 1.00 0.00 PROA ATOM 137 CG ARG P 9 1.394 38.613 134.932 1.00 0.00 PROA ATOM 138 HG1 ARG P 9 0.383 38.250 134.650 1.00 0.00 PROA ATOM 139 HG2 ARG P 9 1.347 39.055 135.949 1.00 0.00 PROA ATOM 140 CD ARG P 9 2.343 37.418 134.968 1.00 0.00 PROA ATOM 141 HD1 ARG P 9 2.576 37.059 133.943 1.00 0.00 PROA ATOM 142 HD2 ARG P 9 1.923 36.590 135.578 1.00 0.00 PROA ATOM 143 NE ARG P 9 3.597 37.921 135.613 1.00 0.00 PROA ATOM 144 HE ARG P 9 3.575 38.830 136.028 1.00 0.00 PROA ATOM 145 CZ ARG P 9 4.746 37.235 135.671 1.00 0.00 PROA ATOM 146 NH1 ARG P 9 4.854 36.031 135.121 1.00 0.00 PROA ATOM 147 HH11 ARG P 9 4.126 35.685 134.529 1.00 0.00 PROA ATOM 148 HH12 ARG P 9 5.663 35.471 135.299 1.00 0.00 PROA ATOM 149 NH2 ARG P 9 5.795 37.757 136.300 1.00 0.00 PROA ATOM 150 HH21 ARG P 9 5.724 38.658 136.727 1.00 0.00 PROA ATOM 151 HH22 ARG P 9 6.655 37.248 136.346 1.00 0.00 PROA ATOM 152 C ARG P 9 1.240 41.796 132.743 1.00 0.00 PROA ATOM 153 O ARG P 9 0.815 41.610 131.606 1.00 0.00 PROA ATOM 154 N LYS P 10 2.139 42.769 132.982 1.00 0.00 PROA ATOM 155 HN LYS P 10 2.416 43.035 133.902 1.00 0.00 PROA ATOM 156 CA LYS P 10 2.753 43.485 131.882 1.00 0.00 PROA ATOM 157 HA LYS P 10 1.961 43.894 131.272 1.00 0.00 PROA ATOM 158 CB LYS P 10 3.680 44.624 132.384 1.00 0.00 PROA ATOM 159 HB1 LYS P 10 3.091 45.281 133.058 1.00 0.00 PROA ATOM 160 HB2 LYS P 10 4.013 45.215 131.505 1.00 0.00 PROA ATOM 161 CG LYS P 10 4.929 44.149 133.146 1.00 0.00 PROA ATOM 162 HG1 LYS P 10 5.517 43.482 132.480 1.00 0.00 PROA ATOM 163 HG2 LYS P 10 4.601 43.571 134.036 1.00 0.00 PROA ATOM 164 CD LYS P 10 5.840 45.298 133.616 1.00 0.00 PROA ATOM 165 HD1 LYS P 10 5.249 45.978 134.266 1.00 0.00 PROA ATOM 166 HD2 LYS P 10 6.188 45.863 132.726 1.00 0.00 PROA ATOM 167 CE LYS P 10 7.063 44.812 134.398 1.00 0.00 PROA ATOM 168 HE1 LYS P 10 7.694 44.162 133.754 1.00 0.00 PROA ATOM 169 HE2 LYS P 10 6.740 44.255 135.303 1.00 0.00 PROA ATOM 170 NZ LYS P 10 7.885 45.964 134.835 1.00 0.00 PROA ATOM 171 HZ1 LYS P 10 7.316 46.584 135.446 1.00 0.00 PROA ATOM 172 HZ2 LYS P 10 8.205 46.497 134.002 1.00 0.00 PROA ATOM 173 HZ3 LYS P 10 8.711 45.619 135.364 1.00 0.00 PROA ATOM 174 C LYS P 10 3.494 42.552 130.927 1.00 0.00 PROA ATOM 175 O LYS P 10 4.122 41.558 131.342 1.00 0.00 PROA ATOM 176 N GLY P 11 3.389 42.843 129.614 1.00 0.00 PROA ATOM 177 HN GLY P 11 2.836 43.613 129.310 1.00 0.00 PROA ATOM 178 CA GLY P 11 4.037 42.106 128.543 1.00 0.00 PROA ATOM 179 HA1 GLY P 11 3.867 42.646 127.623 1.00 0.00 PROA ATOM 180 HA2 GLY P 11 3.579 41.129 128.492 1.00 0.00 PROA ATOM 181 C GLY P 11 5.513 41.939 128.741 1.00 0.00 PROA ATOM 182 O GLY P 11 6.226 42.847 129.166 1.00 0.00 PROA ATOM 183 N ASN P 12 6.033 40.747 128.445 1.00 0.00 PROA ATOM 184 HN ASN P 12 5.483 39.984 128.114 1.00 0.00 PROA ATOM 185 CA ASN P 12 7.436 40.516 128.596 1.00 0.00 PROA ATOM 186 HA ASN P 12 7.946 41.465 128.524 1.00 0.00 PROA ATOM 187 CB ASN P 12 7.710 39.856 129.964 1.00 0.00 PROA ATOM 188 HB1 ASN P 12 7.148 38.900 130.030 1.00 0.00 PROA ATOM 189 HB2 ASN P 12 7.370 40.535 130.775 1.00 0.00 PROA ATOM 190 CG ASN P 12 9.189 39.571 130.149 1.00 0.00 PROA ATOM 191 OD1 ASN P 12 9.651 38.558 129.629 1.00 0.00 PROA ATOM 192 ND2 ASN P 12 9.955 40.425 130.857 1.00 0.00 PROA ATOM 193 HD21 ASN P 12 10.930 40.238 130.980 1.00 0.00 PROA ATOM 194 HD22 ASN P 12 9.548 41.245 131.260 1.00 0.00 PROA ATOM 195 C ASN P 12 7.834 39.676 127.409 1.00 0.00 PROA ATOM 196 O ASN P 12 7.325 38.572 127.210 1.00 0.00 PROA ATOM 197 N LEU P 13 8.739 40.199 126.574 1.00 0.00 PROA ATOM 198 HN LEU P 13 9.175 41.074 126.768 1.00 0.00 PROA ATOM 199 CA LEU P 13 9.157 39.564 125.348 1.00 0.00 PROA ATOM 200 HA LEU P 13 8.277 39.314 124.775 1.00 0.00 PROA ATOM 201 CB LEU P 13 10.055 40.529 124.569 1.00 0.00 PROA ATOM 202 HB1 LEU P 13 11.072 40.491 125.013 1.00 0.00 PROA ATOM 203 HB2 LEU P 13 9.647 41.555 124.688 1.00 0.00 PROA ATOM 204 CG LEU P 13 10.176 40.233 123.069 1.00 0.00 PROA ATOM 205 HG LEU P 13 10.472 39.171 122.932 1.00 0.00 PROA ATOM 206 CD1 LEU P 13 8.853 40.483 122.332 1.00 0.00 PROA ATOM 207 HD11 LEU P 13 8.546 41.544 122.449 1.00 0.00 PROA ATOM 208 HD12 LEU P 13 8.056 39.834 122.755 1.00 0.00 PROA ATOM 209 HD13 LEU P 13 8.977 40.267 121.249 1.00 0.00 PROA ATOM 210 CD2 LEU P 13 11.300 41.106 122.507 1.00 0.00 PROA ATOM 211 HD21 LEU P 13 12.283 40.752 122.884 1.00 0.00 PROA ATOM 212 HD22 LEU P 13 11.156 42.160 122.827 1.00 0.00 PROA ATOM 213 HD23 LEU P 13 11.304 41.050 121.397 1.00 0.00 PROA ATOM 214 C LEU P 13 9.873 38.245 125.531 1.00 0.00 PROA ATOM 215 O LEU P 13 9.655 37.310 124.767 1.00 0.00 PROA ATOM 216 N CGU P 14 10.734 38.141 126.563 1.00 0.00 PROA ATOM 217 HN CGU P 14 10.940 38.921 127.148 1.00 0.00 PROA ATOM 218 CA CGU P 14 11.421 36.909 126.904 1.00 0.00 PROA ATOM 219 HA CGU P 14 11.967 36.565 126.038 1.00 0.00 PROA ATOM 220 CB CGU P 14 12.388 37.188 128.071 1.00 0.00 PROA ATOM 221 HB1 CGU P 14 11.781 37.509 128.943 1.00 0.00 PROA ATOM 222 HB2 CGU P 14 13.053 38.023 127.767 1.00 0.00 PROA ATOM 223 CG CGU P 14 13.286 36.012 128.528 1.00 0.00 PROA ATOM 224 HG CGU P 14 13.827 35.607 127.647 1.00 0.00 PROA ATOM 225 CD1 CGU P 14 14.291 36.422 129.555 1.00 0.00 PROA ATOM 226 OE12 CGU P 14 15.436 35.902 129.421 1.00 0.00 PROA ATOM 227 OE11 CGU P 14 13.902 37.140 130.511 1.00 0.00 PROA ATOM 228 CD2 CGU P 14 12.531 34.770 128.866 1.00 0.00 PROA ATOM 229 OE22 CGU P 14 13.003 33.695 128.369 1.00 0.00 PROA ATOM 230 OE21 CGU P 14 11.545 34.825 129.635 1.00 0.00 PROA ATOM 231 C CGU P 14 10.424 35.831 127.255 1.00 0.00 PROA ATOM 232 O CGU P 14 10.278 34.847 126.490 1.00 0.00 PROA ATOM 233 N ARG P 15 9.598 36.027 128.271 1.00 0.00 PROA ATOM 234 HN ARG P 15 9.623 36.882 128.780 1.00 0.00 PROA ATOM 235 CA ARG P 15 8.611 35.080 128.745 1.00 0.00 PROA ATOM 236 HA ARG P 15 9.112 34.157 128.997 1.00 0.00 PROA ATOM 237 CB ARG P 15 7.912 35.682 129.984 1.00 0.00 PROA ATOM 238 HB1 ARG P 15 7.299 36.545 129.648 1.00 0.00 PROA ATOM 239 HB2 ARG P 15 8.697 36.046 130.679 1.00 0.00 PROA ATOM 240 CG ARG P 15 6.996 34.719 130.760 1.00 0.00 PROA ATOM 241 HG1 ARG P 15 7.539 34.359 131.659 1.00 0.00 PROA ATOM 242 HG2 ARG P 15 6.761 33.850 130.109 1.00 0.00 PROA ATOM 243 CD ARG P 15 5.681 35.365 131.208 1.00 0.00 PROA ATOM 244 HD1 ARG P 15 5.095 34.655 131.830 1.00 0.00 PROA ATOM 245 HD2 ARG P 15 5.086 35.680 130.324 1.00 0.00 PROA ATOM 246 NE ARG P 15 5.980 36.584 132.036 1.00 0.00 PROA ATOM 247 HE ARG P 15 6.762 36.562 132.659 1.00 0.00 PROA ATOM 248 CZ ARG P 15 5.240 37.696 131.971 1.00 0.00 PROA ATOM 249 NH1 ARG P 15 4.118 37.767 131.259 1.00 0.00 PROA ATOM 250 HH11 ARG P 15 3.719 36.937 130.870 1.00 0.00 PROA ATOM 251 HH12 ARG P 15 3.674 38.651 131.113 1.00 0.00 PROA ATOM 252 NH2 ARG P 15 5.638 38.808 132.595 1.00 0.00 PROA ATOM 253 HH21 ARG P 15 6.493 38.812 133.114 1.00 0.00 PROA ATOM 254 HH22 ARG P 15 5.081 39.637 132.543 1.00 0.00 PROA ATOM 255 C ARG P 15 7.542 34.710 127.723 1.00 0.00 PROA ATOM 256 O ARG P 15 7.273 33.538 127.481 1.00 0.00 PROA ATOM 257 N CGU P 16 6.914 35.714 127.076 1.00 0.00 PROA ATOM 258 HN CGU P 16 7.175 36.668 127.197 1.00 0.00 PROA ATOM 259 CA CGU P 16 5.815 35.463 126.160 1.00 0.00 PROA ATOM 260 HA CGU P 16 5.288 34.586 126.506 1.00 0.00 PROA ATOM 261 CB CGU P 16 4.828 36.666 126.084 1.00 0.00 PROA ATOM 262 HB1 CGU P 16 4.044 36.414 125.340 1.00 0.00 PROA ATOM 263 HB2 CGU P 16 5.397 37.548 125.724 1.00 0.00 PROA ATOM 264 CG CGU P 16 4.106 37.074 127.421 1.00 0.00 PROA ATOM 265 HG CGU P 16 4.871 37.231 128.211 1.00 0.00 PROA ATOM 266 CD1 CGU P 16 3.304 38.326 127.281 1.00 0.00 PROA ATOM 267 OE12 CGU P 16 3.359 39.111 128.271 1.00 0.00 PROA ATOM 268 OE11 CGU P 16 2.565 38.447 126.271 1.00 0.00 PROA ATOM 269 CD2 CGU P 16 3.384 35.950 128.087 1.00 0.00 PROA ATOM 270 OE22 CGU P 16 3.587 35.840 129.340 1.00 0.00 PROA ATOM 271 OE21 CGU P 16 2.599 35.232 127.427 1.00 0.00 PROA ATOM 272 C CGU P 16 6.263 34.987 124.766 1.00 0.00 PROA ATOM 273 O CGU P 16 5.642 34.100 124.186 1.00 0.00 PROA ATOM 274 N CYS P 17 7.349 35.551 124.183 1.00 0.00 PROA ATOM 275 HN CYS P 17 7.953 36.157 124.693 1.00 0.00 PROA ATOM 276 CA CYS P 17 7.725 35.327 122.783 1.00 0.00 PROA ATOM 277 HA CYS P 17 6.962 34.711 122.332 1.00 0.00 PROA ATOM 278 CB CYS P 17 7.861 36.664 122.002 1.00 0.00 PROA ATOM 279 HB1 CYS P 17 8.806 36.623 121.421 1.00 0.00 PROA ATOM 280 HB2 CYS P 17 7.939 37.485 122.745 1.00 0.00 PROA ATOM 281 SG CYS P 17 6.498 37.045 120.862 1.00 0.00 PROA ATOM 282 C CYS P 17 9.052 34.628 122.543 1.00 0.00 PROA ATOM 283 O CYS P 17 9.313 34.207 121.403 1.00 0.00 PROA ATOM 284 N VAL P 18 9.945 34.492 123.532 1.00 0.00 PROA ATOM 285 HN VAL P 18 9.790 34.878 124.438 1.00 0.00 PROA ATOM 286 CA VAL P 18 11.199 33.774 123.354 1.00 0.00 PROA ATOM 287 HA VAL P 18 11.278 33.502 122.312 1.00 0.00 PROA ATOM 288 CB VAL P 18 12.399 34.622 123.766 1.00 0.00 PROA ATOM 289 HB VAL P 18 12.259 34.965 124.813 1.00 0.00 PROA ATOM 290 CG1 VAL P 18 13.717 33.827 123.668 1.00 0.00 PROA ATOM 291 HG11 VAL P 18 13.792 33.334 122.675 1.00 0.00 PROA ATOM 292 HG12 VAL P 18 13.746 33.045 124.456 1.00 0.00 PROA ATOM 293 HG13 VAL P 18 14.582 34.513 123.790 1.00 0.00 PROA ATOM 294 CG2 VAL P 18 12.458 35.864 122.851 1.00 0.00 PROA ATOM 295 HG21 VAL P 18 11.526 36.460 122.955 1.00 0.00 PROA ATOM 296 HG22 VAL P 18 12.560 35.548 121.791 1.00 0.00 PROA ATOM 297 HG23 VAL P 18 13.321 36.503 123.136 1.00 0.00 PROA ATOM 298 C VAL P 18 11.169 32.438 124.083 1.00 0.00 PROA ATOM 299 O VAL P 18 11.656 31.432 123.571 1.00 0.00 PROA ATOM 300 N CGU P 19 10.549 32.376 125.278 1.00 0.00 PROA ATOM 301 HN CGU P 19 10.181 33.195 125.711 1.00 0.00 PROA ATOM 302 CA CGU P 19 10.364 31.145 126.027 1.00 0.00 PROA ATOM 303 HA CGU P 19 11.223 30.512 125.864 1.00 0.00 PROA ATOM 304 CB CGU P 19 10.220 31.469 127.528 1.00 0.00 PROA ATOM 305 HB1 CGU P 19 9.978 30.525 128.060 1.00 0.00 PROA ATOM 306 HB2 CGU P 19 9.373 32.176 127.645 1.00 0.00 PROA ATOM 307 CG CGU P 19 11.461 32.095 128.208 1.00 0.00 PROA ATOM 308 HG CGU P 19 11.781 32.985 127.626 1.00 0.00 PROA ATOM 309 CD1 CGU P 19 11.193 32.519 129.614 1.00 0.00 PROA ATOM 310 OE12 CGU P 19 11.725 33.616 129.954 1.00 0.00 PROA ATOM 311 OE11 CGU P 19 10.574 31.724 130.366 1.00 0.00 PROA ATOM 312 CD2 CGU P 19 12.713 31.301 128.032 1.00 0.00 PROA ATOM 313 OE22 CGU P 19 13.739 31.973 127.686 1.00 0.00 PROA ATOM 314 OE21 CGU P 19 12.716 30.074 128.276 1.00 0.00 PROA ATOM 315 C CGU P 19 9.125 30.364 125.611 1.00 0.00 PROA ATOM 316 O CGU P 19 9.027 29.161 125.862 1.00 0.00 PROA ATOM 317 N CGU P 20 8.178 31.027 124.931 1.00 0.00 PROA ATOM 318 HN CGU P 20 8.287 31.995 124.721 1.00 0.00 PROA ATOM 319 CA CGU P 20 6.953 30.442 124.450 1.00 0.00 PROA ATOM 320 HA CGU P 20 7.092 29.372 124.396 1.00 0.00 PROA ATOM 321 CB CGU P 20 5.757 30.765 125.385 1.00 0.00 PROA ATOM 322 HB1 CGU P 20 4.891 30.156 125.052 1.00 0.00 PROA ATOM 323 HB2 CGU P 20 5.511 31.840 125.262 1.00 0.00 PROA ATOM 324 CG CGU P 20 5.972 30.497 126.896 1.00 0.00 PROA ATOM 325 HG CGU P 20 6.896 31.017 127.227 1.00 0.00 PROA ATOM 326 CD1 CGU P 20 4.832 30.977 127.732 1.00 0.00 PROA ATOM 327 OE12 CGU P 20 5.162 31.518 128.827 1.00 0.00 PROA ATOM 328 OE11 CGU P 20 3.664 30.711 127.351 1.00 0.00 PROA ATOM 329 CD2 CGU P 20 6.424 29.108 127.206 1.00 0.00 PROA ATOM 330 OE22 CGU P 20 7.402 29.023 128.019 1.00 0.00 PROA ATOM 331 OE21 CGU P 20 5.812 28.128 126.723 1.00 0.00 PROA ATOM 332 C CGU P 20 6.701 31.012 123.069 1.00 0.00 PROA ATOM 333 O CGU P 20 7.289 32.030 122.680 1.00 0.00 PROA ATOM 334 N THR P 21 5.877 30.354 122.246 1.00 0.00 PROA ATOM 335 HN THR P 21 5.574 29.428 122.454 1.00 0.00 PROA ATOM 336 CA THR P 21 5.356 30.910 121.001 1.00 0.00 PROA ATOM 337 HA THR P 21 6.180 31.403 120.509 1.00 0.00 PROA ATOM 338 CB THR P 21 4.739 29.892 120.048 1.00 0.00 PROA ATOM 339 HB THR P 21 4.524 30.397 119.082 1.00 0.00 PROA ATOM 340 OG1 THR P 21 3.524 29.300 120.506 1.00 0.00 PROA ATOM 341 HG1 THR P 21 3.099 29.961 121.057 1.00 0.00 PROA ATOM 342 CG2 THR P 21 5.747 28.759 119.820 1.00 0.00 PROA ATOM 343 HG21 THR P 21 5.855 28.152 120.744 1.00 0.00 PROA ATOM 344 HG22 THR P 21 6.740 29.183 119.557 1.00 0.00 PROA ATOM 345 HG23 THR P 21 5.394 28.098 119.000 1.00 0.00 PROA ATOM 346 C THR P 21 4.408 32.072 121.235 1.00 0.00 PROA ATOM 347 O THR P 21 3.661 32.074 122.215 1.00 0.00 PROA ATOM 348 N CYS P 22 4.364 33.108 120.368 1.00 0.00 PROA ATOM 349 HN CYS P 22 4.889 33.133 119.521 1.00 0.00 PROA ATOM 350 CA CYS P 22 3.515 34.260 120.662 1.00 0.00 PROA ATOM 351 HA CYS P 22 2.711 33.903 121.287 1.00 0.00 PROA ATOM 352 CB CYS P 22 4.231 35.453 121.377 1.00 0.00 PROA ATOM 353 HB1 CYS P 22 4.954 35.016 122.095 1.00 0.00 PROA ATOM 354 HB2 CYS P 22 3.455 36.005 121.946 1.00 0.00 PROA ATOM 355 SG CYS P 22 5.130 36.660 120.346 1.00 0.00 PROA ATOM 356 C CYS P 22 2.821 34.738 119.419 1.00 0.00 PROA ATOM 357 O CYS P 22 3.284 34.497 118.300 1.00 0.00 PROA ATOM 358 N SER P 23 1.680 35.429 119.589 1.00 0.00 PROA ATOM 359 HN SER P 23 1.238 35.453 120.481 1.00 0.00 PROA ATOM 360 CA SER P 23 0.988 36.181 118.563 1.00 0.00 PROA ATOM 361 HA SER P 23 1.176 35.687 117.622 1.00 0.00 PROA ATOM 362 CB SER P 23 -0.553 36.289 118.799 1.00 0.00 PROA ATOM 363 HB1 SER P 23 -0.903 35.351 119.280 1.00 0.00 PROA ATOM 364 HB2 SER P 23 -1.053 36.410 117.815 1.00 0.00 PROA ATOM 365 OG SER P 23 -0.965 37.384 119.633 1.00 0.00 PROA ATOM 366 HG1 SER P 23 -1.895 37.238 119.821 1.00 0.00 PROA ATOM 367 C SER P 23 1.625 37.531 118.278 1.00 0.00 PROA ATOM 368 O SER P 23 2.503 38.011 119.031 1.00 0.00 PROA ATOM 369 N TYR P 24 1.255 38.209 117.186 1.00 0.00 PROA ATOM 370 HN TYR P 24 0.653 37.796 116.508 1.00 0.00 PROA ATOM 371 CA TYR P 24 1.675 39.570 116.883 1.00 0.00 PROA ATOM 372 HA TYR P 24 2.746 39.615 117.010 1.00 0.00 PROA ATOM 373 CB TYR P 24 1.296 40.010 115.437 1.00 0.00 PROA ATOM 374 HB1 TYR P 24 1.530 39.187 114.728 1.00 0.00 PROA ATOM 375 HB2 TYR P 24 1.870 40.922 115.167 1.00 0.00 PROA ATOM 376 CG TYR P 24 -0.169 40.337 115.280 1.00 0.00 PROA ATOM 377 CD1 TYR P 24 -1.127 39.354 114.984 1.00 0.00 PROA ATOM 378 HD1 TYR P 24 -0.814 38.338 114.793 1.00 0.00 PROA ATOM 379 CE1 TYR P 24 -2.489 39.687 114.936 1.00 0.00 PROA ATOM 380 HE1 TYR P 24 -3.218 38.925 114.702 1.00 0.00 PROA ATOM 381 CZ TYR P 24 -2.910 40.993 115.188 1.00 0.00 PROA ATOM 382 OH TYR P 24 -4.280 41.320 115.122 1.00 0.00 PROA ATOM 383 HH TYR P 24 -4.391 42.206 115.474 1.00 0.00 PROA ATOM 384 CD2 TYR P 24 -0.604 41.648 115.530 1.00 0.00 PROA ATOM 385 HD2 TYR P 24 0.122 42.420 115.737 1.00 0.00 PROA ATOM 386 CE2 TYR P 24 -1.966 41.968 115.514 1.00 0.00 PROA ATOM 387 HE2 TYR P 24 -2.287 42.971 115.754 1.00 0.00 PROA ATOM 388 C TYR P 24 1.199 40.574 117.934 1.00 0.00 PROA ATOM 389 O TYR P 24 1.915 41.507 118.284 1.00 0.00 PROA ATOM 390 N CGU P 25 -0.038 40.386 118.449 1.00 0.00 PROA ATOM 391 HN CGU P 25 -0.632 39.666 118.100 1.00 0.00 PROA ATOM 392 CA CGU P 25 -0.610 41.180 119.521 1.00 0.00 PROA ATOM 393 HA CGU P 25 -0.473 42.224 119.283 1.00 0.00 PROA ATOM 394 CB CGU P 25 -2.111 40.865 119.668 1.00 0.00 PROA ATOM 395 HB1 CGU P 25 -2.212 39.830 120.057 1.00 0.00 PROA ATOM 396 HB2 CGU P 25 -2.578 40.919 118.662 1.00 0.00 PROA ATOM 397 CG CGU P 25 -2.885 41.816 120.613 1.00 0.00 PROA ATOM 398 HG CGU P 25 -2.704 42.865 120.297 1.00 0.00 PROA ATOM 399 CD1 CGU P 25 -4.357 41.564 120.601 1.00 0.00 PROA ATOM 400 OE12 CGU P 25 -5.079 42.603 120.636 1.00 0.00 PROA ATOM 401 OE11 CGU P 25 -4.756 40.373 120.675 1.00 0.00 PROA ATOM 402 CD2 CGU P 25 -2.290 41.933 121.977 1.00 0.00 PROA ATOM 403 OE22 CGU P 25 -2.174 43.122 122.420 1.00 0.00 PROA ATOM 404 OE21 CGU P 25 -1.996 40.901 122.623 1.00 0.00 PROA ATOM 405 C CGU P 25 0.158 41.012 120.831 1.00 0.00 PROA ATOM 406 O CGU P 25 0.560 42.008 121.440 1.00 0.00 PROA ATOM 407 N CGU P 26 0.508 39.775 121.242 1.00 0.00 PROA ATOM 408 HN CGU P 26 0.202 38.965 120.749 1.00 0.00 PROA ATOM 409 CA CGU P 26 1.347 39.505 122.419 1.00 0.00 PROA ATOM 410 HA CGU P 26 0.878 39.968 123.275 1.00 0.00 PROA ATOM 411 CB CGU P 26 1.514 37.974 122.680 1.00 0.00 PROA ATOM 412 HB1 CGU P 26 2.497 37.818 123.170 1.00 0.00 PROA ATOM 413 HB2 CGU P 26 1.515 37.459 121.697 1.00 0.00 PROA ATOM 414 CG CGU P 26 0.422 37.301 123.572 1.00 0.00 PROA ATOM 415 HG CGU P 26 -0.580 37.535 123.154 1.00 0.00 PROA ATOM 416 CD1 CGU P 26 0.572 35.818 123.642 1.00 0.00 PROA ATOM 417 OE12 CGU P 26 -0.513 35.167 123.610 1.00 0.00 PROA ATOM 418 OE11 CGU P 26 1.721 35.346 123.840 1.00 0.00 PROA ATOM 419 CD2 CGU P 26 0.227 37.965 124.895 1.00 0.00 PROA ATOM 420 OE22 CGU P 26 -0.986 38.179 125.223 1.00 0.00 PROA ATOM 421 OE21 CGU P 26 1.216 38.220 125.619 1.00 0.00 PROA ATOM 422 C CGU P 26 2.738 40.151 122.300 1.00 0.00 PROA ATOM 423 O CGU P 26 3.279 40.720 123.259 1.00 0.00 PROA ATOM 424 N ALA P 27 3.354 40.121 121.101 1.00 0.00 PROA ATOM 425 HN ALA P 27 2.993 39.574 120.351 1.00 0.00 PROA ATOM 426 CA ALA P 27 4.567 40.861 120.795 1.00 0.00 PROA ATOM 427 HA ALA P 27 5.291 40.644 121.566 1.00 0.00 PROA ATOM 428 CB ALA P 27 5.129 40.471 119.414 1.00 0.00 PROA ATOM 429 HB1 ALA P 27 4.381 40.689 118.622 1.00 0.00 PROA ATOM 430 HB2 ALA P 27 5.362 39.385 119.393 1.00 0.00 PROA ATOM 431 HB3 ALA P 27 6.050 41.055 119.202 1.00 0.00 PROA ATOM 432 C ALA P 27 4.403 42.380 120.871 1.00 0.00 PROA ATOM 433 O ALA P 27 5.252 43.066 121.437 1.00 0.00 PROA ATOM 434 N PHE P 28 3.295 42.933 120.339 1.00 0.00 PROA ATOM 435 HN PHE P 28 2.656 42.373 119.819 1.00 0.00 PROA ATOM 436 CA PHE P 28 2.910 44.335 120.447 1.00 0.00 PROA ATOM 437 HA PHE P 28 3.734 44.940 120.099 1.00 0.00 PROA ATOM 438 CB PHE P 28 1.636 44.602 119.589 1.00 0.00 PROA ATOM 439 HB1 PHE P 28 0.803 43.969 119.963 1.00 0.00 PROA ATOM 440 HB2 PHE P 28 1.852 44.360 118.527 1.00 0.00 PROA ATOM 441 CG PHE P 28 1.166 46.033 119.635 1.00 0.00 PROA ATOM 442 CD1 PHE P 28 1.856 47.041 118.948 1.00 0.00 PROA ATOM 443 HD1 PHE P 28 2.669 46.778 118.288 1.00 0.00 PROA ATOM 444 CE1 PHE P 28 1.501 48.384 119.109 1.00 0.00 PROA ATOM 445 HE1 PHE P 28 2.062 49.154 118.600 1.00 0.00 PROA ATOM 446 CZ PHE P 28 0.423 48.733 119.927 1.00 0.00 PROA ATOM 447 HZ PHE P 28 0.148 49.770 120.049 1.00 0.00 PROA ATOM 448 CD2 PHE P 28 0.074 46.394 120.441 1.00 0.00 PROA ATOM 449 HD2 PHE P 28 -0.486 45.627 120.955 1.00 0.00 PROA ATOM 450 CE2 PHE P 28 -0.298 47.734 120.586 1.00 0.00 PROA ATOM 451 HE2 PHE P 28 -1.142 47.997 121.207 1.00 0.00 PROA ATOM 452 C PHE P 28 2.716 44.798 121.891 1.00 0.00 PROA ATOM 453 O PHE P 28 3.197 45.853 122.270 1.00 0.00 PROA ATOM 454 N CGU P 29 2.038 44.008 122.736 1.00 0.00 PROA ATOM 455 HN CGU P 29 1.584 43.183 122.410 1.00 0.00 PROA ATOM 456 CA CGU P 29 1.896 44.258 124.164 1.00 0.00 PROA ATOM 457 HA CGU P 29 1.481 45.246 124.301 1.00 0.00 PROA ATOM 458 CB CGU P 29 0.970 43.209 124.771 1.00 0.00 PROA ATOM 459 HB1 CGU P 29 1.242 43.084 125.840 1.00 0.00 PROA ATOM 460 HB2 CGU P 29 1.140 42.248 124.241 1.00 0.00 PROA ATOM 461 CG CGU P 29 -0.532 43.542 124.693 1.00 0.00 PROA ATOM 462 HG CGU P 29 -0.796 43.775 123.640 1.00 0.00 PROA ATOM 463 CD1 CGU P 29 -1.395 42.416 125.161 1.00 0.00 PROA ATOM 464 OE12 CGU P 29 -2.447 42.231 124.484 1.00 0.00 PROA ATOM 465 OE11 CGU P 29 -1.079 41.833 126.230 1.00 0.00 PROA ATOM 466 CD2 CGU P 29 -0.888 44.873 125.269 1.00 0.00 PROA ATOM 467 OE22 CGU P 29 -1.659 45.588 124.550 1.00 0.00 PROA ATOM 468 OE21 CGU P 29 -0.480 45.192 126.408 1.00 0.00 PROA ATOM 469 C CGU P 29 3.182 44.225 124.979 1.00 0.00 PROA ATOM 470 O CGU P 29 3.320 44.909 125.997 1.00 0.00 PROA ATOM 471 N ALA P 30 4.140 43.377 124.581 1.00 0.00 PROA ATOM 472 HN ALA P 30 3.985 42.756 123.818 1.00 0.00 PROA ATOM 473 CA ALA P 30 5.447 43.274 125.189 1.00 0.00 PROA ATOM 474 HA ALA P 30 5.349 43.439 126.252 1.00 0.00 PROA ATOM 475 CB ALA P 30 5.994 41.868 124.899 1.00 0.00 PROA ATOM 476 HB1 ALA P 30 6.073 41.708 123.802 1.00 0.00 PROA ATOM 477 HB2 ALA P 30 5.310 41.101 125.321 1.00 0.00 PROA ATOM 478 HB3 ALA P 30 7.004 41.755 125.347 1.00 0.00 PROA ATOM 479 C ALA P 30 6.472 44.298 124.710 1.00 0.00 PROA ATOM 480 O ALA P 30 7.557 44.410 125.301 1.00 0.00 PROA ATOM 481 N LEU P 31 6.179 45.038 123.632 1.00 0.00 PROA ATOM 482 HN LEU P 31 5.316 44.905 123.153 1.00 0.00 PROA ATOM 483 CA LEU P 31 7.024 46.063 123.058 1.00 0.00 PROA ATOM 484 HA LEU P 31 7.929 46.112 123.645 1.00 0.00 PROA ATOM 485 CB LEU P 31 7.365 45.753 121.574 1.00 0.00 PROA ATOM 486 HB1 LEU P 31 7.974 46.590 121.173 1.00 0.00 PROA ATOM 487 HB2 LEU P 31 6.415 45.692 121.002 1.00 0.00 PROA ATOM 488 CG LEU P 31 8.146 44.437 121.362 1.00 0.00 PROA ATOM 489 HG LEU P 31 7.665 43.632 121.957 1.00 0.00 PROA ATOM 490 CD1 LEU P 31 8.176 44.017 119.886 1.00 0.00 PROA ATOM 491 HD11 LEU P 31 8.665 44.805 119.275 1.00 0.00 PROA ATOM 492 HD12 LEU P 31 7.140 43.871 119.513 1.00 0.00 PROA ATOM 493 HD13 LEU P 31 8.751 43.073 119.773 1.00 0.00 PROA ATOM 494 CD2 LEU P 31 9.566 44.494 121.928 1.00 0.00 PROA ATOM 495 HD21 LEU P 31 9.534 44.690 123.021 1.00 0.00 PROA ATOM 496 HD22 LEU P 31 10.136 45.312 121.438 1.00 0.00 PROA ATOM 497 HD23 LEU P 31 10.081 43.524 121.757 1.00 0.00 PROA ATOM 498 C LEU P 31 6.361 47.429 123.159 1.00 0.00 PROA ATOM 499 O LEU P 31 5.147 47.571 123.284 1.00 0.00 PROA ATOM 500 N CGU P 32 7.171 48.499 123.077 1.00 0.00 PROA ATOM 501 HN CGU P 32 8.132 48.404 122.831 1.00 0.00 PROA ATOM 502 CA CGU P 32 6.728 49.852 123.333 1.00 0.00 PROA ATOM 503 HA CGU P 32 5.796 49.814 123.878 1.00 0.00 PROA ATOM 504 CB CGU P 32 7.807 50.588 124.167 1.00 0.00 PROA ATOM 505 HB1 CGU P 32 7.493 51.646 124.286 1.00 0.00 PROA ATOM 506 HB2 CGU P 32 8.763 50.557 123.603 1.00 0.00 PROA ATOM 507 CG CGU P 32 8.057 49.992 125.584 1.00 0.00 PROA ATOM 508 HG CGU P 32 8.268 48.906 125.487 1.00 0.00 PROA ATOM 509 CD1 CGU P 32 9.207 50.638 126.284 1.00 0.00 PROA ATOM 510 OE12 CGU P 32 9.944 49.850 126.943 1.00 0.00 PROA ATOM 511 OE11 CGU P 32 9.286 51.893 126.261 1.00 0.00 PROA ATOM 512 CD2 CGU P 32 6.822 49.866 126.414 1.00 0.00 PROA ATOM 513 OE22 CGU P 32 6.678 48.746 127.005 1.00 0.00 PROA ATOM 514 OE21 CGU P 32 6.047 50.841 126.536 1.00 0.00 PROA ATOM 515 C CGU P 32 6.420 50.645 122.050 1.00 0.00 PROA ATOM 516 O CGU P 32 6.163 51.853 122.078 1.00 0.00 PROA ATOM 517 N SER P 33 6.434 50.022 120.851 1.00 0.00 PROA ATOM 518 HN SER P 33 6.643 49.053 120.748 1.00 0.00 PROA ATOM 519 CA SER P 33 6.136 50.765 119.628 1.00 0.00 PROA ATOM 520 HA SER P 33 5.229 51.317 119.819 1.00 0.00 PROA ATOM 521 CB SER P 33 7.239 51.761 119.126 1.00 0.00 PROA ATOM 522 HB1 SER P 33 7.558 52.388 119.985 1.00 0.00 PROA ATOM 523 HB2 SER P 33 6.792 52.407 118.341 1.00 0.00 PROA ATOM 524 OG SER P 33 8.428 51.166 118.566 1.00 0.00 PROA ATOM 525 HG1 SER P 33 8.969 50.902 119.314 1.00 0.00 PROA ATOM 526 C SER P 33 5.745 49.888 118.466 1.00 0.00 PROA ATOM 527 O SER P 33 6.149 48.724 118.381 1.00 0.00 PROA ATOM 528 N SER P 34 4.976 50.427 117.494 1.00 0.00 PROA ATOM 529 HN SER P 34 4.561 51.326 117.604 1.00 0.00 PROA ATOM 530 CA SER P 34 4.688 49.759 116.224 1.00 0.00 PROA ATOM 531 HA SER P 34 4.219 48.814 116.455 1.00 0.00 PROA ATOM 532 CB SER P 34 3.766 50.587 115.300 1.00 0.00 PROA ATOM 533 HB1 SER P 34 3.508 49.989 114.400 1.00 0.00 PROA ATOM 534 HB2 SER P 34 4.289 51.517 114.989 1.00 0.00 PROA ATOM 535 OG SER P 34 2.554 50.946 115.975 1.00 0.00 PROA ATOM 536 HG1 SER P 34 1.990 50.170 115.936 1.00 0.00 PROA ATOM 537 C SER P 34 5.944 49.419 115.442 1.00 0.00 PROA ATOM 538 O SER P 34 6.110 48.304 114.967 1.00 0.00 PROA ATOM 539 N THR P 35 6.904 50.369 115.387 1.00 0.00 PROA ATOM 540 HN THR P 35 6.754 51.265 115.795 1.00 0.00 PROA ATOM 541 CA THR P 35 8.211 50.200 114.753 1.00 0.00 PROA ATOM 542 HA THR P 35 8.051 50.060 113.694 1.00 0.00 PROA ATOM 543 CB THR P 35 9.098 51.414 114.995 1.00 0.00 PROA ATOM 544 HB THR P 35 9.265 51.542 116.086 1.00 0.00 PROA ATOM 545 OG1 THR P 35 8.489 52.594 114.486 1.00 0.00 PROA ATOM 546 HG1 THR P 35 8.370 52.445 113.545 1.00 0.00 PROA ATOM 547 CG2 THR P 35 10.474 51.291 114.326 1.00 0.00 PROA ATOM 548 HG21 THR P 35 10.356 51.001 113.260 1.00 0.00 PROA ATOM 549 HG22 THR P 35 11.076 50.512 114.841 1.00 0.00 PROA ATOM 550 HG23 THR P 35 11.005 52.266 114.372 1.00 0.00 PROA ATOM 551 C THR P 35 8.979 49.012 115.274 1.00 0.00 PROA ATOM 552 O THR P 35 9.491 48.193 114.501 1.00 0.00 PROA ATOM 553 N ALA P 36 9.071 48.857 116.600 1.00 0.00 PROA ATOM 554 HN ALA P 36 8.690 49.534 117.224 1.00 0.00 PROA ATOM 555 CA ALA P 36 9.710 47.732 117.237 1.00 0.00 PROA ATOM 556 HA ALA P 36 10.682 47.593 116.788 1.00 0.00 PROA ATOM 557 CB ALA P 36 9.844 48.007 118.743 1.00 0.00 PROA ATOM 558 HB1 ALA P 36 8.840 48.161 119.194 1.00 0.00 PROA ATOM 559 HB2 ALA P 36 10.451 48.923 118.908 1.00 0.00 PROA ATOM 560 HB3 ALA P 36 10.329 47.142 119.244 1.00 0.00 PROA ATOM 561 C ALA P 36 8.976 46.424 116.961 1.00 0.00 PROA ATOM 562 O ALA P 36 9.603 45.402 116.684 1.00 0.00 PROA ATOM 563 N THR P 37 7.630 46.443 116.996 1.00 0.00 PROA ATOM 564 HN THR P 37 7.137 47.268 117.259 1.00 0.00 PROA ATOM 565 CA THR P 37 6.779 45.294 116.663 1.00 0.00 PROA ATOM 566 HA THR P 37 7.121 44.455 117.250 1.00 0.00 PROA ATOM 567 CB THR P 37 5.308 45.554 116.944 1.00 0.00 PROA ATOM 568 HB THR P 37 4.930 46.365 116.285 1.00 0.00 PROA ATOM 569 OG1 THR P 37 5.167 45.951 118.303 1.00 0.00 PROA ATOM 570 HG1 THR P 37 5.555 46.827 118.364 1.00 0.00 PROA ATOM 571 CG2 THR P 37 4.441 44.294 116.778 1.00 0.00 PROA ATOM 572 HG21 THR P 37 4.780 43.502 117.479 1.00 0.00 PROA ATOM 573 HG22 THR P 37 4.528 43.909 115.739 1.00 0.00 PROA ATOM 574 HG23 THR P 37 3.379 44.534 117.000 1.00 0.00 PROA ATOM 575 C THR P 37 6.927 44.801 115.238 1.00 0.00 PROA ATOM 576 O THR P 37 7.142 43.604 115.027 1.00 0.00 PROA ATOM 577 N ASP P 38 6.901 45.691 114.226 1.00 0.00 PROA ATOM 578 HN ASP P 38 6.725 46.657 114.395 1.00 0.00 PROA ATOM 579 CA ASP P 38 7.121 45.340 112.831 1.00 0.00 PROA ATOM 580 HA ASP P 38 6.375 44.612 112.551 1.00 0.00 PROA ATOM 581 CB ASP P 38 7.022 46.585 111.915 1.00 0.00 PROA ATOM 582 HB1 ASP P 38 7.355 46.311 110.891 1.00 0.00 PROA ATOM 583 HB2 ASP P 38 7.684 47.383 112.312 1.00 0.00 PROA ATOM 584 CG ASP P 38 5.599 47.125 111.838 1.00 0.00 PROA ATOM 585 OD1 ASP P 38 4.653 46.297 111.812 1.00 0.00 PROA ATOM 586 OD2 ASP P 38 5.456 48.372 111.777 1.00 0.00 PROA ATOM 587 C ASP P 38 8.492 44.711 112.622 1.00 0.00 PROA ATOM 588 O ASP P 38 8.640 43.666 111.988 1.00 0.00 PROA ATOM 589 N VAL P 39 9.535 45.332 113.226 1.00 0.00 PROA ATOM 590 HN VAL P 39 9.417 46.197 113.706 1.00 0.00 PROA ATOM 591 CA VAL P 39 10.890 44.798 113.225 1.00 0.00 PROA ATOM 592 HA VAL P 39 11.163 44.611 112.197 1.00 0.00 PROA ATOM 593 CB VAL P 39 11.906 45.748 113.866 1.00 0.00 PROA ATOM 594 HB VAL P 39 11.566 46.004 114.892 1.00 0.00 PROA ATOM 595 CG1 VAL P 39 13.310 45.112 113.944 1.00 0.00 PROA ATOM 596 HG11 VAL P 39 13.596 44.696 112.954 1.00 0.00 PROA ATOM 597 HG12 VAL P 39 13.311 44.288 114.689 1.00 0.00 PROA ATOM 598 HG13 VAL P 39 14.058 45.880 114.235 1.00 0.00 PROA ATOM 599 CG2 VAL P 39 12.021 47.046 113.044 1.00 0.00 PROA ATOM 600 HG21 VAL P 39 11.010 47.463 112.845 1.00 0.00 PROA ATOM 601 HG22 VAL P 39 12.516 46.835 112.072 1.00 0.00 PROA ATOM 602 HG23 VAL P 39 12.611 47.800 113.608 1.00 0.00 PROA ATOM 603 C VAL P 39 10.975 43.436 113.877 1.00 0.00 PROA ATOM 604 O VAL P 39 11.450 42.481 113.260 1.00 0.00 PROA ATOM 605 N PHE P 40 10.477 43.271 115.115 1.00 0.00 PROA ATOM 606 HN PHE P 40 10.042 44.021 115.607 1.00 0.00 PROA ATOM 607 CA PHE P 40 10.533 42.010 115.819 1.00 0.00 PROA ATOM 608 HA PHE P 40 11.556 41.664 115.804 1.00 0.00 PROA ATOM 609 CB PHE P 40 10.041 42.176 117.283 1.00 0.00 PROA ATOM 610 HB1 PHE P 40 9.006 42.581 117.285 1.00 0.00 PROA ATOM 611 HB2 PHE P 40 10.721 42.864 117.829 1.00 0.00 PROA ATOM 612 CG PHE P 40 10.020 40.866 118.032 1.00 0.00 PROA ATOM 613 CD1 PHE P 40 11.204 40.267 118.484 1.00 0.00 PROA ATOM 614 HD1 PHE P 40 12.142 40.792 118.381 1.00 0.00 PROA ATOM 615 CE1 PHE P 40 11.182 38.994 119.068 1.00 0.00 PROA ATOM 616 HE1 PHE P 40 12.101 38.542 119.411 1.00 0.00 PROA ATOM 617 CZ PHE P 40 9.974 38.308 119.207 1.00 0.00 PROA ATOM 618 HZ PHE P 40 9.956 37.329 119.662 1.00 0.00 PROA ATOM 619 CD2 PHE P 40 8.813 40.167 118.176 1.00 0.00 PROA ATOM 620 HD2 PHE P 40 7.892 40.617 117.836 1.00 0.00 PROA ATOM 621 CE2 PHE P 40 8.788 38.894 118.755 1.00 0.00 PROA ATOM 622 HE2 PHE P 40 7.852 38.364 118.853 1.00 0.00 PROA ATOM 623 C PHE P 40 9.760 40.926 115.093 1.00 0.00 PROA ATOM 624 O PHE P 40 10.296 39.837 114.876 1.00 0.00 PROA ATOM 625 N TRP P 41 8.527 41.210 114.645 1.00 0.00 PROA ATOM 626 HN TRP P 41 8.139 42.124 114.730 1.00 0.00 PROA ATOM 627 CA TRP P 41 7.673 40.225 114.011 1.00 0.00 PROA ATOM 628 HA TRP P 41 7.645 39.352 114.646 1.00 0.00 PROA ATOM 629 CB TRP P 41 6.238 40.778 113.798 1.00 0.00 PROA ATOM 630 HB1 TRP P 41 6.262 41.512 112.965 1.00 0.00 PROA ATOM 631 HB2 TRP P 41 5.915 41.291 114.728 1.00 0.00 PROA ATOM 632 CG TRP P 41 5.208 39.718 113.462 1.00 0.00 PROA ATOM 633 CD1 TRP P 41 4.629 39.421 112.262 1.00 0.00 PROA ATOM 634 HD1 TRP P 41 4.776 39.990 111.356 1.00 0.00 PROA ATOM 635 NE1 TRP P 41 3.830 38.297 112.359 1.00 0.00 PROA ATOM 636 HE1 TRP P 41 3.304 37.897 111.641 1.00 0.00 PROA ATOM 637 CE2 TRP P 41 3.914 37.846 113.659 1.00 0.00 PROA ATOM 638 CD2 TRP P 41 4.741 38.703 114.375 1.00 0.00 PROA ATOM 639 CE3 TRP P 41 5.022 38.490 115.723 1.00 0.00 PROA ATOM 640 HE3 TRP P 41 5.659 39.150 116.293 1.00 0.00 PROA ATOM 641 CZ3 TRP P 41 4.440 37.370 116.329 1.00 0.00 PROA ATOM 642 HZ3 TRP P 41 4.622 37.181 117.377 1.00 0.00 PROA ATOM 643 CZ2 TRP P 41 3.342 36.721 114.254 1.00 0.00 PROA ATOM 644 HZ2 TRP P 41 2.701 36.042 113.711 1.00 0.00 PROA ATOM 645 CH2 TRP P 41 3.630 36.494 115.606 1.00 0.00 PROA ATOM 646 HH2 TRP P 41 3.218 35.625 116.097 1.00 0.00 PROA ATOM 647 C TRP P 41 8.278 39.663 112.733 1.00 0.00 PROA ATOM 648 O TRP P 41 8.310 38.441 112.550 1.00 0.00 PROA ATOM 649 N ALA P 42 8.859 40.508 111.865 1.00 0.00 PROA ATOM 650 HN ALA P 42 8.831 41.492 112.017 1.00 0.00 PROA ATOM 651 CA ALA P 42 9.560 40.100 110.664 1.00 0.00 PROA ATOM 652 HA ALA P 42 8.888 39.508 110.061 1.00 0.00 PROA ATOM 653 CB ALA P 42 10.018 41.354 109.897 1.00 0.00 PROA ATOM 654 HB1 ALA P 42 10.698 41.962 110.531 1.00 0.00 PROA ATOM 655 HB2 ALA P 42 9.137 41.974 109.625 1.00 0.00 PROA ATOM 656 HB3 ALA P 42 10.564 41.056 108.976 1.00 0.00 PROA ATOM 657 C ALA P 42 10.762 39.192 110.913 1.00 0.00 PROA ATOM 658 O ALA P 42 11.036 38.270 110.151 1.00 0.00 PROA ATOM 659 N LYS P 43 11.534 39.455 111.984 1.00 0.00 PROA ATOM 660 HN LYS P 43 11.389 40.267 112.543 1.00 0.00 PROA ATOM 661 CA LYS P 43 12.625 38.592 112.407 1.00 0.00 PROA ATOM 662 HA LYS P 43 13.198 38.327 111.531 1.00 0.00 PROA ATOM 663 CB LYS P 43 13.525 39.304 113.438 1.00 0.00 PROA ATOM 664 HB1 LYS P 43 14.384 38.640 113.674 1.00 0.00 PROA ATOM 665 HB2 LYS P 43 12.935 39.472 114.364 1.00 0.00 PROA ATOM 666 CG LYS P 43 14.070 40.651 112.959 1.00 0.00 PROA ATOM 667 HG1 LYS P 43 13.227 41.262 112.573 1.00 0.00 PROA ATOM 668 HG2 LYS P 43 14.792 40.473 112.134 1.00 0.00 PROA ATOM 669 CD LYS P 43 14.776 41.431 114.075 1.00 0.00 PROA ATOM 670 HD1 LYS P 43 14.144 41.409 114.988 1.00 0.00 PROA ATOM 671 HD2 LYS P 43 14.906 42.486 113.754 1.00 0.00 PROA ATOM 672 CE LYS P 43 16.142 40.838 114.400 1.00 0.00 PROA ATOM 673 HE1 LYS P 43 16.754 40.770 113.476 1.00 0.00 PROA ATOM 674 HE2 LYS P 43 16.019 39.831 114.852 1.00 0.00 PROA ATOM 675 NZ LYS P 43 16.871 41.686 115.368 1.00 0.00 PROA ATOM 676 HZ1 LYS P 43 16.322 41.759 116.248 1.00 0.00 PROA ATOM 677 HZ2 LYS P 43 17.007 42.635 114.964 1.00 0.00 PROA ATOM 678 HZ3 LYS P 43 17.798 41.261 115.572 1.00 0.00 PROA ATOM 679 C LYS P 43 12.173 37.277 113.025 1.00 0.00 PROA ATOM 680 O LYS P 43 12.783 36.235 112.799 1.00 0.00 PROA ATOM 681 N TYR P 44 11.118 37.338 113.851 1.00 0.00 PROA ATOM 682 HN TYR P 44 10.681 38.216 114.020 1.00 0.00 PROA ATOM 683 CA TYR P 44 10.497 36.239 114.567 1.00 0.00 PROA ATOM 684 HA TYR P 44 11.256 35.699 115.113 1.00 0.00 PROA ATOM 685 CB TYR P 44 9.458 36.868 115.523 1.00 0.00 PROA ATOM 686 HB1 TYR P 44 8.606 37.263 114.930 1.00 0.00 PROA ATOM 687 HB2 TYR P 44 9.937 37.690 116.096 1.00 0.00 PROA ATOM 688 CG TYR P 44 8.899 35.905 116.514 1.00 0.00 PROA ATOM 689 CD1 TYR P 44 9.736 35.123 117.318 1.00 0.00 PROA ATOM 690 HD1 TYR P 44 10.807 35.244 117.257 1.00 0.00 PROA ATOM 691 CE1 TYR P 44 9.189 34.185 118.201 1.00 0.00 PROA ATOM 692 HE1 TYR P 44 9.838 33.571 118.807 1.00 0.00 PROA ATOM 693 CZ TYR P 44 7.805 34.044 118.298 1.00 0.00 PROA ATOM 694 OH TYR P 44 7.198 33.084 119.136 1.00 0.00 PROA ATOM 695 HH TYR P 44 7.777 32.937 119.887 1.00 0.00 PROA ATOM 696 CD2 TYR P 44 7.514 35.773 116.640 1.00 0.00 PROA ATOM 697 HD2 TYR P 44 6.861 36.378 116.028 1.00 0.00 PROA ATOM 698 CE2 TYR P 44 6.965 34.865 117.551 1.00 0.00 PROA ATOM 699 HE2 TYR P 44 5.894 34.801 117.674 1.00 0.00 PROA ATOM 700 C TYR P 44 9.819 35.195 113.689 1.00 0.00 PROA ATOM 701 O TYR P 44 9.918 33.987 113.941 1.00 0.00 PROA ATOM 702 N THR P 45 9.085 35.626 112.652 1.00 0.00 PROA ATOM 703 HN THR P 45 8.935 36.600 112.503 1.00 0.00 PROA ATOM 704 CA THR P 45 8.452 34.752 111.669 1.00 0.00 PROA ATOM 705 HA THR P 45 8.018 33.925 112.211 1.00 0.00 PROA ATOM 706 CB THR P 45 7.374 35.434 110.834 1.00 0.00 PROA ATOM 707 HB THR P 45 6.989 34.713 110.082 1.00 0.00 PROA ATOM 708 OG1 THR P 45 7.847 36.585 110.141 1.00 0.00 PROA ATOM 709 HG1 THR P 45 8.010 37.250 110.814 1.00 0.00 PROA ATOM 710 CG2 THR P 45 6.246 35.901 111.753 1.00 0.00 PROA ATOM 711 HG21 THR P 45 6.638 36.620 112.504 1.00 0.00 PROA ATOM 712 HG22 THR P 45 5.810 35.031 112.289 1.00 0.00 PROA ATOM 713 HG23 THR P 45 5.457 36.406 111.156 1.00 0.00 PROA ATOM 714 C THR P 45 9.445 34.155 110.701 1.00 0.00 PROA ATOM 715 O THR P 45 9.257 33.065 110.160 1.00 0.00 PROA ATOM 716 N ALA P 46 10.534 34.891 110.440 1.00 0.00 PROA ATOM 717 HN ALA P 46 10.647 35.799 110.835 1.00 0.00 PROA ATOM 718 CA ALA P 46 11.607 34.460 109.596 1.00 0.00 PROA ATOM 719 HA ALA P 46 11.181 33.942 108.750 1.00 0.00 PROA ATOM 720 CB ALA P 46 12.435 35.663 109.124 1.00 0.00 PROA ATOM 721 HB1 ALA P 46 12.864 36.198 109.998 1.00 0.00 PROA ATOM 722 HB2 ALA P 46 11.789 36.368 108.558 1.00 0.00 PROA ATOM 723 HB3 ALA P 46 13.269 35.317 108.476 1.00 0.00 PROA ATOM 724 C ALA P 46 12.517 33.444 110.248 1.00 0.00 PROA ATOM 725 O ALA P 46 12.643 33.341 111.469 1.00 0.00 PROA ATOM 726 N CYS P 47 13.219 32.658 109.423 1.00 0.00 PROA ATOM 727 HN CYS P 47 13.092 32.686 108.435 1.00 0.00 PROA ATOM 728 CA CYS P 47 14.196 31.728 109.901 1.00 0.00 PROA ATOM 729 HA CYS P 47 14.594 32.119 110.825 1.00 0.00 PROA ATOM 730 CB CYS P 47 13.596 30.311 110.139 1.00 0.00 PROA ATOM 731 HB1 CYS P 47 13.274 29.908 109.156 1.00 0.00 PROA ATOM 732 HB2 CYS P 47 12.698 30.425 110.781 1.00 0.00 PROA ATOM 733 SG CYS P 47 14.730 29.116 110.921 1.00 0.00 PROA ATOM 734 HG1 CYS P 47 13.858 28.118 110.929 1.00 0.00 PROA ATOM 735 C CYS P 47 15.343 31.757 108.929 1.00 0.00 PROA ATOM 736 O CYS P 47 15.124 31.883 107.683 1.00 0.00 PROA ATOM 737 N ALA P 48 16.581 31.712 109.391 1.00 0.00 PROA ATOM 738 HN ALA P 48 16.737 31.687 110.374 1.00 0.00 PROA ATOM 739 CA ALA P 48 17.805 31.693 108.610 1.00 0.00 PROA ATOM 740 HA ALA P 48 17.789 32.544 107.945 1.00 0.00 PROA ATOM 741 CB ALA P 48 19.028 31.754 109.514 1.00 0.00 PROA ATOM 742 HB1 ALA P 48 19.038 30.882 110.203 1.00 0.00 PROA ATOM 743 HB2 ALA P 48 19.004 32.685 110.120 1.00 0.00 PROA ATOM 744 HB3 ALA P 48 19.954 31.731 108.900 1.00 0.00 PROA ATOM 745 C ALA P 48 18.010 30.454 107.788 1.00 0.00 PROA ATOM 746 O ALA P 48 18.646 30.489 106.736 1.00 0.00 PROA ATOM 747 N GLU P 49 17.452 29.336 108.268 1.00 0.00 PROA ATOM 748 HN GLU P 49 16.938 29.354 109.121 1.00 0.00 PROA ATOM 749 CA GLU P 49 17.524 28.046 107.643 1.00 0.00 PROA ATOM 750 HA GLU P 49 18.533 27.882 107.295 1.00 0.00 PROA ATOM 751 CB GLU P 49 17.128 27.007 108.695 1.00 0.00 PROA ATOM 752 HB1 GLU P 49 17.165 26.002 108.224 1.00 0.00 PROA ATOM 753 HB2 GLU P 49 16.086 27.216 109.016 1.00 0.00 PROA ATOM 754 CG GLU P 49 18.031 26.987 109.956 1.00 0.00 PROA ATOM 755 HG1 GLU P 49 18.033 27.995 110.424 1.00 0.00 PROA ATOM 756 HG2 GLU P 49 19.068 26.719 109.662 1.00 0.00 PROA ATOM 757 CD GLU P 49 17.525 25.965 110.980 1.00 0.00 PROA ATOM 758 OE1 GLU P 49 16.456 25.356 110.717 1.00 0.00 PROA ATOM 759 OE2 GLU P 49 18.176 25.815 112.043 1.00 0.00 PROA ATOM 760 C GLU P 49 16.619 27.952 106.419 1.00 0.00 PROA ATOM 761 O GLU P 49 16.667 27.005 105.648 1.00 0.00 PROA ATOM 762 N GLY P 50 15.768 28.982 106.213 1.00 0.00 PROA ATOM 763 HN GLY P 50 15.695 29.736 106.861 1.00 0.00 PROA ATOM 764 CA GLY P 50 14.905 29.070 105.048 1.00 0.00 PROA ATOM 765 HA1 GLY P 50 14.048 29.671 105.314 1.00 0.00 PROA ATOM 766 HA2 GLY P 50 14.592 28.069 104.790 1.00 0.00 PROA ATOM 767 C GLY P 50 15.593 29.692 103.862 1.00 0.00 PROA ATOM 768 O GLY P 50 16.181 29.006 103.020 1.00 0.00 PROA ATOM 769 N LEU P 51 15.506 31.025 103.749 1.00 0.00 PROA ATOM 770 HN LEU P 51 15.133 31.581 104.487 1.00 0.00 PROA ATOM 771 CA LEU P 51 15.934 31.767 102.576 1.00 0.00 PROA ATOM 772 HA LEU P 51 16.709 31.196 102.087 1.00 0.00 PROA ATOM 773 CB LEU P 51 14.747 32.008 101.599 1.00 0.00 PROA ATOM 774 HB1 LEU P 51 15.119 32.636 100.763 1.00 0.00 PROA ATOM 775 HB2 LEU P 51 13.963 32.568 102.151 1.00 0.00 PROA ATOM 776 CG LEU P 51 14.086 30.752 100.986 1.00 0.00 PROA ATOM 777 HG LEU P 51 13.871 30.019 101.793 1.00 0.00 PROA ATOM 778 CD1 LEU P 51 12.773 31.122 100.271 1.00 0.00 PROA ATOM 779 HD11 LEU P 51 12.974 31.849 99.455 1.00 0.00 PROA ATOM 780 HD12 LEU P 51 12.067 31.585 100.993 1.00 0.00 PROA ATOM 781 HD13 LEU P 51 12.313 30.212 99.830 1.00 0.00 PROA ATOM 782 CD2 LEU P 51 15.028 29.992 100.042 1.00 0.00 PROA ATOM 783 HD21 LEU P 51 15.934 29.659 100.593 1.00 0.00 PROA ATOM 784 HD22 LEU P 51 15.344 30.655 99.208 1.00 0.00 PROA ATOM 785 HD23 LEU P 51 14.512 29.097 99.633 1.00 0.00 PROA ATOM 786 C LEU P 51 16.512 33.126 102.973 1.00 0.00 PROA ATOM 787 O LEU P 51 16.687 34.022 102.147 1.00 0.00 PROA ATOM 788 N GLY P 52 16.848 33.350 104.263 1.00 0.00 PROA ATOM 789 HN GLY P 52 16.655 32.694 104.989 1.00 0.00 PROA ATOM 790 CA GLY P 52 17.523 34.588 104.662 1.00 0.00 PROA ATOM 791 HA1 GLY P 52 18.248 34.800 103.891 1.00 0.00 PROA ATOM 792 HA2 GLY P 52 18.021 34.374 105.595 1.00 0.00 PROA ATOM 793 C GLY P 52 16.688 35.850 104.866 1.00 0.00 PROA ATOM 794 O GLY P 52 17.233 36.954 104.933 1.00 0.00 PROA ATOM 795 NT GLY P 52 15.343 35.679 104.966 1.00 0.00 PROA ATOM 796 HT1 GLY P 52 14.747 36.471 105.100 1.00 0.00 PROA ATOM 797 HT2 GLY P 52 14.950 34.762 104.905 1.00 0.00 PROA ATOM 798 CAL CAL H 201 -3.838 43.998 123.492 1.00 0.00 HETA ATOM 799 CAL CAL H 202 -2.960 39.697 125.417 1.00 0.00 HETB ATOM 800 CAL CAL H 203 0.517 39.837 127.003 1.00 0.00 HETC ATOM 801 CAL CAL H 204 0.676 36.233 126.859 1.00 0.00 HETD ATOM 802 CAL CAL H 205 2.311 33.198 128.616 1.00 0.00 HETE ATOM 803 CAL CAL H 206 5.962 29.935 130.283 1.00 0.00 HETF ATOM 804 CAL CAL H 207 14.377 33.117 129.709 1.00 0.00 HETG ATOM 805 O1 DPS H 451 4.204 32.577 130.930 1.00 0.00 HETH ATOM 806 C1 DPS H 451 4.504 31.572 131.622 1.00 0.00 HETH ATOM 807 O2 DPS H 451 5.676 31.287 131.997 1.00 0.00 HETH ATOM 808 C2 DPS H 451 3.297 30.690 132.010 1.00 0.00 HETH ATOM 809 H1 DPS H 451 2.696 30.468 131.103 1.00 0.00 HETH ATOM 810 N1 DPS H 451 3.727 29.387 132.606 1.00 0.00 HETH ATOM 811 H2 DPS H 451 4.635 29.513 133.097 1.00 0.00 HETH ATOM 812 H3 DPS H 451 3.836 28.680 131.851 1.00 0.00 HETH ATOM 813 H4 DPS H 451 3.009 29.062 133.284 1.00 0.00 HETH ATOM 814 C3 DPS H 451 2.219 31.384 132.905 1.00 0.00 HETH ATOM 815 H5 DPS H 451 2.484 31.205 133.968 1.00 0.00 HETH ATOM 816 H6 DPS H 451 1.236 30.915 132.689 1.00 0.00 HETH ATOM 817 O3 DPS H 451 2.072 32.826 132.722 1.00 0.00 HETH ATOM 818 P1 DPS H 451 2.650 34.071 133.621 1.00 0.00 HETH ATOM 819 O4 DPS H 451 3.781 33.604 134.462 1.00 0.00 HETH ATOM 820 O5 DPS H 451 2.897 35.229 132.745 1.00 0.00 HETH ATOM 821 O6 DPS H 451 1.380 34.424 134.544 1.00 0.00 HETH ATOM 822 C4 DPS H 451 0.893 33.903 135.781 1.00 0.00 HETH ATOM 823 H7 DPS H 451 1.521 34.286 136.614 1.00 0.00 HETH ATOM 824 H8 DPS H 451 0.951 32.794 135.761 1.00 0.00 HETH ATOM 825 C5 DPS H 451 -0.566 34.345 135.983 1.00 0.00 HETH ATOM 826 H9 DPS H 451 -1.064 34.437 134.994 1.00 0.00 HETH ATOM 827 O7 DPS H 451 -0.628 35.600 136.651 1.00 0.00 HETH ATOM 828 C6 DPS H 451 -1.445 33.338 136.723 1.00 0.00 HETH ATOM 829 H10 DPS H 451 -2.325 33.855 137.161 1.00 0.00 HETH ATOM 830 H11 DPS H 451 -0.863 32.857 137.538 1.00 0.00 HETH ATOM 831 O8 DPS H 451 -1.890 32.339 135.803 1.00 0.00 HETH ATOM 832 C7 DPS H 451 -3.120 31.840 135.987 1.00 0.00 HETH ATOM 833 O9 DPS H 451 -4.118 32.504 136.204 1.00 0.00 HETH ATOM 834 C8 DPS H 451 -3.071 30.274 135.816 1.00 0.00 HETH ATOM 835 H12 DPS H 451 -2.248 29.859 136.437 1.00 0.00 HETH ATOM 836 H13 DPS H 451 -2.883 30.018 134.751 1.00 0.00 HETH ATOM 837 H14 DPS H 451 -4.033 29.830 136.149 1.00 0.00 HETH ATOM 838 C9 DPS H 451 -0.110 35.429 137.897 1.00 0.00 HETH ATOM 839 C10 DPS H 451 0.308 34.100 138.212 1.00 0.00 HETH ATOM 840 H15 DPS H 451 0.291 33.478 137.292 1.00 0.00 HETH ATOM 841 H16 DPS H 451 -0.384 33.656 138.959 1.00 0.00 HETH ATOM 842 H17 DPS H 451 1.343 34.118 138.616 1.00 0.00 HETH ATOM 843 O10 DPS H 451 -0.007 36.352 138.694 1.00 0.00 HETH ATOM 844 C1 DPE H 451 1.280 38.968 130.508 1.00 0.00 HETI ATOM 845 H1 DPE H 451 2.096 39.102 131.224 1.00 0.00 HETI ATOM 846 H2 DPE H 451 0.316 39.045 131.019 1.00 0.00 HETI ATOM 847 N DPE H 451 1.361 37.529 130.208 1.00 0.00 HETI ATOM 848 H3 DPE H 451 1.396 36.990 131.097 1.00 0.00 HETI ATOM 849 H4 DPE H 451 2.220 37.338 129.653 1.00 0.00 HETI ATOM 850 H5 DPE H 451 0.525 37.241 129.661 1.00 0.00 HETI ATOM 851 C2 DPE H 451 1.351 40.162 129.561 1.00 0.00 HETI ATOM 852 H6 DPE H 451 1.728 39.817 128.575 1.00 0.00 HETI ATOM 853 H7 DPE H 451 2.056 40.911 129.979 1.00 0.00 HETI ATOM 854 O1 DPE H 451 0.053 40.811 129.359 1.00 0.00 HETI ATOM 855 P DPE H 451 -0.088 42.350 128.794 1.00 0.00 HETI ATOM 856 O2 DPE H 451 -0.270 43.315 129.894 1.00 0.00 HETI ATOM 857 O3 DPE H 451 1.081 42.460 127.918 1.00 0.00 HETI ATOM 858 O4 DPE H 451 -1.411 42.407 127.864 1.00 0.00 HETI ATOM 859 C3 DPE H 451 -2.692 42.320 128.452 1.00 0.00 HETI ATOM 860 H8 DPE H 451 -2.754 43.103 129.237 1.00 0.00 HETI ATOM 861 H9 DPE H 451 -2.776 41.319 128.925 1.00 0.00 HETI ATOM 862 C4 DPE H 451 -3.888 42.500 127.504 1.00 0.00 HETI ATOM 863 H10 DPE H 451 -3.818 41.722 126.716 1.00 0.00 HETI ATOM 864 O5 DPE H 451 -4.011 43.786 126.835 1.00 0.00 HETI ATOM 865 C5 DPE H 451 -5.190 42.156 128.241 1.00 0.00 HETI ATOM 866 H11 DPE H 451 -5.138 41.104 128.595 1.00 0.00 HETI ATOM 867 H12 DPE H 451 -6.043 42.262 127.537 1.00 0.00 HETI ATOM 868 O6 DPE H 451 -5.427 43.015 129.384 1.00 0.00 HETI ATOM 869 C6 DPE H 451 -6.077 42.668 130.510 1.00 0.00 HETI ATOM 870 O7 DPE H 451 -6.212 43.516 131.387 1.00 0.00 HETI ATOM 871 C7 DPE H 451 -6.658 41.270 130.706 1.00 0.00 HETI ATOM 872 H13 DPE H 451 -5.831 40.538 130.828 1.00 0.00 HETI ATOM 873 H14 DPE H 451 -7.262 40.986 129.817 1.00 0.00 HETI ATOM 874 H15 DPE H 451 -7.293 41.252 131.618 1.00 0.00 HETI ATOM 875 C8 DPE H 451 -3.892 45.068 127.234 1.00 0.00 HETI ATOM 876 C9 DPE H 451 -3.249 45.483 128.554 1.00 0.00 HETI ATOM 877 H16 DPE H 451 -2.195 45.133 128.579 1.00 0.00 HETI ATOM 878 H17 DPE H 451 -3.801 45.023 129.401 1.00 0.00 HETI ATOM 879 H18 DPE H 451 -3.264 46.590 128.647 1.00 0.00 HETI ATOM 880 O8 DPE H 451 -4.347 45.928 126.482 1.00 0.00 HETI TER 881 DPE 451 END If you find results from this site helpful for 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