Datasets
Models
358 lines (357 with data), 20.4 kB
ATOM 1 N GLY A 4 -2.263 16.045 5.462 1.00 20.23 N ATOM 2 CA GLY A 4 -2.678 17.137 4.579 1.00 19.80 C ATOM 3 C GLY A 4 -3.462 18.145 5.424 1.00 17.57 C ATOM 4 O GLY A 4 -3.936 17.774 6.494 1.00 13.72 O ATOM 5 N ARG A 5 -3.580 19.375 4.975 1.00 17.20 N ATOM 6 CA ARG A 5 -4.213 20.471 5.695 1.00 16.99 C ATOM 7 C ARG A 5 -5.645 20.140 6.082 1.00 17.18 C ATOM 8 O ARG A 5 -6.029 20.066 7.255 1.00 19.75 O ATOM 9 CB ARG A 5 -4.129 21.721 4.801 1.00 16.27 C ATOM 10 CG ARG A 5 -4.661 22.982 5.452 1.00 17.29 C ATOM 11 CD ARG A 5 -4.390 24.225 4.633 1.00 17.12 C ATOM 12 NE ARG A 5 -4.982 24.231 3.314 1.00 18.38 N ATOM 13 CZ ARG A 5 -6.195 24.611 2.953 1.00 21.61 C ATOM 14 NH1 ARG A 5 -7.092 25.062 3.825 1.00 17.53 N ATOM 15 NH2 ARG A 5 -6.530 24.534 1.667 1.00 24.97 N ATOM 16 N CYS A 6 -6.469 19.934 5.055 1.00 17.51 N ATOM 17 CA CYS A 6 -7.876 19.614 5.227 1.00 16.10 C ATOM 18 C CYS A 6 -8.068 18.295 5.959 1.00 17.01 C ATOM 19 O CYS A 6 -9.004 18.173 6.758 1.00 26.66 O ATOM 20 CB CYS A 6 -8.563 19.607 3.845 1.00 17.37 C ATOM 21 SG CYS A 6 -8.654 21.284 3.148 1.00 20.33 S ATOM 22 N LEU A 25 -11.165 26.126 14.823 1.00 18.05 N ATOM 23 CA LEU A 25 -10.365 25.124 14.143 1.00 15.29 C ATOM 24 C LEU A 25 -9.187 25.742 13.402 1.00 12.54 C ATOM 25 O LEU A 25 -8.093 25.177 13.472 1.00 19.58 O ATOM 26 CB LEU A 25 -11.224 24.310 13.169 1.00 18.15 C ATOM 27 CG LEU A 25 -10.708 22.922 12.795 1.00 17.75 C ATOM 28 CD1 LEU A 25 -10.456 22.064 14.030 1.00 10.63 C ATOM 29 CD2 LEU A 25 -11.691 22.249 11.844 1.00 22.49 C ATOM 30 N GLY A 26 -9.364 26.859 12.711 1.00 10.34 N ATOM 31 CA GLY A 26 -8.262 27.531 12.040 1.00 8.36 C ATOM 32 C GLY A 26 -7.057 27.721 12.951 1.00 9.53 C ATOM 33 O GLY A 26 -5.921 27.577 12.490 1.00 15.29 O ATOM 34 N ASN A 27 -7.272 28.012 14.228 1.00 8.64 N ATOM 35 CA ASN A 27 -6.183 28.184 15.180 1.00 10.30 C ATOM 36 C ASN A 27 -5.370 26.904 15.365 1.00 9.38 C ATOM 37 O ASN A 27 -4.143 26.964 15.371 1.00 10.71 O ATOM 38 CB ASN A 27 -6.688 28.628 16.561 1.00 8.34 C ATOM 39 CG ASN A 27 -7.064 30.099 16.518 1.00 13.61 C ATOM 40 OD1 ASN A 27 -6.183 30.949 16.427 1.00 13.42 O ATOM 41 ND2 ASN A 27 -8.362 30.384 16.551 1.00 14.28 N ATOM 42 N VAL A 29 -5.120 24.224 13.436 1.00 7.83 N ATOM 43 CA VAL A 29 -4.453 23.833 12.197 1.00 6.24 C ATOM 44 C VAL A 29 -3.256 24.727 11.940 1.00 6.35 C ATOM 45 O VAL A 29 -2.184 24.250 11.573 1.00 9.65 O ATOM 46 CB VAL A 29 -5.437 23.882 11.013 1.00 9.62 C ATOM 47 CG1 VAL A 29 -4.749 23.647 9.678 1.00 14.31 C ATOM 48 CG2 VAL A 29 -6.529 22.838 11.223 1.00 9.00 C ATOM 49 N CYS A 30 -3.410 26.032 12.144 1.00 7.77 N ATOM 50 CA CYS A 30 -2.275 26.942 12.020 1.00 7.41 C ATOM 51 C CYS A 30 -1.146 26.551 12.965 1.00 6.56 C ATOM 52 O CYS A 30 0.030 26.545 12.609 1.00 8.11 O ATOM 53 CB CYS A 30 -2.730 28.373 12.314 1.00 7.16 C ATOM 54 SG CYS A 30 -1.451 29.630 12.065 1.00 14.02 S ATOM 55 N ALA A 31 -1.503 26.235 14.208 1.00 6.88 N ATOM 56 CA ALA A 31 -0.516 25.894 15.224 1.00 8.48 C ATOM 57 C ALA A 31 0.271 24.649 14.840 1.00 8.72 C ATOM 58 O ALA A 31 1.486 24.586 14.954 1.00 11.37 O ATOM 59 CB ALA A 31 -1.186 25.658 16.573 1.00 9.12 C ATOM 60 N ALA A 32 -0.480 23.655 14.376 1.00 8.67 N ATOM 61 CA ALA A 32 0.115 22.392 13.961 1.00 9.19 C ATOM 62 C ALA A 32 1.025 22.606 12.764 1.00 9.51 C ATOM 63 O ALA A 32 2.123 22.061 12.667 1.00 8.92 O ATOM 64 CB ALA A 32 -0.996 21.400 13.656 1.00 11.50 C ATOM 65 N LYS A 33 0.564 23.428 11.823 1.00 7.29 N ATOM 66 CA LYS A 33 1.410 23.749 10.677 1.00 9.14 C ATOM 67 C LYS A 33 2.764 24.287 11.101 1.00 10.78 C ATOM 68 O LYS A 33 3.840 23.799 10.774 1.00 13.36 O ATOM 69 CB LYS A 33 0.712 24.798 9.806 1.00 11.37 C ATOM 70 CG LYS A 33 1.626 25.494 8.817 1.00 13.11 C ATOM 71 CD LYS A 33 2.122 24.506 7.772 1.00 17.41 C ATOM 72 CE LYS A 33 2.521 25.215 6.488 1.00 21.28 C ATOM 73 NZ LYS A 33 2.996 24.232 5.471 1.00 33.94 N ATOM 74 N PHE A 34 2.730 25.368 11.878 1.00 12.63 N ATOM 75 CA PHE A 34 3.993 25.975 12.282 1.00 16.61 C ATOM 76 C PHE A 34 4.732 25.211 13.363 1.00 17.88 C ATOM 77 O PHE A 34 5.963 25.325 13.494 1.00 21.18 O ATOM 78 CB PHE A 34 3.674 27.433 12.691 1.00 16.11 C ATOM 79 CG PHE A 34 3.278 28.213 11.436 1.00 14.84 C ATOM 80 CD1 PHE A 34 4.106 28.158 10.326 1.00 14.81 C ATOM 81 CD2 PHE A 34 2.122 28.964 11.382 1.00 15.10 C ATOM 82 CE1 PHE A 34 3.787 28.847 9.166 1.00 16.08 C ATOM 83 CE2 PHE A 34 1.795 29.651 10.221 1.00 16.35 C ATOM 84 CZ PHE A 34 2.622 29.596 9.112 1.00 15.36 C ATOM 85 N ASN A 37 4.893 21.197 11.021 1.00 11.67 N ATOM 86 CA ASN A 37 4.633 21.057 9.606 1.00 13.41 C ATOM 87 C ASN A 37 3.713 19.871 9.328 1.00 12.77 C ATOM 88 O ASN A 37 3.820 19.210 8.294 1.00 12.00 O ATOM 89 CB ASN A 37 5.961 20.924 8.854 1.00 17.58 C ATOM 90 CG ASN A 37 5.825 21.307 7.393 1.00 21.54 C ATOM 91 OD1 ASN A 37 4.882 22.006 7.012 1.00 27.69 O ATOM 92 ND2 ASN A 37 6.768 20.844 6.577 1.00 27.05 N ATOM 93 N PHE A 38 2.797 19.600 10.247 1.00 12.64 N ATOM 94 CA PHE A 38 1.788 18.565 10.076 1.00 12.71 C ATOM 95 C PHE A 38 2.355 17.151 10.174 1.00 13.33 C ATOM 96 O PHE A 38 1.700 16.215 9.711 1.00 12.05 O ATOM 97 CB PHE A 38 1.105 18.707 8.716 1.00 11.39 C ATOM 98 CG PHE A 38 0.277 19.966 8.546 1.00 12.91 C ATOM 99 CD1 PHE A 38 -0.411 20.513 9.612 1.00 14.96 C ATOM 100 CD2 PHE A 38 0.198 20.575 7.310 1.00 16.66 C ATOM 101 CE1 PHE A 38 -1.185 21.653 9.455 1.00 16.55 C ATOM 102 CE2 PHE A 38 -0.570 21.716 7.136 1.00 17.80 C ATOM 103 CZ PHE A 38 -1.257 22.246 8.211 1.00 17.34 C ATOM 104 N ARG A 114 2.892 33.307 15.300 1.00 15.34 N ATOM 105 CA ARG A 114 2.634 33.159 13.867 1.00 16.25 C ATOM 106 C ARG A 114 1.159 33.053 13.513 1.00 16.94 C ATOM 107 O ARG A 114 0.831 33.273 12.340 1.00 13.10 O ATOM 108 CB ARG A 114 3.403 31.923 13.352 1.00 14.29 C ATOM 109 CG ARG A 114 4.885 32.036 13.679 1.00 16.24 C ATOM 110 CD ARG A 114 5.771 30.983 13.089 1.00 18.12 C ATOM 111 NE ARG A 114 5.935 31.080 11.637 1.00 18.19 N ATOM 112 CZ ARG A 114 6.744 30.264 10.965 1.00 17.74 C ATOM 113 NH1 ARG A 114 7.445 29.321 11.584 1.00 14.78 N ATOM 114 NH2 ARG A 114 6.846 30.399 9.652 1.00 16.93 N ATOM 115 N CYS A 115 0.299 32.740 14.479 1.00 13.66 N ATOM 116 CA CYS A 115 -1.110 32.556 14.179 1.00 13.56 C ATOM 117 C CYS A 115 -2.072 33.529 14.854 1.00 15.65 C ATOM 118 O CYS A 115 -3.038 33.942 14.216 1.00 8.58 O ATOM 119 CB CYS A 115 -1.559 31.168 14.659 1.00 13.25 C ATOM 120 SG CYS A 115 -0.617 29.834 13.918 1.00 12.23 S ATOM 121 N THR A 118 -3.961 36.688 13.319 1.00 18.16 N ATOM 122 CA THR A 118 -3.980 36.553 11.866 1.00 17.52 C ATOM 123 C THR A 118 -5.332 36.002 11.430 1.00 17.58 C ATOM 124 O THR A 118 -6.146 35.579 12.251 1.00 17.21 O ATOM 125 CB THR A 118 -2.826 35.652 11.388 1.00 17.80 C ATOM 126 OG1 THR A 118 -3.063 34.279 11.736 1.00 15.14 O ATOM 127 CG2 THR A 118 -1.535 36.057 12.094 1.00 15.40 C ATOM 128 N ASP A 119 -5.621 35.983 10.135 1.00 19.45 N ATOM 129 CA ASP A 119 -6.893 35.398 9.688 1.00 19.02 C ATOM 130 C ASP A 119 -6.780 33.893 9.685 1.00 18.04 C ATOM 131 O ASP A 119 -6.669 33.211 8.666 1.00 17.71 O ATOM 132 CB ASP A 119 -7.241 35.947 8.311 1.00 21.94 C ATOM 133 CG ASP A 119 -8.366 35.198 7.624 1.00 27.28 C ATOM 134 OD1 ASP A 119 -9.135 34.480 8.300 1.00 29.28 O ATOM 135 OD2 ASP A 119 -8.461 35.341 6.383 1.00 34.94 O ATOM 136 N VAL A 120 -6.809 33.280 10.872 1.00 19.46 N ATOM 137 CA VAL A 120 -6.545 31.842 10.932 1.00 19.55 C ATOM 138 C VAL A 120 -7.581 31.033 10.171 1.00 21.91 C ATOM 139 O VAL A 120 -7.384 29.862 9.842 1.00 23.85 O ATOM 140 CB VAL A 120 -6.510 31.359 12.392 1.00 18.88 C ATOM 141 CG1 VAL A 120 -5.551 32.187 13.231 1.00 16.69 C ATOM 142 CG2 VAL A 120 -7.918 31.425 12.965 1.00 19.80 C ATOM 143 N GLN A 121 -8.724 31.639 9.884 1.00 23.72 N ATOM 144 CA GLN A 121 -9.775 31.017 9.093 1.00 25.96 C ATOM 145 C GLN A 121 -9.233 30.519 7.765 1.00 23.72 C ATOM 146 O GLN A 121 -9.676 29.504 7.217 1.00 22.39 O ATOM 147 CB GLN A 121 -10.889 32.057 8.934 1.00 32.72 C ATOM 148 CG GLN A 121 -12.294 31.485 8.849 1.00 40.13 C ATOM 149 CD GLN A 121 -12.725 31.326 7.400 1.00 47.55 C ATOM 150 OE1 GLN A 121 -12.921 30.212 6.907 1.00 57.38 O ATOM 151 NE2 GLN A 121 -12.864 32.456 6.712 1.00 55.12 N ATOM 152 N ALA A 122 -8.243 31.214 7.192 1.00 20.12 N ATOM 153 CA ALA A 122 -7.679 30.742 5.933 1.00 20.14 C ATOM 154 C ALA A 122 -7.152 29.316 6.022 1.00 20.79 C ATOM 155 O ALA A 122 -7.047 28.584 5.026 1.00 17.24 O ATOM 156 CB ALA A 122 -6.580 31.698 5.485 1.00 26.50 C ATOM 157 N TRP A 123 -6.792 28.841 7.222 1.00 17.27 N ATOM 158 CA TRP A 123 -6.268 27.476 7.279 1.00 15.99 C ATOM 159 C TRP A 123 -7.315 26.412 7.018 1.00 16.37 C ATOM 160 O TRP A 123 -6.964 25.241 6.825 1.00 19.93 O ATOM 161 CB TRP A 123 -5.592 27.227 8.650 1.00 15.31 C ATOM 162 CG TRP A 123 -4.327 28.050 8.686 1.00 16.14 C ATOM 163 CD1 TRP A 123 -4.112 29.237 9.319 1.00 15.02 C ATOM 164 CD2 TRP A 123 -3.104 27.704 8.026 1.00 13.98 C ATOM 165 NE1 TRP A 123 -2.822 29.653 9.096 1.00 13.61 N ATOM 166 CE2 TRP A 123 -2.184 28.731 8.308 1.00 15.58 C ATOM 167 CE3 TRP A 123 -2.716 26.624 7.233 1.00 14.25 C ATOM 168 CZ2 TRP A 123 -0.878 28.708 7.814 1.00 16.45 C ATOM 169 CZ3 TRP A 123 -1.426 26.601 6.745 1.00 16.07 C ATOM 170 CH2 TRP A 123 -0.525 27.633 7.037 1.00 16.61 C ATOM 171 N ILE A 124 -8.605 26.752 7.003 1.00 16.00 N ATOM 172 CA ILE A 124 -9.550 25.650 6.750 1.00 19.20 C ATOM 173 C ILE A 124 -10.343 25.907 5.480 1.00 21.57 C ATOM 174 O ILE A 124 -11.202 25.123 5.088 1.00 23.15 O ATOM 175 CB ILE A 124 -10.486 25.436 7.939 1.00 18.57 C ATOM 176 CG1 ILE A 124 -11.225 26.693 8.417 1.00 19.09 C ATOM 177 CG2 ILE A 124 -9.717 24.816 9.098 1.00 15.06 C ATOM 178 CD1 ILE A 124 -11.919 26.446 9.744 1.00 22.78 C ATOM 179 N ARG A 125 -10.016 27.030 4.853 1.00 23.84 N ATOM 180 CA ARG A 125 -10.620 27.392 3.581 1.00 29.87 C ATOM 181 C ARG A 125 -10.521 26.220 2.609 1.00 27.06 C ATOM 182 O ARG A 125 -9.458 25.606 2.533 1.00 23.27 O ATOM 183 CB ARG A 125 -9.933 28.630 2.999 1.00 39.05 C ATOM 184 CG ARG A 125 -8.792 28.310 2.041 1.00 46.05 C ATOM 185 CD ARG A 125 -7.552 29.143 2.332 1.00 50.08 C ATOM 186 NE ARG A 125 -6.334 28.332 2.256 1.00 53.06 N ATOM 187 CZ ARG A 125 -5.243 28.746 1.618 1.00 55.99 C ATOM 188 NH1 ARG A 125 -5.244 29.937 1.024 1.00 58.35 N ATOM 189 NH2 ARG A 125 -4.166 27.974 1.578 1.00 57.24 N ATOM 190 N GLY A 126 -11.601 25.917 1.909 1.00 26.78 N ATOM 191 CA GLY A 126 -11.664 24.861 0.923 1.00 24.80 C ATOM 192 C GLY A 126 -11.926 23.471 1.435 1.00 22.74 C ATOM 193 O GLY A 126 -12.251 22.546 0.674 1.00 24.67 O ATOM 194 N CYS A 127 -11.795 23.239 2.742 1.00 19.77 N ATOM 195 CA CYS A 127 -11.995 21.865 3.202 1.00 19.62 C ATOM 196 C CYS A 127 -13.459 21.487 3.319 1.00 22.08 C ATOM 197 O CYS A 127 -14.328 22.319 3.560 1.00 19.22 O ATOM 198 CB CYS A 127 -11.308 21.670 4.563 1.00 19.87 C ATOM 199 SG CYS A 127 -9.629 22.339 4.570 1.00 18.60 S HETATM 200 O HOH A 207 4.107 33.273 9.973 1.00 14.25 O HETATM 201 O HOH A 211 8.133 28.132 8.323 1.00 24.37 O HETATM 202 O HOH A 214 1.915 33.973 9.937 1.00 18.92 O HETATM 203 O HOH A 217 -11.170 29.018 11.936 1.00 22.15 O HETATM 204 O HOH A 227 -2.919 32.791 9.988 1.00 26.55 O HETATM 205 O HOH A 239 1.121 31.396 5.276 1.00 44.70 O HETATM 206 O HOH A 243 -9.396 33.290 3.592 1.00 55.90 O HETATM 207 O HOH A 249 -0.520 24.174 3.789 1.00 43.68 O HETATM 208 O HOH A 258 5.632 33.443 7.643 1.00 27.80 O HETATM 209 O HOH A 259 -11.747 35.105 6.874 1.00 47.69 O HETATM 210 O HOH A 260 6.561 26.773 7.166 1.00 46.36 O HETATM 211 O HOH A 269 -8.993 33.682 0.911 1.00 63.25 O HETATM 212 O HOH A 271 3.753 23.842 2.616 1.00 38.75 O HETATM 213 O HOH A 273 -0.147 36.144 8.908 1.00 29.93 O HETATM 214 O HOH A 279 -2.121 40.033 10.725 1.00 61.67 O HETATM 215 O HOH A 282 6.770 24.789 1.216 1.00 48.02 O HETATM 216 O HOH A 284 -10.256 35.313 1.926 1.00 51.59 O CONECT 1 2 CONECT 2 3 CONECT 3 4 4 5 CONECT 5 6 CONECT 6 7 9 CONECT 7 8 8 16 CONECT 9 10 CONECT 10 11 CONECT 11 12 CONECT 12 13 CONECT 13 14 15 15 CONECT 16 17 CONECT 17 18 20 CONECT 18 19 19 CONECT 20 21 CONECT 21 199 CONECT 22 23 CONECT 23 24 26 CONECT 24 25 25 30 CONECT 26 27 CONECT 27 28 29 CONECT 30 31 CONECT 31 32 CONECT 32 33 33 34 CONECT 34 35 CONECT 35 36 38 CONECT 36 37 37 CONECT 38 39 CONECT 39 40 40 41 CONECT 42 43 CONECT 43 44 46 CONECT 44 45 45 49 CONECT 46 47 48 CONECT 49 50 CONECT 50 51 53 CONECT 51 52 52 55 CONECT 53 54 CONECT 54 120 CONECT 55 56 CONECT 56 57 59 CONECT 57 58 58 60 CONECT 60 61 CONECT 61 62 64 CONECT 62 63 63 65 CONECT 65 66 CONECT 66 67 69 CONECT 67 68 68 74 CONECT 69 70 CONECT 70 71 CONECT 71 72 CONECT 72 73 CONECT 74 75 CONECT 75 76 78 CONECT 76 77 77 CONECT 78 79 CONECT 79 80 80 81 CONECT 80 82 CONECT 81 83 83 CONECT 82 84 84 CONECT 83 84 CONECT 85 86 CONECT 86 87 89 CONECT 87 88 88 93 CONECT 89 90 CONECT 90 91 91 92 CONECT 93 94 CONECT 94 95 97 CONECT 95 96 96 CONECT 97 98 CONECT 98 99 99 100 CONECT 99 101 CONECT 100 102 102 CONECT 101 103 103 CONECT 102 103 CONECT 104 105 CONECT 105 106 108 CONECT 106 107 107 115 CONECT 108 109 CONECT 109 110 CONECT 110 111 CONECT 111 112 CONECT 112 113 114 114 CONECT 115 116 CONECT 116 117 119 CONECT 117 118 118 CONECT 119 120 CONECT 121 122 CONECT 122 123 125 CONECT 123 124 124 128 CONECT 125 126 127 CONECT 128 129 CONECT 129 130 132 CONECT 130 131 131 136 CONECT 132 133 CONECT 133 134 134 135 CONECT 136 137 CONECT 137 138 140 CONECT 138 139 139 143 CONECT 140 141 142 CONECT 143 144 CONECT 144 145 147 CONECT 145 146 146 152 CONECT 147 148 CONECT 148 149 CONECT 149 150 150 151 CONECT 152 153 CONECT 153 154 156 CONECT 154 155 155 157 CONECT 157 158 CONECT 158 159 161 CONECT 159 160 160 171 CONECT 161 162 CONECT 162 163 163 164 CONECT 163 165 CONECT 164 166 166 167 CONECT 165 166 CONECT 166 168 CONECT 167 169 169 CONECT 168 170 170 CONECT 169 170 CONECT 171 172 CONECT 172 173 175 CONECT 173 174 174 179 CONECT 175 176 177 CONECT 176 178 CONECT 179 180 CONECT 180 181 183 CONECT 181 182 182 190 CONECT 183 184 CONECT 184 185 CONECT 185 186 CONECT 186 187 CONECT 187 188 189 189 CONECT 190 191 CONECT 191 192 CONECT 192 193 193 194 CONECT 194 195 CONECT 195 196 198 CONECT 196 197 197 CONECT 198 199 END