Datasets:

PDBbind_test / 6d07 /6d07_protein_alphafold_aligned_tr_fix.pdb
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Add batch 3
b57a5d2 verified
REMARK 1 CREATED WITH OPENMM 8.0, 2023-08-19
ATOM 1 N GLY A 1 9.705 18.071 4.640 1.00 0.00 N
ATOM 2 CA GLY A 1 9.862 19.140 5.612 1.00 0.00 C
ATOM 3 C GLY A 1 10.762 18.764 6.774 1.00 0.00 C
ATOM 4 O GLY A 1 10.776 17.610 7.206 1.00 0.00 O
ATOM 5 N GLU A 2 11.966 19.331 6.863 1.00 0.00 N
ATOM 6 CA GLU A 2 13.006 18.963 7.820 1.00 0.00 C
ATOM 7 C GLU A 2 12.480 19.012 9.252 1.00 0.00 C
ATOM 8 CB GLU A 2 14.220 19.883 7.674 1.00 0.00 C
ATOM 9 O GLU A 2 12.107 20.078 9.746 1.00 0.00 O
ATOM 10 CG GLU A 2 15.081 19.575 6.457 1.00 0.00 C
ATOM 11 CD GLU A 2 16.152 20.624 6.200 1.00 0.00 C
ATOM 12 OE1 GLU A 2 17.300 20.447 6.671 1.00 0.00 O
ATOM 13 OE2 GLU A 2 15.842 21.630 5.524 1.00 0.00 O
ATOM 14 N TYR A 3 11.822 17.969 9.788 1.00 0.00 N
ATOM 15 CA TYR A 3 11.425 17.890 11.190 1.00 0.00 C
ATOM 16 C TYR A 3 12.644 17.938 12.105 1.00 0.00 C
ATOM 17 CB TYR A 3 10.626 16.611 11.452 1.00 0.00 C
ATOM 18 O TYR A 3 13.545 17.103 11.993 1.00 0.00 O
ATOM 19 CG TYR A 3 9.443 16.435 10.531 1.00 0.00 C
ATOM 20 CD1 TYR A 3 8.253 17.124 10.756 1.00 0.00 C
ATOM 21 CD2 TYR A 3 9.511 15.580 9.437 1.00 0.00 C
ATOM 22 CE1 TYR A 3 7.159 16.964 9.911 1.00 0.00 C
ATOM 23 CE2 TYR A 3 8.424 15.412 8.586 1.00 0.00 C
ATOM 24 OH TYR A 3 6.174 15.945 7.992 1.00 0.00 O
ATOM 25 CZ TYR A 3 7.255 16.107 8.830 1.00 0.00 C
ATOM 26 N VAL A 4 12.752 19.115 12.782 1.00 0.00 N
ATOM 27 CA VAL A 4 13.875 19.330 13.689 1.00 0.00 C
ATOM 28 C VAL A 4 13.475 18.935 15.109 1.00 0.00 C
ATOM 29 CB VAL A 4 14.355 20.798 13.661 1.00 0.00 C
ATOM 30 O VAL A 4 12.482 19.435 15.643 1.00 0.00 O
ATOM 31 CG1 VAL A 4 15.517 21.006 14.630 1.00 0.00 C
ATOM 32 CG2 VAL A 4 14.759 21.199 12.243 1.00 0.00 C
ATOM 33 N VAL A 5 14.123 17.983 15.637 1.00 0.00 N
ATOM 34 CA VAL A 5 13.895 17.574 17.018 1.00 0.00 C
ATOM 35 C VAL A 5 14.379 18.667 17.968 1.00 0.00 C
ATOM 36 CB VAL A 5 14.604 16.239 17.338 1.00 0.00 C
ATOM 37 O VAL A 5 15.510 19.142 17.854 1.00 0.00 O
ATOM 38 CG1 VAL A 5 14.320 15.807 18.775 1.00 0.00 C
ATOM 39 CG2 VAL A 5 14.168 15.154 16.355 1.00 0.00 C
ATOM 40 N GLU A 6 13.511 19.109 18.926 1.00 0.00 N
ATOM 41 CA GLU A 6 13.876 20.075 19.959 1.00 0.00 C
ATOM 42 C GLU A 6 14.592 19.394 21.122 1.00 0.00 C
ATOM 43 CB GLU A 6 12.635 20.814 20.466 1.00 0.00 C
ATOM 44 O GLU A 6 15.671 19.828 21.532 1.00 0.00 O
ATOM 45 CG GLU A 6 12.950 22.005 21.359 1.00 0.00 C
ATOM 46 CD GLU A 6 11.710 22.750 21.824 1.00 0.00 C
ATOM 47 OE1 GLU A 6 11.253 22.516 22.966 1.00 0.00 O
ATOM 48 OE2 GLU A 6 11.190 23.576 21.041 1.00 0.00 O
ATOM 49 N LYS A 7 13.842 18.393 21.691 1.00 0.00 N
ATOM 50 CA LYS A 7 14.424 17.655 22.807 1.00 0.00 C
ATOM 51 C LYS A 7 13.730 16.309 22.996 1.00 0.00 C
ATOM 52 CB LYS A 7 14.339 18.474 24.096 1.00 0.00 C
ATOM 53 O LYS A 7 12.646 16.081 22.456 1.00 0.00 O
ATOM 54 CG LYS A 7 12.918 18.797 24.532 1.00 0.00 C
ATOM 55 CD LYS A 7 12.898 19.615 25.816 1.00 0.00 C
ATOM 56 CE LYS A 7 11.477 19.958 26.241 1.00 0.00 C
ATOM 57 NZ LYS A 7 11.453 20.766 27.497 1.00 0.00 N
ATOM 58 N VAL A 8 14.475 15.462 23.754 1.00 0.00 N
ATOM 59 CA VAL A 8 13.914 14.166 24.121 1.00 0.00 C
ATOM 60 C VAL A 8 13.169 14.283 25.448 1.00 0.00 C
ATOM 61 CB VAL A 8 15.010 13.081 24.218 1.00 0.00 C
ATOM 62 O VAL A 8 13.736 14.726 26.450 1.00 0.00 O
ATOM 63 CG1 VAL A 8 14.394 11.719 24.532 1.00 0.00 C
ATOM 64 CG2 VAL A 8 15.816 13.020 22.923 1.00 0.00 C
ATOM 65 N LEU A 9 11.923 13.841 25.506 1.00 0.00 N
ATOM 66 CA LEU A 9 11.077 14.024 26.680 1.00 0.00 C
ATOM 67 C LEU A 9 11.046 12.757 27.530 1.00 0.00 C
ATOM 68 CB LEU A 9 9.655 14.407 26.263 1.00 0.00 C
ATOM 69 O LEU A 9 10.944 12.829 28.757 1.00 0.00 O
ATOM 70 CG LEU A 9 9.491 15.773 25.593 1.00 0.00 C
ATOM 71 CD1 LEU A 9 8.056 15.956 25.109 1.00 0.00 C
ATOM 72 CD2 LEU A 9 9.883 16.890 26.554 1.00 0.00 C
ATOM 73 N ASP A 10 11.036 11.713 26.780 1.00 0.00 N
ATOM 74 CA ASP A 10 10.904 10.441 27.483 1.00 0.00 C
ATOM 75 C ASP A 10 11.555 9.307 26.695 1.00 0.00 C
ATOM 76 CB ASP A 10 9.430 10.123 27.743 1.00 0.00 C
ATOM 77 O ASP A 10 11.942 9.490 25.539 1.00 0.00 O
ATOM 78 CG ASP A 10 9.204 9.381 29.048 1.00 0.00 C
ATOM 79 OD1 ASP A 10 10.061 8.557 29.438 1.00 0.00 O
ATOM 80 OD2 ASP A 10 8.160 9.619 29.692 1.00 0.00 O
ATOM 81 N ARG A 11 11.795 8.185 27.366 1.00 0.00 N
ATOM 82 CA ARG A 11 12.404 6.991 26.788 1.00 0.00 C
ATOM 83 C ARG A 11 11.694 5.728 27.265 1.00 0.00 C
ATOM 84 CB ARG A 11 13.891 6.921 27.142 1.00 0.00 C
ATOM 85 O ARG A 11 11.356 5.609 28.445 1.00 0.00 O
ATOM 86 CG ARG A 11 14.574 5.641 26.687 1.00 0.00 C
ATOM 87 CD ARG A 11 15.960 5.494 27.296 1.00 0.00 C
ATOM 88 NE ARG A 11 16.260 4.103 27.627 1.00 0.00 N
ATOM 89 NH1 ARG A 11 18.110 4.592 28.921 1.00 0.00 N
ATOM 90 NH2 ARG A 11 17.454 2.415 28.628 1.00 0.00 N
ATOM 91 CZ ARG A 11 17.274 3.707 28.391 1.00 0.00 C
ATOM 92 N ARG A 12 11.454 4.833 26.288 1.00 0.00 N
ATOM 93 CA ARG A 12 10.833 3.568 26.664 1.00 0.00 C
ATOM 94 C ARG A 12 11.382 2.418 25.825 1.00 0.00 C
ATOM 95 CB ARG A 12 9.312 3.648 26.511 1.00 0.00 C
ATOM 96 O ARG A 12 12.017 2.645 24.793 1.00 0.00 O
ATOM 97 CG ARG A 12 8.842 3.725 25.067 1.00 0.00 C
ATOM 98 CD ARG A 12 7.332 3.894 24.974 1.00 0.00 C
ATOM 99 NE ARG A 12 6.873 3.890 23.589 1.00 0.00 N
ATOM 100 NH1 ARG A 12 4.675 4.386 24.098 1.00 0.00 N
ATOM 101 NH2 ARG A 12 5.313 4.096 21.915 1.00 0.00 N
ATOM 102 CZ ARG A 12 5.621 4.124 23.203 1.00 0.00 C
ATOM 103 N VAL A 13 11.267 1.193 26.398 1.00 0.00 N
ATOM 104 CA VAL A 13 11.680 -0.004 25.672 1.00 0.00 C
ATOM 105 C VAL A 13 10.456 -0.862 25.353 1.00 0.00 C
ATOM 106 CB VAL A 13 12.713 -0.827 26.475 1.00 0.00 C
ATOM 107 O VAL A 13 9.769 -1.337 26.261 1.00 0.00 O
ATOM 108 CG1 VAL A 13 13.180 -2.039 25.671 1.00 0.00 C
ATOM 109 CG2 VAL A 13 13.901 0.048 26.868 1.00 0.00 C
ATOM 110 N VAL A 14 10.213 -1.021 24.049 1.00 0.00 N
ATOM 111 CA VAL A 14 9.066 -1.788 23.576 1.00 0.00 C
ATOM 112 C VAL A 14 9.542 -2.935 22.688 1.00 0.00 C
ATOM 113 CB VAL A 14 8.067 -0.897 22.804 1.00 0.00 C
ATOM 114 O VAL A 14 10.218 -2.710 21.681 1.00 0.00 O
ATOM 115 CG1 VAL A 14 6.863 -1.715 22.338 1.00 0.00 C
ATOM 116 CG2 VAL A 14 7.615 0.275 23.675 1.00 0.00 C
ATOM 117 N LYS A 15 9.163 -4.199 23.099 1.00 0.00 N
ATOM 118 CA LYS A 15 9.527 -5.372 22.312 1.00 0.00 C
ATOM 119 C LYS A 15 11.041 -5.472 22.142 1.00 0.00 C
ATOM 120 CB LYS A 15 8.848 -5.331 20.942 1.00 0.00 C
ATOM 121 O LYS A 15 11.529 -5.801 21.058 1.00 0.00 O
ATOM 122 CG LYS A 15 7.331 -5.431 21.001 1.00 0.00 C
ATOM 123 CD LYS A 15 6.721 -5.501 19.607 1.00 0.00 C
ATOM 124 CE LYS A 15 5.208 -5.653 19.664 1.00 0.00 C
ATOM 125 NZ LYS A 15 4.605 -5.717 18.300 1.00 0.00 N
ATOM 126 N GLY A 16 11.710 -4.981 23.161 1.00 0.00 N
ATOM 127 CA GLY A 16 13.162 -5.019 23.096 1.00 0.00 C
ATOM 128 C GLY A 16 13.755 -3.858 22.319 1.00 0.00 C
ATOM 129 O GLY A 16 14.966 -3.804 22.101 1.00 0.00 O
ATOM 130 N LYS A 17 12.954 -2.955 21.848 1.00 0.00 N
ATOM 131 CA LYS A 17 13.376 -1.768 21.110 1.00 0.00 C
ATOM 132 C LYS A 17 13.234 -0.511 21.964 1.00 0.00 C
ATOM 133 CB LYS A 17 12.565 -1.621 19.822 1.00 0.00 C
ATOM 134 O LYS A 17 12.216 -0.320 22.632 1.00 0.00 O
ATOM 135 CG LYS A 17 12.832 -2.711 18.793 1.00 0.00 C
ATOM 136 CD LYS A 17 12.230 -2.361 17.439 1.00 0.00 C
ATOM 137 CE LYS A 17 12.514 -3.442 16.404 1.00 0.00 C
ATOM 138 NZ LYS A 17 12.042 -3.044 15.045 1.00 0.00 N
ATOM 139 N VAL A 18 14.276 0.270 21.831 1.00 0.00 N
ATOM 140 CA VAL A 18 14.281 1.517 22.589 1.00 0.00 C
ATOM 141 C VAL A 18 13.636 2.627 21.762 1.00 0.00 C
ATOM 142 CB VAL A 18 15.713 1.925 23.003 1.00 0.00 C
ATOM 143 O VAL A 18 14.010 2.847 20.607 1.00 0.00 O
ATOM 144 CG1 VAL A 18 15.698 3.243 23.774 1.00 0.00 C
ATOM 145 CG2 VAL A 18 16.361 0.821 23.836 1.00 0.00 C
ATOM 146 N GLU A 19 12.665 3.242 22.347 1.00 0.00 N
ATOM 147 CA GLU A 19 11.980 4.373 21.730 1.00 0.00 C
ATOM 148 C GLU A 19 12.107 5.630 22.587 1.00 0.00 C
ATOM 149 CB GLU A 19 10.503 4.045 21.495 1.00 0.00 C
ATOM 150 O GLU A 19 12.104 5.551 23.817 1.00 0.00 O
ATOM 151 CG GLU A 19 10.278 2.838 20.595 1.00 0.00 C
ATOM 152 CD GLU A 19 8.807 2.543 20.345 1.00 0.00 C
ATOM 153 OE1 GLU A 19 8.433 2.273 19.181 1.00 0.00 O
ATOM 154 OE2 GLU A 19 8.023 2.584 21.319 1.00 0.00 O
ATOM 155 N TYR A 20 12.194 6.780 21.860 1.00 0.00 N
ATOM 156 CA TYR A 20 12.298 8.072 22.529 1.00 0.00 C
ATOM 157 C TYR A 20 11.142 8.985 22.136 1.00 0.00 C
ATOM 158 CB TYR A 20 13.632 8.746 22.193 1.00 0.00 C
ATOM 159 O TYR A 20 10.740 9.021 20.971 1.00 0.00 O
ATOM 160 CG TYR A 20 14.832 8.038 22.775 1.00 0.00 C
ATOM 161 CD1 TYR A 20 15.281 8.331 24.061 1.00 0.00 C
ATOM 162 CD2 TYR A 20 15.521 7.079 22.041 1.00 0.00 C
ATOM 163 CE1 TYR A 20 16.387 7.685 24.601 1.00 0.00 C
ATOM 164 CE2 TYR A 20 16.628 6.426 22.571 1.00 0.00 C
ATOM 165 OH TYR A 20 18.150 6.092 24.380 1.00 0.00 O
ATOM 166 CZ TYR A 20 17.053 6.734 23.850 1.00 0.00 C
ATOM 167 N LEU A 21 10.628 9.559 23.139 1.00 0.00 N
ATOM 168 CA LEU A 21 9.619 10.580 22.877 1.00 0.00 C
ATOM 169 C LEU A 21 10.274 11.904 22.496 1.00 0.00 C
ATOM 170 CB LEU A 21 8.722 10.774 24.102 1.00 0.00 C
ATOM 171 O LEU A 21 10.879 12.568 23.341 1.00 0.00 O
ATOM 172 CG LEU A 21 7.509 11.686 23.916 1.00 0.00 C
ATOM 173 CD1 LEU A 21 6.549 11.089 22.891 1.00 0.00 C
ATOM 174 CD2 LEU A 21 6.801 11.914 25.247 1.00 0.00 C
ATOM 175 N LEU A 22 10.085 12.276 21.270 1.00 0.00 N
ATOM 176 CA LEU A 22 10.740 13.460 20.726 1.00 0.00 C
ATOM 177 C LEU A 22 9.773 14.638 20.670 1.00 0.00 C
ATOM 178 CB LEU A 22 11.293 13.173 19.329 1.00 0.00 C
ATOM 179 O LEU A 22 8.629 14.487 20.236 1.00 0.00 O
ATOM 180 CG LEU A 22 12.299 12.025 19.220 1.00 0.00 C
ATOM 181 CD1 LEU A 22 12.620 11.738 17.757 1.00 0.00 C
ATOM 182 CD2 LEU A 22 13.569 12.352 19.998 1.00 0.00 C
ATOM 183 N LYS A 23 10.301 15.729 21.066 1.00 0.00 N
ATOM 184 CA LYS A 23 9.615 17.008 20.908 1.00 0.00 C
ATOM 185 C LYS A 23 10.128 17.760 19.683 1.00 0.00 C
ATOM 186 CB LYS A 23 9.787 17.868 22.161 1.00 0.00 C
ATOM 187 O LYS A 23 11.322 18.051 19.582 1.00 0.00 O
ATOM 188 CG LYS A 23 9.027 19.185 22.117 1.00 0.00 C
ATOM 189 CD LYS A 23 8.606 19.634 23.511 1.00 0.00 C
ATOM 190 CE LYS A 23 7.975 21.020 23.486 1.00 0.00 C
ATOM 191 NZ LYS A 23 6.568 20.978 22.990 1.00 0.00 N
ATOM 192 N TRP A 24 9.202 18.085 18.870 1.00 0.00 N
ATOM 193 CA TRP A 24 9.540 18.762 17.623 1.00 0.00 C
ATOM 194 C TRP A 24 9.472 20.276 17.790 1.00 0.00 C
ATOM 195 CB TRP A 24 8.602 18.317 16.499 1.00 0.00 C
ATOM 196 O TRP A 24 8.557 20.795 18.435 1.00 0.00 O
ATOM 197 CG TRP A 24 8.573 16.834 16.280 1.00 0.00 C
ATOM 198 CD1 TRP A 24 7.664 15.944 16.784 1.00 0.00 C
ATOM 199 CD2 TRP A 24 9.498 16.066 15.504 1.00 0.00 C
ATOM 200 CE2 TRP A 24 9.089 14.716 15.582 1.00 0.00 C
ATOM 201 CE3 TRP A 24 10.634 16.389 14.750 1.00 0.00 C
ATOM 202 NE1 TRP A 24 7.969 14.669 16.367 1.00 0.00 N
ATOM 203 CH2 TRP A 24 10.886 14.033 14.200 1.00 0.00 C
ATOM 204 CZ2 TRP A 24 9.778 13.689 14.931 1.00 0.00 C
ATOM 205 CZ3 TRP A 24 11.318 15.366 14.104 1.00 0.00 C
ATOM 206 N LYS A 25 10.461 20.842 17.197 1.00 0.00 N
ATOM 207 CA LYS A 25 10.535 22.298 17.277 1.00 0.00 C
ATOM 208 C LYS A 25 9.360 22.947 16.551 1.00 0.00 C
ATOM 209 CB LYS A 25 11.855 22.801 16.693 1.00 0.00 C
ATOM 210 O LYS A 25 9.142 22.697 15.363 1.00 0.00 O
ATOM 211 CG LYS A 25 12.130 24.274 16.963 1.00 0.00 C
ATOM 212 CD LYS A 25 13.499 24.691 16.443 1.00 0.00 C
ATOM 213 CE LYS A 25 13.838 26.121 16.843 1.00 0.00 C
ATOM 214 NZ LYS A 25 15.176 26.539 16.329 1.00 0.00 N
ATOM 215 N GLY A 26 8.656 23.853 17.277 1.00 0.00 N
ATOM 216 CA GLY A 26 7.532 24.545 16.666 1.00 0.00 C
ATOM 217 C GLY A 26 6.215 23.814 16.844 1.00 0.00 C
ATOM 218 O GLY A 26 5.174 24.276 16.372 1.00 0.00 O
ATOM 219 N PHE A 27 6.426 22.612 17.404 1.00 0.00 N
ATOM 220 CA PHE A 27 5.222 21.822 17.629 1.00 0.00 C
ATOM 221 C PHE A 27 4.921 21.704 19.118 1.00 0.00 C
ATOM 222 CB PHE A 27 5.369 20.428 17.011 1.00 0.00 C
ATOM 223 O PHE A 27 5.745 22.080 19.955 1.00 0.00 O
ATOM 224 CG PHE A 27 5.330 20.423 15.506 1.00 0.00 C
ATOM 225 CD1 PHE A 27 4.137 20.207 14.829 1.00 0.00 C
ATOM 226 CD2 PHE A 27 6.489 20.635 14.770 1.00 0.00 C
ATOM 227 CE1 PHE A 27 4.098 20.201 13.436 1.00 0.00 C
ATOM 228 CE2 PHE A 27 6.457 20.632 13.378 1.00 0.00 C
ATOM 229 CZ PHE A 27 5.262 20.414 12.713 1.00 0.00 C
ATOM 230 N SER A 28 3.615 21.399 19.411 1.00 0.00 N
ATOM 231 CA SER A 28 3.196 21.245 20.800 1.00 0.00 C
ATOM 232 C SER A 28 3.485 19.838 21.312 1.00 0.00 C
ATOM 233 CB SER A 28 1.705 21.554 20.947 1.00 0.00 C
ATOM 234 O SER A 28 3.903 18.966 20.546 1.00 0.00 O
ATOM 235 OG SER A 28 1.419 22.870 20.508 1.00 0.00 O
ATOM 236 N ASP A 29 3.315 19.686 22.586 1.00 0.00 N
ATOM 237 CA ASP A 29 3.552 18.398 23.231 1.00 0.00 C
ATOM 238 C ASP A 29 2.626 17.323 22.667 1.00 0.00 C
ATOM 239 CB ASP A 29 3.362 18.514 24.745 1.00 0.00 C
ATOM 240 O ASP A 29 2.935 16.132 22.737 1.00 0.00 O
ATOM 241 CG ASP A 29 4.223 19.599 25.369 1.00 0.00 C
ATOM 242 OD1 ASP A 29 5.455 19.413 25.476 1.00 0.00 O
ATOM 243 OD2 ASP A 29 3.665 20.647 25.759 1.00 0.00 O
ATOM 244 N GLU A 30 1.621 17.726 22.109 1.00 0.00 N
ATOM 245 CA GLU A 30 0.660 16.797 21.522 1.00 0.00 C
ATOM 246 C GLU A 30 1.185 16.217 20.211 1.00 0.00 C
ATOM 247 CB GLU A 30 -0.684 17.491 21.288 1.00 0.00 C
ATOM 248 O GLU A 30 0.715 15.171 19.758 1.00 0.00 O
ATOM 249 CG GLU A 30 -1.354 17.978 22.565 1.00 0.00 C
ATOM 250 CD GLU A 30 -2.863 18.116 22.435 1.00 0.00 C
ATOM 251 OE1 GLU A 30 -3.594 17.169 22.804 1.00 0.00 O
ATOM 252 OE2 GLU A 30 -3.317 19.180 21.959 1.00 0.00 O
ATOM 253 N ASP A 31 2.093 16.954 19.715 1.00 0.00 N
ATOM 254 CA ASP A 31 2.680 16.540 18.445 1.00 0.00 C
ATOM 255 C ASP A 31 3.915 15.670 18.668 1.00 0.00 C
ATOM 256 CB ASP A 31 3.044 17.762 17.599 1.00 0.00 C
ATOM 257 O ASP A 31 4.544 15.219 17.708 1.00 0.00 O
ATOM 258 CG ASP A 31 1.846 18.374 16.894 1.00 0.00 C
ATOM 259 OD1 ASP A 31 1.343 17.779 15.917 1.00 0.00 O
ATOM 260 OD2 ASP A 31 1.402 19.462 17.319 1.00 0.00 O
ATOM 261 N ASN A 32 4.171 15.409 19.900 1.00 0.00 N
ATOM 262 CA ASN A 32 5.315 14.562 20.220 1.00 0.00 C
ATOM 263 C ASN A 32 5.139 13.149 19.671 1.00 0.00 C
ATOM 264 CB ASN A 32 5.546 14.520 21.732 1.00 0.00 C
ATOM 265 O ASN A 32 4.042 12.591 19.725 1.00 0.00 O
ATOM 266 CG ASN A 32 5.835 15.889 22.318 1.00 0.00 C
ATOM 267 ND2 ASN A 32 5.719 16.006 23.635 1.00 0.00 N
ATOM 268 OD1 ASN A 32 6.159 16.832 21.592 1.00 0.00 O
ATOM 269 N THR A 33 6.166 12.591 19.140 1.00 0.00 N
ATOM 270 CA THR A 33 6.108 11.268 18.529 1.00 0.00 C
ATOM 271 C THR A 33 7.177 10.353 19.118 1.00 0.00 C
ATOM 272 CB THR A 33 6.285 11.351 17.000 1.00 0.00 C
ATOM 273 O THR A 33 8.274 10.806 19.455 1.00 0.00 O
ATOM 274 CG2 THR A 33 5.157 12.152 16.359 1.00 0.00 C
ATOM 275 OG1 THR A 33 7.536 11.985 16.704 1.00 0.00 O
ATOM 276 N TRP A 34 6.822 9.110 19.244 1.00 0.00 N
ATOM 277 CA TRP A 34 7.754 8.079 19.687 1.00 0.00 C
ATOM 278 C TRP A 34 8.531 7.505 18.507 1.00 0.00 C
ATOM 279 CB TRP A 34 7.008 6.957 20.417 1.00 0.00 C
ATOM 280 O TRP A 34 7.954 6.852 17.633 1.00 0.00 O
ATOM 281 CG TRP A 34 6.464 7.359 21.755 1.00 0.00 C
ATOM 282 CD1 TRP A 34 5.192 7.776 22.035 1.00 0.00 C
ATOM 283 CD2 TRP A 34 7.178 7.384 22.994 1.00 0.00 C
ATOM 284 CE2 TRP A 34 6.277 7.827 23.987 1.00 0.00 C
ATOM 285 CE3 TRP A 34 8.494 7.074 23.362 1.00 0.00 C
ATOM 286 NE1 TRP A 34 5.074 8.059 23.377 1.00 0.00 N
ATOM 287 CH2 TRP A 34 7.944 7.659 25.659 1.00 0.00 C
ATOM 288 CZ2 TRP A 34 6.650 7.968 25.326 1.00 0.00 C
ATOM 289 CZ3 TRP A 34 8.864 7.215 24.695 1.00 0.00 C
ATOM 290 N GLU A 35 9.848 7.758 18.548 1.00 0.00 N
ATOM 291 CA GLU A 35 10.718 7.281 17.478 1.00 0.00 C
ATOM 292 C GLU A 35 11.773 6.316 18.014 1.00 0.00 C
ATOM 293 CB GLU A 35 11.395 8.457 16.769 1.00 0.00 C
ATOM 294 O GLU A 35 12.329 6.531 19.093 1.00 0.00 O
ATOM 295 CG GLU A 35 10.451 9.272 15.897 1.00 0.00 C
ATOM 296 CD GLU A 35 10.035 8.552 14.624 1.00 0.00 C
ATOM 297 OE1 GLU A 35 8.856 8.144 14.515 1.00 0.00 O
ATOM 298 OE2 GLU A 35 10.895 8.392 13.730 1.00 0.00 O
ATOM 299 N PRO A 36 12.001 5.189 17.303 1.00 0.00 N
ATOM 300 CA PRO A 36 13.059 4.257 17.701 1.00 0.00 C
ATOM 301 C PRO A 36 14.444 4.899 17.690 1.00 0.00 C
ATOM 302 CB PRO A 36 12.963 3.147 16.652 1.00 0.00 C
ATOM 303 O PRO A 36 14.719 5.768 16.859 1.00 0.00 O
ATOM 304 CG PRO A 36 12.267 3.777 15.490 1.00 0.00 C
ATOM 305 CD PRO A 36 11.500 4.971 15.983 1.00 0.00 C
ATOM 306 N GLU A 37 15.278 4.465 18.628 1.00 0.00 N
ATOM 307 CA GLU A 37 16.644 4.965 18.745 1.00 0.00 C
ATOM 308 C GLU A 37 17.392 4.841 17.420 1.00 0.00 C
ATOM 309 CB GLU A 37 17.399 4.219 19.847 1.00 0.00 C
ATOM 310 O GLU A 37 18.216 5.694 17.084 1.00 0.00 O
ATOM 311 CG GLU A 37 18.822 4.713 20.062 1.00 0.00 C
ATOM 312 CD GLU A 37 19.598 3.886 21.074 1.00 0.00 C
ATOM 313 OE1 GLU A 37 20.182 2.847 20.690 1.00 0.00 O
ATOM 314 OE2 GLU A 37 19.623 4.280 22.262 1.00 0.00 O
ATOM 315 N GLU A 38 17.062 3.880 16.683 1.00 0.00 N
ATOM 316 CA GLU A 38 17.712 3.614 15.403 1.00 0.00 C
ATOM 317 C GLU A 38 17.313 4.650 14.356 1.00 0.00 C
ATOM 318 CB GLU A 38 17.371 2.206 14.908 1.00 0.00 C
ATOM 319 O GLU A 38 18.041 4.873 13.387 1.00 0.00 O
ATOM 320 CG GLU A 38 15.877 1.937 14.803 1.00 0.00 C
ATOM 321 CD GLU A 38 15.553 0.511 14.387 1.00 0.00 C
ATOM 322 OE1 GLU A 38 15.243 -0.323 15.268 1.00 0.00 O
ATOM 323 OE2 GLU A 38 15.609 0.225 13.171 1.00 0.00 O
ATOM 324 N ASN A 39 16.165 5.253 14.492 1.00 0.00 N
ATOM 325 CA ASN A 39 15.659 6.246 13.550 1.00 0.00 C
ATOM 326 C ASN A 39 16.116 7.654 13.921 1.00 0.00 C
ATOM 327 CB ASN A 39 14.132 6.185 13.476 1.00 0.00 C
ATOM 328 O ASN A 39 16.048 8.569 13.097 1.00 0.00 O
ATOM 329 CG ASN A 39 13.636 5.168 12.466 1.00 0.00 C
ATOM 330 ND2 ASN A 39 12.560 5.505 11.764 1.00 0.00 N
ATOM 331 OD1 ASN A 39 14.214 4.089 12.318 1.00 0.00 O
ATOM 332 N LEU A 40 16.550 7.742 15.117 1.00 0.00 N
ATOM 333 CA LEU A 40 17.003 9.043 15.598 1.00 0.00 C
ATOM 334 C LEU A 40 18.444 9.307 15.175 1.00 0.00 C
ATOM 335 CB LEU A 40 16.882 9.122 17.122 1.00 0.00 C
ATOM 336 O LEU A 40 19.312 8.448 15.342 1.00 0.00 O
ATOM 337 CG LEU A 40 15.465 9.064 17.694 1.00 0.00 C
ATOM 338 CD1 LEU A 40 15.506 8.708 19.176 1.00 0.00 C
ATOM 339 CD2 LEU A 40 14.747 10.392 17.478 1.00 0.00 C
ATOM 340 N ASP A 41 18.716 10.259 14.464 1.00 0.00 N
ATOM 341 CA ASP A 41 20.054 10.657 14.041 1.00 0.00 C
ATOM 342 C ASP A 41 20.606 11.767 14.931 1.00 0.00 C
ATOM 343 CB ASP A 41 20.041 11.113 12.579 1.00 0.00 C
ATOM 344 O ASP A 41 21.325 12.650 14.460 1.00 0.00 O
ATOM 345 CG ASP A 41 21.333 10.794 11.847 1.00 0.00 C
ATOM 346 OD1 ASP A 41 22.116 11.726 11.558 1.00 0.00 O
ATOM 347 OD2 ASP A 41 21.569 9.603 11.554 1.00 0.00 O
ATOM 348 N CYS A 42 20.191 11.776 16.186 1.00 0.00 N
ATOM 349 CA CYS A 42 20.618 12.802 17.130 1.00 0.00 C
ATOM 350 C CYS A 42 21.122 12.177 18.425 1.00 0.00 C
ATOM 351 CB CYS A 42 19.470 13.766 17.431 1.00 0.00 C
ATOM 352 O CYS A 42 20.540 12.392 19.491 1.00 0.00 O
ATOM 353 SG CYS A 42 18.672 14.432 15.953 1.00 0.00 S
ATOM 354 N PRO A 43 22.275 11.543 18.348 1.00 0.00 N
ATOM 355 CA PRO A 43 22.834 10.896 19.538 1.00 0.00 C
ATOM 356 C PRO A 43 23.187 11.892 20.641 1.00 0.00 C
ATOM 357 CB PRO A 43 24.091 10.202 19.006 1.00 0.00 C
ATOM 358 O PRO A 43 23.192 11.536 21.821 1.00 0.00 O
ATOM 359 CG PRO A 43 24.413 10.921 17.734 1.00 0.00 C
ATOM 360 CD PRO A 43 23.149 11.527 17.195 1.00 0.00 C
ATOM 361 N ASP A 44 23.380 13.076 20.203 1.00 0.00 N
ATOM 362 CA ASP A 44 23.727 14.118 21.165 1.00 0.00 C
ATOM 363 C ASP A 44 22.536 14.464 22.053 1.00 0.00 C
ATOM 364 CB ASP A 44 24.227 15.371 20.443 1.00 0.00 C
ATOM 365 O ASP A 44 22.672 14.559 23.275 1.00 0.00 O
ATOM 366 CG ASP A 44 25.736 15.392 20.268 1.00 0.00 C
ATOM 367 OD1 ASP A 44 26.450 15.843 21.188 1.00 0.00 O
ATOM 368 OD2 ASP A 44 26.214 14.957 19.197 1.00 0.00 O
ATOM 369 N LEU A 45 21.420 14.625 21.432 1.00 0.00 N
ATOM 370 CA LEU A 45 20.205 14.934 22.179 1.00 0.00 C
ATOM 371 C LEU A 45 19.850 13.798 23.132 1.00 0.00 C
ATOM 372 CB LEU A 45 19.039 15.195 21.221 1.00 0.00 C
ATOM 373 O LEU A 45 19.463 14.042 24.278 1.00 0.00 O
ATOM 374 CG LEU A 45 18.996 16.576 20.566 1.00 0.00 C
ATOM 375 CD1 LEU A 45 18.021 16.577 19.394 1.00 0.00 C
ATOM 376 CD2 LEU A 45 18.613 17.641 21.587 1.00 0.00 C
ATOM 377 N ILE A 46 20.023 12.570 22.716 1.00 0.00 N
ATOM 378 CA ILE A 46 19.738 11.386 23.517 1.00 0.00 C
ATOM 379 C ILE A 46 20.709 11.312 24.693 1.00 0.00 C
ATOM 380 CB ILE A 46 19.823 10.096 22.670 1.00 0.00 C
ATOM 381 O ILE A 46 20.302 11.053 25.829 1.00 0.00 O
ATOM 382 CG1 ILE A 46 18.763 10.114 21.563 1.00 0.00 C
ATOM 383 CG2 ILE A 46 19.669 8.856 23.556 1.00 0.00 C
ATOM 384 CD1 ILE A 46 18.903 8.981 20.555 1.00 0.00 C
ATOM 385 N ALA A 47 21.867 11.575 24.426 1.00 0.00 N
ATOM 386 CA ALA A 47 22.887 11.554 25.470 1.00 0.00 C
ATOM 387 C ALA A 47 22.597 12.603 26.540 1.00 0.00 C
ATOM 388 CB ALA A 47 24.271 11.782 24.868 1.00 0.00 C
ATOM 389 O ALA A 47 22.770 12.346 27.734 1.00 0.00 O
ATOM 390 N GLU A 48 22.168 13.667 26.162 1.00 0.00 N
ATOM 391 CA GLU A 48 21.815 14.736 27.090 1.00 0.00 C
ATOM 392 C GLU A 48 20.639 14.333 27.977 1.00 0.00 C
ATOM 393 CB GLU A 48 21.483 16.022 26.328 1.00 0.00 C
ATOM 394 O GLU A 48 20.654 14.579 29.184 1.00 0.00 O
ATOM 395 CG GLU A 48 21.637 17.287 27.160 1.00 0.00 C
ATOM 396 CD GLU A 48 21.620 18.559 26.326 1.00 0.00 C
ATOM 397 OE1 GLU A 48 20.521 19.101 26.069 1.00 0.00 O
ATOM 398 OE2 GLU A 48 22.715 19.015 25.926 1.00 0.00 O
ATOM 399 N PHE A 49 19.682 13.783 27.314 1.00 0.00 N
ATOM 400 CA PHE A 49 18.514 13.301 28.040 1.00 0.00 C
ATOM 401 C PHE A 49 18.907 12.226 29.046 1.00 0.00 C
ATOM 402 CB PHE A 49 17.464 12.753 27.069 1.00 0.00 C
ATOM 403 O PHE A 49 18.511 12.285 30.213 1.00 0.00 O
ATOM 404 CG PHE A 49 16.276 12.126 27.749 1.00 0.00 C
ATOM 405 CD1 PHE A 49 16.172 10.746 27.862 1.00 0.00 C
ATOM 406 CD2 PHE A 49 15.264 12.919 28.274 1.00 0.00 C
ATOM 407 CE1 PHE A 49 15.073 10.163 28.490 1.00 0.00 C
ATOM 408 CE2 PHE A 49 14.164 12.343 28.904 1.00 0.00 C
ATOM 409 CZ PHE A 49 14.070 10.965 29.011 1.00 0.00 C
ATOM 410 N LEU A 50 19.771 11.328 28.665 1.00 0.00 N
ATOM 411 CA LEU A 50 20.206 10.227 29.518 1.00 0.00 C
ATOM 412 C LEU A 50 21.107 10.732 30.640 1.00 0.00 C
ATOM 413 CB LEU A 50 20.942 9.168 28.693 1.00 0.00 C
ATOM 414 O LEU A 50 21.036 10.238 31.769 1.00 0.00 O
ATOM 415 CG LEU A 50 20.089 8.352 27.721 1.00 0.00 C
ATOM 416 CD1 LEU A 50 20.979 7.526 26.799 1.00 0.00 C
ATOM 417 CD2 LEU A 50 19.121 7.453 28.483 1.00 0.00 C
ATOM 418 N GLN A 51 21.813 11.727 30.352 1.00 0.00 N
ATOM 419 CA GLN A 51 22.697 12.326 31.346 1.00 0.00 C
ATOM 420 C GLN A 51 21.902 13.094 32.397 1.00 0.00 C
ATOM 421 CB GLN A 51 23.710 13.253 30.674 1.00 0.00 C
ATOM 422 O GLN A 51 22.286 13.135 33.568 1.00 0.00 O
ATOM 423 CG GLN A 51 24.968 12.543 30.191 1.00 0.00 C
ATOM 424 CD GLN A 51 25.958 13.485 29.532 1.00 0.00 C
ATOM 425 NE2 GLN A 51 26.523 13.059 28.407 1.00 0.00 N
ATOM 426 OE1 GLN A 51 26.213 14.586 30.029 1.00 0.00 O
ATOM 427 N SER A 52 20.887 13.656 31.921 1.00 0.00 N
ATOM 428 CA SER A 52 20.054 14.416 32.846 1.00 0.00 C
ATOM 429 C SER A 52 19.254 13.492 33.757 1.00 0.00 C
ATOM 430 CB SER A 52 19.105 15.339 32.080 1.00 0.00 C
ATOM 431 O SER A 52 18.857 13.884 34.856 1.00 0.00 O
ATOM 432 OG SER A 52 19.351 16.696 32.403 1.00 0.00 O
ATOM 433 N GLN A 53 18.963 12.364 33.351 1.00 0.00 N
ATOM 434 CA GLN A 53 18.245 11.388 34.164 1.00 0.00 C
ATOM 435 C GLN A 53 19.173 10.723 35.176 1.00 0.00 C
ATOM 436 CB GLN A 53 17.592 10.326 33.275 1.00 0.00 C
ATOM 437 O GLN A 53 18.711 10.065 36.111 1.00 0.00 O
ATOM 438 CG GLN A 53 16.466 10.864 32.401 1.00 0.00 C
ATOM 439 CD GLN A 53 15.224 11.222 33.197 1.00 0.00 C
ATOM 440 NE2 GLN A 53 14.916 12.512 33.265 1.00 0.00 N
ATOM 441 OE1 GLN A 53 14.548 10.346 33.745 1.00 0.00 O
ATOM 442 N LYS A 54 20.442 10.831 34.986 1.00 0.00 N
ATOM 443 CA LYS A 54 21.363 10.295 35.984 1.00 0.00 C
ATOM 444 C LYS A 54 21.453 11.215 37.198 1.00 0.00 C
ATOM 445 CB LYS A 54 22.752 10.089 35.378 1.00 0.00 C
ATOM 446 O LYS A 54 21.490 10.745 38.338 1.00 0.00 O
ATOM 447 CG LYS A 54 23.116 8.630 35.146 1.00 0.00 C
ATOM 448 CD LYS A 54 24.497 8.493 34.517 1.00 0.00 C
ATOM 449 CE LYS A 54 24.766 7.064 34.064 1.00 0.00 C
ATOM 450 NZ LYS A 54 26.175 6.885 33.602 1.00 0.00 N
ATOM 451 OXT LYS A 54 21.465 12.140 36.438 1.00 0.00 O
TER 452 LYS A 54
END