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*** fic_noh_6_50 ***elNémo ID: 2207062127475999Job options:ID = 2207062127475999 JOBID = fic_noh_6_50 USERID = nina PRIVAT = 0 NMODES = 10 DQMIN = -50 DQMAX = 50 DQSTEP = 10 DOGRAPHS = on DOPROJMODS = 0 DORMSD = 0 NRBL = 0 CUTOFF = 6 CAONLY = 0 Input data for this run:HEADER fic_noh_6_50 CRYST1 0.000 0.000 0.000 90.00 90.00 90.00 P 1 1 ATOM 1 N ALA P 1 2.349 32.965 124.748 1.00 0.00 PROA ATOM 2 CA ALA P 1 1.196 32.118 125.145 1.00 0.00 PROA ATOM 3 CB ALA P 1 1.676 30.879 125.892 1.00 0.00 PROA ATOM 4 C ALA P 1 0.257 32.922 126.020 1.00 0.00 PROA ATOM 5 O ALA P 1 0.630 33.996 126.497 1.00 0.00 PROA ATOM 6 N ASN P 2 -0.954 32.399 126.234 1.00 0.00 PROA ATOM 7 CA ASN P 2 -1.931 33.043 127.122 1.00 0.00 PROA ATOM 8 CB ASN P 2 -2.906 33.900 126.309 1.00 0.00 PROA ATOM 9 CG ASN P 2 -2.202 34.887 125.416 1.00 0.00 PROA ATOM 10 OD1 ASN P 2 -1.713 35.930 125.868 1.00 0.00 PROA ATOM 11 ND2 ASN P 2 -2.139 34.559 124.133 1.00 0.00 PROA ATOM 12 C ASN P 2 -2.724 32.104 128.042 1.00 0.00 PROA ATOM 13 O ASN P 2 -3.947 32.161 128.068 1.00 0.00 PROA ATOM 14 N THR P 3 -2.031 31.270 128.815 1.00 0.00 PROA ATOM 15 CA THR P 3 -2.690 30.358 129.771 1.00 0.00 PROA ATOM 16 CB THR P 3 -1.659 29.429 130.506 1.00 0.00 PROA ATOM 17 OG1 THR P 3 -0.423 30.133 130.718 1.00 0.00 PROA ATOM 18 CG2 THR P 3 -1.391 28.148 129.714 1.00 0.00 PROA ATOM 19 C THR P 3 -3.639 31.039 130.804 1.00 0.00 PROA ATOM 20 O THR P 3 -3.307 31.202 131.987 1.00 0.00 PROA ATOM 21 N PHE P 4 -4.834 31.401 130.357 1.00 0.00 PROA ATOM 22 CA PHE P 4 -5.799 32.049 131.224 1.00 0.00 PROA ATOM 23 CB PHE P 4 -6.297 31.078 132.322 1.00 0.00 PROA ATOM 24 CG PHE P 4 -7.468 31.596 133.154 1.00 0.00 PROA ATOM 25 CD1 PHE P 4 -8.058 32.842 132.909 1.00 0.00 PROA ATOM 26 CE1 PHE P 4 -9.134 33.298 133.686 1.00 0.00 PROA ATOM 27 CZ PHE P 4 -9.637 32.502 134.711 1.00 0.00 PROA ATOM 28 CD2 PHE P 4 -7.995 30.810 134.178 1.00 0.00 PROA ATOM 29 CE2 PHE P 4 -9.071 31.260 134.958 1.00 0.00 PROA ATOM 30 C PHE P 4 -5.187 33.337 131.777 1.00 0.00 PROA ATOM 31 O PHE P 4 -4.940 34.261 131.009 1.00 0.00 PROA ATOM 32 N LEU P 5 -4.845 33.323 133.141 1.00 0.00 PROA ATOM 33 CA LEU P 5 -4.766 34.615 133.836 1.00 0.00 PROA ATOM 34 CB LEU P 5 -4.526 34.402 135.323 1.00 0.00 PROA ATOM 35 CG LEU P 5 -5.817 34.015 136.031 1.00 0.00 PROA ATOM 36 CD1 LEU P 5 -5.564 33.703 137.492 1.00 0.00 PROA ATOM 37 CD2 LEU P 5 -6.829 35.127 135.888 1.00 0.00 PROA ATOM 38 C LEU P 5 -3.824 35.683 133.285 1.00 0.00 PROA ATOM 39 O LEU P 5 -4.271 36.565 132.567 1.00 0.00 PROA ATOM 40 N CGU P 6 -2.471 35.446 133.880 1.00 0.00 PROA ATOM 41 CA CGU P 6 -1.253 36.243 133.515 1.00 0.00 PROA ATOM 42 CB CGU P 6 -0.177 35.309 132.946 1.00 0.00 PROA ATOM 43 CG CGU P 6 -0.329 35.084 131.448 1.00 0.00 PROA ATOM 44 CD1 CGU P 6 1.004 34.967 130.739 1.00 0.00 PROA ATOM 45 OE12 CGU P 6 1.731 33.977 130.968 1.00 0.00 PROA ATOM 46 OE11 CGU P 6 1.337 35.880 129.961 1.00 0.00 PROA ATOM 47 CD2 CGU P 6 -1.309 33.956 131.102 1.00 0.00 PROA ATOM 48 OE22 CGU P 6 -2.307 34.194 130.368 1.00 0.00 PROA ATOM 49 OE21 CGU P 6 -1.093 32.818 131.584 1.00 0.00 PROA ATOM 50 C CGU P 6 -1.294 37.510 132.607 1.00 0.00 PROA ATOM 51 O CGU P 6 -0.229 38.027 132.242 1.00 0.00 PROA ATOM 52 N CGU P 7 -2.470 38.008 132.235 1.00 0.00 PROA ATOM 53 CA CGU P 7 -2.525 39.217 131.421 1.00 0.00 PROA ATOM 54 CB CGU P 7 -3.450 39.037 130.219 1.00 0.00 PROA ATOM 55 CG CGU P 7 -2.901 37.948 129.316 1.00 0.00 PROA ATOM 56 CD1 CGU P 7 -3.780 37.584 128.132 1.00 0.00 PROA ATOM 57 OE12 CGU P 7 -3.478 38.010 126.996 1.00 0.00 PROA ATOM 58 OE11 CGU P 7 -4.757 36.828 128.327 1.00 0.00 PROA ATOM 59 CD2 CGU P 7 -1.454 38.176 128.915 1.00 0.00 PROA ATOM 60 OE22 CGU P 7 -0.581 37.458 129.444 1.00 0.00 PROA ATOM 61 OE21 CGU P 7 -1.183 39.067 128.080 1.00 0.00 PROA ATOM 62 C CGU P 7 -2.818 40.436 132.266 1.00 0.00 PROA ATOM 63 O CGU P 7 -3.033 41.526 131.761 1.00 0.00 PROA ATOM 64 N VAL P 8 -2.795 40.228 133.575 1.00 0.00 PROA ATOM 65 CA VAL P 8 -2.639 41.310 134.528 1.00 0.00 PROA ATOM 66 CB VAL P 8 -2.923 40.829 135.974 1.00 0.00 PROA ATOM 67 CG1 VAL P 8 -2.564 41.929 137.015 1.00 0.00 PROA ATOM 68 CG2 VAL P 8 -4.400 40.369 136.107 1.00 0.00 PROA ATOM 69 C VAL P 8 -1.197 41.818 134.427 1.00 0.00 PROA ATOM 70 O VAL P 8 -0.936 43.027 134.571 1.00 0.00 PROA ATOM 71 N ARG P 9 -0.276 40.882 134.169 1.00 0.00 PROA ATOM 72 CA ARG P 9 1.161 41.176 134.071 1.00 0.00 PROA ATOM 73 CB ARG P 9 1.988 39.887 134.220 1.00 0.00 PROA ATOM 74 CG ARG P 9 1.487 38.935 135.302 1.00 0.00 PROA ATOM 75 CD ARG P 9 2.323 37.652 135.371 1.00 0.00 PROA ATOM 76 NE ARG P 9 3.584 37.826 136.109 1.00 0.00 PROA ATOM 77 CZ ARG P 9 4.358 36.837 136.574 1.00 0.00 PROA ATOM 78 NH1 ARG P 9 4.026 35.560 136.397 1.00 0.00 PROA ATOM 79 NH2 ARG P 9 5.477 37.129 137.230 1.00 0.00 PROA ATOM 80 C ARG P 9 1.525 41.912 132.763 1.00 0.00 PROA ATOM 81 O ARG P 9 0.934 41.638 131.693 1.00 0.00 PROA ATOM 82 N LYS P 10 2.485 42.849 132.867 1.00 0.00 PROA ATOM 83 CA LYS P 10 3.048 43.569 131.703 1.00 0.00 PROA ATOM 84 CB LYS P 10 4.011 44.696 132.149 1.00 0.00 PROA ATOM 85 CG LYS P 10 5.433 44.258 132.548 1.00 0.00 PROA ATOM 86 CD LYS P 10 6.368 45.454 132.725 1.00 0.00 PROA ATOM 87 CE LYS P 10 7.716 45.030 133.282 1.00 0.00 PROA ATOM 88 NZ LYS P 10 8.571 46.214 133.563 1.00 0.00 PROA ATOM 89 C LYS P 10 3.752 42.597 130.742 1.00 0.00 PROA ATOM 90 O LYS P 10 4.346 41.601 131.185 1.00 0.00 PROA ATOM 91 N GLY P 11 3.682 42.879 129.439 1.00 0.00 PROA ATOM 92 CA GLY P 11 4.327 42.029 128.426 1.00 0.00 PROA ATOM 93 C GLY P 11 5.802 41.712 128.689 1.00 0.00 PROA ATOM 94 O GLY P 11 6.547 42.553 129.206 1.00 0.00 PROA ATOM 95 N ASN P 12 6.211 40.484 128.360 1.00 0.00 PROA ATOM 96 CA ASN P 12 7.629 40.081 128.389 1.00 0.00 PROA ATOM 97 CB ASN P 12 7.973 39.298 129.671 1.00 0.00 PROA ATOM 98 CG ASN P 12 9.441 38.862 129.734 1.00 0.00 PROA ATOM 99 OD1 ASN P 12 10.263 39.212 128.877 1.00 0.00 PROA ATOM 100 ND2 ASN P 12 9.770 38.081 130.759 1.00 0.00 PROA ATOM 101 C ASN P 12 8.005 39.299 127.118 1.00 0.00 PROA ATOM 102 O ASN P 12 7.498 38.191 126.869 1.00 0.00 PROA ATOM 103 N LEU P 13 8.889 39.897 126.315 1.00 0.00 PROA ATOM 104 CA LEU P 13 9.335 39.308 125.057 1.00 0.00 PROA ATOM 105 CB LEU P 13 10.373 40.214 124.367 1.00 0.00 PROA ATOM 106 CG LEU P 13 10.538 40.167 122.834 1.00 0.00 PROA ATOM 107 CD1 LEU P 13 9.373 40.842 122.086 1.00 0.00 PROA ATOM 108 CD2 LEU P 13 11.872 40.794 122.398 1.00 0.00 PROA ATOM 109 C LEU P 13 9.885 37.904 125.312 1.00 0.00 PROA ATOM 110 O LEU P 13 9.502 36.958 124.611 1.00 0.00 PROA ATOM 111 N CGU P 14 10.735 37.777 126.343 1.00 0.00 PROA ATOM 112 CA CGU P 14 11.355 36.492 126.704 1.00 0.00 PROA ATOM 113 CB CGU P 14 12.453 36.657 127.764 1.00 0.00 PROA ATOM 114 CG CGU P 14 13.126 35.322 128.126 1.00 0.00 PROA ATOM 115 CD1 CGU P 14 14.128 34.825 127.080 1.00 0.00 PROA ATOM 116 OE12 CGU P 14 14.366 33.586 126.998 1.00 0.00 PROA ATOM 117 OE11 CGU P 14 14.681 35.670 126.334 1.00 0.00 PROA ATOM 118 CD2 CGU P 14 13.782 35.326 129.481 1.00 0.00 PROA ATOM 119 OE22 CGU P 14 14.295 36.390 129.872 1.00 0.00 PROA ATOM 120 OE21 CGU P 14 13.794 34.264 130.140 1.00 0.00 PROA ATOM 121 C CGU P 14 10.372 35.387 127.138 1.00 0.00 PROA ATOM 122 O CGU P 14 10.316 34.324 126.510 1.00 0.00 PROA ATOM 123 N ARG P 15 9.638 35.632 128.225 1.00 0.00 PROA ATOM 124 CA ARG P 15 8.648 34.690 128.759 1.00 0.00 PROA ATOM 125 CB ARG P 15 7.906 35.338 129.931 1.00 0.00 PROA ATOM 126 CG ARG P 15 6.962 34.404 130.694 1.00 0.00 PROA ATOM 127 CD ARG P 15 5.693 35.114 131.165 1.00 0.00 PROA ATOM 128 NE ARG P 15 5.885 36.542 131.441 1.00 0.00 PROA ATOM 129 CZ ARG P 15 4.919 37.380 131.821 1.00 0.00 PROA ATOM 130 NH1 ARG P 15 3.673 36.946 131.977 1.00 0.00 PROA ATOM 131 NH2 ARG P 15 5.195 38.661 132.049 1.00 0.00 PROA ATOM 132 C ARG P 15 7.624 34.278 127.714 1.00 0.00 PROA ATOM 133 O ARG P 15 7.253 33.113 127.602 1.00 0.00 PROA ATOM 134 N CGU P 16 7.181 35.258 126.945 1.00 0.00 PROA ATOM 135 CA CGU P 16 6.046 35.065 126.088 1.00 0.00 PROA ATOM 136 CB CGU P 16 5.089 36.247 126.222 1.00 0.00 PROA ATOM 137 CG CGU P 16 4.460 36.331 127.606 1.00 0.00 PROA ATOM 138 CD1 CGU P 16 3.709 37.636 127.878 1.00 0.00 PROA ATOM 139 OE12 CGU P 16 3.370 38.389 126.931 1.00 0.00 PROA ATOM 140 OE11 CGU P 16 3.441 37.909 129.064 1.00 0.00 PROA ATOM 141 CD2 CGU P 16 3.578 35.130 127.919 1.00 0.00 PROA ATOM 142 OE22 CGU P 16 3.555 34.692 129.080 1.00 0.00 PROA ATOM 143 OE21 CGU P 16 2.889 34.612 127.015 1.00 0.00 PROA ATOM 144 C CGU P 16 6.379 34.753 124.633 1.00 0.00 PROA ATOM 145 O CGU P 16 5.812 33.810 124.081 1.00 0.00 PROA ATOM 146 N CYS P 17 7.285 35.511 124.010 1.00 0.00 PROA ATOM 147 CA CYS P 17 7.578 35.291 122.578 1.00 0.00 PROA ATOM 148 CB CYS P 17 7.579 36.602 121.784 1.00 0.00 PROA ATOM 149 SG CYS P 17 5.915 37.198 121.322 1.00 0.00 PROA ATOM 150 C CYS P 17 8.841 34.490 122.281 1.00 0.00 PROA ATOM 151 O CYS P 17 9.058 34.092 121.130 1.00 0.00 PROA ATOM 152 N VAL P 18 9.639 34.241 123.324 1.00 0.00 PROA ATOM 153 CA VAL P 18 10.911 33.504 123.216 1.00 0.00 PROA ATOM 154 CB VAL P 18 12.115 34.358 123.698 1.00 0.00 PROA ATOM 155 CG1 VAL P 18 13.423 33.585 123.553 1.00 0.00 PROA ATOM 156 CG2 VAL P 18 12.185 35.681 122.926 1.00 0.00 PROA ATOM 157 C VAL P 18 10.903 32.146 123.943 1.00 0.00 PROA ATOM 158 O VAL P 18 11.397 31.149 123.412 1.00 0.00 PROA ATOM 159 N CGU P 19 10.359 32.117 125.157 1.00 0.00 PROA ATOM 160 CA CGU P 19 10.168 30.864 125.885 1.00 0.00 PROA ATOM 161 CB CGU P 19 10.050 31.109 127.398 1.00 0.00 PROA ATOM 162 CG CGU P 19 11.400 31.342 128.080 1.00 0.00 PROA ATOM 163 CD1 CGU P 19 11.319 32.095 129.387 1.00 0.00 PROA ATOM 164 OE12 CGU P 19 10.229 32.142 129.996 1.00 0.00 PROA ATOM 165 OE11 CGU P 19 12.378 32.605 129.823 1.00 0.00 PROA ATOM 166 CD2 CGU P 19 12.172 30.070 128.380 1.00 0.00 PROA ATOM 167 OE22 CGU P 19 11.615 28.960 128.182 1.00 0.00 PROA ATOM 168 OE21 CGU P 19 13.344 30.194 128.836 1.00 0.00 PROA ATOM 169 C CGU P 19 8.973 30.068 125.334 1.00 0.00 PROA ATOM 170 O CGU P 19 8.997 28.832 125.334 1.00 0.00 PROA ATOM 171 N CGU P 20 7.998 30.793 124.764 1.00 0.00 PROA ATOM 172 CA CGU P 20 6.789 30.212 124.140 1.00 0.00 PROA ATOM 173 CB CGU P 20 5.533 30.566 124.965 1.00 0.00 PROA ATOM 174 CG CGU P 20 5.662 30.324 126.476 1.00 0.00 PROA ATOM 175 CD1 CGU P 20 5.003 31.380 127.329 1.00 0.00 PROA ATOM 176 OE12 CGU P 20 4.790 31.132 128.543 1.00 0.00 PROA ATOM 177 OE11 CGU P 20 4.694 32.461 126.799 1.00 0.00 PROA ATOM 178 CD2 CGU P 20 5.150 28.980 126.937 1.00 0.00 PROA ATOM 179 OE22 CGU P 20 5.538 28.534 128.040 1.00 0.00 PROA ATOM 180 OE21 CGU P 20 4.341 28.382 126.213 1.00 0.00 PROA ATOM 181 C CGU P 20 6.689 30.773 122.708 1.00 0.00 PROA ATOM 182 O CGU P 20 7.238 31.835 122.431 1.00 0.00 PROA ATOM 183 N THR P 21 6.167 30.205 121.740 1.00 0.00 PROA ATOM 184 CA THR P 21 5.894 30.908 120.469 1.00 0.00 PROA ATOM 185 CB THR P 21 5.687 29.955 119.246 1.00 0.00 PROA ATOM 186 OG1 THR P 21 4.708 28.956 119.549 1.00 0.00 PROA ATOM 187 CG2 THR P 21 7.004 29.268 118.856 1.00 0.00 PROA ATOM 188 C THR P 21 4.702 31.852 120.708 1.00 0.00 PROA ATOM 189 O THR P 21 4.116 31.814 121.791 1.00 0.00 PROA ATOM 190 N CYS P 22 4.350 32.711 119.749 1.00 0.00 PROA ATOM 191 CA CYS P 22 3.377 33.794 120.046 1.00 0.00 PROA ATOM 192 CB CYS P 22 4.065 34.941 120.807 1.00 0.00 PROA ATOM 193 SG CYS P 22 5.277 35.922 119.878 1.00 0.00 PROA ATOM 194 C CYS P 22 2.546 34.366 118.886 1.00 0.00 PROA ATOM 195 O CYS P 22 2.602 33.865 117.758 1.00 0.00 PROA ATOM 196 N SER P 23 1.772 35.416 119.190 1.00 0.00 PROA ATOM 197 CA SER P 23 0.914 36.118 118.218 1.00 0.00 PROA ATOM 198 CB SER P 23 -0.567 35.944 118.600 1.00 0.00 PROA ATOM 199 OG SER P 23 -0.790 36.267 119.968 1.00 0.00 PROA ATOM 200 C SER P 23 1.279 37.618 118.093 1.00 0.00 PROA ATOM 201 O SER P 23 2.147 38.116 118.832 1.00 0.00 PROA ATOM 202 N TYR P 24 0.617 38.330 117.169 1.00 0.00 PROA ATOM 203 CA TYR P 24 0.887 39.763 116.944 1.00 0.00 PROA ATOM 204 CB TYR P 24 0.076 40.382 115.774 1.00 0.00 PROA ATOM 205 CG TYR P 24 -0.778 39.503 114.841 1.00 0.00 PROA ATOM 206 CD1 TYR P 24 -0.475 39.396 113.465 1.00 0.00 PROA ATOM 207 CE1 TYR P 24 -1.288 38.630 112.599 1.00 0.00 PROA ATOM 208 CZ TYR P 24 -2.432 37.988 113.106 1.00 0.00 PROA ATOM 209 OH TYR P 24 -3.238 37.235 112.274 1.00 0.00 PROA ATOM 210 CD2 TYR P 24 -1.951 38.869 115.315 1.00 0.00 PROA ATOM 211 CE2 TYR P 24 -2.766 38.099 114.458 1.00 0.00 PROA ATOM 212 C TYR P 24 0.704 40.648 118.199 1.00 0.00 PROA ATOM 213 O TYR P 24 1.646 41.345 118.588 1.00 0.00 PROA ATOM 214 N CGU P 25 -0.496 40.626 118.804 1.00 0.00 PROA ATOM 215 CA CGU P 25 -0.839 41.508 119.955 1.00 0.00 PROA ATOM 216 CB CGU P 25 -2.366 41.551 120.230 1.00 0.00 PROA ATOM 217 CG CGU P 25 -2.758 42.253 121.547 1.00 0.00 PROA ATOM 218 CD1 CGU P 25 -2.547 43.751 121.544 1.00 0.00 PROA ATOM 219 OE12 CGU P 25 -2.266 44.296 122.630 1.00 0.00 PROA ATOM 220 OE11 CGU P 25 -2.712 44.388 120.481 1.00 0.00 PROA ATOM 221 CD2 CGU P 25 -4.201 42.086 121.945 1.00 0.00 PROA ATOM 222 OE22 CGU P 25 -5.045 41.840 121.060 1.00 0.00 PROA ATOM 223 OE21 CGU P 25 -4.488 42.257 123.150 1.00 0.00 PROA ATOM 224 C CGU P 25 -0.042 41.253 121.265 1.00 0.00 PROA ATOM 225 O CGU P 25 0.266 42.206 122.006 1.00 0.00 PROA ATOM 226 N CGU P 26 0.272 39.984 121.550 1.00 0.00 PROA ATOM 227 CA CGU P 26 1.156 39.632 122.670 1.00 0.00 PROA ATOM 228 CB CGU P 26 1.374 38.116 122.742 1.00 0.00 PROA ATOM 229 CG CGU P 26 0.434 37.360 123.660 1.00 0.00 PROA ATOM 230 CD1 CGU P 26 0.061 38.132 124.913 1.00 0.00 PROA ATOM 231 OE12 CGU P 26 -1.104 38.555 125.023 1.00 0.00 PROA ATOM 232 OE11 CGU P 26 0.923 38.317 125.794 1.00 0.00 PROA ATOM 233 CD2 CGU P 26 1.034 36.047 124.081 1.00 0.00 PROA ATOM 234 OE22 CGU P 26 2.039 36.066 124.812 1.00 0.00 PROA ATOM 235 OE21 CGU P 26 0.518 34.995 123.670 1.00 0.00 PROA ATOM 236 C CGU P 26 2.496 40.338 122.491 1.00 0.00 PROA ATOM 237 O CGU P 26 3.037 40.935 123.436 1.00 0.00 PROA ATOM 238 N ALA P 27 3.007 40.251 121.260 1.00 0.00 PROA ATOM 239 CA ALA P 27 4.155 41.016 120.799 1.00 0.00 PROA ATOM 240 CB ALA P 27 4.394 40.771 119.305 1.00 0.00 PROA ATOM 241 C ALA P 27 3.955 42.508 121.085 1.00 0.00 PROA ATOM 242 O ALA P 27 4.748 43.101 121.828 1.00 0.00 PROA ATOM 243 N PHE P 28 2.888 43.100 120.531 1.00 0.00 PROA ATOM 244 CA PHE P 28 2.590 44.522 120.749 1.00 0.00 PROA ATOM 245 CB PHE P 28 1.294 44.974 120.065 1.00 0.00 PROA ATOM 246 CG PHE P 28 0.835 46.342 120.514 1.00 0.00 PROA ATOM 247 CD1 PHE P 28 1.409 47.498 119.976 1.00 0.00 PROA ATOM 248 CE1 PHE P 28 1.002 48.770 120.409 1.00 0.00 PROA ATOM 249 CZ PHE P 28 0.011 48.892 121.403 1.00 0.00 PROA ATOM 250 CD2 PHE P 28 -0.144 46.478 121.512 1.00 0.00 PROA ATOM 251 CE2 PHE P 28 -0.565 47.746 121.955 1.00 0.00 PROA ATOM 252 C PHE P 28 2.570 44.943 122.226 1.00 0.00 PROA ATOM 253 O PHE P 28 3.274 45.880 122.600 1.00 0.00 PROA ATOM 254 N CGU P 29 1.763 44.272 123.053 1.00 0.00 PROA ATOM 255 CA CGU P 29 1.678 44.590 124.494 1.00 0.00 PROA ATOM 256 CB CGU P 29 0.911 43.514 125.266 1.00 0.00 PROA ATOM 257 CG CGU P 29 -0.593 43.465 125.037 1.00 0.00 PROA ATOM 258 CD1 CGU P 29 -1.352 44.688 125.568 1.00 0.00 PROA ATOM 259 OE12 CGU P 29 -0.794 45.459 126.381 1.00 0.00 PROA ATOM 260 OE11 CGU P 29 -2.515 44.896 125.162 1.00 0.00 PROA ATOM 261 CD2 CGU P 29 -1.202 42.163 125.529 1.00 0.00 PROA ATOM 262 OE22 CGU P 29 -2.303 41.822 125.060 1.00 0.00 PROA ATOM 263 OE21 CGU P 29 -0.580 41.459 126.365 1.00 0.00 PROA ATOM 264 C CGU P 29 3.060 44.706 125.107 1.00 0.00 PROA ATOM 265 O CGU P 29 3.350 45.645 125.845 1.00 0.00 PROA ATOM 266 N ALA P 30 3.935 43.680 124.570 1.00 0.00 PROA ATOM 267 CA ALA P 30 5.234 43.771 125.201 1.00 0.00 PROA ATOM 268 CB ALA P 30 6.108 42.553 124.843 1.00 0.00 PROA ATOM 269 C ALA P 30 5.988 45.025 124.802 1.00 0.00 PROA ATOM 270 O ALA P 30 6.602 45.671 125.645 1.00 0.00 PROA ATOM 271 N LEU P 31 5.943 45.397 123.506 1.00 0.00 PROA ATOM 272 CA LEU P 31 6.634 46.547 122.950 1.00 0.00 PROA ATOM 273 CB LEU P 31 7.021 46.239 121.487 1.00 0.00 PROA ATOM 274 CG LEU P 31 7.976 45.028 121.349 1.00 0.00 PROA ATOM 275 CD1 LEU P 31 8.171 44.640 119.889 1.00 0.00 PROA ATOM 276 CD2 LEU P 31 9.347 45.280 122.004 1.00 0.00 PROA ATOM 277 C LEU P 31 5.785 47.801 123.011 1.00 0.00 PROA ATOM 278 O LEU P 31 4.575 47.733 123.201 1.00 0.00 PROA ATOM 279 N GLU P 32 6.401 49.002 122.876 1.00 0.00 PROA ATOM 280 CA GLU P 32 5.650 50.244 122.806 1.00 0.00 PROA ATOM 281 CB GLU P 32 6.180 51.383 123.700 1.00 0.00 PROA ATOM 282 CG GLU P 32 6.123 51.052 125.198 1.00 0.00 PROA ATOM 283 CD GLU P 32 6.473 52.304 125.998 1.00 0.00 PROA ATOM 284 OE1 GLU P 32 7.536 52.918 125.722 1.00 0.00 PROA ATOM 285 OE2 GLU P 32 5.672 52.675 126.895 1.00 0.00 PROA ATOM 286 C GLU P 32 5.578 50.784 121.406 1.00 0.00 PROA ATOM 287 O GLU P 32 4.645 51.524 121.087 1.00 0.00 PROA ATOM 288 N SER P 33 6.571 50.461 120.547 1.00 0.00 PROA ATOM 289 CA SER P 33 6.625 50.993 119.204 1.00 0.00 PROA ATOM 290 CB SER P 33 8.045 51.399 118.741 1.00 0.00 PROA ATOM 291 OG SER P 33 8.532 52.486 119.518 1.00 0.00 PROA ATOM 292 C SER P 33 6.082 49.982 118.242 1.00 0.00 PROA ATOM 293 O SER P 33 6.411 48.796 118.289 1.00 0.00 PROA ATOM 294 N SER P 34 5.233 50.464 117.311 1.00 0.00 PROA ATOM 295 CA SER P 34 4.625 49.694 116.252 1.00 0.00 PROA ATOM 296 CB SER P 34 3.437 50.448 115.600 1.00 0.00 PROA ATOM 297 OG SER P 34 3.836 51.663 114.970 1.00 0.00 PROA ATOM 298 C SER P 34 5.639 49.283 115.210 1.00 0.00 PROA ATOM 299 O SER P 34 5.572 48.179 114.675 1.00 0.00 PROA ATOM 300 N THR P 35 6.635 50.156 114.925 1.00 0.00 PROA ATOM 301 CA THR P 35 7.703 49.875 113.980 1.00 0.00 PROA ATOM 302 CB THR P 35 8.516 51.109 113.622 1.00 0.00 PROA ATOM 303 OG1 THR P 35 7.672 52.076 113.010 1.00 0.00 PROA ATOM 304 CG2 THR P 35 9.650 50.756 112.625 1.00 0.00 PROA ATOM 305 C THR P 35 8.625 48.820 114.540 1.00 0.00 PROA ATOM 306 O THR P 35 9.033 47.900 113.833 1.00 0.00 PROA ATOM 307 N ALA P 36 8.933 48.892 115.859 1.00 0.00 PROA ATOM 308 CA ALA P 36 9.744 47.897 116.524 1.00 0.00 PROA ATOM 309 CB ALA P 36 10.045 48.264 117.991 1.00 0.00 PROA ATOM 310 C ALA P 36 9.055 46.555 116.516 1.00 0.00 PROA ATOM 311 O ALA P 36 9.707 45.535 116.331 1.00 0.00 PROA ATOM 312 N THR P 37 7.704 46.538 116.657 1.00 0.00 PROA ATOM 313 CA THR P 37 6.905 45.328 116.640 1.00 0.00 PROA ATOM 314 CB THR P 37 5.446 45.554 117.004 1.00 0.00 PROA ATOM 315 OG1 THR P 37 5.357 46.121 118.303 1.00 0.00 PROA ATOM 316 CG2 THR P 37 4.700 44.199 117.083 1.00 0.00 PROA ATOM 317 C THR P 37 6.968 44.690 115.278 1.00 0.00 PROA ATOM 318 O THR P 37 7.054 43.476 115.190 1.00 0.00 PROA ATOM 319 N ASP P 38 6.964 45.478 114.179 1.00 0.00 PROA ATOM 320 CA ASP P 38 7.011 44.956 112.827 1.00 0.00 PROA ATOM 321 CB ASP P 38 6.697 46.069 111.791 1.00 0.00 PROA ATOM 322 CG ASP P 38 5.215 46.467 111.834 1.00 0.00 PROA ATOM 323 OD1 ASP P 38 4.385 45.742 112.444 1.00 0.00 PROA ATOM 324 OD2 ASP P 38 4.888 47.522 111.234 1.00 0.00 PROA ATOM 325 C ASP P 38 8.354 44.329 112.512 1.00 0.00 PROA ATOM 326 O ASP P 38 8.410 43.263 111.900 1.00 0.00 PROA ATOM 327 N VAL P 39 9.472 44.946 112.965 1.00 0.00 PROA ATOM 328 CA VAL P 39 10.814 44.419 112.786 1.00 0.00 PROA ATOM 329 CB VAL P 39 11.875 45.447 113.154 1.00 0.00 PROA ATOM 330 CG1 VAL P 39 13.295 44.830 113.141 1.00 0.00 PROA ATOM 331 CG2 VAL P 39 11.781 46.623 112.154 1.00 0.00 PROA ATOM 332 C VAL P 39 10.987 43.150 113.597 1.00 0.00 PROA ATOM 333 O VAL P 39 11.507 42.159 113.088 1.00 0.00 PROA ATOM 334 N PHE P 40 10.503 43.123 114.865 1.00 0.00 PROA ATOM 335 CA PHE P 40 10.525 41.932 115.687 1.00 0.00 PROA ATOM 336 CB PHE P 40 10.147 42.118 117.190 1.00 0.00 PROA ATOM 337 CG PHE P 40 11.322 42.568 118.020 1.00 0.00 PROA ATOM 338 CD1 PHE P 40 11.396 43.849 118.594 1.00 0.00 PROA ATOM 339 CE1 PHE P 40 12.462 44.206 119.430 1.00 0.00 PROA ATOM 340 CZ PHE P 40 13.490 43.288 119.678 1.00 0.00 PROA ATOM 341 CD2 PHE P 40 12.365 41.656 118.282 1.00 0.00 PROA ATOM 342 CE2 PHE P 40 13.447 42.011 119.099 1.00 0.00 PROA ATOM 343 C PHE P 40 9.667 40.836 115.136 1.00 0.00 PROA ATOM 344 O PHE P 40 10.081 39.692 115.192 1.00 0.00 PROA ATOM 345 N TRP P 41 8.479 41.120 114.558 1.00 0.00 PROA ATOM 346 CA TRP P 41 7.596 40.109 114.015 1.00 0.00 PROA ATOM 347 CB TRP P 41 6.191 40.670 113.694 1.00 0.00 PROA ATOM 348 CG TRP P 41 5.200 39.658 113.142 1.00 0.00 PROA ATOM 349 CD1 TRP P 41 4.675 39.580 111.884 1.00 0.00 PROA ATOM 350 NE1 TRP P 41 3.852 38.483 111.776 1.00 0.00 PROA ATOM 351 CE2 TRP P 41 3.846 37.818 112.984 1.00 0.00 PROA ATOM 352 CD2 TRP P 41 4.681 38.530 113.871 1.00 0.00 PROA ATOM 353 CE3 TRP P 41 4.885 38.090 115.180 1.00 0.00 PROA ATOM 354 CZ3 TRP P 41 4.238 36.911 115.582 1.00 0.00 PROA ATOM 355 CZ2 TRP P 41 3.196 36.655 113.384 1.00 0.00 PROA ATOM 356 CH2 TRP P 41 3.403 36.205 114.699 1.00 0.00 PROA ATOM 357 C TRP P 41 8.209 39.466 112.798 1.00 0.00 PROA ATOM 358 O TRP P 41 8.108 38.256 112.620 1.00 0.00 PROA ATOM 359 N ALA P 42 8.921 40.254 111.965 1.00 0.00 PROA ATOM 360 CA ALA P 42 9.680 39.744 110.848 1.00 0.00 PROA ATOM 361 CB ALA P 42 10.226 40.900 109.984 1.00 0.00 PROA ATOM 362 C ALA P 42 10.833 38.887 111.320 1.00 0.00 PROA ATOM 363 O ALA P 42 11.161 37.876 110.710 1.00 0.00 PROA ATOM 364 N LYS P 43 11.457 39.261 112.456 1.00 0.00 PROA ATOM 365 CA LYS P 43 12.571 38.553 113.032 1.00 0.00 PROA ATOM 366 CB LYS P 43 13.426 39.531 113.843 1.00 0.00 PROA ATOM 367 CG LYS P 43 14.870 39.084 114.048 1.00 0.00 PROA ATOM 368 CD LYS P 43 15.676 40.174 114.745 1.00 0.00 PROA ATOM 369 CE LYS P 43 17.164 39.859 114.795 1.00 0.00 PROA ATOM 370 NZ LYS P 43 17.891 40.929 115.512 1.00 0.00 PROA ATOM 371 C LYS P 43 12.117 37.365 113.866 1.00 0.00 PROA ATOM 372 O LYS P 43 12.926 36.526 114.233 1.00 0.00 PROA ATOM 373 N TYR P 44 10.805 37.233 114.184 1.00 0.00 PROA ATOM 374 CA TYR P 44 10.238 36.000 114.689 1.00 0.00 PROA ATOM 375 CB TYR P 44 8.905 36.130 115.499 1.00 0.00 PROA ATOM 376 CG TYR P 44 9.131 36.665 116.894 1.00 0.00 PROA ATOM 377 CD1 TYR P 44 8.778 37.979 117.247 1.00 0.00 PROA ATOM 378 CE1 TYR P 44 9.098 38.511 118.503 1.00 0.00 PROA ATOM 379 CZ TYR P 44 9.753 37.717 119.446 1.00 0.00 PROA ATOM 380 OH TYR P 44 10.160 38.273 120.679 1.00 0.00 PROA ATOM 381 CD2 TYR P 44 9.717 35.852 117.884 1.00 0.00 PROA ATOM 382 CE2 TYR P 44 10.004 36.368 119.158 1.00 0.00 PROA ATOM 383 C TYR P 44 9.977 35.094 113.515 1.00 0.00 PROA ATOM 384 O TYR P 44 10.403 33.947 113.531 1.00 0.00 PROA ATOM 385 N THR P 45 9.308 35.608 112.452 1.00 0.00 PROA ATOM 386 CA THR P 45 8.808 34.838 111.321 1.00 0.00 PROA ATOM 387 CB THR P 45 7.906 35.661 110.409 1.00 0.00 PROA ATOM 388 OG1 THR P 45 6.778 36.121 111.144 1.00 0.00 PROA ATOM 389 CG2 THR P 45 7.375 34.803 109.236 1.00 0.00 PROA ATOM 390 C THR P 45 9.935 34.235 110.513 1.00 0.00 PROA ATOM 391 O THR P 45 9.872 33.075 110.114 1.00 0.00 PROA ATOM 392 N ALA P 46 11.027 34.996 110.291 1.00 0.00 PROA ATOM 393 CA ALA P 46 12.206 34.529 109.591 1.00 0.00 PROA ATOM 394 CB ALA P 46 13.162 35.686 109.236 1.00 0.00 PROA ATOM 395 C ALA P 46 12.985 33.531 110.411 1.00 0.00 PROA ATOM 396 O ALA P 46 13.699 32.692 109.866 1.00 0.00 PROA ATOM 397 N CYS P 47 12.851 33.598 111.754 1.00 0.00 PROA ATOM 398 CA CYS P 47 13.557 32.730 112.657 1.00 0.00 PROA ATOM 399 CB CYS P 47 13.984 33.447 113.951 1.00 0.00 PROA ATOM 400 SG CYS P 47 15.189 34.753 113.547 1.00 0.00 PROA ATOM 401 C CYS P 47 12.739 31.513 112.973 1.00 0.00 PROA ATOM 402 O CYS P 47 13.200 30.694 113.753 1.00 0.00 PROA ATOM 403 N GLU P 48 11.546 31.317 112.336 1.00 0.00 PROA ATOM 404 CA GLU P 48 10.727 30.120 112.487 1.00 0.00 PROA ATOM 405 CB GLU P 48 9.316 30.215 111.862 1.00 0.00 PROA ATOM 406 CG GLU P 48 8.399 31.196 112.614 1.00 0.00 PROA ATOM 407 CD GLU P 48 7.033 31.332 111.936 1.00 0.00 PROA ATOM 408 OE1 GLU P 48 6.790 30.666 110.896 1.00 0.00 PROA ATOM 409 OE2 GLU P 48 6.193 32.100 112.470 1.00 0.00 PROA ATOM 410 C GLU P 48 11.382 28.878 111.929 1.00 0.00 PROA ATOM 411 O GLU P 48 10.953 27.764 112.228 1.00 0.00 PROA ATOM 412 N THR P 49 12.480 29.045 111.158 1.00 0.00 PROA ATOM 413 CA THR P 49 13.379 28.003 110.703 1.00 0.00 PROA ATOM 414 CB THR P 49 14.503 28.619 109.883 1.00 0.00 PROA ATOM 415 OG1 THR P 49 13.952 29.286 108.754 1.00 0.00 PROA ATOM 416 CG2 THR P 49 15.498 27.559 109.368 1.00 0.00 PROA ATOM 417 C THR P 49 13.948 27.238 111.890 1.00 0.00 PROA ATOM 418 O THR P 49 14.155 26.029 111.803 1.00 0.00 PROA ATOM 419 N ALA P 50 14.164 27.932 113.035 1.00 0.00 PROA ATOM 420 CA ALA P 50 14.460 27.338 114.317 1.00 0.00 PROA ATOM 421 CB ALA P 50 15.646 28.040 114.999 1.00 0.00 PROA ATOM 422 C ALA P 50 13.255 27.499 115.221 1.00 0.00 PROA ATOM 423 O ALA P 50 12.651 28.565 115.273 1.00 0.00 PROA ATOM 424 N ARG P 51 12.857 26.448 115.970 1.00 0.00 PROA ATOM 425 CA ARG P 51 11.868 26.590 117.026 1.00 0.00 PROA ATOM 426 CB ARG P 51 10.399 26.252 116.635 1.00 0.00 PROA ATOM 427 CG ARG P 51 9.753 27.183 115.603 1.00 0.00 PROA ATOM 428 CD ARG P 51 8.280 26.822 115.368 1.00 0.00 PROA ATOM 429 NE ARG P 51 7.708 27.704 114.298 1.00 0.00 PROA ATOM 430 CZ ARG P 51 6.436 27.545 113.838 1.00 0.00 PROA ATOM 431 NH1 ARG P 51 5.590 26.622 114.351 1.00 0.00 PROA ATOM 432 NH2 ARG P 51 5.990 28.327 112.831 1.00 0.00 PROA ATOM 433 C ARG P 51 12.242 25.682 118.158 1.00 0.00 PROA ATOM 434 O ARG P 51 11.377 25.218 118.898 1.00 0.00 PROA ATOM 435 N THR P 52 13.548 25.389 118.325 1.00 0.00 PROA ATOM 436 CA THR P 52 14.030 24.400 119.266 1.00 0.00 PROA ATOM 437 CB THR P 52 15.100 23.533 118.619 1.00 0.00 PROA ATOM 438 OG1 THR P 52 16.165 24.309 118.085 1.00 0.00 PROA ATOM 439 CG2 THR P 52 14.456 22.729 117.468 1.00 0.00 PROA ATOM 440 C THR P 52 14.223 25.035 120.649 1.00 0.00 PROA ATOM 441 O THR P 52 13.227 25.628 121.070 1.00 0.00 PROA ATOM 442 NT THR P 52 15.442 24.869 121.228 1.00 0.00 PROA ATOM 443 CA CA H 53 -2.489 40.050 126.184 1.00 0.00 HETA ATOM 444 CA CA H 54 1.225 40.068 127.030 1.00 0.00 HETB ATOM 445 CA CA H 55 0.990 35.902 127.703 1.00 0.00 HETC ATOM 446 CA CA H 56 2.355 32.778 128.964 1.00 0.00 HETD ATOM 447 CA CA H 57 5.191 29.791 130.264 1.00 0.00 HETE ATOM 448 CA CA H 58 -3.688 43.812 124.111 1.00 0.00 HETF ATOM 449 CA CA H 59 14.450 32.310 129.421 1.00 0.00 HETG END If you find 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