Browse entries in the PDBbind-CN Database
HEADER 5U1Q_COMPLEX COMPND 5U1Q_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 100 GLN LEU TRP PHE HIS GLY ARG ILE SER ARG GLU GLU SER SEQRES 2 A 100 GLN ARG LEU ILE GLY GLN GLN GLY LEU VAL ASP GLY LEU SEQRES 3 A 100 PHE LEU VAL ARG GLU SER GLN ARG ASN PRO GLN GLY PHE SEQRES 4 A 100 VAL LEU SER LEU CYS HIS LEU GLN LYS VAL LYS HIS TYR SEQRES 5 A 100 LEU ILE LEU PRO SER GLU GLU GLU GLY ARG LEU TYR PHE SEQRES 6 A 100 SER MET ASP ASP GLY GLN THR ARG PHE THR ASP LEU LEU SEQRES 7 A 100 GLN LEU VAL GLU PHE HIS GLN LEU ASN ARG GLY ILE LEU SEQRES 8 A 100 PRO CYS LEU LEU ARG HIS CYS CYS THR SEQRES 1 B 107 SER ALA ALA ILE HIS ARG THR GLN LEU TRP PHE HIS GLY SEQRES 2 B 107 ARG ILE SER ARG GLU GLU SER GLN ARG LEU ILE GLY GLN SEQRES 3 B 107 GLN GLY LEU VAL ASP GLY LEU PHE LEU VAL ARG GLU SER SEQRES 4 B 107 GLN ARG ASN PRO GLN GLY PHE VAL LEU SER LEU CYS HIS SEQRES 5 B 107 LEU GLN LYS VAL LYS HIS TYR LEU ILE LEU PRO SER GLU SEQRES 6 B 107 GLU GLU GLY ARG LEU TYR PHE SER MET ASP ASP GLY GLN SEQRES 7 B 107 THR ARG PHE THR ASP LEU LEU GLN LEU VAL GLU PHE HIS SEQRES 8 B 107 GLN LEU ASN ARG GLY ILE LEU PRO CYS LEU LEU ARG HIS SEQRES 9 B 107 CYS CYS THR HET LYS A 279 142 ATOM 1 N GLN A 429 1.099 17.626 126.279 1.00 70.65 N ATOM 2 CA GLN A 429 0.394 16.373 126.025 1.00 65.19 C ATOM 3 C GLN A 429 0.359 15.474 127.261 1.00 61.84 C ATOM 4 O GLN A 429 -0.616 15.483 128.015 1.00 62.64 O ATOM 5 CB GLN A 429 1.040 15.626 124.857 1.00 63.78 C ATOM 6 HN3 GLN A 429 2.079 17.420 126.559 1.00 0.00 H ATOM 7 HN2 GLN A 429 0.620 18.143 127.044 1.00 0.00 H ATOM 8 HN1 GLN A 429 1.098 18.204 125.414 1.00 0.00 H ATOM 9 N LEU A 430 1.440 14.718 127.482 1.00 52.56 N ATOM 10 CA LEU A 430 1.451 13.732 128.558 1.00 54.44 C ATOM 11 C LEU A 430 1.503 14.365 129.943 1.00 53.98 C ATOM 12 O LEU A 430 1.218 13.679 130.930 1.00 59.62 O ATOM 13 CB LEU A 430 2.635 12.779 128.387 1.00 58.58 C ATOM 14 H LEU A 430 2.281 14.834 126.881 1.00 0.00 H ATOM 15 N TRP A 431 1.863 15.645 130.046 1.00 37.32 N ATOM 16 CA TRP A 431 1.868 16.324 131.336 1.00 40.21 C ATOM 17 C TRP A 431 0.497 16.866 131.737 1.00 37.29 C ATOM 18 O TRP A 431 0.321 17.254 132.893 1.00 36.50 O ATOM 19 CB TRP A 431 2.891 17.463 131.308 1.00 35.06 C ATOM 20 CG TRP A 431 2.854 18.234 130.024 1.00 43.72 C ATOM 21 CD1 TRP A 431 3.686 18.080 128.955 1.00 46.34 C ATOM 22 CD2 TRP A 431 1.942 19.285 129.675 1.00 47.57 C ATOM 23 NE1 TRP A 431 3.337 18.955 127.955 1.00 50.22 N ATOM 24 CE2 TRP A 431 2.273 19.710 128.373 1.00 50.04 C ATOM 25 CE3 TRP A 431 0.875 19.903 130.335 1.00 46.18 C ATOM 26 CZ2 TRP A 431 1.576 20.726 127.717 1.00 51.94 C ATOM 27 CZ3 TRP A 431 0.185 20.914 129.686 1.00 46.48 C ATOM 28 CH2 TRP A 431 0.538 21.314 128.388 1.00 52.42 C ATOM 29 HE1 TRP A 431 3.805 19.032 127.030 1.00 0.00 H ATOM 30 H TRP A 431 2.145 16.167 129.192 1.00 0.00 H ATOM 31 N PHE A 432 -0.484 16.870 130.836 1.00 36.87 N ATOM 32 CA PHE A 432 -1.810 17.405 131.145 1.00 31.59 C ATOM 33 C PHE A 432 -2.720 16.281 131.627 1.00 36.67 C ATOM 34 O PHE A 432 -2.877 15.267 130.943 1.00 42.04 O ATOM 35 CB PHE A 432 -2.400 18.124 129.928 1.00 35.63 C ATOM 36 CG PHE A 432 -3.765 18.703 130.173 1.00 37.42 C ATOM 37 CD1 PHE A 432 -3.930 19.797 131.008 1.00 35.20 C ATOM 38 CD2 PHE A 432 -4.882 18.173 129.540 1.00 45.49 C ATOM 39 CE1 PHE A 432 -5.202 20.337 131.244 1.00 27.33 C ATOM 40 CE2 PHE A 432 -6.148 18.714 129.755 1.00 42.39 C ATOM 41 CZ PHE A 432 -6.306 19.793 130.610 1.00 28.84 C ATOM 42 H PHE A 432 -0.303 16.483 129.888 1.00 0.00 H ATOM 43 N HIS A 433 -3.311 16.464 132.810 1.00 36.18 N ATOM 44 CA HIS A 433 -4.112 15.439 133.467 1.00 34.58 C ATOM 45 C HIS A 433 -5.584 15.800 133.570 1.00 41.20 C ATOM 46 O HIS A 433 -6.335 15.084 134.242 1.00 43.74 O ATOM 47 CB HIS A 433 -3.588 15.179 134.885 1.00 34.54 C ATOM 48 CG HIS A 433 -2.352 14.348 134.932 1.00 35.56 C ATOM 49 ND1 HIS A 433 -2.303 13.131 135.574 1.00 39.31 N ATOM 50 CD2 HIS A 433 -1.122 14.548 134.404 1.00 33.48 C ATOM 51 CE1 HIS A 433 -1.092 12.621 135.447 1.00 40.21 C ATOM 52 NE2 HIS A 433 -0.358 13.459 134.738 1.00 37.86 N ATOM 53 H HIS A 433 -3.194 17.382 133.285 1.00 0.00 H ATOM 54 N GLY A 434 -6.019 16.886 132.945 1.00 38.47 N ATOM 55 CA GLY A 434 -7.427 17.211 132.980 1.00 38.80 C ATOM 56 C GLY A 434 -7.899 17.704 134.333 1.00 37.04 C ATOM 57 O GLY A 434 -7.161 18.390 135.049 1.00 35.32 O ATOM 58 H GLY A 434 -5.352 17.499 132.434 1.00 0.00 H ATOM 59 N ARG A 435 -9.113 17.320 134.717 1.00 32.38 N ATOM 60 CA ARG A 435 -9.779 17.910 135.879 1.00 46.44 C ATOM 61 C ARG A 435 -9.604 17.053 137.137 1.00 53.98 C ATOM 62 O ARG A 435 -10.570 16.699 137.815 1.00 66.45 O ATOM 63 CB ARG A 435 -11.256 18.139 135.567 1.00 51.14 C ATOM 64 H ARG A 435 -9.603 16.579 134.176 1.00 0.00 H ATOM 65 N ILE A 436 -8.350 16.734 137.474 1.00 51.41 N ATOM 66 CA ILE A 436 -8.054 16.026 138.718 1.00 40.93 C ATOM 67 C ILE A 436 -7.887 17.033 139.851 1.00 40.50 C ATOM 68 O ILE A 436 -7.586 18.210 139.637 1.00 45.25 O ATOM 69 CB ILE A 436 -6.805 15.129 138.597 1.00 38.85 C ATOM 70 CG1 ILE A 436 -5.538 15.979 138.433 1.00 36.52 C ATOM 71 CG2 ILE A 436 -6.950 14.156 137.430 1.00 44.78 C ATOM 72 CD1 ILE A 436 -4.263 15.181 138.535 1.00 32.16 C ATOM 73 H ILE A 436 -7.569 16.995 136.838 1.00 0.00 H ATOM 74 N SER A 437 -8.100 16.566 141.079 1.00 32.54 N ATOM 75 CA SER A 437 -8.014 17.429 142.246 1.00 32.83 C ATOM 76 C SER A 437 -6.560 17.589 142.703 1.00 40.60 C ATOM 77 O SER A 437 -5.656 16.856 142.286 1.00 33.97 O ATOM 78 CB SER A 437 -8.870 16.875 143.386 1.00 40.91 C ATOM 79 OG SER A 437 -8.268 15.721 143.952 1.00 45.81 O ATOM 80 HG SER A 437 -8.837 15.380 144.686 1.00 0.00 H ATOM 81 H SER A 437 -8.333 15.561 141.207 1.00 0.00 H ATOM 82 N ARG A 438 -6.362 18.549 143.612 1.00 29.58 N ATOM 83 CA ARG A 438 -5.049 18.802 144.193 1.00 31.49 C ATOM 84 C ARG A 438 -4.532 17.590 144.951 1.00 37.06 C ATOM 85 O ARG A 438 -3.372 17.187 144.790 1.00 33.63 O ATOM 86 CB ARG A 438 -5.127 20.009 145.133 1.00 31.92 C ATOM 87 CG ARG A 438 -3.950 20.121 146.097 1.00 30.11 C ATOM 88 CD ARG A 438 -4.155 21.227 147.132 1.00 40.34 C ATOM 89 NE ARG A 438 -3.969 22.570 146.590 1.00 50.72 N ATOM 90 CZ ARG A 438 -3.040 23.415 147.032 1.00 56.38 C ATOM 91 NH1 ARG A 438 -2.240 23.048 148.026 1.00 64.03 N ATOM 92 NH2 ARG A 438 -2.912 24.626 146.495 1.00 46.83 N ATOM 93 HE ARG A 438 -4.594 22.882 145.820 1.00 0.00 H ATOM 94 HH12 ARG A 438 -1.512 23.703 148.376 1.00 0.00 H ATOM 95 HH11 ARG A 438 -2.341 22.106 148.454 1.00 0.00 H ATOM 96 HH22 ARG A 438 -2.182 25.277 146.849 1.00 0.00 H ATOM 97 HH21 ARG A 438 -3.542 24.921 145.722 1.00 0.00 H ATOM 98 H ARG A 438 -7.168 19.133 143.914 1.00 0.00 H ATOM 99 N GLU A 439 -5.390 16.985 145.777 1.00 32.26 N ATOM 100 CA GLU A 439 -4.971 15.820 146.545 1.00 29.88 C ATOM 101 C GLU A 439 -4.569 14.691 145.614 1.00 30.31 C ATOM 102 O GLU A 439 -3.592 13.980 145.871 1.00 25.70 O ATOM 103 CB GLU A 439 -6.097 15.379 147.484 1.00 31.06 C ATOM 104 CG GLU A 439 -6.434 16.404 148.571 1.00 44.39 C ATOM 105 CD GLU A 439 -7.263 17.586 148.057 1.00 58.09 C ATOM 106 OE1 GLU A 439 -7.926 17.459 147.001 1.00 55.40 O ATOM 107 OE2 GLU A 439 -7.243 18.650 148.715 1.00 63.09 O ATOM 108 H GLU A 439 -6.360 17.347 145.872 1.00 0.00 H ATOM 109 N GLU A 440 -5.293 14.536 144.505 1.00 32.91 N ATOM 110 CA GLU A 440 -4.930 13.512 143.532 1.00 35.97 C ATOM 111 C GLU A 440 -3.590 13.822 142.871 1.00 31.21 C ATOM 112 O GLU A 440 -2.770 12.920 142.671 1.00 29.64 O ATOM 113 CB GLU A 440 -6.033 13.370 142.486 1.00 44.88 C ATOM 114 CG GLU A 440 -5.729 12.345 141.396 1.00 48.27 C ATOM 115 CD GLU A 440 -5.616 10.926 141.930 1.00 55.23 C ATOM 116 OE1 GLU A 440 -6.085 10.659 143.057 1.00 63.66 O ATOM 117 OE2 GLU A 440 -5.061 10.073 141.212 1.00 61.98 O ATOM 118 H GLU A 440 -6.118 15.146 144.334 1.00 0.00 H ATOM 119 N SER A 441 -3.339 15.092 142.542 1.00 24.65 N ATOM 120 CA SER A 441 -2.051 15.443 141.952 1.00 28.57 C ATOM 121 C SER A 441 -0.911 15.126 142.912 1.00 31.35 C ATOM 122 O SER A 441 0.151 14.644 142.493 1.00 25.87 O ATOM 123 CB SER A 441 -2.036 16.918 141.543 1.00 30.95 C ATOM 124 OG SER A 441 -1.907 17.782 142.661 1.00 25.84 O ATOM 125 HG SER A 441 -2.670 17.640 143.276 1.00 0.00 H ATOM 126 H SER A 441 -4.057 15.826 142.705 1.00 0.00 H ATOM 127 N GLN A 442 -1.116 15.380 144.207 1.00 25.77 N ATOM 128 CA GLN A 442 -0.077 15.070 145.180 1.00 25.34 C ATOM 129 C GLN A 442 0.130 13.571 145.307 1.00 26.76 C ATOM 130 O GLN A 442 1.270 13.109 145.428 1.00 30.32 O ATOM 131 CB GLN A 442 -0.423 15.687 146.531 1.00 28.69 C ATOM 132 CG GLN A 442 -0.296 17.182 146.514 1.00 29.76 C ATOM 133 CD GLN A 442 -1.020 17.834 147.655 1.00 32.32 C ATOM 134 OE1 GLN A 442 -1.771 17.186 148.386 1.00 34.96 O ATOM 135 NE2 GLN A 442 -0.813 19.130 147.810 1.00 25.37 N ATOM 136 HE22 GLN A 442 -0.169 19.634 147.167 1.00 0.00 H ATOM 137 HE21 GLN A 442 -1.294 19.646 148.575 1.00 0.00 H ATOM 138 H GLN A 442 -2.015 15.798 144.520 1.00 0.00 H ATOM 139 N ARG A 443 -0.950 12.791 145.231 1.00 27.22 N ATOM 140 CA ARG A 443 -0.806 11.341 145.296 1.00 28.57 C ATOM 141 C ARG A 443 -0.071 10.816 144.069 1.00 36.00 C ATOM 142 O ARG A 443 0.804 9.945 144.178 1.00 33.97 O ATOM 143 CB ARG A 443 -2.177 10.675 145.422 1.00 30.75 C ATOM 144 CG ARG A 443 -2.104 9.160 145.511 1.00 42.77 C ATOM 145 CD ARG A 443 -3.448 8.486 145.290 1.00 48.22 C ATOM 146 NE ARG A 443 -3.827 8.517 143.882 1.00 58.17 N ATOM 147 CZ ARG A 443 -3.386 7.645 142.981 1.00 61.45 C ATOM 148 NH1 ARG A 443 -2.542 6.683 143.342 1.00 58.54 N ATOM 149 NH2 ARG A 443 -3.780 7.736 141.720 1.00 62.34 N ATOM 150 HE ARG A 443 -4.479 9.263 143.565 1.00 0.00 H ATOM 151 HH12 ARG A 443 -2.198 6.001 142.636 1.00 0.00 H ATOM 152 HH11 ARG A 443 -2.226 6.612 144.330 1.00 0.00 H ATOM 153 HH22 ARG A 443 -3.434 7.053 141.016 1.00 0.00 H ATOM 154 HH21 ARG A 443 -4.436 8.491 141.433 1.00 0.00 H ATOM 155 H ARG A 443 -1.893 13.216 145.126 1.00 0.00 H ATOM 156 N LEU A 444 -0.418 11.331 142.887 1.00 29.44 N ATOM 157 CA LEU A 444 0.242 10.879 141.664 1.00 25.94 C ATOM 158 C LEU A 444 1.729 11.218 141.688 1.00 29.57 C ATOM 159 O LEU A 444 2.572 10.389 141.325 1.00 33.40 O ATOM 160 CB LEU A 444 -0.426 11.519 140.447 1.00 25.50 C ATOM 161 CG LEU A 444 -1.795 10.992 140.013 1.00 49.14 C ATOM 162 CD1 LEU A 444 -2.463 11.938 139.016 1.00 47.59 C ATOM 163 CD2 LEU A 444 -1.676 9.597 139.438 1.00 54.11 C ATOM 164 H LEU A 444 -1.161 12.057 142.836 1.00 0.00 H ATOM 165 N ILE A 445 2.075 12.422 142.148 1.00 27.61 N ATOM 166 CA ILE A 445 3.481 12.812 142.174 1.00 32.96 C ATOM 167 C ILE A 445 4.239 12.001 143.222 1.00 38.11 C ATOM 168 O ILE A 445 5.365 11.542 142.981 1.00 28.07 O ATOM 169 CB ILE A 445 3.591 14.333 142.402 1.00 26.69 C ATOM 170 CG1 ILE A 445 3.030 15.093 141.191 1.00 30.69 C ATOM 171 CG2 ILE A 445 5.030 14.749 142.654 1.00 26.66 C ATOM 172 CD1 ILE A 445 3.001 16.614 141.367 1.00 21.24 C ATOM 173 H ILE A 445 1.345 13.080 142.487 1.00 0.00 H ATOM 174 N GLY A 446 3.612 11.750 144.373 1.00 31.92 N ATOM 175 CA GLY A 446 4.254 10.922 145.385 1.00 31.07 C ATOM 176 C GLY A 446 4.456 9.491 144.924 1.00 32.20 C ATOM 177 O GLY A 446 5.489 8.875 145.199 1.00 34.69 O ATOM 178 H GLY A 446 2.666 12.145 144.547 1.00 0.00 H ATOM 179 N GLN A 447 3.502 8.966 144.160 1.00 30.09 N ATOM 180 CA GLN A 447 3.613 7.587 143.706 1.00 44.37 C ATOM 181 C GLN A 447 4.733 7.278 142.728 1.00 43.96 C ATOM 182 O GLN A 447 5.141 6.120 142.620 1.00 42.07 O ATOM 183 CB GLN A 447 2.298 7.128 143.088 1.00 48.43 C ATOM 184 CG GLN A 447 1.401 6.386 144.047 1.00 70.91 C ATOM 185 CD GLN A 447 0.796 5.155 143.423 1.00 79.47 C ATOM 186 OE1 GLN A 447 0.746 5.028 142.198 1.00 76.09 O ATOM 187 NE2 GLN A 447 0.329 4.237 144.261 1.00 83.97 N ATOM 188 HE22 GLN A 447 0.394 4.389 145.288 1.00 0.00 H ATOM 189 HE21 GLN A 447 -0.102 3.366 143.891 1.00 0.00 H ATOM 190 H GLN A 447 2.678 9.539 143.887 1.00 0.00 H ATOM 191 N GLN A 448 5.216 8.333 142.073 1.00 33.62 N ATOM 192 CA GLN A 448 6.274 8.264 141.080 1.00 37.60 C ATOM 193 C GLN A 448 7.658 8.643 141.604 1.00 38.32 C ATOM 194 O GLN A 448 8.596 8.756 140.826 1.00 45.08 O ATOM 195 CB GLN A 448 5.924 9.148 139.882 1.00 35.66 C ATOM 196 CG GLN A 448 5.593 8.371 138.622 1.00 59.37 C ATOM 197 CD GLN A 448 5.243 9.270 137.455 1.00 67.12 C ATOM 198 OE1 GLN A 448 4.152 9.825 137.395 1.00 73.88 O ATOM 199 NE2 GLN A 448 6.171 9.415 136.519 1.00 56.09 N ATOM 200 HE22 GLN A 448 7.084 8.925 136.611 1.00 0.00 H ATOM 201 HE21 GLN A 448 5.986 10.019 135.693 1.00 0.00 H ATOM 202 H GLN A 448 4.809 9.266 142.286 1.00 0.00 H ATOM 203 N GLY A 449 7.787 8.863 142.907 1.00 35.55 N ATOM 204 CA GLY A 449 9.093 9.184 143.476 1.00 29.14 C ATOM 205 C GLY A 449 9.444 10.477 144.210 1.00 43.24 C ATOM 206 O GLY A 449 10.468 10.519 144.893 1.00 52.49 O ATOM 207 H GLY A 449 6.953 8.806 143.526 1.00 0.00 H ATOM 208 N LEU A 450 8.633 11.523 144.090 1.00 48.69 N ATOM 209 CA LEU A 450 8.933 12.804 144.745 1.00 45.30 C ATOM 210 C LEU A 450 10.270 13.386 144.292 1.00 49.16 C ATOM 211 O LEU A 450 11.022 13.962 145.082 1.00 53.05 O ATOM 212 CB LEU A 450 8.909 12.674 146.269 1.00 47.31 C ATOM 213 CG LEU A 450 7.590 12.924 146.979 1.00 39.45 C ATOM 214 CD1 LEU A 450 7.815 12.903 148.498 1.00 41.32 C ATOM 215 CD2 LEU A 450 7.005 14.238 146.528 1.00 36.12 C ATOM 216 H LEU A 450 7.768 11.433 143.520 1.00 0.00 H ATOM 217 N VAL A 451 10.565 13.224 143.010 1.00 42.39 N ATOM 218 CA VAL A 451 11.806 13.702 142.415 1.00 36.45 C ATOM 219 C VAL A 451 11.677 15.188 142.084 1.00 30.91 C ATOM 220 O VAL A 451 10.605 15.655 141.679 1.00 34.36 O ATOM 221 CB VAL A 451 12.127 12.864 141.161 1.00 50.60 C ATOM 222 CG1 VAL A 451 13.124 13.548 140.269 1.00 47.85 C ATOM 223 CG2 VAL A 451 12.606 11.479 141.561 1.00 54.79 C ATOM 224 H VAL A 451 9.879 12.733 142.401 1.00 0.00 H ATOM 225 N ASP A 452 12.773 15.925 142.219 1.00 27.20 N ATOM 226 CA ASP A 452 12.787 17.352 141.916 1.00 31.57 C ATOM 227 C ASP A 452 12.487 17.585 140.438 1.00 32.37 C ATOM 228 O ASP A 452 13.086 16.955 139.576 1.00 28.64 O ATOM 229 CB ASP A 452 14.147 17.954 142.263 1.00 34.76 C ATOM 230 CG ASP A 452 14.083 18.924 143.428 1.00 58.66 C ATOM 231 OD1 ASP A 452 13.164 18.818 144.259 1.00 63.25 O ATOM 232 OD2 ASP A 452 14.964 19.798 143.518 1.00 65.90 O ATOM 233 H ASP A 452 13.648 15.471 142.551 1.00 0.00 H ATOM 234 N GLY A 453 11.572 18.499 140.144 1.00 26.11 N ATOM 235 CA GLY A 453 11.211 18.771 138.768 1.00 27.09 C ATOM 236 C GLY A 453 10.087 17.924 138.200 1.00 29.23 C ATOM 237 O GLY A 453 9.671 18.170 137.066 1.00 22.80 O ATOM 238 H GLY A 453 11.108 19.027 140.911 1.00 0.00 H ATOM 239 N LEU A 454 9.601 16.919 138.928 1.00 26.20 N ATOM 240 CA LEU A 454 8.431 16.172 138.481 1.00 28.61 C ATOM 241 C LEU A 454 7.190 17.055 138.580 1.00 25.33 C ATOM 242 O LEU A 454 6.988 17.749 139.580 1.00 24.14 O ATOM 243 CB LEU A 454 8.265 14.903 139.316 1.00 28.35 C ATOM 244 CG LEU A 454 7.217 13.874 138.878 1.00 33.48 C ATOM 245 CD1 LEU A 454 7.554 13.261 137.531 1.00 33.10 C ATOM 246 CD2 LEU A 454 7.065 12.788 139.937 1.00 35.22 C ATOM 247 H LEU A 454 10.061 16.665 139.825 1.00 0.00 H ATOM 248 N PHE A 455 6.365 17.045 137.537 1.00 23.12 N ATOM 249 CA PHE A 455 5.279 18.008 137.443 1.00 16.35 C ATOM 250 C PHE A 455 4.121 17.454 136.624 1.00 17.60 C ATOM 251 O PHE A 455 4.282 16.539 135.813 1.00 29.88 O ATOM 252 CB PHE A 455 5.759 19.328 136.815 1.00 20.44 C ATOM 253 CG PHE A 455 5.926 19.267 135.314 1.00 22.32 C ATOM 254 CD1 PHE A 455 7.096 18.752 134.743 1.00 25.53 C ATOM 255 CD2 PHE A 455 4.914 19.713 134.472 1.00 26.88 C ATOM 256 CE1 PHE A 455 7.253 18.692 133.356 1.00 27.85 C ATOM 257 CE2 PHE A 455 5.057 19.660 133.080 1.00 21.12 C ATOM 258 CZ PHE A 455 6.223 19.143 132.521 1.00 20.23 C ATOM 259 H PHE A 455 6.498 16.342 136.782 1.00 0.00 H ATOM 260 N LEU A 456 2.954 18.072 136.813 1.00 21.37 N ATOM 261 CA LEU A 456 1.813 17.882 135.924 1.00 27.53 C ATOM 262 C LEU A 456 1.037 19.189 135.863 1.00 28.65 C ATOM 263 O LEU A 456 1.207 20.072 136.704 1.00 24.47 O ATOM 264 CB LEU A 456 0.878 16.747 136.375 1.00 25.07 C ATOM 265 CG LEU A 456 0.297 16.794 137.798 1.00 28.20 C ATOM 266 CD1 LEU A 456 -0.981 17.632 137.866 1.00 26.39 C ATOM 267 CD2 LEU A 456 -0.001 15.379 138.294 1.00 22.95 C ATOM 268 H LEU A 456 2.854 18.714 137.625 1.00 0.00 H ATOM 269 N VAL A 457 0.177 19.299 134.857 1.00 25.98 N ATOM 270 CA VAL A 457 -0.738 20.426 134.733 1.00 25.44 C ATOM 271 C VAL A 457 -2.154 19.867 134.808 1.00 26.26 C ATOM 272 O VAL A 457 -2.451 18.832 134.207 1.00 30.63 O ATOM 273 CB VAL A 457 -0.534 21.227 133.424 1.00 27.66 C ATOM 274 CG1 VAL A 457 -1.541 22.374 133.332 1.00 25.47 C ATOM 275 CG2 VAL A 457 0.898 21.774 133.322 1.00 21.40 C ATOM 276 H VAL A 457 0.156 18.554 134.132 1.00 0.00 H ATOM 277 N ARG A 458 -3.013 20.540 135.571 1.00 25.49 N ATOM 278 CA ARG A 458 -4.393 20.109 135.741 1.00 27.49 C ATOM 279 C ARG A 458 -5.307 21.316 135.595 1.00 30.05 C ATOM 280 O ARG A 458 -4.885 22.461 135.774 1.00 34.32 O ATOM 281 CB ARG A 458 -4.619 19.451 137.110 1.00 28.84 C ATOM 282 CG ARG A 458 -4.120 20.290 138.291 1.00 24.82 C ATOM 283 CD ARG A 458 -4.171 19.467 139.590 1.00 33.96 C ATOM 284 NE ARG A 458 -3.512 20.113 140.721 1.00 29.34 N ATOM 285 CZ ARG A 458 -4.095 20.981 141.539 1.00 32.46 C ATOM 286 NH1 ARG A 458 -5.362 21.326 141.358 1.00 32.16 N ATOM 287 NH2 ARG A 458 -3.411 21.504 142.546 1.00 30.47 N ATOM 288 HE ARG A 458 -2.515 19.876 140.899 1.00 0.00 H ATOM 289 HH12 ARG A 458 -5.813 22.007 142.002 1.00 0.00 H ATOM 290 HH11 ARG A 458 -5.905 20.916 140.572 1.00 0.00 H ATOM 291 HH22 ARG A 458 -3.867 22.184 143.187 1.00 0.00 H ATOM 292 HH21 ARG A 458 -2.418 21.235 142.695 1.00 0.00 H ATOM 293 H ARG A 458 -2.689 21.399 136.060 1.00 0.00 H ATOM 294 N GLU A 459 -6.573 21.050 135.272 1.00 35.53 N ATOM 295 CA GLU A 459 -7.564 22.119 135.282 1.00 43.20 C ATOM 296 C GLU A 459 -7.862 22.469 136.733 1.00 42.64 C ATOM 297 O GLU A 459 -8.015 21.578 137.574 1.00 43.70 O ATOM 298 CB GLU A 459 -8.853 21.697 134.573 1.00 43.79 C ATOM 299 CG GLU A 459 -8.679 21.263 133.132 1.00 58.89 C ATOM 300 CD GLU A 459 -9.985 20.840 132.489 1.00 60.37 C ATOM 301 OE1 GLU A 459 -11.010 21.523 132.711 1.00 60.36 O ATOM 302 OE2 GLU A 459 -9.990 19.806 131.789 1.00 56.81 O ATOM 303 H GLU A 459 -6.853 20.082 135.014 1.00 0.00 H ATOM 304 N SER A 460 -7.923 23.762 137.031 1.00 38.48 N ATOM 305 CA SER A 460 -8.231 24.194 138.383 1.00 44.23 C ATOM 306 C SER A 460 -9.705 23.947 138.686 1.00 52.21 C ATOM 307 O SER A 460 -10.584 24.360 137.921 1.00 49.97 O ATOM 308 CB SER A 460 -7.886 25.671 138.550 1.00 45.11 C ATOM 309 OG SER A 460 -8.351 26.166 139.791 1.00 50.66 O ATOM 310 HG SER A 460 -7.929 25.657 140.527 1.00 0.00 H ATOM 311 H SER A 460 -7.749 24.471 136.290 1.00 0.00 H ATOM 312 N GLN A 461 -9.972 23.251 139.793 1.00 53.13 N ATOM 313 CA GLN A 461 -11.341 23.006 140.228 1.00 63.80 C ATOM 314 C GLN A 461 -11.946 24.216 140.920 1.00 68.45 C ATOM 315 O GLN A 461 -13.172 24.293 141.043 1.00 64.09 O ATOM 316 CB GLN A 461 -11.412 21.781 141.139 1.00 70.01 C ATOM 317 CG GLN A 461 -11.233 20.480 140.383 1.00 71.09 C ATOM 318 CD GLN A 461 -11.365 19.251 141.260 1.00 69.14 C ATOM 319 OE1 GLN A 461 -11.343 19.337 142.488 1.00 60.27 O ATOM 320 NE2 GLN A 461 -11.498 18.092 140.625 1.00 69.71 N ATOM 321 HE22 GLN A 461 -11.511 18.067 139.585 1.00 0.00 H ATOM 322 HE21 GLN A 461 -11.589 17.209 141.167 1.00 0.00 H ATOM 323 H GLN A 461 -9.184 22.875 140.358 1.00 0.00 H ATOM 324 N ARG A 462 -11.115 25.160 141.365 1.00 76.40 N ATOM 325 CA ARG A 462 -11.586 26.355 142.048 1.00 75.47 C ATOM 326 C ARG A 462 -11.524 27.593 141.165 1.00 76.52 C ATOM 327 O ARG A 462 -12.083 28.629 141.539 1.00 74.19 O ATOM 328 CB ARG A 462 -10.763 26.596 143.321 1.00 74.49 C ATOM 329 H ARG A 462 -10.093 25.037 141.218 1.00 0.00 H ATOM 330 N ASN A 463 -10.811 27.533 140.041 1.00 78.13 N ATOM 331 CA ASN A 463 -10.835 28.585 139.030 1.00 74.93 C ATOM 332 C ASN A 463 -11.134 27.848 137.725 1.00 81.13 C ATOM 333 O ASN A 463 -10.230 27.274 137.112 1.00 84.01 O ATOM 334 CB ASN A 463 -9.512 29.341 138.990 1.00 71.27 C ATOM 335 CG ASN A 463 -9.236 30.087 140.284 1.00 72.11 C ATOM 336 OD1 ASN A 463 -8.780 29.493 141.265 1.00 73.33 O ATOM 337 ND2 ASN A 463 -9.511 31.387 140.296 1.00 66.13 N ATOM 338 HD22 ASN A 463 -9.894 31.845 139.445 1.00 0.00 H ATOM 339 HD21 ASN A 463 -9.343 31.946 141.157 1.00 0.00 H ATOM 340 H ASN A 463 -10.211 26.700 139.877 1.00 0.00 H ATOM 341 N PRO A 464 -12.387 27.868 137.267 1.00 85.14 N ATOM 342 CA PRO A 464 -12.724 27.097 136.053 1.00 81.06 C ATOM 343 C PRO A 464 -12.065 27.596 134.781 1.00 69.26 C ATOM 344 O PRO A 464 -11.941 26.814 133.830 1.00 66.83 O ATOM 345 CB PRO A 464 -14.254 27.200 135.985 1.00 84.59 C ATOM 346 CG PRO A 464 -14.588 28.419 136.764 1.00 87.87 C ATOM 347 CD PRO A 464 -13.571 28.497 137.867 1.00 87.85 C ATOM 348 N GLN A 465 -11.658 28.859 134.705 1.00 63.56 N ATOM 349 CA GLN A 465 -10.964 29.332 133.514 1.00 58.43 C ATOM 350 C GLN A 465 -9.448 29.238 133.653 1.00 54.44 C ATOM 351 O GLN A 465 -8.725 29.635 132.734 1.00 63.27 O ATOM 352 CB GLN A 465 -11.365 30.784 133.211 1.00 49.42 C ATOM 353 H GLN A 465 -11.835 29.510 135.496 1.00 0.00 H ATOM 354 N GLY A 466 -8.968 28.705 134.777 1.00 43.21 N ATOM 355 CA GLY A 466 -7.558 28.582 135.077 1.00 39.45 C ATOM 356 C GLY A 466 -7.034 27.155 135.121 1.00 35.89 C ATOM 357 O GLY A 466 -7.766 26.177 134.946 1.00 36.16 O ATOM 358 H GLY A 466 -9.649 28.356 135.481 1.00 0.00 H ATOM 359 N PHE A 467 -5.717 27.065 135.310 1.00 34.35 N ATOM 360 CA PHE A 467 -5.019 25.793 135.427 1.00 23.17 C ATOM 361 C PHE A 467 -4.038 25.873 136.587 1.00 24.72 C ATOM 362 O PHE A 467 -3.723 26.951 137.098 1.00 25.16 O ATOM 363 CB PHE A 467 -4.297 25.414 134.124 1.00 27.96 C ATOM 364 CG PHE A 467 -5.217 25.268 132.944 1.00 26.43 C ATOM 365 CD1 PHE A 467 -5.663 24.015 132.554 1.00 32.84 C ATOM 366 CD2 PHE A 467 -5.651 26.378 132.238 1.00 33.83 C ATOM 367 CE1 PHE A 467 -6.516 23.869 131.471 1.00 37.92 C ATOM 368 CE2 PHE A 467 -6.506 26.237 131.154 1.00 34.21 C ATOM 369 CZ PHE A 467 -6.935 24.981 130.772 1.00 32.21 C ATOM 370 H PHE A 467 -5.164 27.943 135.377 1.00 0.00 H ATOM 371 N VAL A 468 -3.539 24.715 136.999 1.00 23.11 N ATOM 372 CA VAL A 468 -2.593 24.642 138.101 1.00 26.75 C ATOM 373 C VAL A 468 -1.399 23.811 137.668 1.00 27.65 C ATOM 374 O VAL A 468 -1.554 22.693 137.165 1.00 26.95 O ATOM 375 CB VAL A 468 -3.228 24.046 139.369 1.00 22.53 C ATOM 376 CG1 VAL A 468 -2.216 24.061 140.519 1.00 17.38 C ATOM 377 CG2 VAL A 468 -4.484 24.827 139.733 1.00 22.37 C ATOM 378 H VAL A 468 -3.831 23.838 136.522 1.00 0.00 H ATOM 379 N LEU A 469 -0.211 24.351 137.873 1.00 22.12 N ATOM 380 CA LEU A 469 1.010 23.596 137.659 1.00 19.90 C ATOM 381 C LEU A 469 1.385 22.986 139.006 1.00 22.98 C ATOM 382 O LEU A 469 1.667 23.712 139.961 1.00 27.03 O ATOM 383 CB LEU A 469 2.104 24.507 137.110 1.00 18.63 C ATOM 384 CG LEU A 469 3.513 23.916 137.120 1.00 28.77 C ATOM 385 CD1 LEU A 469 3.608 22.801 136.088 1.00 26.96 C ATOM 386 CD2 LEU A 469 4.535 24.997 136.823 1.00 32.76 C ATOM 387 H LEU A 469 -0.149 25.338 138.195 1.00 0.00 H ATOM 388 N SER A 470 1.349 21.661 139.099 1.00 21.40 N ATOM 389 CA SER A 470 1.708 20.962 140.327 1.00 30.36 C ATOM 390 C SER A 470 3.111 20.407 140.153 1.00 26.70 C ATOM 391 O SER A 470 3.373 19.663 139.204 1.00 22.73 O ATOM 392 CB SER A 470 0.707 19.851 140.657 1.00 30.03 C ATOM 393 OG SER A 470 -0.600 20.370 140.866 1.00 25.06 O ATOM 394 HG SER A 470 -0.583 21.010 141.621 1.00 0.00 H ATOM 395 H SER A 470 1.056 21.105 138.270 1.00 0.00 H ATOM 396 N LEU A 471 4.000 20.753 141.079 1.00 22.75 N ATOM 397 CA LEU A 471 5.427 20.545 140.903 1.00 20.99 C ATOM 398 C LEU A 471 6.062 20.024 142.183 1.00 26.26 C ATOM 399 O LEU A 471 5.756 20.504 143.274 1.00 29.14 O ATOM 400 CB LEU A 471 6.081 21.870 140.478 1.00 22.25 C ATOM 401 CG LEU A 471 7.593 22.024 140.536 1.00 35.03 C ATOM 402 CD1 LEU A 471 8.280 21.024 139.617 1.00 28.85 C ATOM 403 CD2 LEU A 471 7.964 23.460 140.177 1.00 25.34 C ATOM 404 H LEU A 471 3.662 21.188 141.961 1.00 0.00 H ATOM 405 N CYS A 472 6.970 19.065 142.042 1.00 26.01 N ATOM 406 CA CYS A 472 7.688 18.526 143.187 1.00 25.40 C ATOM 407 C CYS A 472 9.035 19.217 143.321 1.00 33.87 C ATOM 408 O CYS A 472 9.797 19.299 142.355 1.00 27.92 O ATOM 409 CB CYS A 472 7.900 17.016 143.055 1.00 30.16 C ATOM 410 SG CYS A 472 8.892 16.327 144.438 1.00 31.86 S ATOM 411 H CYS A 472 7.172 18.691 141.093 1.00 0.00 H ATOM 412 N HIS A 473 9.332 19.694 144.528 1.00 27.86 N ATOM 413 CA HIS A 473 10.607 20.350 144.807 1.00 30.32 C ATOM 414 C HIS A 473 10.991 20.097 146.257 1.00 32.34 C ATOM 415 O HIS A 473 10.208 20.396 147.163 1.00 28.97 O ATOM 416 CB HIS A 473 10.524 21.850 144.533 1.00 25.25 C ATOM 417 CG HIS A 473 11.791 22.581 144.836 1.00 39.18 C ATOM 418 ND1 HIS A 473 11.847 23.637 145.723 1.00 45.52 N ATOM 419 CD2 HIS A 473 13.057 22.385 144.403 1.00 39.69 C ATOM 420 CE1 HIS A 473 13.091 24.076 145.804 1.00 38.98 C ATOM 421 NE2 HIS A 473 13.846 23.330 145.018 1.00 45.41 N ATOM 422 H HIS A 473 8.636 19.597 145.295 1.00 0.00 H ATOM 423 N LEU A 474 12.191 19.556 146.469 1.00 32.30 N ATOM 424 CA LEU A 474 12.695 19.247 147.811 1.00 39.28 C ATOM 425 C LEU A 474 11.726 18.348 148.583 1.00 35.59 C ATOM 426 O LEU A 474 11.362 18.625 149.727 1.00 35.74 O ATOM 427 CB LEU A 474 12.998 20.529 148.595 1.00 41.39 C ATOM 428 CG LEU A 474 13.992 21.496 147.939 1.00 48.24 C ATOM 429 CD1 LEU A 474 14.171 22.757 148.773 1.00 44.92 C ATOM 430 CD2 LEU A 474 15.328 20.804 147.716 1.00 39.97 C ATOM 431 H LEU A 474 12.794 19.344 145.649 1.00 0.00 H ATOM 432 N GLN A 475 11.286 17.272 147.929 1.00 26.16 N ATOM 433 CA GLN A 475 10.438 16.252 148.556 1.00 39.47 C ATOM 434 C GLN A 475 9.113 16.826 149.064 1.00 30.32 C ATOM 435 O GLN A 475 8.545 16.342 150.042 1.00 41.76 O ATOM 436 CB GLN A 475 11.198 15.538 149.682 1.00 41.19 C ATOM 437 CG GLN A 475 12.293 14.600 149.167 1.00 54.92 C ATOM 438 CD GLN A 475 13.644 14.826 149.818 1.00 65.39 C ATOM 439 OE1 GLN A 475 13.733 15.344 150.932 1.00 71.22 O ATOM 440 NE2 GLN A 475 14.707 14.432 149.123 1.00 68.44 N ATOM 441 HE22 GLN A 475 14.584 13.999 148.185 1.00 0.00 H ATOM 442 HE21 GLN A 475 15.661 14.557 149.517 1.00 0.00 H ATOM 443 H GLN A 475 11.556 17.151 146.932 1.00 0.00 H ATOM 444 N LYS A 476 8.637 17.882 148.405 1.00 31.45 N ATOM 445 CA LYS A 476 7.395 18.575 148.726 1.00 31.48 C ATOM 446 C LYS A 476 6.681 18.942 147.428 1.00 37.75 C ATOM 447 O LYS A 476 7.341 19.274 146.440 1.00 36.41 O ATOM 448 CB LYS A 476 7.685 19.836 149.543 1.00 30.93 C ATOM 449 CG LYS A 476 6.477 20.507 150.161 1.00 53.83 C ATOM 450 CD LYS A 476 6.811 21.943 150.539 1.00 61.09 C ATOM 451 CE LYS A 476 8.308 22.124 150.798 1.00 66.80 C ATOM 452 NZ LYS A 476 8.830 21.293 151.923 1.00 70.55 N ATOM 453 HZ1 LYS A 476 8.332 21.546 152.800 1.00 0.00 H ATOM 454 HZ2 LYS A 476 8.672 20.287 151.712 1.00 0.00 H ATOM 455 HZ3 LYS A 476 9.849 21.469 152.039 1.00 0.00 H ATOM 456 H LYS A 476 9.193 18.238 147.602 1.00 0.00 H ATOM 457 N VAL A 477 5.345 18.857 147.416 1.00 22.47 N ATOM 458 CA VAL A 477 4.549 19.211 146.240 1.00 25.11 C ATOM 459 C VAL A 477 4.013 20.622 146.409 1.00 29.29 C ATOM 460 O VAL A 477 3.375 20.936 147.420 1.00 29.58 O ATOM 461 CB VAL A 477 3.396 18.220 146.005 1.00 22.10 C ATOM 462 CG1 VAL A 477 2.566 18.662 144.795 1.00 22.54 C ATOM 463 CG2 VAL A 477 3.939 16.827 145.775 1.00 18.22 C ATOM 464 H VAL A 477 4.856 18.528 148.273 1.00 0.00 H ATOM 465 N LYS A 478 4.277 21.471 145.423 1.00 18.36 N ATOM 466 CA LYS A 478 3.781 22.836 145.380 1.00 19.75 C ATOM 467 C LYS A 478 2.874 23.024 144.168 1.00 23.54 C ATOM 468 O LYS A 478 2.937 22.266 143.201 1.00 27.41 O ATOM 469 CB LYS A 478 4.950 23.829 145.359 1.00 27.19 C ATOM 470 CG LYS A 478 5.784 23.791 146.641 1.00 39.56 C ATOM 471 CD LYS A 478 7.213 24.213 146.378 1.00 51.22 C ATOM 472 CE LYS A 478 8.003 24.344 147.667 1.00 50.70 C ATOM 473 NZ LYS A 478 9.440 24.644 147.406 1.00 47.58 N ATOM 474 HZ1 LYS A 478 9.857 23.875 146.843 1.00 0.00 H ATOM 475 HZ2 LYS A 478 9.516 25.539 146.882 1.00 0.00 H ATOM 476 HZ3 LYS A 478 9.946 24.726 148.311 1.00 0.00 H ATOM 477 H LYS A 478 4.872 21.140 144.637 1.00 0.00 H ATOM 478 N HIS A 479 2.022 24.048 144.232 1.00 23.42 N ATOM 479 CA HIS A 479 0.987 24.276 143.230 1.00 22.40 C ATOM 480 C HIS A 479 0.983 25.736 142.807 1.00 34.04 C ATOM 481 O HIS A 479 0.951 26.630 143.659 1.00 29.05 O ATOM 482 CB HIS A 479 -0.379 23.874 143.769 1.00 25.32 C ATOM 483 CG HIS A 479 -0.393 22.498 144.340 1.00 25.94 C ATOM 484 ND1 HIS A 479 -0.630 21.381 143.568 1.00 23.65 N ATOM 485 CD2 HIS A 479 -0.149 22.049 145.593 1.00 16.10 C ATOM 486 CE1 HIS A 479 -0.561 20.303 144.328 1.00 24.16 C ATOM 487 NE2 HIS A 479 -0.262 20.681 145.557 1.00 23.66 N ATOM 488 H HIS A 479 2.099 24.711 145.029 1.00 0.00 H ATOM 489 N TYR A 480 1.016 25.977 141.496 1.00 18.19 N ATOM 490 CA TYR A 480 1.125 27.326 140.955 1.00 23.17 C ATOM 491 C TYR A 480 -0.054 27.600 140.036 1.00 30.09 C ATOM 492 O TYR A 480 -0.278 26.865 139.065 1.00 27.72 O ATOM 493 CB TYR A 480 2.464 27.503 140.233 1.00 25.11 C ATOM 494 CG TYR A 480 3.606 27.212 141.172 1.00 23.51 C ATOM 495 CD1 TYR A 480 4.063 25.913 141.358 1.00 20.40 C ATOM 496 CD2 TYR A 480 4.191 28.227 141.911 1.00 21.35 C ATOM 497 CE1 TYR A 480 5.085 25.638 142.234 1.00 17.95 C ATOM 498 CE2 TYR A 480 5.226 27.966 142.787 1.00 18.47 C ATOM 499 CZ TYR A 480 5.665 26.671 142.947 1.00 18.59 C ATOM 500 OH TYR A 480 6.685 26.398 143.821 1.00 24.63 O ATOM 501 HH TYR A 480 6.873 25.426 143.813 1.00 0.00 H ATOM 502 H TYR A 480 0.962 25.175 140.837 1.00 0.00 H ATOM 503 N LEU A 481 -0.805 28.651 140.342 1.00 22.01 N ATOM 504 CA LEU A 481 -1.995 28.991 139.574 1.00 25.32 C ATOM 505 C LEU A 481 -1.617 29.656 138.254 1.00 18.29 C ATOM 506 O LEU A 481 -0.795 30.573 138.230 1.00 27.85 O ATOM 507 CB LEU A 481 -2.901 29.917 140.392 1.00 25.58 C ATOM 508 CG LEU A 481 -4.180 30.404 139.696 1.00 33.43 C ATOM 509 CD1 LEU A 481 -5.120 29.259 139.354 1.00 29.67 C ATOM 510 CD2 LEU A 481 -4.897 31.437 140.556 1.00 34.22 C ATOM 511 H LEU A 481 -0.537 29.247 141.151 1.00 0.00 H ATOM 512 N ILE A 482 -2.229 29.195 137.163 1.00 21.09 N ATOM 513 CA ILE A 482 -2.058 29.773 135.834 1.00 27.13 C ATOM 514 C ILE A 482 -3.387 30.395 135.416 1.00 27.24 C ATOM 515 O ILE A 482 -4.390 29.684 135.272 1.00 26.32 O ATOM 516 CB ILE A 482 -1.621 28.714 134.809 1.00 29.56 C ATOM 517 CG1 ILE A 482 -0.393 27.938 135.310 1.00 29.42 C ATOM 518 CG2 ILE A 482 -1.363 29.373 133.454 1.00 22.88 C ATOM 519 CD1 ILE A 482 -0.154 26.607 134.551 1.00 27.52 C ATOM 520 H ILE A 482 -2.864 28.378 137.265 1.00 0.00 H ATOM 521 N LEU A 483 -3.393 31.712 135.191 1.00 26.12 N ATOM 522 CA LEU A 483 -4.628 32.410 134.858 1.00 34.89 C ATOM 523 C LEU A 483 -4.581 33.010 133.456 1.00 35.63 C ATOM 524 O LEU A 483 -3.540 33.520 133.035 1.00 30.47 O ATOM 525 CB LEU A 483 -4.901 33.533 135.873 1.00 32.07 C ATOM 526 CG LEU A 483 -5.383 33.082 137.255 1.00 36.65 C ATOM 527 CD1 LEU A 483 -5.624 34.284 138.129 1.00 35.95 C ATOM 528 CD2 LEU A 483 -6.649 32.252 137.127 1.00 29.41 C ATOM 529 H LEU A 483 -2.503 32.247 135.254 1.00 0.00 H ATOM 530 N PRO A 484 -5.693 33.003 132.731 1.00 40.58 N ATOM 531 CA PRO A 484 -5.745 33.695 131.441 1.00 41.81 C ATOM 532 C PRO A 484 -5.998 35.185 131.614 1.00 36.97 C ATOM 533 O PRO A 484 -6.507 35.645 132.636 1.00 41.88 O ATOM 534 CB PRO A 484 -6.915 33.015 130.724 1.00 36.70 C ATOM 535 CG PRO A 484 -7.825 32.619 131.828 1.00 38.73 C ATOM 536 CD PRO A 484 -6.941 32.274 133.012 1.00 43.93 C ATOM 537 N SER A 485 -5.631 35.932 130.586 1.00 38.90 N ATOM 538 CA SER A 485 -5.801 37.367 130.578 1.00 43.33 C ATOM 539 C SER A 485 -5.859 37.884 129.146 1.00 46.28 C ATOM 540 O SER A 485 -5.459 37.202 128.211 1.00 50.43 O ATOM 541 CB SER A 485 -4.665 38.033 131.343 1.00 49.65 C ATOM 542 OG SER A 485 -4.988 39.373 131.644 1.00 61.30 O ATOM 543 HG SER A 485 -5.807 39.397 132.200 1.00 0.00 H ATOM 544 H SER A 485 -5.206 35.471 129.756 1.00 0.00 H ATOM 545 N GLU A 486 -6.375 39.093 128.986 1.00 49.69 N ATOM 546 CA GLU A 486 -6.500 39.719 127.681 1.00 52.91 C ATOM 547 C GLU A 486 -5.856 41.095 127.731 1.00 63.70 C ATOM 548 O GLU A 486 -6.100 41.865 128.664 1.00 67.63 O ATOM 549 CB GLU A 486 -7.970 39.841 127.254 1.00 53.52 C ATOM 550 H GLU A 486 -6.703 39.613 129.825 1.00 0.00 H ATOM 551 N GLU A 487 -4.988 41.379 126.762 1.00 65.52 N ATOM 552 CA GLU A 487 -4.458 42.727 126.586 1.00 75.37 C ATOM 553 C GLU A 487 -4.520 43.073 125.107 1.00 80.58 C ATOM 554 O GLU A 487 -3.917 42.370 124.289 1.00 74.70 O ATOM 555 CB GLU A 487 -3.033 42.858 127.110 1.00 77.17 C ATOM 556 CG GLU A 487 -2.509 44.279 127.031 1.00 74.38 C ATOM 557 CD GLU A 487 -1.131 44.417 127.626 1.00 70.05 C ATOM 558 OE1 GLU A 487 -0.146 44.334 126.862 1.00 60.42 O ATOM 559 OE2 GLU A 487 -1.039 44.605 128.861 1.00 71.03 O ATOM 560 H GLU A 487 -4.681 40.624 126.117 1.00 0.00 H ATOM 561 N GLU A 488 -5.227 44.156 124.775 1.00 87.50 N ATOM 562 CA GLU A 488 -5.411 44.581 123.387 1.00 87.04 C ATOM 563 C GLU A 488 -5.989 43.450 122.541 1.00 80.62 C ATOM 564 O GLU A 488 -5.545 43.195 121.423 1.00 75.59 O ATOM 565 CB GLU A 488 -4.102 45.096 122.781 1.00 84.70 C ATOM 566 H GLU A 488 -5.664 44.719 125.532 1.00 0.00 H ATOM 567 N GLY A 489 -6.976 42.749 123.087 1.00 78.61 N ATOM 568 CA GLY A 489 -7.581 41.645 122.373 1.00 80.64 C ATOM 569 C GLY A 489 -6.727 40.403 122.240 1.00 81.27 C ATOM 570 O GLY A 489 -7.145 39.449 121.580 1.00 86.41 O ATOM 571 H GLY A 489 -7.318 42.996 124.038 1.00 0.00 H ATOM 572 N ARG A 490 -5.538 40.377 122.834 1.00 71.48 N ATOM 573 CA ARG A 490 -4.661 39.212 122.768 1.00 68.03 C ATOM 574 C ARG A 490 -4.797 38.419 124.065 1.00 56.52 C ATOM 575 O ARG A 490 -4.621 38.972 125.158 1.00 60.24 O ATOM 576 CB ARG A 490 -3.204 39.629 122.544 1.00 67.78 C ATOM 577 H ARG A 490 -5.222 41.215 123.363 1.00 0.00 H ATOM 578 N LEU A 491 -5.118 37.132 123.948 1.00 48.38 N ATOM 579 CA LEU A 491 -5.238 36.266 125.113 1.00 41.69 C ATOM 580 C LEU A 491 -3.884 35.639 125.424 1.00 36.59 C ATOM 581 O LEU A 491 -3.105 35.337 124.516 1.00 43.13 O ATOM 582 CB LEU A 491 -6.288 35.178 124.883 1.00 39.70 C ATOM 583 CG LEU A 491 -7.752 35.629 124.805 1.00 51.85 C ATOM 584 CD1 LEU A 491 -8.682 34.451 124.536 1.00 45.68 C ATOM 585 CD2 LEU A 491 -8.163 36.338 126.087 1.00 59.38 C ATOM 586 H LEU A 491 -5.287 36.735 123.002 1.00 0.00 H ATOM 587 N TYR A 492 -3.611 35.439 126.711 1.00 36.01 N ATOM 588 CA TYR A 492 -2.383 34.789 127.145 1.00 36.82 C ATOM 589 C TYR A 492 -2.601 34.159 128.513 1.00 35.63 C ATOM 590 O TYR A 492 -3.581 34.446 129.204 1.00 34.67 O ATOM 591 CB TYR A 492 -1.207 35.768 127.191 1.00 44.70 C ATOM 592 CG TYR A 492 -1.376 36.871 128.214 1.00 44.44 C ATOM 593 CD1 TYR A 492 -1.000 36.687 129.541 1.00 41.41 C ATOM 594 CD2 TYR A 492 -1.907 38.099 127.848 1.00 44.89 C ATOM 595 CE1 TYR A 492 -1.155 37.697 130.472 1.00 50.96 C ATOM 596 CE2 TYR A 492 -2.064 39.110 128.765 1.00 49.39 C ATOM 597 CZ TYR A 492 -1.686 38.907 130.077 1.00 46.81 C ATOM 598 OH TYR A 492 -1.845 39.920 130.991 1.00 45.47 O ATOM 599 HH TYR A 492 -1.528 39.615 131.878 1.00 0.00 H ATOM 600 H TYR A 492 -4.295 35.756 127.427 1.00 0.00 H ATOM 601 N PHE A 493 -1.675 33.280 128.887 1.00 33.22 N ATOM 602 CA PHE A 493 -1.631 32.665 130.207 1.00 28.62 C ATOM 603 C PHE A 493 -0.451 33.214 130.993 1.00 34.12 C ATOM 604 O PHE A 493 0.591 33.562 130.427 1.00 29.59 O ATOM 605 CB PHE A 493 -1.490 31.144 130.124 1.00 23.57 C ATOM 606 CG PHE A 493 -2.677 30.449 129.542 1.00 29.95 C ATOM 607 CD1 PHE A 493 -3.800 30.195 130.314 1.00 32.54 C ATOM 608 CD2 PHE A 493 -2.670 30.045 128.223 1.00 29.99 C ATOM 609 CE1 PHE A 493 -4.890 29.543 129.776 1.00 32.63 C ATOM 610 CE2 PHE A 493 -3.756 29.392 127.677 1.00 38.18 C ATOM 611 CZ PHE A 493 -4.868 29.139 128.456 1.00 41.25 C ATOM 612 H PHE A 493 -0.941 33.017 128.198 1.00 0.00 H ATOM 613 N SER A 494 -0.613 33.271 132.310 1.00 27.03 N ATOM 614 CA SER A 494 0.440 33.800 133.154 1.00 28.11 C ATOM 615 C SER A 494 0.285 33.232 134.558 1.00 35.97 C ATOM 616 O SER A 494 -0.829 32.956 135.018 1.00 32.97 O ATOM 617 CB SER A 494 0.409 35.331 133.186 1.00 27.38 C ATOM 618 OG SER A 494 1.372 35.846 134.085 1.00 33.51 O ATOM 619 HG SER A 494 2.275 35.555 133.802 1.00 0.00 H ATOM 620 H SER A 494 -1.499 32.935 132.738 1.00 0.00 H ATOM 621 N MET A 495 1.422 33.045 135.221 1.00 29.38 N ATOM 622 CA MET A 495 1.466 32.692 136.629 1.00 34.97 C ATOM 623 C MET A 495 1.849 33.873 137.500 1.00 33.72 C ATOM 624 O MET A 495 1.911 33.729 138.720 1.00 35.79 O ATOM 625 CB MET A 495 2.457 31.547 136.869 1.00 33.06 C ATOM 626 CG MET A 495 2.127 30.259 136.154 1.00 31.00 C ATOM 627 SD MET A 495 3.257 28.906 136.589 1.00 29.71 S ATOM 628 CE MET A 495 4.791 29.493 135.867 1.00 30.42 C ATOM 629 H MET A 495 2.320 33.156 134.708 1.00 0.00 H ATOM 630 N ASP A 496 2.130 35.034 136.903 1.00 31.55 N ATOM 631 CA ASP A 496 2.652 36.158 137.669 1.00 29.54 C ATOM 632 C ASP A 496 1.976 37.464 137.269 1.00 38.08 C ATOM 633 O ASP A 496 2.618 38.519 137.249 1.00 39.70 O ATOM 634 CB ASP A 496 4.184 36.271 137.517 1.00 31.60 C ATOM 635 CG ASP A 496 4.652 36.281 136.049 1.00 32.49 C ATOM 636 OD1 ASP A 496 3.823 36.467 135.131 1.00 33.62 O ATOM 637 OD2 ASP A 496 5.871 36.101 135.815 1.00 38.73 O ATOM 638 H ASP A 496 1.974 35.137 135.880 1.00 0.00 H ATOM 639 N ASP A 497 0.682 37.404 136.952 1.00 37.25 N ATOM 640 CA ASP A 497 -0.128 38.577 136.624 1.00 45.48 C ATOM 641 C ASP A 497 0.434 39.339 135.422 1.00 44.83 C ATOM 642 O ASP A 497 0.565 40.564 135.430 1.00 40.64 O ATOM 643 CB ASP A 497 -0.316 39.495 137.836 1.00 60.90 C ATOM 644 CG ASP A 497 -1.593 39.184 138.594 1.00 78.34 C ATOM 645 OD1 ASP A 497 -2.530 38.645 137.961 1.00 79.64 O ATOM 646 OD2 ASP A 497 -1.666 39.474 139.809 1.00 87.23 O ATOM 647 H ASP A 497 0.223 36.471 136.937 1.00 0.00 H ATOM 648 N GLY A 498 0.822 38.578 134.402 1.00 37.88 N ATOM 649 CA GLY A 498 1.176 39.157 133.125 1.00 33.30 C ATOM 650 C GLY A 498 2.604 39.617 132.986 1.00 38.65 C ATOM 651 O GLY A 498 2.957 40.161 131.932 1.00 49.84 O ATOM 652 H GLY A 498 0.872 37.547 134.525 1.00 0.00 H ATOM 653 N GLN A 499 3.442 39.425 134.004 1.00 34.34 N ATOM 654 CA GLN A 499 4.853 39.743 133.840 1.00 33.85 C ATOM 655 C GLN A 499 5.496 38.817 132.813 1.00 40.92 C ATOM 656 O GLN A 499 6.366 39.241 132.043 1.00 46.92 O ATOM 657 CB GLN A 499 5.574 39.662 135.181 1.00 33.07 C ATOM 658 CG GLN A 499 5.114 40.739 136.152 1.00 42.93 C ATOM 659 CD GLN A 499 5.940 40.794 137.419 1.00 52.58 C ATOM 660 OE1 GLN A 499 5.962 39.851 138.208 1.00 61.23 O ATOM 661 NE2 GLN A 499 6.586 41.930 137.645 1.00 60.67 N ATOM 662 HE22 GLN A 499 6.540 42.702 136.950 1.00 0.00 H ATOM 663 HE21 GLN A 499 7.139 42.049 138.518 1.00 0.00 H ATOM 664 H GLN A 499 3.091 39.051 134.909 1.00 0.00 H ATOM 665 N THR A 500 5.095 37.542 132.803 1.00 33.73 N ATOM 666 CA THR A 500 5.544 36.568 131.811 1.00 31.47 C ATOM 667 C THR A 500 4.327 35.909 131.186 1.00 34.43 C ATOM 668 O THR A 500 3.526 35.288 131.894 1.00 31.80 O ATOM 669 CB THR A 500 6.458 35.509 132.428 1.00 30.21 C ATOM 670 OG1 THR A 500 7.342 36.130 133.369 1.00 36.43 O ATOM 671 CG2 THR A 500 7.271 34.806 131.326 1.00 25.68 C ATOM 672 HG1 THR A 500 6.810 36.564 134.083 1.00 0.00 H ATOM 673 H THR A 500 4.430 37.228 133.538 1.00 0.00 H ATOM 674 N ARG A 501 4.202 36.017 129.865 1.00 28.09 N ATOM 675 CA ARG A 501 2.983 35.649 129.159 1.00 27.47 C ATOM 676 C ARG A 501 3.246 34.531 128.159 1.00 35.77 C ATOM 677 O ARG A 501 4.309 34.466 127.539 1.00 31.33 O ATOM 678 CB ARG A 501 2.396 36.871 128.445 1.00 28.36 C ATOM 679 CG ARG A 501 2.290 38.074 129.362 1.00 28.67 C ATOM 680 CD ARG A 501 1.813 39.331 128.664 1.00 34.29 C ATOM 681 NE ARG A 501 1.601 40.400 129.639 1.00 41.82 N ATOM 682 CZ ARG A 501 1.030 41.569 129.363 1.00 47.50 C ATOM 683 NH1 ARG A 501 0.614 41.832 128.128 1.00 50.94 N ATOM 684 NH2 ARG A 501 0.872 42.473 130.322 1.00 40.83 N ATOM 685 HE ARG A 501 1.919 40.235 130.615 1.00 0.00 H ATOM 686 HH12 ARG A 501 0.168 42.746 127.913 1.00 0.00 H ATOM 687 HH11 ARG A 501 0.735 41.123 127.377 1.00 0.00 H ATOM 688 HH22 ARG A 501 0.426 43.387 130.106 1.00 0.00 H ATOM 689 HH21 ARG A 501 1.195 42.267 131.289 1.00 0.00 H ATOM 690 H ARG A 501 5.007 36.379 129.315 1.00 0.00 H ATOM 691 N PHE A 502 2.258 33.652 128.004 1.00 31.10 N ATOM 692 CA PHE A 502 2.368 32.511 127.112 1.00 27.17 C ATOM 693 C PHE A 502 1.075 32.356 126.324 1.00 31.20 C ATOM 694 O PHE A 502 -0.011 32.590 126.857 1.00 35.33 O ATOM 695 CB PHE A 502 2.685 31.235 127.914 1.00 22.28 C ATOM 696 CG PHE A 502 3.934 31.346 128.755 1.00 28.48 C ATOM 697 CD1 PHE A 502 3.858 31.722 130.086 1.00 24.84 C ATOM 698 CD2 PHE A 502 5.181 31.095 128.204 1.00 30.71 C ATOM 699 CE1 PHE A 502 4.997 31.827 130.863 1.00 26.31 C ATOM 700 CE2 PHE A 502 6.329 31.194 128.969 1.00 28.93 C ATOM 701 CZ PHE A 502 6.244 31.565 130.300 1.00 28.69 C ATOM 702 H PHE A 502 1.377 33.787 128.540 1.00 0.00 H ATOM 703 N THR A 503 1.198 31.958 125.053 1.00 28.17 N ATOM 704 CA THR A 503 0.021 31.788 124.207 1.00 35.22 C ATOM 705 C THR A 503 -0.753 30.529 124.570 1.00 38.69 C ATOM 706 O THR A 503 -1.974 30.483 124.378 1.00 41.98 O ATOM 707 CB THR A 503 0.406 31.766 122.714 1.00 32.97 C ATOM 708 OG1 THR A 503 1.225 30.627 122.424 1.00 34.67 O ATOM 709 CG2 THR A 503 1.181 33.013 122.345 1.00 30.93 C ATOM 710 HG1 THR A 503 2.050 30.668 122.969 1.00 0.00 H ATOM 711 H THR A 503 2.143 31.768 124.663 1.00 0.00 H ATOM 712 N ASP A 504 -0.069 29.497 125.061 1.00 31.64 N ATOM 713 CA ASP A 504 -0.726 28.252 125.430 1.00 30.01 C ATOM 714 C ASP A 504 0.054 27.584 126.556 1.00 34.36 C ATOM 715 O ASP A 504 1.163 28.001 126.906 1.00 34.17 O ATOM 716 CB ASP A 504 -0.869 27.315 124.225 1.00 33.21 C ATOM 717 CG ASP A 504 0.410 27.174 123.437 1.00 41.38 C ATOM 718 OD1 ASP A 504 1.410 26.671 123.985 1.00 45.63 O ATOM 719 OD2 ASP A 504 0.406 27.548 122.245 1.00 59.24 O ATOM 720 H ASP A 504 0.960 29.583 125.184 1.00 0.00 H ATOM 721 N LEU A 505 -0.537 26.522 127.116 1.00 24.87 N ATOM 722 CA LEU A 505 0.096 25.839 128.243 1.00 34.56 C ATOM 723 C LEU A 505 1.366 25.125 127.815 1.00 33.91 C ATOM 724 O LEU A 505 2.309 25.021 128.605 1.00 29.54 O ATOM 725 CB LEU A 505 -0.861 24.839 128.889 1.00 22.06 C ATOM 726 CG LEU A 505 -2.141 25.412 129.487 1.00 29.85 C ATOM 727 CD1 LEU A 505 -2.973 24.299 130.128 1.00 23.31 C ATOM 728 CD2 LEU A 505 -1.841 26.522 130.466 1.00 27.65 C ATOM 729 H LEU A 505 -1.449 26.182 126.749 1.00 0.00 H ATOM 730 N LEU A 506 1.413 24.635 126.577 1.00 29.67 N ATOM 731 CA LEU A 506 2.623 23.977 126.101 1.00 30.62 C ATOM 732 C LEU A 506 3.812 24.931 126.132 1.00 24.53 C ATOM 733 O LEU A 506 4.893 24.568 126.610 1.00 28.87 O ATOM 734 CB LEU A 506 2.405 23.459 124.678 1.00 27.58 C ATOM 735 CG LEU A 506 3.586 22.731 124.030 1.00 30.00 C ATOM 736 CD1 LEU A 506 4.066 21.580 124.909 1.00 32.45 C ATOM 737 CD2 LEU A 506 3.257 22.258 122.605 1.00 37.61 C ATOM 738 H LEU A 506 0.587 24.722 125.951 1.00 0.00 H ATOM 739 N GLN A 507 3.618 26.170 125.652 1.00 21.26 N ATOM 740 CA GLN A 507 4.697 27.156 125.642 1.00 24.86 C ATOM 741 C GLN A 507 5.166 27.495 127.055 1.00 27.72 C ATOM 742 O GLN A 507 6.371 27.654 127.298 1.00 21.77 O ATOM 743 CB GLN A 507 4.242 28.423 124.906 1.00 24.00 C ATOM 744 CG GLN A 507 5.386 29.400 124.669 1.00 23.93 C ATOM 745 CD GLN A 507 4.955 30.756 124.115 1.00 30.02 C ATOM 746 OE1 GLN A 507 3.807 31.176 124.253 1.00 32.19 O ATOM 747 NE2 GLN A 507 5.900 31.453 123.496 1.00 32.83 N ATOM 748 HE22 GLN A 507 6.858 31.060 123.401 1.00 0.00 H ATOM 749 HE21 GLN A 507 5.682 32.392 123.106 1.00 0.00 H ATOM 750 H GLN A 507 2.683 26.433 125.281 1.00 0.00 H ATOM 751 N LEU A 508 4.230 27.604 128.002 1.00 24.00 N ATOM 752 CA LEU A 508 4.599 27.844 129.394 1.00 21.05 C ATOM 753 C LEU A 508 5.469 26.714 129.918 1.00 18.46 C ATOM 754 O LEU A 508 6.515 26.952 130.527 1.00 25.41 O ATOM 755 CB LEU A 508 3.335 27.987 130.253 1.00 20.35 C ATOM 756 CG LEU A 508 3.471 28.262 131.755 1.00 24.96 C ATOM 757 CD1 LEU A 508 2.285 29.073 132.289 1.00 27.20 C ATOM 758 CD2 LEU A 508 3.594 26.951 132.522 1.00 22.45 C ATOM 759 H LEU A 508 3.226 27.517 127.744 1.00 0.00 H ATOM 760 N VAL A 509 5.057 25.473 129.660 1.00 21.36 N ATOM 761 CA VAL A 509 5.798 24.312 130.149 1.00 22.32 C ATOM 762 C VAL A 509 7.181 24.248 129.498 1.00 25.96 C ATOM 763 O VAL A 509 8.200 24.086 130.180 1.00 20.98 O ATOM 764 CB VAL A 509 4.973 23.033 129.902 1.00 24.22 C ATOM 765 CG1 VAL A 509 5.813 21.784 130.060 1.00 22.63 C ATOM 766 CG2 VAL A 509 3.776 22.993 130.879 1.00 21.44 C ATOM 767 H VAL A 509 4.192 25.328 129.100 1.00 0.00 H ATOM 768 N GLU A 510 7.243 24.442 128.181 1.00 19.00 N ATOM 769 CA GLU A 510 8.521 24.340 127.482 1.00 17.91 C ATOM 770 C GLU A 510 9.494 25.421 127.934 1.00 17.69 C ATOM 771 O GLU A 510 10.699 25.176 128.036 1.00 23.68 O ATOM 772 CB GLU A 510 8.296 24.414 125.970 1.00 24.03 C ATOM 773 CG GLU A 510 7.708 23.129 125.385 1.00 27.31 C ATOM 774 CD GLU A 510 7.539 23.184 123.868 1.00 46.15 C ATOM 775 OE1 GLU A 510 7.655 24.286 123.283 1.00 51.12 O ATOM 776 OE2 GLU A 510 7.282 22.122 123.263 1.00 53.47 O ATOM 777 H GLU A 510 6.378 24.667 127.649 1.00 0.00 H ATOM 778 N PHE A 511 8.988 26.620 128.211 1.00 17.02 N ATOM 779 CA PHE A 511 9.837 27.682 128.725 1.00 16.32 C ATOM 780 C PHE A 511 10.447 27.300 130.067 1.00 24.94 C ATOM 781 O PHE A 511 11.639 27.540 130.308 1.00 15.98 O ATOM 782 CB PHE A 511 9.031 28.976 128.850 1.00 19.19 C ATOM 783 CG PHE A 511 9.820 30.116 129.410 1.00 24.05 C ATOM 784 CD1 PHE A 511 10.710 30.810 128.614 1.00 22.98 C ATOM 785 CD2 PHE A 511 9.674 30.495 130.735 1.00 31.82 C ATOM 786 CE1 PHE A 511 11.451 31.860 129.126 1.00 27.79 C ATOM 787 CE2 PHE A 511 10.407 31.545 131.251 1.00 33.26 C ATOM 788 CZ PHE A 511 11.296 32.230 130.447 1.00 27.98 C ATOM 789 H PHE A 511 7.975 26.799 128.058 1.00 0.00 H ATOM 790 N HIS A 512 9.644 26.722 130.959 1.00 21.13 N ATOM 791 CA HIS A 512 10.096 26.407 132.308 1.00 21.42 C ATOM 792 C HIS A 512 10.851 25.093 132.405 1.00 22.29 C ATOM 793 O HIS A 512 11.366 24.768 133.478 1.00 19.91 O ATOM 794 CB HIS A 512 8.912 26.402 133.269 1.00 20.51 C ATOM 795 CG HIS A 512 8.433 27.774 133.604 1.00 19.60 C ATOM 796 ND1 HIS A 512 7.370 28.369 132.960 1.00 22.86 N ATOM 797 CD2 HIS A 512 8.928 28.703 134.454 1.00 14.60 C ATOM 798 CE1 HIS A 512 7.197 29.589 133.436 1.00 21.61 C ATOM 799 NE2 HIS A 512 8.133 29.819 134.340 1.00 22.24 N ATOM 800 H HIS A 512 8.668 26.489 130.685 1.00 0.00 H ATOM 801 N GLN A 513 10.948 24.339 131.317 1.00 19.44 N ATOM 802 CA GLN A 513 11.909 23.246 131.297 1.00 18.34 C ATOM 803 C GLN A 513 13.339 23.767 131.182 1.00 20.07 C ATOM 804 O GLN A 513 14.277 23.042 131.509 1.00 21.97 O ATOM 805 CB GLN A 513 11.582 22.278 130.156 1.00 28.71 C ATOM 806 CG GLN A 513 10.280 21.517 130.421 1.00 35.38 C ATOM 807 CD GLN A 513 9.860 20.587 129.302 1.00 41.70 C ATOM 808 OE1 GLN A 513 10.182 20.809 128.143 1.00 38.43 O ATOM 809 NE2 GLN A 513 9.121 19.537 129.653 1.00 43.78 N ATOM 810 HE22 GLN A 513 8.871 19.388 130.651 1.00 0.00 H ATOM 811 HE21 GLN A 513 8.794 18.866 128.929 1.00 0.00 H ATOM 812 H GLN A 513 10.346 24.527 130.490 1.00 0.00 H ATOM 813 N LEU A 514 13.528 25.019 130.764 1.00 19.65 N ATOM 814 CA LEU A 514 14.862 25.601 130.666 1.00 25.59 C ATOM 815 C LEU A 514 15.078 26.809 131.556 1.00 26.66 C ATOM 816 O LEU A 514 16.228 27.116 131.873 1.00 25.66 O ATOM 817 CB LEU A 514 15.169 26.018 129.218 1.00 29.91 C ATOM 818 CG LEU A 514 16.076 25.116 128.378 1.00 40.73 C ATOM 819 CD1 LEU A 514 15.519 23.715 128.249 1.00 41.72 C ATOM 820 CD2 LEU A 514 16.259 25.746 126.999 1.00 36.01 C ATOM 821 H LEU A 514 12.703 25.595 130.501 1.00 0.00 H ATOM 822 N ASN A 515 14.020 27.488 131.973 1.00 20.77 N ATOM 823 CA ASN A 515 14.131 28.710 132.752 1.00 16.07 C ATOM 824 C ASN A 515 13.258 28.581 133.988 1.00 29.40 C ATOM 825 O ASN A 515 12.089 28.200 133.884 1.00 24.53 O ATOM 826 CB ASN A 515 13.697 29.910 131.912 1.00 13.65 C ATOM 827 CG ASN A 515 14.435 29.967 130.591 1.00 26.04 C ATOM 828 OD1 ASN A 515 15.554 30.462 130.537 1.00 19.88 O ATOM 829 ND2 ASN A 515 13.834 29.425 129.532 1.00 19.72 N ATOM 830 HD22 ASN A 515 12.882 29.016 129.627 1.00 0.00 H ATOM 831 HD21 ASN A 515 14.317 29.411 128.611 1.00 0.00 H ATOM 832 H ASN A 515 13.072 27.133 131.734 1.00 0.00 H ATOM 833 N ARG A 516 13.821 28.910 135.150 1.00 26.33 N ATOM 834 CA ARG A 516 13.054 28.792 136.388 1.00 28.28 C ATOM 835 C ARG A 516 11.908 29.791 136.436 1.00 21.88 C ATOM 836 O ARG A 516 10.796 29.443 136.852 1.00 27.82 O ATOM 837 CB ARG A 516 13.977 28.975 137.593 1.00 24.53 C ATOM 838 CG ARG A 516 14.603 27.684 138.090 1.00 23.14 C ATOM 839 CD ARG A 516 15.405 27.946 139.355 1.00 37.68 C ATOM 840 NE ARG A 516 14.632 28.667 140.362 1.00 40.15 N ATOM 841 CZ ARG A 516 15.100 28.999 141.561 1.00 37.44 C ATOM 842 NH1 ARG A 516 16.340 28.677 141.905 1.00 34.47 N ATOM 843 NH2 ARG A 516 14.333 29.671 142.401 1.00 35.87 N ATOM 844 HE ARG A 516 13.656 28.937 140.127 1.00 0.00 H ATOM 845 HH12 ARG A 516 16.704 28.938 142.844 1.00 0.00 H ATOM 846 HH11 ARG A 516 16.949 28.164 141.236 1.00 0.00 H ATOM 847 HH22 ARG A 516 14.695 29.933 143.340 1.00 0.00 H ATOM 848 HH21 ARG A 516 13.367 29.938 142.123 1.00 0.00 H ATOM 849 H ARG A 516 14.804 29.250 135.176 1.00 0.00 H ATOM 850 N GLY A 517 12.139 31.026 135.996 1.00 24.18 N ATOM 851 CA GLY A 517 11.113 32.037 136.204 1.00 23.82 C ATOM 852 C GLY A 517 10.825 32.169 137.692 1.00 29.73 C ATOM 853 O GLY A 517 11.734 32.118 138.524 1.00 27.46 O ATOM 854 H GLY A 517 13.031 31.262 135.516 1.00 0.00 H ATOM 855 N ILE A 518 9.536 32.277 138.040 1.00 30.61 N ATOM 856 CA ILE A 518 9.120 32.326 139.443 1.00 30.38 C ATOM 857 C ILE A 518 9.108 30.965 140.113 1.00 34.33 C ATOM 858 O ILE A 518 8.781 30.880 141.306 1.00 30.89 O ATOM 859 CB ILE A 518 7.700 32.894 139.636 1.00 36.17 C ATOM 860 CG1 ILE A 518 6.668 31.938 139.032 1.00 39.54 C ATOM 861 CG2 ILE A 518 7.589 34.283 139.040 1.00 31.48 C ATOM 862 CD1 ILE A 518 5.246 32.213 139.457 1.00 39.82 C ATOM 863 H ILE A 518 8.812 32.327 137.295 1.00 0.00 H ATOM 864 N LEU A 519 9.452 29.897 139.391 1.00 22.71 N ATOM 865 CA LEU A 519 9.415 28.572 139.980 1.00 20.30 C ATOM 866 C LEU A 519 10.702 28.289 140.748 1.00 23.39 C ATOM 867 O LEU A 519 11.751 28.864 140.456 1.00 32.16 O ATOM 868 CB LEU A 519 9.203 27.507 138.904 1.00 18.51 C ATOM 869 CG LEU A 519 7.922 27.650 138.091 1.00 20.77 C ATOM 870 CD1 LEU A 519 7.854 26.526 137.076 1.00 22.49 C ATOM 871 CD2 LEU A 519 6.701 27.628 139.000 1.00 23.29 C ATOM 872 H LEU A 519 9.748 30.015 138.401 1.00 0.00 H ATOM 873 N PRO A 520 10.643 27.417 141.753 1.00 27.72 N ATOM 874 CA PRO A 520 11.843 27.125 142.544 1.00 26.63 C ATOM 875 C PRO A 520 12.815 26.188 141.861 1.00 29.93 C ATOM 876 O PRO A 520 13.946 26.040 142.340 1.00 29.16 O ATOM 877 CB PRO A 520 11.269 26.491 143.819 1.00 31.19 C ATOM 878 CG PRO A 520 9.991 25.857 143.375 1.00 29.23 C ATOM 879 CD PRO A 520 9.438 26.766 142.298 1.00 26.70 C ATOM 880 N CYS A 521 12.419 25.554 140.765 1.00 22.88 N ATOM 881 CA CYS A 521 13.300 24.650 140.046 1.00 21.24 C ATOM 882 C CYS A 521 12.740 24.484 138.646 1.00 22.13 C ATOM 883 O CYS A 521 11.603 24.868 138.366 1.00 22.45 O ATOM 884 CB CYS A 521 13.417 23.288 140.746 1.00 23.73 C ATOM 885 SG CYS A 521 11.856 22.348 140.799 1.00 31.23 S ATOM 886 H CYS A 521 11.453 25.708 140.411 1.00 0.00 H ATOM 887 N LEU A 522 13.517 23.828 137.797 1.00 21.88 N ATOM 888 CA LEU A 522 13.092 23.582 136.427 1.00 23.57 C ATOM 889 C LEU A 522 12.113 22.417 136.371 1.00 20.99 C ATOM 890 O LEU A 522 12.142 21.512 137.209 1.00 24.13 O ATOM 891 CB LEU A 522 14.305 23.266 135.547 1.00 23.37 C ATOM 892 CG LEU A 522 15.388 24.333 135.443 1.00 30.11 C ATOM 893 CD1 LEU A 522 16.582 23.781 134.663 1.00 32.79 C ATOM 894 CD2 LEU A 522 14.822 25.571 134.744 1.00 22.20 C ATOM 895 H LEU A 522 14.445 23.483 138.115 1.00 0.00 H ATOM 896 N LEU A 523 11.254 22.428 135.352 1.00 22.91 N ATOM 897 CA LEU A 523 10.429 21.261 135.076 1.00 22.45 C ATOM 898 C LEU A 523 11.256 20.207 134.350 1.00 31.12 C ATOM 899 O LEU A 523 11.772 20.451 133.257 1.00 33.50 O ATOM 900 CB LEU A 523 9.212 21.644 134.248 1.00 22.15 C ATOM 901 CG LEU A 523 8.363 22.796 134.777 1.00 23.58 C ATOM 902 CD1 LEU A 523 7.196 23.016 133.837 1.00 22.24 C ATOM 903 CD2 LEU A 523 7.877 22.494 136.207 1.00 23.00 C ATOM 904 H LEU A 523 11.173 23.273 134.752 1.00 0.00 H ATOM 905 N ARG A 524 11.434 19.064 134.986 1.00 28.92 N ATOM 906 CA ARG A 524 12.343 18.039 134.488 1.00 31.79 C ATOM 907 C ARG A 524 11.655 16.763 134.029 1.00 39.44 C ATOM 908 O ARG A 524 12.050 16.205 133.009 1.00 53.88 O ATOM 909 CB ARG A 524 13.400 17.719 135.563 1.00 38.37 C ATOM 910 CG ARG A 524 14.300 18.911 135.875 1.00 39.88 C ATOM 911 CD ARG A 524 15.413 18.557 136.836 1.00 56.02 C ATOM 912 NE ARG A 524 16.282 19.707 137.064 1.00 63.48 N ATOM 913 CZ ARG A 524 17.334 20.005 136.311 1.00 59.60 C ATOM 914 NH1 ARG A 524 17.655 19.232 135.282 1.00 60.93 N ATOM 915 NH2 ARG A 524 18.067 21.072 136.593 1.00 58.09 N ATOM 916 HE ARG A 524 16.064 20.332 137.866 1.00 0.00 H ATOM 917 HH12 ARG A 524 18.479 19.466 134.693 1.00 0.00 H ATOM 918 HH11 ARG A 524 17.082 18.392 135.064 1.00 0.00 H ATOM 919 HH22 ARG A 524 18.891 21.307 136.004 1.00 0.00 H ATOM 920 HH21 ARG A 524 17.818 21.675 137.403 1.00 0.00 H ATOM 921 H ARG A 524 10.911 18.890 135.868 1.00 0.00 H ATOM 922 N HIS A 525 10.681 16.251 134.771 1.00 40.67 N ATOM 923 CA HIS A 525 10.085 14.955 134.450 1.00 46.56 C ATOM 924 C HIS A 525 8.570 15.066 134.373 1.00 39.11 C ATOM 925 O HIS A 525 7.927 15.531 135.318 1.00 28.86 O ATOM 926 CB HIS A 525 10.488 13.901 135.485 1.00 51.54 C ATOM 927 CG HIS A 525 11.921 13.994 135.907 1.00 56.94 C ATOM 928 ND1 HIS A 525 12.962 13.542 135.123 1.00 57.45 N ATOM 929 CD2 HIS A 525 12.487 14.493 137.032 1.00 55.61 C ATOM 930 CE1 HIS A 525 14.107 13.754 135.749 1.00 54.49 C ATOM 931 NE2 HIS A 525 13.846 14.327 136.910 1.00 55.97 N ATOM 932 H HIS A 525 10.335 16.781 135.596 1.00 0.00 H ATOM 933 N CYS A 526 7.992 14.586 133.284 1.00 39.21 N ATOM 934 CA CYS A 526 6.549 14.609 133.147 1.00 48.21 C ATOM 935 C CYS A 526 5.930 13.494 133.975 1.00 46.92 C ATOM 936 O CYS A 526 6.356 12.346 133.914 1.00 46.85 O ATOM 937 CB CYS A 526 6.136 14.437 131.689 1.00 59.79 C ATOM 938 SG CYS A 526 6.730 15.737 130.596 1.00 82.42 S ATOM 939 H CYS A 526 8.577 14.189 132.521 1.00 0.00 H ATOM 940 N CYS A 527 4.936 13.848 134.770 1.00 39.24 N ATOM 941 CA CYS A 527 4.214 12.872 135.575 1.00 41.57 C ATOM 942 C CYS A 527 3.140 12.194 134.733 1.00 47.50 C ATOM 943 O CYS A 527 2.185 12.846 134.297 1.00 47.27 O ATOM 944 CB CYS A 527 3.595 13.534 136.802 1.00 44.97 C ATOM 945 SG CYS A 527 2.923 12.344 137.949 1.00 56.18 S ATOM 946 H CYS A 527 4.662 14.850 134.822 1.00 0.00 H ATOM 947 N THR A 528 3.313 10.897 134.487 1.00 56.44 N ATOM 948 CA THR A 528 2.390 10.116 133.655 1.00 60.26 C ATOM 949 C THR A 528 0.943 10.187 134.150 1.00 65.91 C ATOM 950 O THR A 528 0.527 9.402 135.005 1.00 65.58 O ATOM 951 CB THR A 528 2.813 8.635 133.598 1.00 54.66 C ATOM 952 H THR A 528 4.137 10.417 134.902 1.00 0.00 H TER 953 THR A 528 ATOM 954 N SER B 422 21.634 22.072 106.191 1.00 56.54 N ATOM 955 CA SER B 422 20.873 22.157 107.434 1.00 57.61 C ATOM 956 C SER B 422 19.375 22.125 107.161 1.00 53.82 C ATOM 957 O SER B 422 18.901 22.644 106.147 1.00 57.36 O ATOM 958 CB SER B 422 21.236 23.429 108.207 1.00 60.11 C ATOM 959 OG SER B 422 20.390 23.610 109.335 1.00 51.72 O ATOM 960 HG SER B 422 20.650 24.438 109.811 1.00 0.00 H ATOM 961 HN3 SER B 422 21.389 22.877 105.580 1.00 0.00 H ATOM 962 HN2 SER B 422 21.402 21.183 105.704 1.00 0.00 H ATOM 963 HN1 SER B 422 22.651 22.096 106.406 1.00 0.00 H ATOM 964 N ALA B 423 18.630 21.508 108.074 1.00 43.93 N ATOM 965 CA ALA B 423 17.180 21.422 107.954 1.00 48.90 C ATOM 966 C ALA B 423 16.527 21.726 109.294 1.00 48.02 C ATOM 967 O ALA B 423 15.554 21.079 109.697 1.00 39.35 O ATOM 968 CB ALA B 423 16.748 20.055 107.425 1.00 42.03 C ATOM 969 H ALA B 423 19.095 21.075 108.897 1.00 0.00 H ATOM 970 N ALA B 424 17.059 22.718 110.001 1.00 47.28 N ATOM 971 CA ALA B 424 16.488 23.119 111.274 1.00 45.87 C ATOM 972 C ALA B 424 15.125 23.774 111.067 1.00 43.68 C ATOM 973 O ALA B 424 14.835 24.366 110.017 1.00 35.56 O ATOM 974 CB ALA B 424 17.425 24.076 112.005 1.00 44.00 C ATOM 975 H ALA B 424 17.897 23.214 109.637 1.00 0.00 H ATOM 976 N ILE B 425 14.296 23.687 112.110 1.00 42.73 N ATOM 977 CA ILE B 425 12.901 24.102 112.005 1.00 43.68 C ATOM 978 C ILE B 425 12.787 25.590 111.725 1.00 32.03 C ATOM 979 O ILE B 425 11.839 26.026 111.065 1.00 35.59 O ATOM 980 CB ILE B 425 12.119 23.714 113.278 1.00 59.86 C ATOM 981 CG1 ILE B 425 12.605 24.523 114.488 1.00 61.61 C ATOM 982 CG2 ILE B 425 12.223 22.210 113.534 1.00 68.86 C ATOM 983 CD1 ILE B 425 11.793 24.305 115.746 1.00 70.82 C ATOM 984 H ILE B 425 14.651 23.316 113.014 1.00 0.00 H ATOM 985 N HIS B 426 13.730 26.401 112.222 1.00 26.95 N ATOM 986 CA HIS B 426 13.641 27.832 111.954 1.00 27.00 C ATOM 987 C HIS B 426 13.710 28.141 110.459 1.00 25.04 C ATOM 988 O HIS B 426 13.214 29.187 110.033 1.00 29.74 O ATOM 989 CB HIS B 426 14.732 28.592 112.705 1.00 27.79 C ATOM 990 CG HIS B 426 16.128 28.193 112.335 1.00 34.43 C ATOM 991 ND1 HIS B 426 16.929 27.439 113.165 1.00 33.67 N ATOM 992 CD2 HIS B 426 16.876 28.473 111.241 1.00 35.10 C ATOM 993 CE1 HIS B 426 18.106 27.257 112.593 1.00 36.03 C ATOM 994 NE2 HIS B 426 18.099 27.871 111.424 1.00 34.47 N ATOM 995 H HIS B 426 14.512 26.017 112.789 1.00 0.00 H ATOM 996 N ARG B 427 14.291 27.248 109.655 1.00 24.91 N ATOM 997 CA ARG B 427 14.343 27.475 108.212 1.00 26.47 C ATOM 998 C ARG B 427 12.970 27.386 107.551 1.00 28.78 C ATOM 999 O ARG B 427 12.825 27.826 106.406 1.00 32.60 O ATOM 1000 CB ARG B 427 15.315 26.486 107.550 1.00 29.70 C ATOM 1001 CG ARG B 427 16.732 26.553 108.125 1.00 31.89 C ATOM 1002 CD ARG B 427 17.730 25.742 107.312 1.00 32.92 C ATOM 1003 NE ARG B 427 17.886 26.273 105.964 1.00 31.23 N ATOM 1004 CZ ARG B 427 18.757 27.219 105.619 1.00 39.27 C ATOM 1005 NH1 ARG B 427 19.563 27.746 106.529 1.00 37.23 N ATOM 1006 NH2 ARG B 427 18.826 27.634 104.357 1.00 33.04 N ATOM 1007 HE ARG B 427 17.273 25.885 105.218 1.00 0.00 H ATOM 1008 HH12 ARG B 427 20.242 28.485 106.257 1.00 0.00 H ATOM 1009 HH11 ARG B 427 19.516 27.421 107.516 1.00 0.00 H ATOM 1010 HH22 ARG B 427 19.507 28.373 104.089 1.00 0.00 H ATOM 1011 HH21 ARG B 427 18.199 27.219 103.638 1.00 0.00 H ATOM 1012 H ARG B 427 14.709 26.385 110.058 1.00 0.00 H ATOM 1013 N THR B 428 11.963 26.846 108.242 1.00 30.73 N ATOM 1014 CA THR B 428 10.596 26.852 107.741 1.00 27.40 C ATOM 1015 C THR B 428 9.846 28.140 108.059 1.00 27.25 C ATOM 1016 O THR B 428 8.672 28.256 107.696 1.00 27.09 O ATOM 1017 CB THR B 428 9.811 25.664 108.312 1.00 33.21 C ATOM 1018 OG1 THR B 428 9.640 25.834 109.726 1.00 34.27 O ATOM 1019 CG2 THR B 428 10.541 24.356 108.046 1.00 30.79 C ATOM 1020 HG1 THR B 428 10.528 25.882 110.161 1.00 0.00 H ATOM 1021 H THR B 428 12.161 26.409 109.165 1.00 0.00 H ATOM 1022 N GLN B 429 10.476 29.105 108.722 1.00 29.96 N ATOM 1023 CA GLN B 429 9.764 30.262 109.247 1.00 27.24 C ATOM 1024 C GLN B 429 9.939 31.473 108.342 1.00 36.84 C ATOM 1025 O GLN B 429 11.005 31.674 107.749 1.00 28.50 O ATOM 1026 CB GLN B 429 10.268 30.584 110.654 1.00 26.62 C ATOM 1027 CG GLN B 429 10.016 29.451 111.626 1.00 34.00 C ATOM 1028 CD GLN B 429 8.537 29.172 111.779 1.00 37.12 C ATOM 1029 OE1 GLN B 429 7.762 30.078 112.072 1.00 38.17 O ATOM 1030 NE2 GLN B 429 8.136 27.925 111.560 1.00 38.83 N ATOM 1031 HE22 GLN B 429 8.831 27.191 111.314 1.00 0.00 H ATOM 1032 HE21 GLN B 429 7.127 27.682 111.634 1.00 0.00 H ATOM 1033 H GLN B 429 11.503 29.032 108.869 1.00 0.00 H ATOM 1034 N LEU B 430 8.906 32.315 108.290 1.00 36.18 N ATOM 1035 CA LEU B 430 8.940 33.435 107.359 1.00 38.18 C ATOM 1036 C LEU B 430 9.858 34.559 107.823 1.00 43.50 C ATOM 1037 O LEU B 430 10.277 35.382 107.002 1.00 42.37 O ATOM 1038 CB LEU B 430 7.521 33.947 107.116 1.00 50.51 C ATOM 1039 CG LEU B 430 6.878 33.262 105.896 1.00 51.84 C ATOM 1040 CD1 LEU B 430 5.534 33.872 105.528 1.00 44.50 C ATOM 1041 CD2 LEU B 430 7.830 33.278 104.702 1.00 51.11 C ATOM 1042 H LEU B 430 8.083 32.173 108.909 1.00 0.00 H ATOM 1043 N TRP B 431 10.200 34.604 109.106 1.00 37.37 N ATOM 1044 CA TRP B 431 11.127 35.606 109.599 1.00 31.66 C ATOM 1045 C TRP B 431 12.594 35.211 109.422 1.00 32.35 C ATOM 1046 O TRP B 431 13.471 36.041 109.673 1.00 31.77 O ATOM 1047 CB TRP B 431 10.827 35.918 111.077 1.00 24.63 C ATOM 1048 CG TRP B 431 10.475 34.720 111.915 1.00 25.28 C ATOM 1049 CD1 TRP B 431 9.219 34.326 112.305 1.00 27.39 C ATOM 1050 CD2 TRP B 431 11.383 33.762 112.474 1.00 25.03 C ATOM 1051 NE1 TRP B 431 9.295 33.185 113.077 1.00 25.89 N ATOM 1052 CE2 TRP B 431 10.609 32.823 113.202 1.00 27.40 C ATOM 1053 CE3 TRP B 431 12.772 33.612 112.447 1.00 22.75 C ATOM 1054 CZ2 TRP B 431 11.183 31.741 113.875 1.00 28.97 C ATOM 1055 CZ3 TRP B 431 13.339 32.535 113.123 1.00 28.72 C ATOM 1056 CH2 TRP B 431 12.545 31.618 113.829 1.00 29.24 C ATOM 1057 HE1 TRP B 431 8.486 32.682 113.495 1.00 0.00 H ATOM 1058 H TRP B 431 9.797 33.910 109.768 1.00 0.00 H ATOM 1059 N PHE B 432 12.889 33.984 108.995 1.00 29.45 N ATOM 1060 CA PHE B 432 14.273 33.546 108.825 1.00 35.43 C ATOM 1061 C PHE B 432 14.748 33.848 107.405 1.00 35.35 C ATOM 1062 O PHE B 432 14.175 33.345 106.432 1.00 33.14 O ATOM 1063 CB PHE B 432 14.423 32.050 109.093 1.00 24.49 C ATOM 1064 CG PHE B 432 15.844 31.567 108.966 1.00 32.58 C ATOM 1065 CD1 PHE B 432 16.769 31.850 109.958 1.00 32.64 C ATOM 1066 CD2 PHE B 432 16.269 30.881 107.835 1.00 27.10 C ATOM 1067 CE1 PHE B 432 18.078 31.432 109.845 1.00 38.06 C ATOM 1068 CE2 PHE B 432 17.579 30.458 107.718 1.00 30.54 C ATOM 1069 CZ PHE B 432 18.489 30.736 108.725 1.00 33.40 C ATOM 1070 H PHE B 432 12.117 33.322 108.778 1.00 0.00 H ATOM 1071 N HIS B 433 15.832 34.620 107.291 1.00 31.62 N ATOM 1072 CA HIS B 433 16.312 35.100 106.000 1.00 28.65 C ATOM 1073 C HIS B 433 17.706 34.588 105.645 1.00 34.32 C ATOM 1074 O HIS B 433 18.383 35.190 104.809 1.00 41.54 O ATOM 1075 CB HIS B 433 16.266 36.626 105.920 1.00 40.54 C ATOM 1076 CG HIS B 433 14.886 37.168 105.712 1.00 51.15 C ATOM 1077 ND1 HIS B 433 14.493 37.781 104.541 1.00 52.02 N ATOM 1078 CD2 HIS B 433 13.810 37.201 106.533 1.00 47.82 C ATOM 1079 CE1 HIS B 433 13.228 38.151 104.644 1.00 56.75 C ATOM 1080 NE2 HIS B 433 12.793 37.817 105.846 1.00 54.80 N ATOM 1081 H HIS B 433 16.351 34.888 108.151 1.00 0.00 H ATOM 1082 N GLY B 434 18.196 33.558 106.324 1.00 37.67 N ATOM 1083 CA GLY B 434 19.452 32.968 105.886 1.00 39.29 C ATOM 1084 C GLY B 434 20.645 33.853 106.177 1.00 39.46 C ATOM 1085 O GLY B 434 20.732 34.502 107.229 1.00 28.33 O ATOM 1086 H GLY B 434 17.693 33.180 107.152 1.00 0.00 H ATOM 1087 N ARG B 435 21.591 33.878 105.232 1.00 35.89 N ATOM 1088 CA ARG B 435 22.880 34.521 105.444 1.00 43.55 C ATOM 1089 C ARG B 435 22.920 35.935 104.891 1.00 51.68 C ATOM 1090 O ARG B 435 23.907 36.327 104.266 1.00 56.50 O ATOM 1091 CB ARG B 435 23.992 33.691 104.806 1.00 49.85 C ATOM 1092 CG ARG B 435 24.134 32.295 105.370 1.00 62.40 C ATOM 1093 CD ARG B 435 25.456 31.677 104.949 1.00 69.50 C ATOM 1094 NE ARG B 435 25.664 30.368 105.560 1.00 77.45 N ATOM 1095 CZ ARG B 435 25.585 29.211 104.907 1.00 77.68 C ATOM 1096 NH1 ARG B 435 25.305 29.193 103.610 1.00 72.88 N ATOM 1097 NH2 ARG B 435 25.790 28.069 105.552 1.00 76.54 N ATOM 1098 HE ARG B 435 25.889 30.337 106.575 1.00 0.00 H ATOM 1099 HH12 ARG B 435 25.244 28.287 103.104 1.00 0.00 H ATOM 1100 HH11 ARG B 435 25.146 30.085 103.100 1.00 0.00 H ATOM 1101 HH22 ARG B 435 25.728 27.165 105.041 1.00 0.00 H ATOM 1102 HH21 ARG B 435 26.012 28.078 106.568 1.00 0.00 H ATOM 1103 H ARG B 435 21.400 33.424 104.316 1.00 0.00 H ATOM 1104 N ILE B 436 21.917 36.752 105.191 1.00 47.37 N ATOM 1105 CA ILE B 436 21.978 38.126 104.735 1.00 35.95 C ATOM 1106 C ILE B 436 22.789 38.941 105.727 1.00 38.03 C ATOM 1107 O ILE B 436 22.844 38.639 106.931 1.00 37.26 O ATOM 1108 CB ILE B 436 20.565 38.702 104.543 1.00 43.34 C ATOM 1109 CG1 ILE B 436 19.840 38.792 105.892 1.00 40.89 C ATOM 1110 CG2 ILE B 436 19.798 37.873 103.532 1.00 50.00 C ATOM 1111 CD1 ILE B 436 18.517 39.513 105.823 1.00 57.62 C ATOM 1112 H ILE B 436 21.103 36.412 105.743 1.00 0.00 H ATOM 1113 N SER B 437 23.402 40.000 105.222 1.00 33.78 N ATOM 1114 CA SER B 437 24.311 40.811 106.008 1.00 36.49 C ATOM 1115 C SER B 437 23.540 41.803 106.871 1.00 34.70 C ATOM 1116 O SER B 437 22.333 42.006 106.714 1.00 39.50 O ATOM 1117 CB SER B 437 25.276 41.561 105.094 1.00 41.03 C ATOM 1118 OG SER B 437 24.605 42.643 104.477 1.00 40.08 O ATOM 1119 HG SER B 437 25.235 43.126 103.885 1.00 0.00 H ATOM 1120 H SER B 437 23.226 40.258 104.230 1.00 0.00 H ATOM 1121 N ARG B 438 24.267 42.447 107.784 1.00 40.53 N ATOM 1122 CA ARG B 438 23.646 43.467 108.617 1.00 38.19 C ATOM 1123 C ARG B 438 23.135 44.621 107.768 1.00 42.08 C ATOM 1124 O ARG B 438 22.005 45.084 107.955 1.00 39.16 O ATOM 1125 CB ARG B 438 24.627 43.976 109.675 1.00 36.96 C ATOM 1126 CG ARG B 438 24.113 45.215 110.417 1.00 45.49 C ATOM 1127 CD ARG B 438 25.122 45.740 111.425 1.00 33.24 C ATOM 1128 NE ARG B 438 25.272 44.812 112.545 1.00 41.76 N ATOM 1129 CZ ARG B 438 25.662 45.155 113.770 1.00 42.10 C ATOM 1130 NH1 ARG B 438 25.951 46.417 114.049 1.00 42.46 N ATOM 1131 NH2 ARG B 438 25.778 44.228 114.713 1.00 44.15 N ATOM 1132 HE ARG B 438 25.058 43.809 112.371 1.00 0.00 H ATOM 1133 HH12 ARG B 438 26.255 46.681 115.008 1.00 0.00 H ATOM 1134 HH11 ARG B 438 25.873 47.144 113.309 1.00 0.00 H ATOM 1135 HH22 ARG B 438 26.083 44.496 115.671 1.00 0.00 H ATOM 1136 HH21 ARG B 438 25.564 43.234 114.494 1.00 0.00 H ATOM 1137 H ARG B 438 25.275 42.221 107.901 1.00 0.00 H ATOM 1138 N GLU B 439 23.952 45.085 106.810 1.00 41.23 N ATOM 1139 CA GLU B 439 23.517 46.186 105.953 1.00 40.88 C ATOM 1140 C GLU B 439 22.299 45.790 105.122 1.00 38.64 C ATOM 1141 O GLU B 439 21.371 46.589 104.955 1.00 42.41 O ATOM 1142 CB GLU B 439 24.665 46.650 105.052 1.00 45.76 C ATOM 1143 H GLU B 439 24.893 44.662 106.678 1.00 0.00 H ATOM 1144 N GLU B 440 22.276 44.531 104.696 1.00 47.46 N ATOM 1145 CA GLU B 440 21.163 43.994 103.930 1.00 43.60 C ATOM 1146 C GLU B 440 19.898 43.961 104.787 1.00 39.74 C ATOM 1147 O GLU B 440 18.830 44.373 104.335 1.00 37.69 O ATOM 1148 CB GLU B 440 21.491 42.590 103.418 1.00 50.55 C ATOM 1149 CG GLU B 440 22.344 42.571 102.161 1.00 68.89 C ATOM 1150 CD GLU B 440 22.503 41.177 101.586 1.00 86.07 C ATOM 1151 OE1 GLU B 440 23.251 40.370 102.176 1.00 88.11 O ATOM 1152 OE2 GLU B 440 21.879 40.888 100.543 1.00 87.54 O ATOM 1153 H GLU B 440 23.080 43.910 104.918 1.00 0.00 H ATOM 1154 N SER B 441 20.013 43.473 106.023 1.00 30.43 N ATOM 1155 CA SER B 441 18.856 43.419 106.898 1.00 30.90 C ATOM 1156 C SER B 441 18.328 44.828 107.160 1.00 37.94 C ATOM 1157 O SER B 441 17.112 45.051 107.173 1.00 39.43 O ATOM 1158 CB SER B 441 19.212 42.673 108.187 1.00 32.35 C ATOM 1159 OG SER B 441 20.018 43.468 109.029 1.00 44.97 O ATOM 1160 HG SER B 441 20.856 43.702 108.557 1.00 0.00 H ATOM 1161 H SER B 441 20.935 43.130 106.361 1.00 0.00 H ATOM 1162 N GLN B 442 19.227 45.802 107.309 1.00 35.61 N ATOM 1163 CA GLN B 442 18.786 47.176 107.526 1.00 35.46 C ATOM 1164 C GLN B 442 18.081 47.747 106.299 1.00 39.46 C ATOM 1165 O GLN B 442 17.096 48.483 106.433 1.00 45.28 O ATOM 1166 CB GLN B 442 19.975 48.048 107.903 1.00 44.26 C ATOM 1167 CG GLN B 442 20.611 47.663 109.212 1.00 57.50 C ATOM 1168 CD GLN B 442 21.447 48.777 109.783 1.00 61.51 C ATOM 1169 OE1 GLN B 442 21.964 48.675 110.899 1.00 59.90 O ATOM 1170 NE2 GLN B 442 21.584 49.859 109.020 1.00 57.53 N ATOM 1171 HE22 GLN B 442 21.129 49.898 108.086 1.00 0.00 H ATOM 1172 HE21 GLN B 442 22.146 50.666 109.358 1.00 0.00 H ATOM 1173 H GLN B 442 20.243 45.582 107.271 1.00 0.00 H ATOM 1174 N ARG B 443 18.560 47.416 105.094 1.00 38.33 N ATOM 1175 CA ARG B 443 17.869 47.874 103.891 1.00 39.53 C ATOM 1176 C ARG B 443 16.511 47.200 103.765 1.00 46.13 C ATOM 1177 O ARG B 443 15.504 47.858 103.481 1.00 44.01 O ATOM 1178 CB ARG B 443 18.721 47.606 102.645 1.00 38.63 C ATOM 1179 CG ARG B 443 19.976 48.484 102.524 1.00 53.48 C ATOM 1180 CD ARG B 443 20.616 48.428 101.123 1.00 61.66 C ATOM 1181 NE ARG B 443 21.925 47.766 101.143 1.00 69.77 N ATOM 1182 CZ ARG B 443 22.162 46.534 100.691 1.00 66.89 C ATOM 1183 NH1 ARG B 443 21.183 45.809 100.170 1.00 70.25 N ATOM 1184 NH2 ARG B 443 23.381 46.018 100.763 1.00 54.73 N ATOM 1185 HE ARG B 443 22.727 48.297 101.539 1.00 0.00 H ATOM 1186 HH12 ARG B 443 21.377 44.849 99.820 1.00 0.00 H ATOM 1187 HH11 ARG B 443 20.221 46.200 100.111 1.00 0.00 H ATOM 1188 HH22 ARG B 443 23.560 45.057 100.409 1.00 0.00 H ATOM 1189 HH21 ARG B 443 24.158 46.574 101.173 1.00 0.00 H ATOM 1190 H ARG B 443 19.419 46.836 105.014 1.00 0.00 H ATOM 1191 N LEU B 444 16.457 45.891 104.022 1.00 41.94 N ATOM 1192 CA LEU B 444 15.203 45.159 103.892 1.00 43.22 C ATOM 1193 C LEU B 444 14.151 45.678 104.866 1.00 52.30 C ATOM 1194 O LEU B 444 12.984 45.850 104.495 1.00 49.31 O ATOM 1195 CB LEU B 444 15.464 43.672 104.105 1.00 44.61 C ATOM 1196 CG LEU B 444 14.390 42.705 103.622 1.00 51.67 C ATOM 1197 CD1 LEU B 444 14.147 42.911 102.136 1.00 50.27 C ATOM 1198 CD2 LEU B 444 14.814 41.274 103.910 1.00 51.86 C ATOM 1199 H LEU B 444 17.318 45.389 104.318 1.00 0.00 H ATOM 1200 N ILE B 445 14.548 45.948 106.113 1.00 54.00 N ATOM 1201 CA ILE B 445 13.607 46.474 107.098 1.00 42.74 C ATOM 1202 C ILE B 445 13.213 47.909 106.757 1.00 45.84 C ATOM 1203 O ILE B 445 12.054 48.306 106.924 1.00 47.00 O ATOM 1204 CB ILE B 445 14.210 46.358 108.513 1.00 43.59 C ATOM 1205 CG1 ILE B 445 14.319 44.879 108.910 1.00 39.65 C ATOM 1206 CG2 ILE B 445 13.380 47.142 109.515 1.00 46.16 C ATOM 1207 CD1 ILE B 445 15.004 44.631 110.218 1.00 38.40 C ATOM 1208 H ILE B 445 15.538 45.782 106.385 1.00 0.00 H ATOM 1209 N GLY B 446 14.162 48.706 106.259 1.00 48.46 N ATOM 1210 CA GLY B 446 13.828 50.054 105.829 1.00 45.26 C ATOM 1211 C GLY B 446 12.861 50.071 104.662 1.00 52.11 C ATOM 1212 O GLY B 446 11.980 50.932 104.589 1.00 57.07 O ATOM 1213 H GLY B 446 15.140 48.362 106.179 1.00 0.00 H ATOM 1214 N GLN B 447 12.983 49.101 103.756 1.00 47.61 N ATOM 1215 CA GLN B 447 12.098 49.059 102.601 1.00 58.91 C ATOM 1216 C GLN B 447 10.675 48.670 102.969 1.00 55.65 C ATOM 1217 O GLN B 447 9.760 48.923 102.181 1.00 55.85 O ATOM 1218 CB GLN B 447 12.641 48.079 101.554 1.00 64.47 C ATOM 1219 CG GLN B 447 13.920 48.547 100.902 1.00 65.52 C ATOM 1220 CD GLN B 447 14.586 47.478 100.060 1.00 69.70 C ATOM 1221 OE1 GLN B 447 14.199 46.309 100.089 1.00 65.96 O ATOM 1222 NE2 GLN B 447 15.608 47.874 99.311 1.00 75.01 N ATOM 1223 HE22 GLN B 447 15.901 48.872 99.317 1.00 0.00 H ATOM 1224 HE21 GLN B 447 16.115 47.186 98.718 1.00 0.00 H ATOM 1225 H GLN B 447 13.714 48.371 103.875 1.00 0.00 H ATOM 1226 N GLN B 448 10.464 48.058 104.133 1.00 52.51 N ATOM 1227 CA GLN B 448 9.155 47.544 104.512 1.00 60.52 C ATOM 1228 C GLN B 448 8.432 48.438 105.513 1.00 64.26 C ATOM 1229 O GLN B 448 7.472 48.004 106.151 1.00 58.73 O ATOM 1230 CB GLN B 448 9.287 46.129 105.067 1.00 63.28 C ATOM 1231 CG GLN B 448 9.863 45.174 104.052 1.00 71.42 C ATOM 1232 CD GLN B 448 9.581 43.732 104.388 1.00 75.98 C ATOM 1233 OE1 GLN B 448 8.663 43.429 105.152 1.00 72.16 O ATOM 1234 NE2 GLN B 448 10.356 42.827 103.801 1.00 82.48 N ATOM 1235 HE22 GLN B 448 11.119 43.131 103.163 1.00 0.00 H ATOM 1236 HE21 GLN B 448 10.200 41.814 103.979 1.00 0.00 H ATOM 1237 H GLN B 448 11.260 47.943 104.793 1.00 0.00 H ATOM 1238 N GLY B 449 8.876 49.680 105.678 1.00 51.68 N ATOM 1239 CA GLY B 449 8.114 50.648 106.435 1.00 55.39 C ATOM 1240 C GLY B 449 8.774 51.159 107.695 1.00 51.68 C ATOM 1241 O GLY B 449 8.338 52.190 108.216 1.00 51.22 O ATOM 1242 H GLY B 449 9.785 49.960 105.256 1.00 0.00 H ATOM 1243 N LEU B 450 9.799 50.471 108.200 1.00 52.48 N ATOM 1244 CA LEU B 450 10.443 50.839 109.460 1.00 53.27 C ATOM 1245 C LEU B 450 9.434 50.828 110.609 1.00 52.13 C ATOM 1246 O LEU B 450 9.476 51.670 111.510 1.00 51.33 O ATOM 1247 CB LEU B 450 11.138 52.199 109.359 1.00 57.61 C ATOM 1248 CG LEU B 450 12.580 52.169 108.846 1.00 64.68 C ATOM 1249 CD1 LEU B 450 13.232 53.535 109.012 1.00 62.52 C ATOM 1250 CD2 LEU B 450 13.402 51.078 109.518 1.00 66.57 C ATOM 1251 H LEU B 450 10.153 49.643 107.679 1.00 0.00 H ATOM 1252 N VAL B 451 8.507 49.872 110.572 1.00 48.09 N ATOM 1253 CA VAL B 451 7.472 49.786 111.593 1.00 54.35 C ATOM 1254 C VAL B 451 8.056 49.128 112.837 1.00 56.77 C ATOM 1255 O VAL B 451 8.911 48.237 112.761 1.00 54.88 O ATOM 1256 CB VAL B 451 6.247 49.013 111.066 1.00 55.36 C ATOM 1257 H VAL B 451 8.523 49.175 109.800 1.00 0.00 H ATOM 1258 N ASP B 452 7.613 49.595 114.000 1.00 57.14 N ATOM 1259 CA ASP B 452 8.086 49.059 115.270 1.00 50.16 C ATOM 1260 C ASP B 452 7.705 47.594 115.395 1.00 42.48 C ATOM 1261 O ASP B 452 6.578 47.214 115.107 1.00 44.96 O ATOM 1262 CB ASP B 452 7.518 49.857 116.442 1.00 55.10 C ATOM 1263 CG ASP B 452 8.192 51.202 116.612 1.00 64.35 C ATOM 1264 OD1 ASP B 452 7.787 52.160 115.929 1.00 74.99 O ATOM 1265 OD2 ASP B 452 9.123 51.307 117.429 1.00 67.32 O ATOM 1266 H ASP B 452 6.911 50.362 114.004 1.00 0.00 H ATOM 1267 N GLY B 453 8.645 46.772 115.838 1.00 40.27 N ATOM 1268 CA GLY B 453 8.380 45.358 115.962 1.00 32.08 C ATOM 1269 C GLY B 453 8.642 44.559 114.706 1.00 31.90 C ATOM 1270 O GLY B 453 8.491 43.331 114.731 1.00 32.23 O ATOM 1271 H GLY B 453 9.579 47.147 116.098 1.00 0.00 H ATOM 1272 N LEU B 454 8.978 45.222 113.597 1.00 26.75 N ATOM 1273 CA LEU B 454 9.361 44.523 112.376 1.00 30.16 C ATOM 1274 C LEU B 454 10.726 43.863 112.587 1.00 31.05 C ATOM 1275 O LEU B 454 11.649 44.491 113.113 1.00 34.39 O ATOM 1276 CB LEU B 454 9.395 45.522 111.215 1.00 42.32 C ATOM 1277 CG LEU B 454 9.405 45.054 109.767 1.00 48.98 C ATOM 1278 CD1 LEU B 454 8.125 44.307 109.480 1.00 52.62 C ATOM 1279 CD2 LEU B 454 9.543 46.256 108.838 1.00 47.61 C ATOM 1280 H LEU B 454 8.966 46.262 113.604 1.00 0.00 H ATOM 1281 N PHE B 455 10.861 42.592 112.210 1.00 28.52 N ATOM 1282 CA PHE B 455 12.062 41.863 112.604 1.00 26.80 C ATOM 1283 C PHE B 455 12.370 40.733 111.633 1.00 28.41 C ATOM 1284 O PHE B 455 11.489 40.223 110.945 1.00 30.79 O ATOM 1285 CB PHE B 455 11.924 41.266 114.019 1.00 21.18 C ATOM 1286 CG PHE B 455 11.077 40.027 114.061 1.00 23.85 C ATOM 1287 CD1 PHE B 455 9.693 40.127 114.108 1.00 26.96 C ATOM 1288 CD2 PHE B 455 11.653 38.769 114.017 1.00 18.04 C ATOM 1289 CE1 PHE B 455 8.898 38.993 114.112 1.00 25.71 C ATOM 1290 CE2 PHE B 455 10.865 37.629 114.027 1.00 23.73 C ATOM 1291 CZ PHE B 455 9.483 37.740 114.078 1.00 22.10 C ATOM 1292 H PHE B 455 10.122 42.127 111.644 1.00 0.00 H ATOM 1293 N LEU B 456 13.627 40.287 111.668 1.00 26.61 N ATOM 1294 CA LEU B 456 14.035 39.053 111.017 1.00 28.76 C ATOM 1295 C LEU B 456 15.172 38.418 111.806 1.00 27.09 C ATOM 1296 O LEU B 456 15.836 39.068 112.615 1.00 28.58 O ATOM 1297 CB LEU B 456 14.465 39.290 109.553 1.00 24.16 C ATOM 1298 CG LEU B 456 15.521 40.367 109.332 1.00 25.41 C ATOM 1299 CD1 LEU B 456 16.936 39.825 109.526 1.00 25.30 C ATOM 1300 CD2 LEU B 456 15.371 40.935 107.924 1.00 32.12 C ATOM 1301 H LEU B 456 14.341 40.843 112.180 1.00 0.00 H ATOM 1302 N VAL B 457 15.414 37.144 111.524 1.00 24.21 N ATOM 1303 CA VAL B 457 16.528 36.400 112.097 1.00 26.86 C ATOM 1304 C VAL B 457 17.414 35.924 110.955 1.00 26.90 C ATOM 1305 O VAL B 457 16.917 35.459 109.928 1.00 30.37 O ATOM 1306 CB VAL B 457 16.038 35.213 112.953 1.00 25.83 C ATOM 1307 CG1 VAL B 457 17.211 34.404 113.470 1.00 25.50 C ATOM 1308 CG2 VAL B 457 15.164 35.715 114.123 1.00 21.62 C ATOM 1309 H VAL B 457 14.778 36.654 110.863 1.00 0.00 H ATOM 1310 N ARG B 458 18.724 36.055 111.130 1.00 26.56 N ATOM 1311 CA ARG B 458 19.685 35.694 110.099 1.00 30.89 C ATOM 1312 C ARG B 458 20.841 34.922 110.723 1.00 37.45 C ATOM 1313 O ARG B 458 21.082 34.989 111.933 1.00 26.97 O ATOM 1314 CB ARG B 458 20.186 36.946 109.366 1.00 30.27 C ATOM 1315 CG ARG B 458 20.654 38.049 110.293 1.00 32.76 C ATOM 1316 CD ARG B 458 20.853 39.357 109.555 1.00 33.57 C ATOM 1317 NE ARG B 458 21.158 40.462 110.459 1.00 31.96 N ATOM 1318 CZ ARG B 458 22.384 40.740 110.896 1.00 33.64 C ATOM 1319 NH1 ARG B 458 23.408 39.986 110.517 1.00 29.32 N ATOM 1320 NH2 ARG B 458 22.595 41.769 111.709 1.00 28.34 N ATOM 1321 HE ARG B 458 20.374 41.065 110.779 1.00 0.00 H ATOM 1322 HH12 ARG B 458 24.367 40.202 110.857 1.00 0.00 H ATOM 1323 HH11 ARG B 458 23.252 39.179 109.879 1.00 0.00 H ATOM 1324 HH22 ARG B 458 23.557 41.978 112.045 1.00 0.00 H ATOM 1325 HH21 ARG B 458 21.798 42.366 112.010 1.00 0.00 H ATOM 1326 H ARG B 458 19.075 36.428 112.035 1.00 0.00 H ATOM 1327 N GLU B 459 21.533 34.155 109.886 1.00 26.93 N ATOM 1328 CA GLU B 459 22.750 33.475 110.310 1.00 32.86 C ATOM 1329 C GLU B 459 23.906 34.457 110.428 1.00 29.54 C ATOM 1330 O GLU B 459 24.046 35.376 109.616 1.00 35.93 O ATOM 1331 CB GLU B 459 23.148 32.380 109.324 1.00 40.51 C ATOM 1332 CG GLU B 459 22.124 31.312 109.057 1.00 54.46 C ATOM 1333 CD GLU B 459 22.595 30.354 107.968 1.00 65.09 C ATOM 1334 OE1 GLU B 459 23.807 30.048 107.928 1.00 65.90 O ATOM 1335 OE2 GLU B 459 21.763 29.939 107.129 1.00 64.11 O ATOM 1336 H GLU B 459 21.199 34.038 108.908 1.00 0.00 H ATOM 1337 N SER B 460 24.726 34.263 111.459 1.00 39.64 N ATOM 1338 CA SER B 460 25.958 35.029 111.601 1.00 43.56 C ATOM 1339 C SER B 460 26.925 34.624 110.497 1.00 47.37 C ATOM 1340 O SER B 460 27.041 33.444 110.159 1.00 59.14 O ATOM 1341 CB SER B 460 26.605 34.794 112.964 1.00 44.86 C ATOM 1342 OG SER B 460 25.925 35.504 113.980 1.00 55.16 O ATOM 1343 HG SER B 460 26.365 35.334 114.851 1.00 0.00 H ATOM 1344 H SER B 460 24.483 33.551 112.177 1.00 0.00 H ATOM 1345 N GLN B 461 27.602 35.610 109.907 1.00 51.58 N ATOM 1346 CA GLN B 461 28.505 35.295 108.806 1.00 56.12 C ATOM 1347 C GLN B 461 29.747 34.539 109.259 1.00 54.50 C ATOM 1348 O GLN B 461 30.377 33.878 108.427 1.00 61.78 O ATOM 1349 CB GLN B 461 28.937 36.573 108.081 1.00 67.90 C ATOM 1350 CG GLN B 461 27.802 37.373 107.440 1.00 78.10 C ATOM 1351 CD GLN B 461 27.480 36.935 106.022 1.00 84.89 C ATOM 1352 OE1 GLN B 461 28.007 35.937 105.530 1.00 91.57 O ATOM 1353 NE2 GLN B 461 26.611 37.688 105.357 1.00 81.39 N ATOM 1354 HE22 GLN B 461 26.190 38.523 105.813 1.00 0.00 H ATOM 1355 HE21 GLN B 461 26.351 37.443 104.380 1.00 0.00 H ATOM 1356 H GLN B 461 27.487 36.592 110.228 1.00 0.00 H ATOM 1357 N ARG B 462 30.111 34.595 110.546 1.00 48.92 N ATOM 1358 CA ARG B 462 31.313 33.890 110.987 1.00 60.30 C ATOM 1359 C ARG B 462 31.171 33.106 112.290 1.00 83.73 C ATOM 1360 O ARG B 462 32.013 32.237 112.543 1.00 88.88 O ATOM 1361 CB ARG B 462 32.462 34.895 111.146 1.00 59.16 C ATOM 1362 CG ARG B 462 32.955 35.524 109.841 1.00 51.18 C ATOM 1363 CD ARG B 462 33.816 36.743 110.141 1.00 51.98 C ATOM 1364 NE ARG B 462 34.208 37.468 108.936 1.00 46.43 N ATOM 1365 CZ ARG B 462 35.313 37.206 108.247 1.00 49.11 C ATOM 1366 NH1 ARG B 462 36.129 36.238 108.648 1.00 49.99 N ATOM 1367 NH2 ARG B 462 35.606 37.910 107.162 1.00 42.35 N ATOM 1368 HE ARG B 462 33.588 38.232 108.598 1.00 0.00 H ATOM 1369 HH12 ARG B 462 36.995 36.031 108.110 1.00 0.00 H ATOM 1370 HH11 ARG B 462 35.902 35.687 109.500 1.00 0.00 H ATOM 1371 HH22 ARG B 462 36.472 37.702 106.625 1.00 0.00 H ATOM 1372 HH21 ARG B 462 34.970 38.670 106.848 1.00 0.00 H ATOM 1373 H ARG B 462 29.542 35.137 111.228 1.00 0.00 H ATOM 1374 N ASN B 463 30.142 33.339 113.107 1.00 90.07 N ATOM 1375 CA ASN B 463 29.975 32.581 114.353 1.00 92.99 C ATOM 1376 C ASN B 463 29.421 31.193 114.060 1.00 91.78 C ATOM 1377 O ASN B 463 28.368 31.075 113.421 1.00 92.87 O ATOM 1378 CB ASN B 463 29.049 33.292 115.344 1.00 97.49 C ATOM 1379 CG ASN B 463 29.649 34.568 115.912 1.00 98.05 C ATOM 1380 OD1 ASN B 463 30.268 34.558 116.978 1.00103.68 O ATOM 1381 ND2 ASN B 463 29.444 35.679 115.215 1.00 99.88 N ATOM 1382 HD22 ASN B 463 28.916 35.641 114.320 1.00 0.00 H ATOM 1383 HD21 ASN B 463 29.812 36.587 115.564 1.00 0.00 H ATOM 1384 H ASN B 463 29.446 34.070 112.857 1.00 0.00 H ATOM 1385 N PRO B 464 30.111 30.126 114.459 1.00 91.92 N ATOM 1386 CA PRO B 464 29.594 28.779 114.186 1.00 87.65 C ATOM 1387 C PRO B 464 28.259 28.583 114.887 1.00 78.11 C ATOM 1388 O PRO B 464 28.161 28.689 116.114 1.00 76.59 O ATOM 1389 CB PRO B 464 30.678 27.857 114.764 1.00 89.78 C ATOM 1390 CG PRO B 464 31.908 28.709 114.864 1.00 92.16 C ATOM 1391 CD PRO B 464 31.407 30.092 115.158 1.00 94.28 C ATOM 1392 N GLN B 465 27.214 28.349 114.091 1.00 63.73 N ATOM 1393 CA GLN B 465 25.871 28.078 114.600 1.00 55.52 C ATOM 1394 C GLN B 465 25.257 29.264 115.346 1.00 46.68 C ATOM 1395 O GLN B 465 24.348 29.073 116.156 1.00 40.01 O ATOM 1396 CB GLN B 465 25.848 26.829 115.490 1.00 50.92 C ATOM 1397 H GLN B 465 27.362 28.360 113.062 1.00 0.00 H ATOM 1398 N GLY B 466 25.725 30.499 115.108 1.00 50.59 N ATOM 1399 CA GLY B 466 25.162 31.655 115.768 1.00 47.21 C ATOM 1400 C GLY B 466 24.220 32.410 114.848 1.00 45.10 C ATOM 1401 O GLY B 466 24.238 32.237 113.633 1.00 33.27 O ATOM 1402 H GLY B 466 26.508 30.627 114.436 1.00 0.00 H ATOM 1403 N PHE B 467 23.365 33.241 115.449 1.00 20.83 N ATOM 1404 CA PHE B 467 22.343 33.954 114.693 1.00 18.78 C ATOM 1405 C PHE B 467 22.251 35.391 115.186 1.00 22.00 C ATOM 1406 O PHE B 467 22.821 35.759 116.217 1.00 26.59 O ATOM 1407 CB PHE B 467 20.992 33.217 114.779 1.00 17.54 C ATOM 1408 CG PHE B 467 21.052 31.790 114.272 1.00 23.03 C ATOM 1409 CD1 PHE B 467 20.695 31.484 112.966 1.00 28.87 C ATOM 1410 CD2 PHE B 467 21.501 30.764 115.091 1.00 26.50 C ATOM 1411 CE1 PHE B 467 20.767 30.180 112.492 1.00 25.08 C ATOM 1412 CE2 PHE B 467 21.582 29.462 114.626 1.00 27.38 C ATOM 1413 CZ PHE B 467 21.208 29.168 113.317 1.00 25.57 C ATOM 1414 H PHE B 467 23.430 33.382 116.477 1.00 0.00 H ATOM 1415 N VAL B 468 21.573 36.224 114.405 1.00 19.82 N ATOM 1416 CA VAL B 468 21.377 37.622 114.752 1.00 23.31 C ATOM 1417 C VAL B 468 19.905 37.947 114.568 1.00 31.39 C ATOM 1418 O VAL B 468 19.317 37.614 113.535 1.00 32.37 O ATOM 1419 CB VAL B 468 22.248 38.577 113.914 1.00 28.89 C ATOM 1420 CG1 VAL B 468 22.059 39.994 114.424 1.00 29.68 C ATOM 1421 CG2 VAL B 468 23.724 38.177 113.966 1.00 24.88 C ATOM 1422 H VAL B 468 21.169 35.865 113.516 1.00 0.00 H ATOM 1423 N LEU B 469 19.307 38.556 115.588 1.00 20.37 N ATOM 1424 CA LEU B 469 17.954 39.096 115.516 1.00 23.88 C ATOM 1425 C LEU B 469 18.033 40.576 115.161 1.00 22.13 C ATOM 1426 O LEU B 469 18.602 41.367 115.922 1.00 31.06 O ATOM 1427 CB LEU B 469 17.219 38.907 116.849 1.00 22.09 C ATOM 1428 CG LEU B 469 15.918 39.687 117.071 1.00 24.82 C ATOM 1429 CD1 LEU B 469 14.836 39.140 116.193 1.00 22.24 C ATOM 1430 CD2 LEU B 469 15.468 39.599 118.544 1.00 20.13 C ATOM 1431 H LEU B 469 19.830 38.652 116.482 1.00 0.00 H ATOM 1432 N SER B 470 17.488 40.943 114.007 1.00 22.43 N ATOM 1433 CA SER B 470 17.443 42.335 113.565 1.00 27.92 C ATOM 1434 C SER B 470 16.040 42.872 113.789 1.00 29.06 C ATOM 1435 O SER B 470 15.063 42.273 113.338 1.00 30.20 O ATOM 1436 CB SER B 470 17.838 42.482 112.092 1.00 26.13 C ATOM 1437 OG SER B 470 19.165 42.037 111.872 1.00 36.62 O ATOM 1438 HG SER B 470 19.788 42.575 112.422 1.00 0.00 H ATOM 1439 H SER B 470 17.077 40.211 113.394 1.00 0.00 H ATOM 1440 N LEU B 471 15.945 43.993 114.494 1.00 31.03 N ATOM 1441 CA LEU B 471 14.659 44.451 114.998 1.00 32.50 C ATOM 1442 C LEU B 471 14.541 45.960 114.850 1.00 34.62 C ATOM 1443 O LEU B 471 15.482 46.699 115.157 1.00 34.45 O ATOM 1444 CB LEU B 471 14.502 44.028 116.467 1.00 31.11 C ATOM 1445 CG LEU B 471 13.350 44.596 117.272 1.00 32.51 C ATOM 1446 CD1 LEU B 471 12.044 44.221 116.607 1.00 38.19 C ATOM 1447 CD2 LEU B 471 13.430 44.001 118.667 1.00 28.73 C ATOM 1448 H LEU B 471 16.801 44.551 114.689 1.00 0.00 H ATOM 1449 N CYS B 472 13.378 46.415 114.412 1.00 32.74 N ATOM 1450 CA CYS B 472 13.130 47.837 114.235 1.00 30.85 C ATOM 1451 C CYS B 472 12.343 48.398 115.412 1.00 37.14 C ATOM 1452 O CYS B 472 11.288 47.864 115.777 1.00 43.24 O ATOM 1453 CB CYS B 472 12.376 48.098 112.933 1.00 45.40 C ATOM 1454 SG CYS B 472 12.040 49.835 112.646 1.00 54.89 S ATOM 1455 H CYS B 472 12.621 45.738 114.188 1.00 0.00 H ATOM 1456 N HIS B 473 12.850 49.485 115.987 1.00 34.43 N ATOM 1457 CA HIS B 473 12.179 50.156 117.091 1.00 37.79 C ATOM 1458 C HIS B 473 12.538 51.631 117.041 1.00 34.85 C ATOM 1459 O HIS B 473 13.723 51.971 117.003 1.00 41.85 O ATOM 1460 CB HIS B 473 12.585 49.551 118.438 1.00 35.76 C ATOM 1461 CG HIS B 473 11.872 50.155 119.606 1.00 41.50 C ATOM 1462 ND1 HIS B 473 12.531 50.737 120.666 1.00 42.41 N ATOM 1463 CD2 HIS B 473 10.550 50.265 119.879 1.00 41.60 C ATOM 1464 CE1 HIS B 473 11.647 51.172 121.546 1.00 42.58 C ATOM 1465 NE2 HIS B 473 10.437 50.900 121.090 1.00 40.73 N ATOM 1466 H HIS B 473 13.752 49.867 115.638 1.00 0.00 H ATOM 1467 N LEU B 474 11.521 52.493 117.035 1.00 41.78 N ATOM 1468 CA LEU B 474 11.710 53.944 116.953 1.00 46.95 C ATOM 1469 C LEU B 474 12.561 54.313 115.739 1.00 46.12 C ATOM 1470 O LEU B 474 13.542 55.056 115.828 1.00 50.64 O ATOM 1471 CB LEU B 474 12.302 54.512 118.245 1.00 42.82 C ATOM 1472 CG LEU B 474 11.490 54.268 119.517 1.00 48.32 C ATOM 1473 CD1 LEU B 474 12.187 54.882 120.717 1.00 48.87 C ATOM 1474 CD2 LEU B 474 10.083 54.824 119.365 1.00 46.70 C ATOM 1475 H LEU B 474 10.552 52.120 117.091 1.00 0.00 H ATOM 1476 N GLN B 475 12.182 53.746 114.595 1.00 50.23 N ATOM 1477 CA GLN B 475 12.795 54.002 113.294 1.00 60.78 C ATOM 1478 C GLN B 475 14.282 53.677 113.269 1.00 57.79 C ATOM 1479 O GLN B 475 14.982 54.074 112.336 1.00 62.90 O ATOM 1480 CB GLN B 475 12.614 55.469 112.885 1.00 69.40 C ATOM 1481 CG GLN B 475 11.286 56.102 113.266 1.00 74.51 C ATOM 1482 CD GLN B 475 10.101 55.264 112.858 1.00 84.18 C ATOM 1483 OE1 GLN B 475 9.869 55.033 111.672 1.00 88.31 O ATOM 1484 NE2 GLN B 475 9.335 54.804 113.841 1.00 92.92 N ATOM 1485 HE22 GLN B 475 9.570 55.025 114.830 1.00 0.00 H ATOM 1486 HE21 GLN B 475 8.501 54.223 113.622 1.00 0.00 H ATOM 1487 H GLN B 475 11.391 53.071 114.631 1.00 0.00 H ATOM 1488 N LYS B 476 14.745 52.835 114.178 1.00 56.56 N ATOM 1489 CA LYS B 476 16.150 52.473 114.244 1.00 45.97 C ATOM 1490 C LYS B 476 16.220 50.962 114.308 1.00 40.81 C ATOM 1491 O LYS B 476 15.416 50.320 114.990 1.00 47.16 O ATOM 1492 CB LYS B 476 16.848 53.088 115.465 1.00 44.24 C ATOM 1493 H LYS B 476 14.084 52.420 114.865 1.00 0.00 H ATOM 1494 N VAL B 477 17.145 50.397 113.554 1.00 34.85 N ATOM 1495 CA VAL B 477 17.292 48.957 113.474 1.00 36.31 C ATOM 1496 C VAL B 477 18.405 48.559 114.423 1.00 41.80 C ATOM 1497 O VAL B 477 19.505 49.122 114.375 1.00 37.51 O ATOM 1498 CB VAL B 477 17.565 48.498 112.037 1.00 36.63 C ATOM 1499 CG1 VAL B 477 17.749 46.997 111.998 1.00 37.19 C ATOM 1500 CG2 VAL B 477 16.402 48.905 111.150 1.00 40.01 C ATOM 1501 H VAL B 477 17.786 51.002 113.002 1.00 0.00 H ATOM 1502 N LYS B 478 18.103 47.621 115.311 1.00 38.85 N ATOM 1503 CA LYS B 478 19.062 47.119 116.276 1.00 35.93 C ATOM 1504 C LYS B 478 19.342 45.645 115.999 1.00 36.31 C ATOM 1505 O LYS B 478 18.578 44.960 115.315 1.00 35.44 O ATOM 1506 CB LYS B 478 18.525 47.321 117.695 1.00 33.65 C ATOM 1507 CG LYS B 478 18.137 48.771 117.978 1.00 46.45 C ATOM 1508 CD LYS B 478 19.002 49.438 119.031 1.00 58.87 C ATOM 1509 CE LYS B 478 18.469 50.823 119.342 1.00 65.25 C ATOM 1510 NZ LYS B 478 16.982 50.842 119.201 1.00 70.43 N ATOM 1511 HZ1 LYS B 478 16.724 50.586 118.226 1.00 0.00 H ATOM 1512 HZ2 LYS B 478 16.563 50.157 119.863 1.00 0.00 H ATOM 1513 HZ3 LYS B 478 16.627 51.795 119.416 1.00 0.00 H ATOM 1514 H LYS B 478 17.139 47.230 115.315 1.00 0.00 H ATOM 1515 N HIS B 479 20.474 45.163 116.497 1.00 33.40 N ATOM 1516 CA HIS B 479 20.891 43.804 116.186 1.00 37.96 C ATOM 1517 C HIS B 479 21.315 43.089 117.459 1.00 33.79 C ATOM 1518 O HIS B 479 22.171 43.586 118.199 1.00 28.28 O ATOM 1519 CB HIS B 479 22.015 43.803 115.146 1.00 35.06 C ATOM 1520 CG HIS B 479 21.685 44.601 113.921 1.00 32.85 C ATOM 1521 ND1 HIS B 479 21.013 44.064 112.844 1.00 27.89 N ATOM 1522 CD2 HIS B 479 21.906 45.903 113.616 1.00 27.69 C ATOM 1523 CE1 HIS B 479 20.843 44.997 111.924 1.00 29.39 C ATOM 1524 NE2 HIS B 479 21.376 46.122 112.368 1.00 31.13 N ATOM 1525 H HIS B 479 21.065 45.759 117.112 1.00 0.00 H ATOM 1526 N TYR B 480 20.740 41.907 117.687 1.00 24.81 N ATOM 1527 CA TYR B 480 20.942 41.160 118.921 1.00 23.10 C ATOM 1528 C TYR B 480 21.568 39.822 118.574 1.00 26.10 C ATOM 1529 O TYR B 480 20.986 39.023 117.835 1.00 21.91 O ATOM 1530 CB TYR B 480 19.620 40.986 119.682 1.00 20.33 C ATOM 1531 CG TYR B 480 18.997 42.329 119.951 1.00 22.26 C ATOM 1532 CD1 TYR B 480 18.176 42.931 119.009 1.00 23.46 C ATOM 1533 CD2 TYR B 480 19.306 43.037 121.099 1.00 26.11 C ATOM 1534 CE1 TYR B 480 17.645 44.184 119.219 1.00 29.32 C ATOM 1535 CE2 TYR B 480 18.771 44.294 121.327 1.00 24.72 C ATOM 1536 CZ TYR B 480 17.942 44.861 120.380 1.00 31.63 C ATOM 1537 OH TYR B 480 17.411 46.108 120.590 1.00 36.10 O ATOM 1538 HH TYR B 480 18.145 46.765 120.690 1.00 0.00 H ATOM 1539 H TYR B 480 20.123 41.503 116.954 1.00 0.00 H ATOM 1540 N LEU B 481 22.751 39.585 119.115 1.00 21.83 N ATOM 1541 CA LEU B 481 23.453 38.353 118.822 1.00 25.81 C ATOM 1542 C LEU B 481 22.838 37.207 119.615 1.00 29.06 C ATOM 1543 O LEU B 481 22.559 37.341 120.810 1.00 23.12 O ATOM 1544 CB LEU B 481 24.925 38.518 119.167 1.00 26.84 C ATOM 1545 CG LEU B 481 25.822 37.328 118.904 1.00 23.17 C ATOM 1546 CD1 LEU B 481 25.856 37.043 117.391 1.00 23.87 C ATOM 1547 CD2 LEU B 481 27.200 37.650 119.456 1.00 23.48 C ATOM 1548 H LEU B 481 23.179 40.286 119.753 1.00 0.00 H ATOM 1549 N ILE B 482 22.584 36.095 118.928 1.00 21.44 N ATOM 1550 CA ILE B 482 22.093 34.859 119.532 1.00 23.90 C ATOM 1551 C ILE B 482 23.193 33.813 119.403 1.00 25.70 C ATOM 1552 O ILE B 482 23.579 33.449 118.286 1.00 28.62 O ATOM 1553 CB ILE B 482 20.802 34.364 118.866 1.00 18.25 C ATOM 1554 CG1 ILE B 482 19.715 35.437 118.903 1.00 19.99 C ATOM 1555 CG2 ILE B 482 20.343 33.045 119.485 1.00 19.84 C ATOM 1556 CD1 ILE B 482 18.568 35.152 117.933 1.00 27.79 C ATOM 1557 H ILE B 482 22.745 36.107 117.901 1.00 0.00 H ATOM 1558 N LEU B 483 23.672 33.309 120.540 1.00 25.80 N ATOM 1559 CA LEU B 483 24.785 32.377 120.563 1.00 20.12 C ATOM 1560 C LEU B 483 24.352 31.023 121.110 1.00 28.57 C ATOM 1561 O LEU B 483 23.522 30.948 122.025 1.00 28.02 O ATOM 1562 CB LEU B 483 25.933 32.918 121.426 1.00 29.98 C ATOM 1563 CG LEU B 483 26.704 34.123 120.866 1.00 29.97 C ATOM 1564 CD1 LEU B 483 27.808 34.545 121.817 1.00 33.28 C ATOM 1565 CD2 LEU B 483 27.247 33.864 119.460 1.00 23.50 C ATOM 1566 H LEU B 483 23.234 33.592 121.440 1.00 0.00 H ATOM 1567 N PRO B 484 24.905 29.940 120.579 1.00 29.37 N ATOM 1568 CA PRO B 484 24.629 28.616 121.139 1.00 30.42 C ATOM 1569 C PRO B 484 25.510 28.327 122.344 1.00 33.32 C ATOM 1570 O PRO B 484 26.589 28.893 122.518 1.00 34.34 O ATOM 1571 CB PRO B 484 24.958 27.671 119.976 1.00 35.25 C ATOM 1572 CG PRO B 484 26.056 28.398 119.218 1.00 32.73 C ATOM 1573 CD PRO B 484 25.754 29.878 119.369 1.00 35.23 C ATOM 1574 N SER B 485 25.015 27.437 123.196 1.00 30.76 N ATOM 1575 CA SER B 485 25.774 27.010 124.362 1.00 42.12 C ATOM 1576 C SER B 485 25.274 25.632 124.757 1.00 44.01 C ATOM 1577 O SER B 485 24.199 25.201 124.338 1.00 45.11 O ATOM 1578 CB SER B 485 25.644 28.003 125.521 1.00 52.48 C ATOM 1579 OG SER B 485 26.306 27.520 126.676 1.00 64.66 O ATOM 1580 HG SER B 485 26.208 28.177 127.410 1.00 0.00 H ATOM 1581 H SER B 485 24.069 27.038 123.027 1.00 0.00 H ATOM 1582 N GLU B 486 26.067 24.933 125.556 1.00 57.01 N ATOM 1583 CA GLU B 486 25.717 23.582 125.969 1.00 70.99 C ATOM 1584 C GLU B 486 25.711 23.531 127.486 1.00 76.93 C ATOM 1585 O GLU B 486 26.683 23.941 128.129 1.00 74.01 O ATOM 1586 CB GLU B 486 26.676 22.539 125.386 1.00 64.08 C ATOM 1587 H GLU B 486 26.955 25.357 125.894 1.00 0.00 H ATOM 1588 N GLU B 487 24.643 22.974 128.041 1.00 83.46 N ATOM 1589 CA GLU B 487 24.501 22.771 129.475 1.00 93.08 C ATOM 1590 C GLU B 487 24.402 21.268 129.651 1.00100.20 C ATOM 1591 O GLU B 487 23.435 20.646 129.197 1.00104.85 O ATOM 1592 CB GLU B 487 23.265 23.480 130.027 1.00 91.85 C ATOM 1593 H GLU B 487 23.868 22.667 127.420 1.00 0.00 H ATOM 1594 N GLU B 488 25.437 20.685 130.255 1.00102.98 N ATOM 1595 CA GLU B 488 25.667 19.239 130.240 1.00103.76 C ATOM 1596 C GLU B 488 25.766 18.829 128.774 1.00101.53 C ATOM 1597 O GLU B 488 26.686 19.300 128.083 1.00100.33 O ATOM 1598 CB GLU B 488 24.587 18.536 131.069 1.00106.43 C ATOM 1599 H GLU B 488 26.116 21.288 130.763 1.00 0.00 H ATOM 1600 N GLY B 489 24.870 17.992 128.256 1.00 98.48 N ATOM 1601 CA GLY B 489 24.891 17.608 126.861 1.00 94.30 C ATOM 1602 C GLY B 489 23.805 18.228 126.004 1.00 88.15 C ATOM 1603 O GLY B 489 23.699 17.889 124.831 1.00 88.01 O ATOM 1604 H GLY B 489 24.131 17.601 128.874 1.00 0.00 H ATOM 1605 N ARG B 490 22.995 19.124 126.568 1.00 77.53 N ATOM 1606 CA ARG B 490 21.884 19.753 125.866 1.00 70.18 C ATOM 1607 C ARG B 490 22.272 21.141 125.369 1.00 59.69 C ATOM 1608 O ARG B 490 22.829 21.948 126.120 1.00 55.76 O ATOM 1609 CB ARG B 490 20.655 19.848 126.773 1.00 72.75 C ATOM 1610 H ARG B 490 23.165 19.387 127.560 1.00 0.00 H ATOM 1611 N LEU B 491 21.983 21.405 124.102 1.00 53.91 N ATOM 1612 CA LEU B 491 22.252 22.698 123.497 1.00 50.07 C ATOM 1613 C LEU B 491 21.104 23.665 123.789 1.00 42.68 C ATOM 1614 O LEU B 491 19.952 23.259 123.959 1.00 42.78 O ATOM 1615 CB LEU B 491 22.427 22.535 121.987 1.00 52.46 C ATOM 1616 CG LEU B 491 22.334 23.767 121.087 1.00 57.15 C ATOM 1617 CD1 LEU B 491 23.654 24.525 121.084 1.00 57.77 C ATOM 1618 CD2 LEU B 491 21.919 23.379 119.676 1.00 55.22 C ATOM 1619 H LEU B 491 21.548 20.660 123.521 1.00 0.00 H ATOM 1620 N TYR B 492 21.435 24.953 123.883 1.00 34.99 N ATOM 1621 CA TYR B 492 20.415 25.985 124.005 1.00 33.56 C ATOM 1622 C TYR B 492 20.956 27.254 123.366 1.00 32.96 C ATOM 1623 O TYR B 492 22.167 27.428 123.220 1.00 30.76 O ATOM 1624 CB TYR B 492 20.012 26.257 125.468 1.00 26.62 C ATOM 1625 CG TYR B 492 21.108 26.866 126.330 1.00 28.15 C ATOM 1626 CD1 TYR B 492 21.329 28.242 126.341 1.00 21.22 C ATOM 1627 CD2 TYR B 492 21.914 26.065 127.146 1.00 33.06 C ATOM 1628 CE1 TYR B 492 22.328 28.807 127.123 1.00 29.32 C ATOM 1629 CE2 TYR B 492 22.917 26.624 127.940 1.00 29.47 C ATOM 1630 CZ TYR B 492 23.111 27.996 127.929 1.00 33.41 C ATOM 1631 OH TYR B 492 24.092 28.572 128.705 1.00 38.92 O ATOM 1632 HH TYR B 492 24.975 28.208 128.443 1.00 0.00 H ATOM 1633 H TYR B 492 22.439 25.225 123.869 1.00 0.00 H ATOM 1634 N PHE B 493 20.041 28.148 123.006 1.00 24.85 N ATOM 1635 CA PHE B 493 20.373 29.449 122.451 1.00 20.77 C ATOM 1636 C PHE B 493 20.018 30.547 123.440 1.00 26.48 C ATOM 1637 O PHE B 493 19.031 30.450 124.177 1.00 24.23 O ATOM 1638 CB PHE B 493 19.621 29.698 121.144 1.00 21.60 C ATOM 1639 CG PHE B 493 20.005 28.770 120.035 1.00 30.25 C ATOM 1640 CD1 PHE B 493 21.151 28.994 119.280 1.00 31.25 C ATOM 1641 CD2 PHE B 493 19.220 27.666 119.746 1.00 30.77 C ATOM 1642 CE1 PHE B 493 21.500 28.129 118.242 1.00 27.40 C ATOM 1643 CE2 PHE B 493 19.555 26.803 118.714 1.00 38.58 C ATOM 1644 CZ PHE B 493 20.702 27.034 117.961 1.00 25.65 C ATOM 1645 H PHE B 493 19.037 27.904 123.128 1.00 0.00 H ATOM 1646 N SER B 494 20.793 31.624 123.405 1.00 19.57 N ATOM 1647 CA SER B 494 20.574 32.705 124.346 1.00 25.78 C ATOM 1648 C SER B 494 21.123 33.993 123.763 1.00 28.36 C ATOM 1649 O SER B 494 22.123 33.989 123.044 1.00 22.51 O ATOM 1650 CB SER B 494 21.240 32.405 125.700 1.00 22.62 C ATOM 1651 OG SER B 494 21.149 33.515 126.570 1.00 35.09 O ATOM 1652 HG SER B 494 20.196 33.733 126.727 1.00 0.00 H ATOM 1653 H SER B 494 21.557 31.692 122.703 1.00 0.00 H ATOM 1654 N MET B 495 20.475 35.095 124.121 1.00 26.17 N ATOM 1655 CA MET B 495 20.945 36.436 123.818 1.00 24.41 C ATOM 1656 C MET B 495 21.597 37.104 125.023 1.00 24.55 C ATOM 1657 O MET B 495 22.013 38.262 124.929 1.00 26.09 O ATOM 1658 CB MET B 495 19.777 37.294 123.334 1.00 22.50 C ATOM 1659 CG MET B 495 19.114 36.754 122.093 1.00 28.93 C ATOM 1660 SD MET B 495 17.813 37.821 121.493 1.00 34.30 S ATOM 1661 CE MET B 495 16.589 37.674 122.806 1.00 32.35 C ATOM 1662 H MET B 495 19.583 34.993 124.646 1.00 0.00 H ATOM 1663 N ASP B 496 21.651 36.422 126.167 1.00 24.89 N ATOM 1664 CA ASP B 496 22.113 37.079 127.385 1.00 27.54 C ATOM 1665 C ASP B 496 23.026 36.181 128.209 1.00 31.10 C ATOM 1666 O ASP B 496 23.004 36.239 129.445 1.00 29.62 O ATOM 1667 CB ASP B 496 20.925 37.540 128.229 1.00 30.18 C ATOM 1668 CG ASP B 496 19.940 36.418 128.527 1.00 37.66 C ATOM 1669 OD1 ASP B 496 20.296 35.230 128.342 1.00 32.06 O ATOM 1670 OD2 ASP B 496 18.812 36.727 128.977 1.00 40.62 O ATOM 1671 H ASP B 496 21.364 35.423 126.191 1.00 0.00 H ATOM 1672 N ASP B 497 23.845 35.368 127.547 1.00 30.14 N ATOM 1673 CA ASP B 497 24.810 34.492 128.208 1.00 39.20 C ATOM 1674 C ASP B 497 24.133 33.500 129.144 1.00 36.54 C ATOM 1675 O ASP B 497 24.665 33.181 130.207 1.00 31.36 O ATOM 1676 CB ASP B 497 25.869 35.292 128.976 1.00 50.24 C ATOM 1677 CG ASP B 497 27.104 35.589 128.142 1.00 64.00 C ATOM 1678 OD1 ASP B 497 27.396 34.822 127.199 1.00 65.98 O ATOM 1679 OD2 ASP B 497 27.797 36.582 128.450 1.00 67.88 O ATOM 1680 H ASP B 497 23.796 35.355 126.508 1.00 0.00 H ATOM 1681 N GLY B 498 22.992 32.953 128.736 1.00 27.77 N ATOM 1682 CA GLY B 498 22.359 31.912 129.512 1.00 24.00 C ATOM 1683 C GLY B 498 21.402 32.370 130.593 1.00 22.91 C ATOM 1684 O GLY B 498 20.924 31.531 131.361 1.00 24.96 O ATOM 1685 H GLY B 498 22.552 33.277 127.851 1.00 0.00 H ATOM 1686 N GLN B 499 21.134 33.671 130.709 1.00 23.56 N ATOM 1687 CA GLN B 499 20.099 34.108 131.641 1.00 30.00 C ATOM 1688 C GLN B 499 18.735 33.598 131.201 1.00 32.33 C ATOM 1689 O GLN B 499 17.936 33.145 132.025 1.00 31.23 O ATOM 1690 CB GLN B 499 20.086 35.633 131.733 1.00 33.33 C ATOM 1691 CG GLN B 499 21.291 36.239 132.429 1.00 40.86 C ATOM 1692 CD GLN B 499 21.271 37.760 132.428 1.00 45.47 C ATOM 1693 OE1 GLN B 499 20.223 38.396 132.265 1.00 40.73 O ATOM 1694 NE2 GLN B 499 22.440 38.349 132.596 1.00 45.37 N ATOM 1695 HE22 GLN B 499 23.297 37.775 132.730 1.00 0.00 H ATOM 1696 HE21 GLN B 499 22.504 39.387 132.595 1.00 0.00 H ATOM 1697 H GLN B 499 21.657 34.368 130.141 1.00 0.00 H ATOM 1698 N THR B 500 18.460 33.648 129.900 1.00 26.63 N ATOM 1699 CA THR B 500 17.225 33.141 129.319 1.00 26.59 C ATOM 1700 C THR B 500 17.596 32.207 128.183 1.00 29.17 C ATOM 1701 O THR B 500 18.273 32.625 127.234 1.00 28.87 O ATOM 1702 CB THR B 500 16.342 34.289 128.807 1.00 36.98 C ATOM 1703 OG1 THR B 500 16.389 35.385 129.734 1.00 34.38 O ATOM 1704 CG2 THR B 500 14.894 33.820 128.623 1.00 32.00 C ATOM 1705 HG1 THR B 500 15.819 36.122 129.400 1.00 0.00 H ATOM 1706 H THR B 500 19.165 34.072 129.264 1.00 0.00 H ATOM 1707 N ARG B 501 17.157 30.958 128.271 1.00 22.22 N ATOM 1708 CA ARG B 501 17.622 29.918 127.370 1.00 26.80 C ATOM 1709 C ARG B 501 16.458 29.342 126.578 1.00 25.75 C ATOM 1710 O ARG B 501 15.336 29.236 127.076 1.00 24.83 O ATOM 1711 CB ARG B 501 18.342 28.813 128.147 1.00 23.28 C ATOM 1712 CG ARG B 501 19.359 29.373 129.133 1.00 31.80 C ATOM 1713 CD ARG B 501 20.027 28.288 129.964 1.00 34.63 C ATOM 1714 NE ARG B 501 21.063 28.846 130.831 1.00 36.62 N ATOM 1715 CZ ARG B 501 21.934 28.114 131.517 1.00 33.60 C ATOM 1716 NH1 ARG B 501 21.891 26.789 131.426 1.00 26.67 N ATOM 1717 NH2 ARG B 501 22.847 28.704 132.289 1.00 26.38 N ATOM 1718 HE ARG B 501 21.122 29.881 130.916 1.00 0.00 H ATOM 1719 HH12 ARG B 501 22.569 26.209 131.960 1.00 0.00 H ATOM 1720 HH11 ARG B 501 21.179 26.332 130.821 1.00 0.00 H ATOM 1721 HH22 ARG B 501 23.527 28.127 132.824 1.00 0.00 H ATOM 1722 HH21 ARG B 501 22.879 29.741 132.356 1.00 0.00 H ATOM 1723 H ARG B 501 16.461 30.717 129.005 1.00 0.00 H ATOM 1724 N PHE B 502 16.739 28.973 125.335 1.00 19.70 N ATOM 1725 CA PHE B 502 15.733 28.422 124.443 1.00 21.25 C ATOM 1726 C PHE B 502 16.323 27.217 123.736 1.00 22.99 C ATOM 1727 O PHE B 502 17.520 27.187 123.449 1.00 26.88 O ATOM 1728 CB PHE B 502 15.271 29.483 123.436 1.00 25.44 C ATOM 1729 CG PHE B 502 14.748 30.712 124.089 1.00 19.38 C ATOM 1730 CD1 PHE B 502 13.424 30.780 124.486 1.00 17.33 C ATOM 1731 CD2 PHE B 502 15.589 31.776 124.365 1.00 20.39 C ATOM 1732 CE1 PHE B 502 12.932 31.912 125.126 1.00 21.27 C ATOM 1733 CE2 PHE B 502 15.111 32.911 125.006 1.00 18.56 C ATOM 1734 CZ PHE B 502 13.773 32.982 125.379 1.00 16.87 C ATOM 1735 H PHE B 502 17.713 29.082 124.987 1.00 0.00 H ATOM 1736 N THR B 503 15.483 26.207 123.488 1.00 20.49 N ATOM 1737 CA THR B 503 15.972 25.010 122.806 1.00 23.80 C ATOM 1738 C THR B 503 16.250 25.274 121.328 1.00 28.34 C ATOM 1739 O THR B 503 17.126 24.629 120.741 1.00 31.71 O ATOM 1740 CB THR B 503 14.965 23.864 122.918 1.00 28.17 C ATOM 1741 OG1 THR B 503 13.763 24.243 122.239 1.00 38.45 O ATOM 1742 CG2 THR B 503 14.653 23.540 124.362 1.00 34.52 C ATOM 1743 HG1 THR B 503 13.966 24.422 121.287 1.00 0.00 H ATOM 1744 H THR B 503 14.487 26.273 123.779 1.00 0.00 H ATOM 1745 N ASP B 504 15.501 26.180 120.706 1.00 26.51 N ATOM 1746 CA ASP B 504 15.684 26.489 119.295 1.00 28.06 C ATOM 1747 C ASP B 504 15.259 27.932 119.062 1.00 31.31 C ATOM 1748 O ASP B 504 14.705 28.588 119.949 1.00 25.13 O ATOM 1749 CB ASP B 504 14.897 25.527 118.393 1.00 25.78 C ATOM 1750 CG ASP B 504 13.438 25.410 118.787 1.00 34.54 C ATOM 1751 OD1 ASP B 504 12.707 26.410 118.649 1.00 38.56 O ATOM 1752 OD2 ASP B 504 13.020 24.323 119.237 1.00 42.56 O ATOM 1753 H ASP B 504 14.764 26.682 121.242 1.00 0.00 H ATOM 1754 N LEU B 505 15.508 28.417 117.842 1.00 27.90 N ATOM 1755 CA LEU B 505 15.188 29.803 117.502 1.00 23.93 C ATOM 1756 C LEU B 505 13.689 30.051 117.477 1.00 19.65 C ATOM 1757 O LEU B 505 13.245 31.185 117.699 1.00 26.52 O ATOM 1758 CB LEU B 505 15.795 30.181 116.144 1.00 16.61 C ATOM 1759 CG LEU B 505 17.314 30.147 116.081 1.00 23.61 C ATOM 1760 CD1 LEU B 505 17.800 30.536 114.683 1.00 33.80 C ATOM 1761 CD2 LEU B 505 17.867 31.077 117.140 1.00 24.03 C ATOM 1762 H LEU B 505 15.936 27.799 117.123 1.00 0.00 H ATOM 1763 N LEU B 506 12.903 29.030 117.137 1.00 25.61 N ATOM 1764 CA LEU B 506 11.454 29.189 117.121 1.00 21.54 C ATOM 1765 C LEU B 506 10.931 29.496 118.518 1.00 25.70 C ATOM 1766 O LEU B 506 10.121 30.411 118.705 1.00 21.94 O ATOM 1767 CB LEU B 506 10.803 27.930 116.555 1.00 27.14 C ATOM 1768 CG LEU B 506 9.280 27.922 116.447 1.00 41.12 C ATOM 1769 CD1 LEU B 506 8.767 29.181 115.755 1.00 38.64 C ATOM 1770 CD2 LEU B 506 8.843 26.675 115.694 1.00 53.44 C ATOM 1771 H LEU B 506 13.326 28.115 116.882 1.00 0.00 H ATOM 1772 N GLN B 507 11.415 28.755 119.520 1.00 28.08 N ATOM 1773 CA GLN B 507 10.993 29.024 120.888 1.00 25.87 C ATOM 1774 C GLN B 507 11.420 30.418 121.318 1.00 23.99 C ATOM 1775 O GLN B 507 10.654 31.130 121.974 1.00 21.11 O ATOM 1776 CB GLN B 507 11.554 27.974 121.848 1.00 25.92 C ATOM 1777 CG GLN B 507 10.955 28.098 123.244 1.00 27.72 C ATOM 1778 CD GLN B 507 11.623 27.223 124.292 1.00 29.04 C ATOM 1779 OE1 GLN B 507 12.778 26.818 124.151 1.00 29.22 O ATOM 1780 NE2 GLN B 507 10.887 26.934 125.362 1.00 35.09 N ATOM 1781 HE22 GLN B 507 9.916 27.298 125.439 1.00 0.00 H ATOM 1782 HE21 GLN B 507 11.283 26.344 126.122 1.00 0.00 H ATOM 1783 H GLN B 507 12.091 27.989 119.323 1.00 0.00 H ATOM 1784 N LEU B 508 12.628 30.843 120.925 1.00 24.93 N ATOM 1785 CA LEU B 508 13.079 32.191 121.258 1.00 22.05 C ATOM 1786 C LEU B 508 12.178 33.246 120.625 1.00 26.02 C ATOM 1787 O LEU B 508 11.794 34.230 121.274 1.00 24.56 O ATOM 1788 CB LEU B 508 14.526 32.386 120.804 1.00 22.41 C ATOM 1789 CG LEU B 508 15.246 33.704 121.131 1.00 28.90 C ATOM 1790 CD1 LEU B 508 16.755 33.465 121.218 1.00 31.19 C ATOM 1791 CD2 LEU B 508 14.940 34.844 120.141 1.00 18.27 C ATOM 1792 H LEU B 508 13.247 30.210 120.380 1.00 0.00 H ATOM 1793 N VAL B 509 11.865 33.080 119.338 1.00 24.20 N ATOM 1794 CA VAL B 509 11.044 34.071 118.650 1.00 19.35 C ATOM 1795 C VAL B 509 9.629 34.081 119.214 1.00 21.94 C ATOM 1796 O VAL B 509 9.058 35.148 119.474 1.00 22.76 O ATOM 1797 CB VAL B 509 11.046 33.817 117.131 1.00 22.63 C ATOM 1798 CG1 VAL B 509 9.931 34.639 116.467 1.00 20.46 C ATOM 1799 CG2 VAL B 509 12.417 34.139 116.545 1.00 19.12 C ATOM 1800 H VAL B 509 12.207 32.243 118.825 1.00 0.00 H ATOM 1801 N GLU B 510 9.048 32.902 119.432 1.00 25.79 N ATOM 1802 CA GLU B 510 7.677 32.852 119.927 1.00 31.96 C ATOM 1803 C GLU B 510 7.569 33.481 121.313 1.00 31.15 C ATOM 1804 O GLU B 510 6.592 34.171 121.615 1.00 27.44 O ATOM 1805 CB GLU B 510 7.177 31.408 119.950 1.00 38.45 C ATOM 1806 CG GLU B 510 6.901 30.842 118.565 1.00 51.69 C ATOM 1807 CD GLU B 510 6.309 29.452 118.611 1.00 62.42 C ATOM 1808 OE1 GLU B 510 6.261 28.858 119.707 1.00 70.02 O ATOM 1809 OE2 GLU B 510 5.903 28.948 117.544 1.00 72.47 O ATOM 1810 H GLU B 510 9.570 32.021 119.250 1.00 0.00 H ATOM 1811 N PHE B 511 8.586 33.293 122.154 1.00 28.19 N ATOM 1812 CA PHE B 511 8.577 33.926 123.468 1.00 25.57 C ATOM 1813 C PHE B 511 8.578 35.443 123.345 1.00 32.03 C ATOM 1814 O PHE B 511 7.818 36.137 124.029 1.00 29.21 O ATOM 1815 CB PHE B 511 9.785 33.466 124.285 1.00 21.13 C ATOM 1816 CG PHE B 511 9.836 34.055 125.684 1.00 27.53 C ATOM 1817 CD1 PHE B 511 9.049 33.526 126.694 1.00 27.92 C ATOM 1818 CD2 PHE B 511 10.664 35.118 125.983 1.00 25.13 C ATOM 1819 CE1 PHE B 511 9.085 34.049 127.985 1.00 28.54 C ATOM 1820 CE2 PHE B 511 10.715 35.641 127.273 1.00 29.60 C ATOM 1821 CZ PHE B 511 9.923 35.101 128.274 1.00 24.26 C ATOM 1822 H PHE B 511 9.388 32.693 121.873 1.00 0.00 H ATOM 1823 N HIS B 512 9.422 35.977 122.466 1.00 28.65 N ATOM 1824 CA HIS B 512 9.600 37.419 122.364 1.00 26.68 C ATOM 1825 C HIS B 512 8.522 38.100 121.527 1.00 27.34 C ATOM 1826 O HIS B 512 8.546 39.327 121.391 1.00 25.79 O ATOM 1827 CB HIS B 512 10.998 37.723 121.824 1.00 22.48 C ATOM 1828 CG HIS B 512 12.076 37.499 122.840 1.00 26.72 C ATOM 1829 ND1 HIS B 512 12.780 36.315 122.932 1.00 22.04 N ATOM 1830 CD2 HIS B 512 12.542 38.293 123.834 1.00 19.75 C ATOM 1831 CE1 HIS B 512 13.649 36.399 123.924 1.00 21.21 C ATOM 1832 NE2 HIS B 512 13.525 37.589 124.487 1.00 21.15 N ATOM 1833 H HIS B 512 9.966 35.351 121.838 1.00 0.00 H ATOM 1834 N GLN B 513 7.596 37.336 120.951 1.00 30.96 N ATOM 1835 CA GLN B 513 6.388 37.925 120.393 1.00 31.08 C ATOM 1836 C GLN B 513 5.420 38.367 121.483 1.00 33.27 C ATOM 1837 O GLN B 513 4.571 39.227 121.233 1.00 31.44 O ATOM 1838 CB GLN B 513 5.708 36.918 119.473 1.00 25.04 C ATOM 1839 CG GLN B 513 6.495 36.644 118.211 1.00 31.23 C ATOM 1840 CD GLN B 513 5.893 35.554 117.350 1.00 37.86 C ATOM 1841 OE1 GLN B 513 5.225 34.647 117.844 1.00 49.78 O ATOM 1842 NE2 GLN B 513 6.142 35.631 116.051 1.00 40.87 N ATOM 1843 HE22 GLN B 513 6.712 36.416 115.676 1.00 0.00 H ATOM 1844 HE21 GLN B 513 5.767 34.906 115.406 1.00 0.00 H ATOM 1845 H GLN B 513 7.738 36.307 120.899 1.00 0.00 H ATOM 1846 N LEU B 514 5.564 37.835 122.698 1.00 29.99 N ATOM 1847 CA LEU B 514 4.688 38.186 123.802 1.00 35.40 C ATOM 1848 C LEU B 514 5.417 38.842 124.956 1.00 35.06 C ATOM 1849 O LEU B 514 4.784 39.538 125.748 1.00 30.54 O ATOM 1850 CB LEU B 514 3.978 36.940 124.342 1.00 39.72 C ATOM 1851 CG LEU B 514 2.731 36.489 123.603 1.00 43.76 C ATOM 1852 CD1 LEU B 514 1.907 35.607 124.522 1.00 34.75 C ATOM 1853 CD2 LEU B 514 1.934 37.682 123.097 1.00 46.48 C ATOM 1854 H LEU B 514 6.327 37.147 122.860 1.00 0.00 H ATOM 1855 N ASN B 515 6.725 38.658 125.059 1.00 31.28 N ATOM 1856 CA ASN B 515 7.496 39.161 126.181 1.00 19.57 C ATOM 1857 C ASN B 515 8.689 39.934 125.653 1.00 30.97 C ATOM 1858 O ASN B 515 9.376 39.472 124.743 1.00 34.11 O ATOM 1859 CB ASN B 515 7.953 38.008 127.087 1.00 17.02 C ATOM 1860 CG ASN B 515 6.800 37.143 127.546 1.00 27.88 C ATOM 1861 OD1 ASN B 515 6.171 37.445 128.554 1.00 36.39 O ATOM 1862 ND2 ASN B 515 6.502 36.084 126.807 1.00 23.83 N ATOM 1863 HD22 ASN B 515 7.064 35.867 125.959 1.00 0.00 H ATOM 1864 HD21 ASN B 515 5.706 35.470 127.075 1.00 0.00 H ATOM 1865 H ASN B 515 7.218 38.134 124.308 1.00 0.00 H ATOM 1866 N ARG B 516 8.913 41.119 126.207 1.00 31.67 N ATOM 1867 CA ARG B 516 10.009 41.956 125.733 1.00 35.33 C ATOM 1868 C ARG B 516 11.364 41.356 126.091 1.00 32.20 C ATOM 1869 O ARG B 516 12.311 41.426 125.295 1.00 26.30 O ATOM 1870 CB ARG B 516 9.843 43.367 126.287 1.00 36.77 C ATOM 1871 CG ARG B 516 8.964 44.259 125.401 1.00 44.87 C ATOM 1872 CD ARG B 516 8.824 45.645 126.001 1.00 55.87 C ATOM 1873 NE ARG B 516 10.101 46.193 126.444 1.00 74.11 N ATOM 1874 CZ ARG B 516 10.254 47.423 126.922 1.00 86.39 C ATOM 1875 NH1 ARG B 516 9.206 48.233 127.013 1.00 86.82 N ATOM 1876 NH2 ARG B 516 11.450 47.840 127.314 1.00 88.52 N ATOM 1877 HE ARG B 516 10.942 45.584 126.382 1.00 0.00 H ATOM 1878 HH12 ARG B 516 9.324 49.196 127.387 1.00 0.00 H ATOM 1879 HH11 ARG B 516 8.267 47.904 126.710 1.00 0.00 H ATOM 1880 HH22 ARG B 516 11.568 48.803 127.688 1.00 0.00 H ATOM 1881 HH21 ARG B 516 12.270 47.204 127.248 1.00 0.00 H ATOM 1882 H ARG B 516 8.305 41.452 126.982 1.00 0.00 H ATOM 1883 N GLY B 517 11.484 40.781 127.279 1.00 27.52 N ATOM 1884 CA GLY B 517 12.780 40.291 127.710 1.00 28.86 C ATOM 1885 C GLY B 517 13.781 41.420 127.688 1.00 30.58 C ATOM 1886 O GLY B 517 13.485 42.556 128.073 1.00 28.24 O ATOM 1887 H GLY B 517 10.655 40.682 127.898 1.00 0.00 H ATOM 1888 N ILE B 518 14.982 41.125 127.181 1.00 27.66 N ATOM 1889 CA ILE B 518 15.991 42.168 127.052 1.00 30.25 C ATOM 1890 C ILE B 518 15.763 43.066 125.846 1.00 30.86 C ATOM 1891 O ILE B 518 16.535 44.008 125.638 1.00 36.34 O ATOM 1892 CB ILE B 518 17.392 41.543 126.938 1.00 36.28 C ATOM 1893 CG1 ILE B 518 17.531 40.828 125.595 1.00 28.27 C ATOM 1894 CG2 ILE B 518 17.623 40.561 128.077 1.00 30.67 C ATOM 1895 CD1 ILE B 518 18.959 40.498 125.246 1.00 34.80 C ATOM 1896 H ILE B 518 15.196 40.153 126.879 1.00 0.00 H ATOM 1897 N LEU B 519 14.725 42.819 125.053 1.00 31.76 N ATOM 1898 CA LEU B 519 14.495 43.599 123.841 1.00 35.76 C ATOM 1899 C LEU B 519 13.726 44.882 124.142 1.00 40.24 C ATOM 1900 O LEU B 519 12.972 44.954 125.117 1.00 31.61 O ATOM 1901 CB LEU B 519 13.729 42.766 122.824 1.00 29.08 C ATOM 1902 CG LEU B 519 14.376 41.455 122.399 1.00 26.78 C ATOM 1903 CD1 LEU B 519 13.459 40.743 121.433 1.00 25.69 C ATOM 1904 CD2 LEU B 519 15.732 41.697 121.774 1.00 22.75 C ATOM 1905 H LEU B 519 14.064 42.055 125.301 1.00 0.00 H ATOM 1906 N PRO B 520 13.877 45.912 123.300 1.00 42.71 N ATOM 1907 CA PRO B 520 13.181 47.182 123.562 1.00 43.35 C ATOM 1908 C PRO B 520 11.705 47.162 123.214 1.00 43.20 C ATOM 1909 O PRO B 520 10.986 48.096 123.595 1.00 42.47 O ATOM 1910 CB PRO B 520 13.932 48.177 122.670 1.00 40.09 C ATOM 1911 CG PRO B 520 14.404 47.332 121.508 1.00 37.63 C ATOM 1912 CD PRO B 520 14.710 45.972 122.084 1.00 38.15 C ATOM 1913 N CYS B 521 11.235 46.142 122.504 1.00 39.47 N ATOM 1914 CA CYS B 521 9.824 46.017 122.166 1.00 38.45 C ATOM 1915 C CYS B 521 9.579 44.579 121.739 1.00 40.58 C ATOM 1916 O CYS B 521 10.512 43.784 121.613 1.00 38.09 O ATOM 1917 CB CYS B 521 9.410 46.998 121.067 1.00 38.82 C ATOM 1918 SG CYS B 521 10.215 46.678 119.483 1.00 40.19 S ATOM 1919 H CYS B 521 11.897 45.409 122.179 1.00 0.00 H ATOM 1920 N LEU B 522 8.314 44.265 121.485 1.00 29.14 N ATOM 1921 CA LEU B 522 7.951 42.926 121.062 1.00 31.96 C ATOM 1922 C LEU B 522 8.275 42.709 119.586 1.00 33.17 C ATOM 1923 O LEU B 522 8.364 43.647 118.790 1.00 30.00 O ATOM 1924 CB LEU B 522 6.460 42.677 121.294 1.00 31.43 C ATOM 1925 CG LEU B 522 5.937 42.834 122.723 1.00 36.88 C ATOM 1926 CD1 LEU B 522 4.412 42.681 122.780 1.00 38.14 C ATOM 1927 CD2 LEU B 522 6.629 41.846 123.655 1.00 20.17 C ATOM 1928 H LEU B 522 7.574 44.988 121.591 1.00 0.00 H ATOM 1929 N LEU B 523 8.465 41.444 119.227 1.00 37.08 N ATOM 1930 CA LEU B 523 8.534 41.058 117.824 1.00 31.27 C ATOM 1931 C LEU B 523 7.105 40.975 117.297 1.00 36.78 C ATOM 1932 O LEU B 523 6.342 40.093 117.699 1.00 42.30 O ATOM 1933 CB LEU B 523 9.264 39.728 117.669 1.00 30.23 C ATOM 1934 CG LEU B 523 10.605 39.655 118.408 1.00 33.93 C ATOM 1935 CD1 LEU B 523 11.299 38.328 118.150 1.00 27.40 C ATOM 1936 CD2 LEU B 523 11.478 40.815 117.997 1.00 27.90 C ATOM 1937 H LEU B 523 8.566 40.715 119.962 1.00 0.00 H ATOM 1938 N ARG B 524 6.742 41.880 116.389 1.00 32.33 N ATOM 1939 CA ARG B 524 5.360 42.030 115.942 1.00 40.84 C ATOM 1940 C ARG B 524 5.120 41.602 114.505 1.00 47.38 C ATOM 1941 O ARG B 524 4.104 40.965 114.229 1.00 57.30 O ATOM 1942 CB ARG B 524 4.894 43.483 116.118 1.00 43.09 C ATOM 1943 CG ARG B 524 4.876 43.937 117.561 1.00 53.06 C ATOM 1944 CD ARG B 524 4.259 45.316 117.730 1.00 61.02 C ATOM 1945 NE ARG B 524 4.146 45.659 119.145 1.00 67.34 N ATOM 1946 CZ ARG B 524 3.101 45.343 119.906 1.00 66.52 C ATOM 1947 NH1 ARG B 524 2.072 44.679 119.390 1.00 63.16 N ATOM 1948 NH2 ARG B 524 3.087 45.685 121.185 1.00 65.77 N ATOM 1949 HE ARG B 524 4.930 46.182 119.585 1.00 0.00 H ATOM 1950 HH12 ARG B 524 1.258 44.435 119.989 1.00 0.00 H ATOM 1951 HH11 ARG B 524 2.081 44.404 118.387 1.00 0.00 H ATOM 1952 HH22 ARG B 524 2.271 45.438 121.780 1.00 0.00 H ATOM 1953 HH21 ARG B 524 3.892 46.200 121.594 1.00 0.00 H ATOM 1954 H ARG B 524 7.470 42.503 115.984 1.00 0.00 H ATOM 1955 N HIS B 525 5.992 41.974 113.570 1.00 39.79 N ATOM 1956 CA HIS B 525 5.776 41.682 112.157 1.00 39.07 C ATOM 1957 C HIS B 525 7.001 41.016 111.548 1.00 36.34 C ATOM 1958 O HIS B 525 8.121 41.511 111.704 1.00 40.58 O ATOM 1959 CB HIS B 525 5.408 42.958 111.395 1.00 44.56 C ATOM 1960 CG HIS B 525 4.416 43.810 112.117 1.00 54.42 C ATOM 1961 ND1 HIS B 525 4.772 44.945 112.815 1.00 55.03 N ATOM 1962 CD2 HIS B 525 3.078 43.672 112.275 1.00 54.81 C ATOM 1963 CE1 HIS B 525 3.692 45.478 113.361 1.00 54.99 C ATOM 1964 NE2 HIS B 525 2.652 44.725 113.049 1.00 58.49 N ATOM 1965 H HIS B 525 6.851 42.487 113.855 1.00 0.00 H ATOM 1966 N CYS B 526 6.784 39.901 110.852 1.00 35.01 N ATOM 1967 CA CYS B 526 7.883 39.218 110.183 1.00 42.99 C ATOM 1968 C CYS B 526 8.291 40.030 108.961 1.00 48.16 C ATOM 1969 O CYS B 526 7.450 40.391 108.132 1.00 41.72 O ATOM 1970 CB CYS B 526 7.481 37.802 109.753 1.00 45.39 C ATOM 1971 SG CYS B 526 6.841 36.707 111.061 1.00 60.12 S ATOM 1972 H CYS B 526 5.821 39.515 110.786 1.00 0.00 H ATOM 1973 N CYS B 527 9.581 40.324 108.855 1.00 53.54 N ATOM 1974 CA CYS B 527 10.112 41.038 107.701 1.00 58.34 C ATOM 1975 C CYS B 527 10.346 40.040 106.575 1.00 58.97 C ATOM 1976 O CYS B 527 11.217 39.172 106.677 1.00 62.41 O ATOM 1977 CB CYS B 527 11.397 41.765 108.082 1.00 65.38 C ATOM 1978 SG CYS B 527 12.040 42.863 106.806 1.00 66.82 S ATOM 1979 H CYS B 527 10.230 40.037 109.616 1.00 0.00 H ATOM 1980 N THR B 528 9.562 40.154 105.508 1.00 57.67 N ATOM 1981 CA THR B 528 9.646 39.227 104.384 1.00 64.32 C ATOM 1982 C THR B 528 9.099 39.860 103.112 1.00 72.75 C ATOM 1983 O THR B 528 7.904 40.145 103.023 1.00 77.63 O ATOM 1984 CB THR B 528 8.875 37.925 104.665 1.00 63.18 C ATOM 1985 H THR B 528 8.867 40.927 105.473 1.00 0.00 H TER 1986 THR B 528 HETATM 1987 O HOH 1 14.392 17.230 151.970 1.00 45.96 O HETATM 1988 O HOH 2 10.277 9.378 146.960 1.00 36.75 O HETATM 1989 O HOH 3 -7.292 40.248 131.547 1.00 48.59 O HETATM 1990 O HOH 4 10.204 24.661 122.860 1.00 46.03 O HETATM 1991 O HOH 5 -7.656 24.587 141.756 1.00 29.11 O HETATM 1992 O HOH 6 6.724 31.198 142.893 1.00 28.23 O HETATM 1993 O HOH 7 12.366 16.383 145.649 1.00 41.51 O HETATM 1994 O HOH 8 10.692 18.008 131.537 1.00 57.14 O HETATM 1995 O HOH 9 8.169 29.994 123.213 1.00 24.96 O HETATM 1996 O HOH 10 12.058 23.239 126.700 1.00 35.49 O HETATM 1997 O HOH 11 14.281 20.784 138.723 1.00 37.14 O HETATM 1998 O HOH 12 12.830 31.623 141.167 1.00 50.39 O HETATM 1999 O HOH 13 14.634 20.438 132.353 1.00 40.81 O HETATM 2000 O HOH 14 -2.630 35.919 134.155 1.00 49.13 O HETATM 2001 O HOH 15 3.861 33.224 133.821 1.00 28.74 O HETATM 2002 O HOH 16 -1.463 35.502 136.694 1.00 39.25 O HETATM 2003 O HOH 17 1.751 9.434 146.855 1.00 43.15 O HETATM 2004 O HOH 18 16.657 29.490 135.286 1.00 33.98 O HETATM 2005 O HOH 19 14.349 27.405 144.982 1.00 44.48 O HETATM 2006 O HOH 20 3.366 31.442 120.423 1.00 46.06 O HETATM 2007 O HOH 21 10.512 30.146 143.712 1.00 46.12 O HETATM 2008 O HOH 22 6.289 4.401 144.885 1.00 43.16 O HETATM 2009 O HOH 23 -2.569 14.281 148.977 1.00 44.90 O HETATM 2010 O HOH 24 -2.275 39.493 134.048 1.00 52.16 O HETATM 2011 O HOH 25 16.437 23.331 138.824 1.00 29.92 O HETATM 2012 O HOH 26 -1.310 23.820 125.171 1.00 35.81 O HETATM 2013 O HOH 27 -9.117 13.489 141.275 1.00 36.79 O HETATM 2014 O HOH 28 12.110 10.973 148.055 1.00 42.62 O HETATM 2015 O HOH 29 18.480 23.005 125.551 1.00 41.33 O HETATM 2016 O HOH 30 25.613 45.841 101.421 1.00 44.27 O HETATM 2017 O HOH 31 23.936 37.996 108.950 1.00 39.96 O HETATM 2018 O HOH 32 24.376 37.016 131.884 1.00 42.72 O HETATM 2019 O HOH 33 16.179 37.763 102.597 1.00 44.43 O HETATM 2020 O HOH 34 6.498 27.278 108.723 1.00 26.19 O HETATM 2021 O HOH 35 27.222 38.142 110.374 1.00 45.88 O HETATM 2022 O HOH 36 15.125 38.297 126.455 1.00 37.65 O HETATM 2023 O HOH 37 17.924 47.552 122.736 1.00 46.53 O HETATM 2024 O HOH 38 6.835 32.062 109.914 1.00 60.23 O HETATM 2025 O HOH 39 6.258 39.969 129.403 1.00 40.02 O HETATM 2026 O HOH 40 16.128 46.643 125.353 1.00 43.76 O HETATM 2027 O HOH 41 8.527 28.213 125.370 1.00 27.65 O HETATM 2028 O HOH 42 16.658 26.660 115.736 1.00 33.98 O HETATM 2029 O HOH 43 4.221 33.536 120.408 1.00 39.09 O HETATM 2030 O HOH 44 17.988 34.692 125.431 1.00 22.85 O HETATM 2031 O HOH 45 6.957 32.545 114.410 1.00 46.88 O HETATM 2032 O HOH 46 2.225 40.511 125.222 1.00 42.34 O HETATM 2033 O HOH 47 14.274 29.412 104.604 1.00 51.10 O HETATM 2034 O HOH 48 24.432 34.612 124.908 1.00 28.52 O HETATM 2035 O HOH 49 14.808 37.646 129.213 1.00 33.11 O HETATM 2036 O HOH 50 20.302 27.621 109.680 1.00 39.11 O HETATM 2037 O HOH 51 24.421 36.215 122.610 1.00 36.74 O HETATM 2038 O HOH 52 12.526 30.929 105.449 1.00 48.72 O HETATM 2039 O HOH 53 17.588 37.344 126.424 1.00 35.97 O HETATM 2040 O HOH 54 16.654 50.480 122.129 1.00 41.82 O HETATM 2041 O HOH 55 26.761 44.085 106.834 1.00 47.19 O HETATM 2042 O HOH 56 24.476 31.489 124.854 1.00 49.07 O HETATM 2043 O HOH 57 15.376 22.651 114.772 1.00 40.35 O HETATM 2044 O HOH 58 17.703 50.974 108.100 1.00 62.99 O HETATM 2045 O HOH 59 6.798 42.320 128.082 1.00 35.50 O HETATM 2046 O HOH 60 6.052 46.395 121.898 1.00 32.24 O HETATM 2047 O HOH 61 25.690 31.096 127.608 1.00 52.70 O HETATM 2048 O HOH 62 0.411 44.127 122.154 1.00 61.64 O HETATM 2049 O HOH 63 5.797 25.680 112.357 1.00 36.37 O HETATM 2050 O HOH 64 2.258 26.087 117.067 1.00 55.06 O HETATM 2051 O HOH 65 0.836 32.835 146.095 1.00 38.88 O HETATM 2052 O HOH 66 -6.943 31.870 144.468 1.00 54.52 O HETATM 2053 O HOH 67 26.134 44.388 123.508 1.00 27.62 O HETATM 2054 O HOH 68 21.606 49.940 121.546 1.00 42.18 O HETATM 2055 O HOH 69 19.356 44.386 124.888 1.00 40.54 O HETATM 2056 O HOH 70 32.125 41.317 123.796 1.00 43.72 O HETATM 2057 O HOH 71 30.864 44.985 124.638 1.00 40.53 O HETATM 2058 N LYS A 72 0.661 37.531 144.000 1.00 -0.26 N HETATM 2059 CA LYS A 72 0.341 36.354 144.798 1.00 0.13 C HETATM 2060 C LYS A 72 -1.112 35.934 144.604 1.00 0.20 C HETATM 2061 O LYS A 72 -1.939 36.721 144.143 1.00 -0.39 O HETATM 2062 N LYS A 72 -1.415 34.689 144.957 1.00 -0.26 N HETATM 2063 CA LYS A 72 -2.766 34.163 144.821 1.00 0.14 C HETATM 2064 C LYS A 72 -3.068 33.254 146.007 1.00 0.21 C HETATM 2065 O LYS A 72 -2.356 32.268 146.228 1.00 -0.39 O HETATM 2066 N LYS A 72 -4.092 33.600 146.779 1.00 -0.26 N HETATM 2067 CA LYS A 72 -4.468 32.838 147.968 1.00 0.13 C HETATM 2068 C LYS A 72 -4.665 31.354 147.698 1.00 0.20 C HETATM 2069 O LYS A 72 -5.384 30.971 146.784 1.00 -0.39 O HETATM 2070 N LYS A 72 -4.037 30.520 148.515 1.00 -0.27 N HETATM 2071 CA LYS A 72 -4.144 29.090 148.339 1.00 0.12 C HETATM 2072 C LYS A 72 -3.155 28.481 147.365 1.00 0.20 C HETATM 2073 O LYS A 72 -3.158 27.256 147.194 1.00 -0.39 O HETATM 2074 N LYS A 72 -2.311 29.285 146.727 1.00 -0.26 N HETATM 2075 CA LYS A 72 -1.321 28.779 145.788 1.00 0.14 C HETATM 2076 C LYS A 72 0.055 29.275 146.196 1.00 0.21 C HETATM 2077 O LYS A 72 0.195 30.159 147.045 1.00 -0.39 O HETATM 2078 N LYS A 72 1.085 28.693 145.583 1.00 -0.26 N HETATM 2079 CA LYS A 72 2.463 28.984 145.950 1.00 0.14 C HETATM 2080 C LYS A 72 3.130 30.035 145.058 1.00 0.21 C HETATM 2081 O LYS A 72 4.330 30.289 145.228 1.00 -0.39 O HETATM 2082 N LYS A 72 2.385 30.687 144.155 1.00 -0.26 N HETATM 2083 CA LYS A 72 2.996 31.699 143.291 1.00 0.15 C HETATM 2084 C LYS A 72 3.592 32.816 144.139 1.00 0.20 C HETATM 2085 O LYS A 72 2.947 33.317 145.056 1.00 -0.39 O HETATM 2086 N LYS A 72 4.797 33.241 143.785 1.00 -0.27 N HETATM 2087 CA LYS A 72 5.457 34.330 144.482 1.00 0.12 C HETATM 2088 C LYS A 72 6.129 35.275 143.491 1.00 0.18 C HETATM 2089 O LYS A 72 7.049 34.889 142.779 1.00 -0.26 O HETATM 2090 N01 LYS A 72 5.818 36.116 142.732 1.00 0.44 N HETATM 2091 C02 LYS A 72 6.148 37.126 141.688 1.00 0.11 C HETATM 2092 C03 LYS A 72 7.494 37.828 142.111 1.00 0.22 C HETATM 2093 O04 LYS A 72 7.793 37.916 143.293 1.00 -0.39 O HETATM 2094 N05 LYS A 72 8.257 38.302 141.143 1.00 -0.30 N HETATM 2095 H58 LYS A 72 9.120 38.755 141.364 1.00 0.18 H HETATM 2096 H59 LYS A 72 7.971 38.207 140.189 1.00 0.18 H HETATM 2097 C06 LYS A 72 4.966 38.139 141.595 1.00 0.06 C HETATM 2098 S07 LYS A 72 3.463 37.404 140.905 1.00 -0.13 S HETATM 2099 C08 LYS A 72 2.045 37.994 141.864 1.00 0.08 C HETATM 2100 C09 LYS A 72 1.870 37.038 143.070 1.00 0.19 C HETATM 2101 O10 LYS A 72 2.549 36.075 143.305 1.00 -0.40 O HETATM 2102 H62 LYS A 72 1.139 37.982 141.241 1.00 0.06 H HETATM 2103 H63 LYS A 72 2.232 39.018 142.220 1.00 0.06 H HETATM 2104 H60 LYS A 72 5.273 38.979 140.954 1.00 0.05 H HETATM 2105 H61 LYS A 72 4.743 38.512 142.606 1.00 0.05 H HETATM 2106 H57 LYS A 72 6.282 36.634 140.713 1.00 0.11 H HETATM 2107 H56 LYS A 72 4.855 35.937 142.494 1.00 0.25 H HETATM 2108 H51 LYS A 72 6.629 35.885 144.257 1.00 0.13 H HETATM 2109 CB LYS A 72 6.472 33.800 145.488 1.00 -0.01 C HETATM 2110 CG LYS A 72 6.613 34.665 146.728 1.00 0.04 C HETATM 2111 CD LYS A 72 5.281 35.176 147.241 1.00 0.18 C HETATM 2112 NZ LYS A 72 4.772 36.357 147.333 1.00 -0.29 N HETATM 2113 CE LYS A 72 3.909 37.219 148.187 1.00 0.03 C HETATM 2114 CD LYS A 72 2.433 36.915 147.989 1.00 -0.03 C HETATM 2115 CG LYS A 72 1.999 37.192 146.559 1.00 -0.05 C HETATM 2116 CB LYS A 72 0.619 36.620 146.279 1.00 -0.01 C HETATM 2117 H3 LYS A 72 0.522 35.670 146.825 1.00 0.03 H HETATM 2118 H4 LYS A 72 -0.132 37.334 146.649 1.00 0.03 H HETATM 2119 H5 LYS A 72 1.976 38.280 146.396 1.00 0.03 H HETATM 2120 H6 LYS A 72 2.723 36.733 145.870 1.00 0.03 H HETATM 2121 H7 LYS A 72 2.252 35.855 148.220 1.00 0.03 H HETATM 2122 H8 LYS A 72 1.843 37.545 148.671 1.00 0.03 H HETATM 2123 H9 LYS A 72 4.169 37.048 149.242 1.00 0.05 H HETATM 2124 H10 LYS A 72 4.093 38.273 147.930 1.00 0.05 H HETATM 2125 H11 LYS A 72 5.064 36.890 146.539 1.00 0.18 H HETATM 2126 OE2 LYS A 72 4.848 34.711 148.313 1.00 -0.40 O HETATM 2127 H54 LYS A 72 7.250 35.528 146.484 1.00 0.05 H HETATM 2128 H55 LYS A 72 7.090 34.069 147.520 1.00 0.05 H HETATM 2129 H52 LYS A 72 7.453 33.740 144.993 1.00 0.03 H HETATM 2130 H53 LYS A 72 6.157 32.794 145.801 1.00 0.03 H HETATM 2131 H50 LYS A 72 4.692 34.897 145.033 1.00 0.06 H HETATM 2132 H49 LYS A 72 5.263 32.800 143.018 1.00 0.19 H HETATM 2133 CB LYS A 72 1.967 32.317 142.335 1.00 0.08 C HETATM 2134 CG LYS A 72 1.184 31.299 141.548 1.00 0.18 C HETATM 2135 OD1 LYS A 72 0.572 30.388 142.111 1.00 -0.40 O HETATM 2136 ND2 LYS A 72 1.140 31.488 140.225 1.00 -0.30 N HETATM 2137 H47 LYS A 72 0.636 30.848 139.645 1.00 0.18 H HETATM 2138 H48 LYS A 72 1.611 32.270 139.816 1.00 0.18 H HETATM 2139 H45 LYS A 72 2.499 32.969 141.627 1.00 0.06 H HETATM 2140 H46 LYS A 72 1.260 32.917 142.927 1.00 0.06 H HETATM 2141 H44 LYS A 72 3.794 31.224 142.701 1.00 0.08 H HETATM 2142 H43 LYS A 72 1.410 30.482 144.071 1.00 0.19 H HETATM 2143 CB LYS A 72 3.295 27.693 145.949 1.00 0.04 C HETATM 2144 CG LYS A 72 2.790 26.660 146.958 1.00 0.04 C HETATM 2145 OD1 LYS A 72 2.851 26.944 148.169 1.00 -0.57 O HETATM 2146 OD2 LYS A 72 2.345 25.569 146.549 1.00 -0.57 O HETATM 2147 H41 LYS A 72 4.336 27.946 146.197 1.00 0.05 H HETATM 2148 H42 LYS A 72 3.255 27.250 144.943 1.00 0.05 H HETATM 2149 H40 LYS A 72 2.452 29.382 146.975 1.00 0.08 H HETATM 2150 H39 LYS A 72 0.906 28.037 144.850 1.00 0.19 H HETATM 2151 CB LYS A 72 -1.662 29.192 144.352 1.00 0.02 C HETATM 2152 CG LYS A 72 -3.011 28.680 143.919 1.00 -0.05 C HETATM 2153 CD1 LYS A 72 -3.154 27.401 143.393 1.00 -0.07 C HETATM 2154 CE1 LYS A 72 -4.389 26.921 143.000 1.00 -0.04 C HETATM 2155 CZ LYS A 72 -5.505 27.724 143.130 1.00 0.08 C HETATM 2156 CE2 LYS A 72 -5.394 28.994 143.654 1.00 -0.04 C HETATM 2157 CD2 LYS A 72 -4.149 29.465 144.051 1.00 -0.07 C HETATM 2158 H35 LYS A 72 -4.064 30.461 144.470 1.00 0.05 H HETATM 2159 H37 LYS A 72 -6.272 29.621 143.756 1.00 0.05 H HETATM 2160 OH LYS A 72 -6.734 27.257 142.741 1.00 -0.34 O HETATM 2161 H38 LYS A 72 -6.644 26.373 142.404 1.00 0.25 H HETATM 2162 H36 LYS A 72 -4.481 25.921 142.592 1.00 0.05 H HETATM 2163 H34 LYS A 72 -2.280 26.768 143.289 1.00 0.05 H HETATM 2164 H32 LYS A 72 -0.895 28.787 143.675 1.00 0.05 H HETATM 2165 H33 LYS A 72 -1.663 30.290 144.290 1.00 0.05 H HETATM 2166 H31 LYS A 72 -1.323 27.680 145.837 1.00 0.08 H HETATM 2167 H30 LYS A 72 -2.358 30.269 146.898 1.00 0.19 H HETATM 2168 H28 LYS A 72 -5.159 28.867 147.977 1.00 0.08 H HETATM 2169 H29 LYS A 72 -3.992 28.615 149.319 1.00 0.08 H HETATM 2170 H27 LYS A 72 -3.482 30.885 149.262 1.00 0.19 H HETATM 2171 CB LYS A 72 -5.727 33.428 148.609 1.00 -0.00 C HETATM 2172 CG LYS A 72 -5.467 34.140 149.924 1.00 0.00 C HETATM 2173 CD LYS A 72 -4.924 33.210 150.990 1.00 0.04 C HETATM 2174 OE1 LYS A 72 -4.233 33.690 151.908 1.00 -0.57 O HETATM 2175 OE2 LYS A 72 -5.189 31.996 150.907 1.00 -0.57 O HETATM 2176 H25 LYS A 72 -6.412 34.574 150.283 1.00 0.04 H HETATM 2177 H26 LYS A 72 -4.736 34.944 149.751 1.00 0.04 H HETATM 2178 H23 LYS A 72 -6.439 32.610 148.792 1.00 0.03 H HETATM 2179 H24 LYS A 72 -6.169 34.149 147.906 1.00 0.03 H HETATM 2180 H22 LYS A 72 -3.644 32.933 148.691 1.00 0.08 H HETATM 2181 H21 LYS A 72 -4.625 34.411 146.538 1.00 0.19 H HETATM 2182 CB LYS A 72 -2.920 33.377 143.515 1.00 0.02 C HETATM 2183 CG LYS A 72 -2.523 34.149 142.292 1.00 -0.04 C HETATM 2184 CD1 LYS A 72 -3.454 34.909 141.607 1.00 -0.06 C HETATM 2185 CE1 LYS A 72 -3.092 35.620 140.480 1.00 -0.07 C HETATM 2186 CZ LYS A 72 -1.784 35.577 140.025 1.00 -0.07 C HETATM 2187 CE2 LYS A 72 -0.844 34.823 140.700 1.00 -0.07 C HETATM 2188 CD2 LYS A 72 -1.214 34.112 141.825 1.00 -0.06 C HETATM 2189 H17 LYS A 72 -0.475 33.518 142.350 1.00 0.06 H HETATM 2190 H19 LYS A 72 0.181 34.789 140.348 1.00 0.06 H HETATM 2191 H20 LYS A 72 -1.499 36.135 139.140 1.00 0.06 H HETATM 2192 H18 LYS A 72 -3.831 36.212 139.952 1.00 0.06 H HETATM 2193 H16 LYS A 72 -4.479 34.947 141.959 1.00 0.06 H HETATM 2194 H14 LYS A 72 -3.974 33.081 143.411 1.00 0.05 H HETATM 2195 H15 LYS A 72 -2.291 32.477 143.576 1.00 0.05 H HETATM 2196 H13 LYS A 72 -3.478 35.002 144.817 1.00 0.08 H HETATM 2197 H12 LYS A 72 -0.697 34.099 145.325 1.00 0.19 H HETATM 2198 H2 LYS A 72 0.986 35.528 144.466 1.00 0.08 H HETATM 2199 H1 LYS A 72 0.229 38.432 144.026 1.00 0.19 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 954 955 961 962 963 CONECT 961 954 CONECT 962 954 CONECT 963 954 CONECT 2058 2059 2100 2199 CONECT 2059 2058 2060 2116 2198 CONECT 2060 2059 2061 2062 CONECT 2061 2060 CONECT 2062 2060 2063 2197 CONECT 2063 2062 2064 2182 2196 CONECT 2064 2063 2065 2066 CONECT 2065 2064 CONECT 2066 2064 2067 2181 CONECT 2067 2066 2068 2171 2180 CONECT 2068 2067 2069 2070 CONECT 2069 2068 CONECT 2070 2068 2071 2170 CONECT 2071 2070 2072 2168 2169 CONECT 2072 2071 2073 2074 CONECT 2073 2072 CONECT 2074 2072 2075 2167 CONECT 2075 2074 2076 2151 2166 CONECT 2076 2075 2077 2078 CONECT 2077 2076 CONECT 2078 2076 2079 2150 CONECT 2079 2078 2080 2143 2149 CONECT 2080 2079 2081 2082 CONECT 2081 2080 CONECT 2082 2080 2083 2142 CONECT 2083 2082 2084 2133 2141 CONECT 2084 2083 2085 2086 CONECT 2085 2084 CONECT 2086 2084 2087 2132 CONECT 2087 2086 2088 2109 2131 CONECT 2088 2087 2089 2090 2108 CONECT 2089 2088 2090 CONECT 2090 2088 2089 2091 2107 CONECT 2091 2090 2092 2097 2106 CONECT 2092 2091 2093 2094 CONECT 2093 2092 CONECT 2094 2092 2095 2096 CONECT 2095 2094 CONECT 2096 2094 CONECT 2097 2091 2098 2104 2105 CONECT 2098 2097 2099 CONECT 2099 2098 2100 2102 2103 CONECT 2100 2058 2099 2101 CONECT 2101 2100 CONECT 2102 2099 CONECT 2103 2099 CONECT 2104 2097 CONECT 2105 2097 CONECT 2106 2091 CONECT 2107 2090 CONECT 2108 2088 CONECT 2109 2087 2110 2129 2130 CONECT 2110 2109 2111 2127 2128 CONECT 2111 2110 2112 2126 CONECT 2112 2111 2113 2125 CONECT 2113 2112 2114 2123 2124 CONECT 2114 2113 2115 2121 2122 CONECT 2115 2114 2116 2119 2120 CONECT 2116 2059 2115 2117 2118 CONECT 2117 2116 CONECT 2118 2116 CONECT 2119 2115 CONECT 2120 2115 CONECT 2121 2114 CONECT 2122 2114 CONECT 2123 2113 CONECT 2124 2113 CONECT 2125 2112 CONECT 2126 2111 CONECT 2127 2110 CONECT 2128 2110 CONECT 2129 2109 CONECT 2130 2109 CONECT 2131 2087 CONECT 2132 2086 CONECT 2133 2083 2134 2139 2140 CONECT 2134 2133 2135 2136 CONECT 2135 2134 CONECT 2136 2134 2137 2138 CONECT 2137 2136 CONECT 2138 2136 CONECT 2139 2133 CONECT 2140 2133 CONECT 2141 2083 CONECT 2142 2082 CONECT 2143 2079 2144 2147 2148 CONECT 2144 2143 2145 2146 CONECT 2145 2144 CONECT 2146 2144 CONECT 2147 2143 CONECT 2148 2143 CONECT 2149 2079 CONECT 2150 2078 CONECT 2151 2075 2152 2164 2165 CONECT 2152 2151 2153 2157 CONECT 2153 2152 2154 2163 CONECT 2154 2153 2155 2162 CONECT 2155 2154 2156 2160 CONECT 2156 2155 2157 2159 CONECT 2157 2152 2156 2158 CONECT 2158 2157 CONECT 2159 2156 CONECT 2160 2155 2161 CONECT 2161 2160 CONECT 2162 2154 CONECT 2163 2153 CONECT 2164 2151 CONECT 2165 2151 CONECT 2166 2075 CONECT 2167 2074 CONECT 2168 2071 CONECT 2169 2071 CONECT 2170 2070 CONECT 2171 2067 2172 2178 2179 CONECT 2172 2171 2173 2176 2177 CONECT 2173 2172 2174 2175 CONECT 2174 2173 CONECT 2175 2173 CONECT 2176 2172 CONECT 2177 2172 CONECT 2178 2171 CONECT 2179 2171 CONECT 2180 2067 CONECT 2181 2066 CONECT 2182 2063 2183 2194 2195 CONECT 2183 2182 2184 2188 CONECT 2184 2183 2185 2193 CONECT 2185 2184 2186 2192 CONECT 2186 2185 2187 2191 CONECT 2187 2186 2188 2190 CONECT 2188 2183 2187 2189 CONECT 2189 2188 CONECT 2190 2187 CONECT 2191 2186 CONECT 2192 2185 CONECT 2193 2184 CONECT 2194 2182 CONECT 2195 2182 CONECT 2196 2063 CONECT 2197 2062 CONECT 2198 2059 CONECT 2199 2058 MASTER 0 0 0 0 0 0 0 0 2197 2 150 17 END
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Related entries of code: 5u1q
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
5d0j
RCSB PDB
PDBbind
120aa, >5D0J_1|Chains... *
5eel
RCSB PDB
PDBbind
120aa, >5EEL_1|Chains... at 100%
5u06
RCSB PDB
PDBbind
120aa, >5U06_1|Chains... at 100%
5tyi
RCSB PDB
PDBbind
120aa, >5TYI_1|Chains... at 100%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1bmb
RCSB PDB
PDBbind
9-mer
1f90
RCSB PDB
PDBbind
9-mer
1fzk
RCSB PDB
PDBbind
9-mer
1fzo
RCSB PDB
PDBbind
9-mer
1g3f
RCSB PDB
PDBbind
9-mer
1g7p
RCSB PDB
PDBbind
9-mer
1gux
RCSB PDB
PDBbind
9-mer
1gwq
RCSB PDB
PDBbind
9-mer
1h24
RCSB PDB
PDBbind
9-mer
1inq
RCSB PDB
PDBbind
9-mer
1jp5
RCSB PDB
PDBbind
9-mer
1juf
RCSB PDB
PDBbind
9-mer
1kl3
RCSB PDB
PDBbind
9-mer
1kl5
RCSB PDB
PDBbind
9-mer
1lb6
RCSB PDB
PDBbind
9-mer
1mfg
RCSB PDB
PDBbind
9-mer
1mpa
RCSB PDB
PDBbind
9-mer
1nlo
RCSB PDB
PDBbind
9-mer
1oai
RCSB PDB
PDBbind
9-mer
1oxn
RCSB PDB
PDBbind
9-mer
1oxq
RCSB PDB
PDBbind
9-mer
1oy7
RCSB PDB
PDBbind
9-mer
1pcg
RCSB PDB
PDBbind
9-mer
1prl
RCSB PDB
PDBbind
9-mer
1prm
RCSB PDB
PDBbind
9-mer
1rlp
RCSB PDB
PDBbind
9-mer
1rlq
RCSB PDB
PDBbind
9-mer
1rst
RCSB PDB
PDBbind
9-mer
1utc
RCSB PDB
PDBbind
9-mer
1vwf
RCSB PDB
PDBbind
9-mer
1vwl
RCSB PDB
PDBbind
9-mer
1x7q
RCSB PDB
PDBbind
9-mer
1xr8
RCSB PDB
PDBbind
9-mer
1xr9
RCSB PDB
PDBbind
9-mer
1zea
RCSB PDB
PDBbind
9-mer
2bgn
RCSB PDB
PDBbind
9-mer
2bgr
RCSB PDB
PDBbind
9-mer
2e7l
RCSB PDB
PDBbind
9-mer
2gv2
RCSB PDB
PDBbind
9-mer
2h6q
RCSB PDB
PDBbind
9-mer
2hkf
RCSB PDB
PDBbind
9-mer
2jo9
RCSB PDB
PDBbind
9-mer
2jup
RCSB PDB
PDBbind
9-mer
2kgi
RCSB PDB
PDBbind
9-mer
2khh
RCSB PDB
PDBbind
9-mer
2lnw
RCSB PDB
PDBbind
9-mer
2lsv
RCSB PDB
PDBbind
9-mer
2mpa
RCSB PDB
PDBbind
9-mer
2ms4
RCSB PDB
PDBbind
9-mer
2oei
RCSB PDB
PDBbind
9-mer
2oi9
RCSB PDB
PDBbind
9-mer
2q8y
RCSB PDB
PDBbind
9-mer
2qt5
RCSB PDB
PDBbind
9-mer
2rm0
RCSB PDB
PDBbind
9-mer
2v83
RCSB PDB
PDBbind
9-mer
2v86
RCSB PDB
PDBbind
9-mer
2vpe
RCSB PDB
PDBbind
9-mer
2w0z
RCSB PDB
PDBbind
9-mer
2x3t
RCSB PDB
PDBbind
9-mer
2x4o
RCSB PDB
PDBbind
9-mer
2x4r
RCSB PDB
PDBbind
9-mer
2x4s
RCSB PDB
PDBbind
9-mer
2x4t
RCSB PDB
PDBbind
9-mer
2x4u
RCSB PDB
PDBbind
9-mer
2xhs
RCSB PDB
PDBbind
9-mer
2ymt
RCSB PDB
PDBbind
9-mer
3ah8
RCSB PDB
PDBbind
9-mer
3bgm
RCSB PDB
PDBbind
9-mer
3bze
RCSB PDB
PDBbind
9-mer
3bzf
RCSB PDB
PDBbind
9-mer
3bzi
RCSB PDB
PDBbind
9-mer
3cii
RCSB PDB
PDBbind
9-mer
3cyy
RCSB PDB
PDBbind
9-mer
3d1f
RCSB PDB
PDBbind
9-mer
3d25
RCSB PDB
PDBbind
9-mer
3drg
RCSB PDB
PDBbind
9-mer
3ery
RCSB PDB
PDBbind
9-mer
3fbr
RCSB PDB
PDBbind
9-mer
3fn0
RCSB PDB
PDBbind
9-mer
3ft2
RCSB PDB
PDBbind
9-mer
3ft3
RCSB PDB
PDBbind
9-mer
3ft4
RCSB PDB
PDBbind
9-mer
3gl6
RCSB PDB
PDBbind
9-mer
3iet
RCSB PDB
PDBbind
9-mer
3k27
RCSB PDB
PDBbind
9-mer
3lqi
RCSB PDB
PDBbind
9-mer
3lqj
RCSB PDB
PDBbind
9-mer
3mxc
RCSB PDB
PDBbind
9-mer
3mxy
RCSB PDB
PDBbind
9-mer
3o4l
RCSB PDB
PDBbind
9-mer
3o6m
RCSB PDB
PDBbind
9-mer
3obq
RCSB PDB
PDBbind
9-mer
3obu
RCSB PDB
PDBbind
9-mer
3obx
RCSB PDB
PDBbind
9-mer
3qfd
RCSB PDB
PDBbind
9-mer
3r0h
RCSB PDB
PDBbind
9-mer
3r42
RCSB PDB
PDBbind
9-mer
3rwc
RCSB PDB
PDBbind
9-mer
3rwe
RCSB PDB
PDBbind
9-mer
3rwf
RCSB PDB
PDBbind
9-mer
3rwg
RCSB PDB
PDBbind
9-mer
3soq
RCSB PDB
PDBbind
9-mer
3sou
RCSB PDB
PDBbind
9-mer
3sov
RCSB PDB
PDBbind
9-mer
3sow
RCSB PDB
PDBbind
9-mer
3t5i
RCSB PDB
PDBbind
9-mer
3tf7
RCSB PDB
PDBbind
9-mer
3tfk
RCSB PDB
PDBbind
9-mer
3tjh
RCSB PDB
PDBbind
9-mer
3tpu
RCSB PDB
PDBbind
9-mer
3zhf
RCSB PDB
PDBbind
9-mer
4bt9
RCSB PDB
PDBbind
9-mer
4btb
RCSB PDB
PDBbind
9-mer
4cdr
RCSB PDB
PDBbind
9-mer
4ezq
RCSB PDB
PDBbind
9-mer
4ezt
RCSB PDB
PDBbind
9-mer
4fcm
RCSB PDB
PDBbind
9-mer
4fmn
RCSB PDB
PDBbind
9-mer
4i80
RCSB PDB
PDBbind
9-mer
4iho
RCSB PDB
PDBbind
9-mer
4j3u
RCSB PDB
PDBbind
9-mer
4mex
RCSB PDB
PDBbind
9-mer
4mnq
RCSB PDB
PDBbind
9-mer
4mzf
RCSB PDB
PDBbind
9-mer
4mzh
RCSB PDB
PDBbind
9-mer
4o2e
RCSB PDB
PDBbind
9-mer
4od7
RCSB PDB
PDBbind
9-mer
4pg9
RCSB PDB
PDBbind
9-mer
4pgb
RCSB PDB
PDBbind
9-mer
4pgc
RCSB PDB
PDBbind
9-mer
4pgd
RCSB PDB
PDBbind
9-mer
4pge
RCSB PDB
PDBbind
9-mer
4qbm
RCSB PDB
PDBbind
9-mer
4rh5
RCSB PDB
PDBbind
9-mer
4utn
RCSB PDB
PDBbind
9-mer
4utr
RCSB PDB
PDBbind
9-mer
4utv
RCSB PDB
PDBbind
9-mer
4utx
RCSB PDB
PDBbind
9-mer
4uu7
RCSB PDB
PDBbind
9-mer
4uu8
RCSB PDB
PDBbind
9-mer
4uua
RCSB PDB
PDBbind
9-mer
4uub
RCSB PDB
PDBbind
9-mer
4x3h
RCSB PDB
PDBbind
9-mer
4y5i
RCSB PDB
PDBbind
9-mer
4yoz
RCSB PDB
PDBbind
9-mer
5apr
RCSB PDB
PDBbind
9-mer
5brz
RCSB PDB
PDBbind
9-mer
5bs0
RCSB PDB
PDBbind
9-mer
5cvd
RCSB PDB
PDBbind
9-mer
5d0j
RCSB PDB
PDBbind
9-mer
5dms
RCSB PDB
PDBbind
9-mer
5e4w
RCSB PDB
PDBbind
9-mer
5eel
RCSB PDB
PDBbind
9-mer
5eok
RCSB PDB
PDBbind
9-mer
5fjw
RCSB PDB
PDBbind
9-mer
5gu4
RCSB PDB
PDBbind
9-mer
5hda
RCSB PDB
PDBbind
9-mer
5heb
RCSB PDB
PDBbind
9-mer
5hed
RCSB PDB
PDBbind
9-mer
5hey
RCSB PDB
PDBbind
9-mer
5hf1
RCSB PDB
PDBbind
9-mer
5hfb
RCSB PDB
PDBbind
9-mer
5hfc
RCSB PDB
PDBbind
9-mer
5hff
RCSB PDB
PDBbind
9-mer
5hjc
RCSB PDB
PDBbind
9-mer
5hkh
RCSB PDB
PDBbind
9-mer
5i8c
RCSB PDB
PDBbind
9-mer
5isz
RCSB PDB
PDBbind
9-mer
5jhd
RCSB PDB
PDBbind
9-mer
5lb7
RCSB PDB
PDBbind
9-mer
5lgs
RCSB PDB
PDBbind
9-mer
5nme
RCSB PDB
PDBbind
9-mer
5nmf
RCSB PDB
PDBbind
9-mer
5nmg
RCSB PDB
PDBbind
9-mer
5npr
RCSB PDB
PDBbind
9-mer
5nps
RCSB PDB
PDBbind
9-mer
5swf
RCSB PDB
PDBbind
9-mer
5u98
RCSB PDB
PDBbind
9-mer
5w1v
RCSB PDB
PDBbind
9-mer
5w1w
RCSB PDB
PDBbind
9-mer
5w7x
RCSB PDB
PDBbind
9-mer
5yc3
RCSB PDB
PDBbind
9-mer
5yc4
RCSB PDB
PDBbind
9-mer
5ygf
RCSB PDB
PDBbind
9-mer
5yvx
RCSB PDB
PDBbind
9-mer
5yy4
RCSB PDB
PDBbind
9-mer
5zia
RCSB PDB
PDBbind
9-mer
6bj2
RCSB PDB
PDBbind
9-mer
6bj3
RCSB PDB
PDBbind
9-mer
6c4u
RCSB PDB
PDBbind
9-mer
6evm
RCSB PDB
PDBbind
9-mer
6evn
RCSB PDB
PDBbind
9-mer
6evo
RCSB PDB
PDBbind
9-mer
6evp
RCSB PDB
PDBbind
9-mer
6fdp
RCSB PDB
PDBbind
9-mer
6fdt
RCSB PDB
PDBbind
9-mer
6qts
RCSB PDB
PDBbind
9-mer
6qtq
RCSB PDB
PDBbind
9-mer
6q38
RCSB PDB
PDBbind
9-mer
6o9c
RCSB PDB
PDBbind
9-mer
6o9b
RCSB PDB
PDBbind
9-mer
6ncp
RCSB PDB
PDBbind
9-mer
6mt6
RCSB PDB
PDBbind
9-mer
6mt5
RCSB PDB
PDBbind
9-mer
6mt4
RCSB PDB
PDBbind
9-mer
6i7a
RCSB PDB
PDBbind
9-mer
6i68
RCSB PDB
PDBbind
9-mer
6i5p
RCSB PDB
PDBbind
9-mer
6i41
RCSB PDB
PDBbind
9-mer
6hlb
RCSB PDB
PDBbind
9-mer
6eqa
RCSB PDB
PDBbind
9-mer
6d78
RCSB PDB
PDBbind
9-mer
6aee
RCSB PDB
PDBbind
9-mer
5y5w
RCSB PDB
PDBbind
9-mer
5wlg
RCSB PDB
PDBbind
9-mer
5u06
RCSB PDB
PDBbind
9-mer
5tyi
RCSB PDB
PDBbind
9-mer
5iza
RCSB PDB
PDBbind
9-mer
5iz9
RCSB PDB
PDBbind
9-mer
5iz6
RCSB PDB
PDBbind
9-mer
6a9c
RCSB PDB
PDBbind
9-mer
5b6g
RCSB PDB
PDBbind
9-mer
Entry Information
PDB ID
5u1q
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Growth factor receptor-bound protein 7
Ligand Name
9-mer
EC.Number
E.C.-.-.-.-
Resolution
2.1(Å)
Affinity (Kd/Ki/IC50)
Kd=1.1uM
Release Year
2017
Protein/NA Sequence
Check fasta file
Primary Reference
(2017) J. Med. Chem. Vol. 60: pp. 9349-9359
Ligand Properties
Formula
C
4
9
H
6
5
N
1
2
O
1
7
S
Molecular Weight
1126.180
Exact Mass
1125.430
No. of atoms
144
No. of bonds
148
Polar Surface Area
485.18
LOGP Value
-2.50 (
Computed with XLOGP3
)
-0.33 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 13
No. of Hydrogen Bond Acceptors: 16
No. of Rotatable Bonds: 11
No. of Nitrogen and Oxygen Atoms: 29
No. of Rings: 5
Canonical SMILES
OC(=O)CC[C@@H]1NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@@H]2CCCCNC(=O)CC[C@@H]([C@@H]3[N@@H+]([C@@H](CSCC(=O)N2)C(=O)N)O3)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC1=O)Cc1ccc(cc1)O)CC(=O)O)CC(=O)N
InChI String
InChI=1S/C49H64N12O17S/c50-36(63)20-33-47(76)57-30-13-15-37(64)52-17-5-4-8-28(54-39(66)24-79-23-35(42(51)71)61-49(30)78-61)44(73)58-32(18-25-6-2-1-3-7-25)46(75)56-29(14-16-40(67)68)43(72)53-22-38(65)55-31(19-26-9-11-27(62)12-10-26)45(74)60-34(21-41(69)70)48(77)59-33/h1-3,6-7,9-12,28-35,49,62H,4-5,8,13-24H2,(H2,50,63)(H2,51,71)(H,52,64)(H,53,72)(H,54,66)(H,55,65)(H,56,75)(H,57,76)(H,58,73)(H,59,77)(H,60,74)(H,67,68)(H,69,70)/p+1/t28-,29-,30-,31-,32-,33-,34-,35-,49+,61+/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
Q14451
Entrez Gene ID
NCBI Entrez Gene ID:
2886
ASD
Information of known allosteric effects of PDB entries
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