Browse entries in the PDBbind-CN Database
HEADER 6NVH_COMPLEX COMPND 6NVH_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 23 ASP LEU PRO LEU ASP PRO LEU TRP GLU PHE PRO ARG ASP SEQRES 2 A 23 ARG LEU VAL LEU GLY LYS PRO LEU GLY GLU SEQRES 1 A 148 GLY GLN VAL VAL ARG ALA GLU ALA PHE GLY MET ASP PRO SEQRES 2 A 148 ALA ARG PRO ASP GLN ALA SER THR VAL ALA VAL LYS MET SEQRES 3 A 148 LEU LYS ASP ASN ALA SER ASP LYS ASP LEU ALA ASP LEU SEQRES 4 A 148 VAL SER GLU MET GLU VAL MET LYS LEU ILE GLY ARG HIS SEQRES 5 A 148 LYS ASN ILE ILE ASN LEU LEU GLY VAL CYS THR GLN GLU SEQRES 6 A 148 GLY PRO LEU TYR VAL ILE VAL GLU CYS ALA ALA LYS GLY SEQRES 7 A 148 ASN LEU ARG GLU PHE LEU ARG ALA ARG ARG PRO PRO GLY SEQRES 8 A 148 SER SER GLU GLY PRO LEU SER PHE PRO VAL LEU VAL SER SEQRES 9 A 148 CYS ALA TYR GLN VAL ALA ARG GLY MET GLN TYR LEU GLU SEQRES 10 A 148 SER ARG LYS CYS ILE HIS ARG ASP LEU ALA ALA ARG ASN SEQRES 11 A 148 VAL LEU VAL THR GLU ASP ASN VAL MET LYS ILE ALA ASP SEQRES 12 A 148 PHE GLY LEU ALA ARG SEQRES 1 A 100 LEU PRO VAL LYS TRP MET ALA PRO GLU ALA LEU PHE ASP SEQRES 2 A 100 ARG VAL TYR THR HIS GLN SER ASP VAL TRP SER PHE GLY SEQRES 3 A 100 ILE LEU LEU TRP GLU ILE PHE THR LEU GLY GLY SER PRO SEQRES 4 A 100 TYR PRO GLY ILE PRO VAL GLU GLU LEU PHE SER LEU LEU SEQRES 5 A 100 ARG GLU GLY HIS ARG MET ASP ARG PRO PRO HIS CYS PRO SEQRES 6 A 100 PRO GLU LEU TYR GLY LEU MET ARG GLU CYS TRP HIS ALA SEQRES 7 A 100 ALA PRO SER GLN ARG PRO THR PHE LYS GLN LEU VAL GLU SEQRES 8 A 100 ALA LEU ASP LYS VAL LEU LEU ALA VAL HET XL A 6 57 ATOM 1 N ASP A 453 -15.322 -24.423 20.263 1.00 79.81 N ATOM 2 CA ASP A 453 -15.341 -24.893 18.844 1.00 78.47 C ATOM 3 C ASP A 453 -14.393 -26.093 18.691 1.00 77.22 C ATOM 4 O ASP A 453 -14.891 -27.207 18.424 1.00 75.99 O ATOM 5 CB ASP A 453 -14.981 -23.755 17.883 1.00 77.21 C ATOM 6 HN3 ASP A 453 -14.355 -24.138 20.519 1.00 0.00 H ATOM 7 HN2 ASP A 453 -15.634 -25.195 20.887 1.00 0.00 H ATOM 8 HN1 ASP A 453 -15.963 -23.611 20.367 1.00 0.00 H ATOM 9 N LEU A 454 -13.085 -25.876 18.894 1.00 72.19 N ATOM 10 CA LEU A 454 -11.992 -26.809 18.493 1.00 67.54 C ATOM 11 C LEU A 454 -11.572 -27.687 19.668 1.00 60.35 C ATOM 12 O LEU A 454 -11.438 -27.212 20.790 1.00 60.59 O ATOM 13 CB LEU A 454 -10.794 -25.997 17.990 1.00 67.85 C ATOM 14 CG LEU A 454 -11.055 -25.084 16.792 1.00 68.94 C ATOM 15 CD1 LEU A 454 -9.914 -24.092 16.612 1.00 70.07 C ATOM 16 CD2 LEU A 454 -11.265 -25.895 15.520 1.00 70.47 C ATOM 17 H LEU A 454 -12.812 -24.991 19.367 1.00 0.00 H ATOM 18 N PRO A 455 -11.293 -28.990 19.439 1.00 60.15 N ATOM 19 CA PRO A 455 -10.795 -29.867 20.498 1.00 56.50 C ATOM 20 C PRO A 455 -9.377 -29.475 20.936 1.00 54.39 C ATOM 21 O PRO A 455 -8.653 -28.930 20.135 1.00 55.62 O ATOM 22 CB PRO A 455 -10.782 -31.270 19.869 1.00 57.74 C ATOM 23 CG PRO A 455 -10.729 -31.020 18.375 1.00 58.72 C ATOM 24 CD PRO A 455 -11.422 -29.688 18.150 1.00 60.38 C ATOM 25 N LEU A 456 -9.038 -29.756 22.193 1.00 49.11 N ATOM 26 CA LEU A 456 -7.680 -29.574 22.768 1.00 50.20 C ATOM 27 C LEU A 456 -6.847 -30.811 22.427 1.00 48.26 C ATOM 28 O LEU A 456 -7.229 -31.930 22.848 1.00 47.48 O ATOM 29 CB LEU A 456 -7.791 -29.377 24.283 1.00 50.52 C ATOM 30 CG LEU A 456 -6.560 -28.777 24.963 1.00 53.77 C ATOM 31 CD1 LEU A 456 -6.920 -28.235 26.339 1.00 58.04 C ATOM 32 CD2 LEU A 456 -5.438 -29.794 25.081 1.00 53.74 C ATOM 33 H LEU A 456 -9.779 -30.131 22.819 1.00 0.00 H ATOM 34 N ASP A 457 -5.766 -30.628 21.668 1.00 42.39 N ATOM 35 CA ASP A 457 -4.829 -31.725 21.316 1.00 42.04 C ATOM 36 C ASP A 457 -3.629 -31.649 22.255 1.00 40.52 C ATOM 37 O ASP A 457 -2.788 -30.766 22.121 1.00 42.01 O ATOM 38 CB ASP A 457 -4.403 -31.654 19.848 1.00 41.04 C ATOM 39 CG ASP A 457 -3.503 -32.805 19.452 1.00 41.71 C ATOM 40 OD1 ASP A 457 -3.002 -33.491 20.371 1.00 38.88 O ATOM 41 OD2 ASP A 457 -3.320 -33.008 18.230 1.00 41.37 O ATOM 42 H ASP A 457 -5.570 -29.673 21.306 1.00 0.00 H ATOM 43 N PRO A 458 -3.483 -32.591 23.210 1.00 41.88 N ATOM 44 CA PRO A 458 -2.441 -32.487 24.233 1.00 40.45 C ATOM 45 C PRO A 458 -1.024 -32.671 23.672 1.00 38.70 C ATOM 46 O PRO A 458 -0.068 -32.350 24.341 1.00 38.19 O ATOM 47 CB PRO A 458 -2.800 -33.601 25.225 1.00 43.40 C ATOM 48 CG PRO A 458 -3.545 -34.622 24.378 1.00 44.32 C ATOM 49 CD PRO A 458 -4.307 -33.803 23.357 1.00 44.72 C ATOM 50 N LEU A 459 -0.901 -33.154 22.442 1.00 38.93 N ATOM 51 CA LEU A 459 0.433 -33.307 21.804 1.00 37.72 C ATOM 52 C LEU A 459 0.936 -31.952 21.280 1.00 35.71 C ATOM 53 O LEU A 459 2.151 -31.861 21.035 1.00 36.20 O ATOM 54 CB LEU A 459 0.324 -34.342 20.685 1.00 37.99 C ATOM 55 CG LEU A 459 0.038 -35.774 21.137 1.00 40.45 C ATOM 56 CD1 LEU A 459 -0.186 -36.685 19.932 1.00 41.67 C ATOM 57 CD2 LEU A 459 1.163 -36.314 22.009 1.00 40.72 C ATOM 58 H LEU A 459 -1.754 -33.431 21.915 1.00 0.00 H ATOM 59 N TRP A 460 0.054 -30.955 21.103 1.00 34.65 N ATOM 60 CA TRP A 460 0.367 -29.716 20.328 1.00 33.94 C ATOM 61 C TRP A 460 -0.023 -28.417 21.045 1.00 36.63 C ATOM 62 O TRP A 460 0.550 -27.373 20.684 1.00 35.88 O ATOM 63 CB TRP A 460 -0.285 -29.789 18.947 1.00 32.88 C ATOM 64 CG TRP A 460 0.376 -30.813 18.088 1.00 32.49 C ATOM 65 CD1 TRP A 460 -0.081 -32.060 17.778 1.00 34.76 C ATOM 66 CD2 TRP A 460 1.672 -30.697 17.475 1.00 35.45 C ATOM 67 NE1 TRP A 460 0.824 -32.714 16.990 1.00 33.92 N ATOM 68 CE2 TRP A 460 1.908 -31.899 16.778 1.00 35.67 C ATOM 69 CE3 TRP A 460 2.632 -29.683 17.419 1.00 36.05 C ATOM 70 CZ2 TRP A 460 3.073 -32.111 16.040 1.00 37.10 C ATOM 71 CZ3 TRP A 460 3.787 -29.898 16.703 1.00 38.04 C ATOM 72 CH2 TRP A 460 4.005 -31.096 16.020 1.00 36.96 C ATOM 73 HE1 TRP A 460 0.710 -33.676 16.611 1.00 0.00 H ATOM 74 H TRP A 460 -0.892 -31.050 21.525 1.00 0.00 H ATOM 75 N GLU A 461 -0.969 -28.445 21.989 1.00 37.20 N ATOM 76 CA GLU A 461 -1.495 -27.202 22.603 1.00 37.86 C ATOM 77 C GLU A 461 -0.343 -26.504 23.341 1.00 36.78 C ATOM 78 O GLU A 461 0.397 -27.189 24.076 1.00 37.76 O ATOM 79 CB GLU A 461 -2.678 -27.495 23.527 1.00 40.61 C ATOM 80 CG GLU A 461 -3.429 -26.245 23.944 1.00 40.65 C ATOM 81 CD GLU A 461 -4.268 -25.600 22.853 1.00 44.27 C ATOM 82 OE1 GLU A 461 -4.575 -24.405 22.995 1.00 44.77 O ATOM 83 OE2 GLU A 461 -4.631 -26.294 21.873 1.00 42.05 O ATOM 84 H GLU A 461 -1.346 -29.363 22.301 1.00 0.00 H ATOM 85 N PHE A 462 -0.180 -25.200 23.096 1.00 38.09 N ATOM 86 CA PHE A 462 0.878 -24.333 23.678 1.00 40.68 C ATOM 87 C PHE A 462 0.199 -23.190 24.436 1.00 40.86 C ATOM 88 O PHE A 462 -0.791 -22.631 23.956 1.00 41.97 O ATOM 89 CB PHE A 462 1.806 -23.807 22.576 1.00 39.79 C ATOM 90 CG PHE A 462 3.017 -23.074 23.090 1.00 37.78 C ATOM 91 CD1 PHE A 462 4.128 -23.772 23.534 1.00 38.35 C ATOM 92 CD2 PHE A 462 3.020 -21.690 23.183 1.00 39.07 C ATOM 93 CE1 PHE A 462 5.235 -23.103 24.040 1.00 39.14 C ATOM 94 CE2 PHE A 462 4.128 -21.023 23.685 1.00 37.81 C ATOM 95 CZ PHE A 462 5.234 -21.731 24.103 1.00 39.35 C ATOM 96 H PHE A 462 -0.852 -24.753 22.441 1.00 0.00 H ATOM 97 N PRO A 463 0.695 -22.791 25.628 1.00 39.91 N ATOM 98 CA PRO A 463 -0.002 -21.785 26.436 1.00 42.43 C ATOM 99 C PRO A 463 0.104 -20.405 25.761 1.00 42.24 C ATOM 100 O PRO A 463 1.206 -19.990 25.463 1.00 37.74 O ATOM 101 CB PRO A 463 0.698 -21.836 27.804 1.00 41.35 C ATOM 102 CG PRO A 463 1.683 -22.996 27.728 1.00 42.58 C ATOM 103 CD PRO A 463 1.933 -23.262 26.257 1.00 40.47 C ATOM 104 N ARG A 464 -1.023 -19.747 25.467 1.00 46.36 N ATOM 105 CA ARG A 464 -0.989 -18.487 24.673 1.00 50.47 C ATOM 106 C ARG A 464 -0.436 -17.359 25.549 1.00 50.80 C ATOM 107 O ARG A 464 0.042 -16.375 24.980 1.00 52.40 O ATOM 108 CB ARG A 464 -2.330 -18.160 24.005 1.00 54.46 C ATOM 109 CG ARG A 464 -3.481 -17.822 24.935 1.00 54.29 C ATOM 110 CD ARG A 464 -4.661 -17.309 24.127 1.00 53.59 C ATOM 111 NE ARG A 464 -5.377 -18.368 23.412 1.00 53.45 N ATOM 112 CZ ARG A 464 -5.652 -18.392 22.105 1.00 50.41 C ATOM 113 NH1 ARG A 464 -5.265 -17.410 21.306 1.00 47.10 N ATOM 114 NH2 ARG A 464 -6.326 -19.414 21.598 1.00 51.53 N ATOM 115 HE ARG A 464 -5.702 -19.179 23.976 1.00 0.00 H ATOM 116 HH12 ARG A 464 -5.489 -17.447 20.291 1.00 0.00 H ATOM 117 HH11 ARG A 464 -4.737 -16.602 21.693 1.00 0.00 H ATOM 118 HH22 ARG A 464 -6.544 -19.440 20.581 1.00 0.00 H ATOM 119 HH21 ARG A 464 -6.637 -20.190 22.217 1.00 0.00 H ATOM 120 H ARG A 464 -1.936 -20.120 25.797 1.00 0.00 H ATOM 121 N ASP A 465 -0.421 -17.538 26.871 1.00 53.58 N ATOM 122 CA ASP A 465 0.219 -16.589 27.823 1.00 59.22 C ATOM 123 C ASP A 465 1.750 -16.663 27.702 1.00 56.18 C ATOM 124 O ASP A 465 2.410 -15.726 28.188 1.00 57.00 O ATOM 125 CB ASP A 465 -0.241 -16.836 29.264 1.00 66.96 C ATOM 126 CG ASP A 465 -0.016 -18.257 29.754 1.00 73.74 C ATOM 127 OD1 ASP A 465 -0.861 -19.128 29.442 1.00 77.78 O ATOM 128 OD2 ASP A 465 1.006 -18.485 30.435 1.00 79.85 O ATOM 129 H ASP A 465 -0.881 -18.387 27.258 1.00 0.00 H ATOM 130 N ARG A 466 2.306 -17.718 27.088 1.00 50.59 N ATOM 131 CA ARG A 466 3.775 -17.869 26.887 1.00 48.55 C ATOM 132 C ARG A 466 4.160 -17.519 25.441 1.00 46.76 C ATOM 133 O ARG A 466 5.300 -17.801 25.050 1.00 43.53 O ATOM 134 CB ARG A 466 4.212 -19.279 27.282 1.00 53.57 C ATOM 135 CG ARG A 466 3.896 -19.605 28.733 1.00 59.56 C ATOM 136 CD ARG A 466 4.781 -20.699 29.280 1.00 64.50 C ATOM 137 NE ARG A 466 6.101 -20.196 29.630 1.00 71.86 N ATOM 138 CZ ARG A 466 7.106 -20.951 30.063 1.00 77.58 C ATOM 139 NH1 ARG A 466 8.267 -20.389 30.355 1.00 79.55 N ATOM 140 NH2 ARG A 466 6.951 -22.260 30.200 1.00 78.49 N ATOM 141 HE ARG A 466 6.270 -19.174 29.535 1.00 0.00 H ATOM 142 HH12 ARG A 466 9.057 -20.974 30.694 1.00 0.00 H ATOM 143 HH11 ARG A 466 8.390 -19.362 30.245 1.00 0.00 H ATOM 144 HH22 ARG A 466 7.741 -22.845 30.539 1.00 0.00 H ATOM 145 HH21 ARG A 466 6.039 -22.703 29.968 1.00 0.00 H ATOM 146 H ARG A 466 1.680 -18.469 26.734 1.00 0.00 H ATOM 147 N LEU A 467 3.243 -16.908 24.691 1.00 48.37 N ATOM 148 CA LEU A 467 3.459 -16.457 23.295 1.00 48.90 C ATOM 149 C LEU A 467 3.260 -14.938 23.235 1.00 50.68 C ATOM 150 O LEU A 467 2.117 -14.490 23.426 1.00 52.29 O ATOM 151 CB LEU A 467 2.470 -17.197 22.394 1.00 49.97 C ATOM 152 CG LEU A 467 2.697 -17.035 20.893 1.00 50.10 C ATOM 153 CD1 LEU A 467 3.971 -17.744 20.456 1.00 48.07 C ATOM 154 CD2 LEU A 467 1.493 -17.541 20.110 1.00 51.29 C ATOM 155 H LEU A 467 2.309 -16.735 25.115 1.00 0.00 H ATOM 156 N VAL A 468 4.344 -14.193 22.987 1.00 51.79 N ATOM 157 CA VAL A 468 4.375 -12.700 22.900 1.00 50.17 C ATOM 158 C VAL A 468 4.378 -12.291 21.420 1.00 46.91 C ATOM 159 O VAL A 468 5.449 -12.355 20.792 1.00 44.85 O ATOM 160 CB VAL A 468 5.599 -12.135 23.647 1.00 52.29 C ATOM 161 CG1 VAL A 468 5.643 -10.612 23.602 1.00 54.47 C ATOM 162 CG2 VAL A 468 5.655 -12.630 25.085 1.00 53.98 C ATOM 163 H VAL A 468 5.243 -14.696 22.842 1.00 0.00 H ATOM 164 N LEU A 469 3.216 -11.894 20.896 1.00 46.17 N ATOM 165 CA LEU A 469 3.020 -11.472 19.485 1.00 50.29 C ATOM 166 C LEU A 469 3.817 -10.188 19.209 1.00 55.98 C ATOM 167 O LEU A 469 3.716 -9.242 20.022 1.00 54.41 O ATOM 168 CB LEU A 469 1.529 -11.242 19.226 1.00 50.80 C ATOM 169 CG LEU A 469 0.618 -12.465 19.313 1.00 53.27 C ATOM 170 CD1 LEU A 469 -0.761 -12.132 18.758 1.00 54.01 C ATOM 171 CD2 LEU A 469 1.210 -13.663 18.580 1.00 54.36 C ATOM 172 H LEU A 469 2.386 -11.879 21.522 1.00 0.00 H ATOM 173 N GLY A 470 4.555 -10.159 18.092 1.00 54.39 N ATOM 174 CA GLY A 470 5.406 -9.031 17.663 1.00 53.25 C ATOM 175 C GLY A 470 4.989 -8.496 16.303 1.00 49.71 C ATOM 176 O GLY A 470 3.779 -8.502 16.018 1.00 49.37 O ATOM 177 H GLY A 470 4.527 -10.998 17.478 1.00 0.00 H ATOM 178 N LYS A 471 5.963 -8.062 15.494 1.00 54.75 N ATOM 179 CA LYS A 471 5.758 -7.341 14.206 1.00 55.52 C ATOM 180 C LYS A 471 5.171 -8.286 13.164 1.00 59.59 C ATOM 181 O LYS A 471 5.658 -9.403 12.999 1.00 59.42 O ATOM 182 CB LYS A 471 7.082 -6.785 13.672 1.00 56.52 C ATOM 183 H LYS A 471 6.944 -8.243 15.789 1.00 0.00 H ATOM 184 N PRO A 472 4.124 -7.862 12.416 1.00 58.82 N ATOM 185 CA PRO A 472 3.608 -8.645 11.293 1.00 57.23 C ATOM 186 C PRO A 472 4.706 -9.055 10.298 1.00 55.60 C ATOM 187 O PRO A 472 5.650 -8.295 10.123 1.00 53.04 O ATOM 188 CB PRO A 472 2.610 -7.695 10.614 1.00 59.45 C ATOM 189 CG PRO A 472 2.162 -6.765 11.725 1.00 58.22 C ATOM 190 CD PRO A 472 3.367 -6.617 12.630 1.00 60.31 C ATOM 191 N LEU A 473 4.568 -10.239 9.691 1.00 52.25 N ATOM 192 CA LEU A 473 5.453 -10.730 8.599 1.00 50.99 C ATOM 193 C LEU A 473 4.743 -10.582 7.249 1.00 52.58 C ATOM 194 O LEU A 473 5.442 -10.285 6.272 1.00 54.35 O ATOM 195 CB LEU A 473 5.833 -12.187 8.869 1.00 51.73 C ATOM 196 CG LEU A 473 6.796 -12.403 10.032 1.00 54.58 C ATOM 197 CD1 LEU A 473 6.812 -13.863 10.462 1.00 56.59 C ATOM 198 CD2 LEU A 473 8.195 -11.934 9.668 1.00 54.74 C ATOM 199 H LEU A 473 3.792 -10.857 10.002 1.00 0.00 H ATOM 200 N GLY A 474 3.421 -10.791 7.205 1.00 53.58 N ATOM 201 CA GLY A 474 2.577 -10.664 5.998 1.00 57.38 C ATOM 202 C GLY A 474 1.099 -10.652 6.355 1.00 62.19 C ATOM 203 O GLY A 474 0.769 -11.155 7.448 1.00 60.96 O ATOM 204 H GLY A 474 2.950 -11.065 8.091 1.00 0.00 H ATOM 205 N GLU A 475 0.243 -10.104 5.477 1.00 68.30 N ATOM 206 CA GLU A 475 -1.212 -9.871 5.733 1.00 70.15 C ATOM 207 C GLU A 475 -2.019 -10.043 4.439 1.00 70.46 C ATOM 208 O GLU A 475 -1.815 -11.080 3.773 1.00 75.45 O ATOM 209 CB GLU A 475 -1.437 -8.470 6.310 1.00 70.73 C ATOM 210 H GLU A 475 0.620 -9.821 4.550 1.00 0.00 H TER 211 GLU A 475 ATOM 212 N GLY A 479 -6.756 -13.327 6.918 1.00 63.61 N ATOM 213 CA GLY A 479 -5.669 -14.003 7.659 1.00 65.49 C ATOM 214 C GLY A 479 -4.349 -13.244 7.594 1.00 64.68 C ATOM 215 O GLY A 479 -4.157 -12.460 6.648 1.00 71.09 O ATOM 216 HN3 GLY A 479 -6.489 -13.239 5.917 1.00 0.00 H ATOM 217 HN2 GLY A 479 -6.913 -12.381 7.321 1.00 0.00 H ATOM 218 HN1 GLY A 479 -7.628 -13.888 6.997 1.00 0.00 H ATOM 219 N GLN A 480 -3.457 -13.475 8.562 1.00 60.88 N ATOM 220 CA GLN A 480 -2.157 -12.763 8.676 1.00 58.18 C ATOM 221 C GLN A 480 -1.139 -13.658 9.391 1.00 52.56 C ATOM 222 O GLN A 480 -1.552 -14.607 10.065 1.00 52.11 O ATOM 223 CB GLN A 480 -2.345 -11.437 9.423 1.00 60.85 C ATOM 224 CG GLN A 480 -2.465 -11.595 10.933 1.00 62.62 C ATOM 225 CD GLN A 480 -2.933 -10.336 11.620 1.00 64.31 C ATOM 226 OE1 GLN A 480 -4.119 -10.018 11.624 1.00 68.90 O ATOM 227 NE2 GLN A 480 -2.000 -9.622 12.229 1.00 63.88 N ATOM 228 HE22 GLN A 480 -1.007 -9.930 12.199 1.00 0.00 H ATOM 229 HE21 GLN A 480 -2.260 -8.753 12.738 1.00 0.00 H ATOM 230 H GLN A 480 -3.686 -14.195 9.277 1.00 0.00 H ATOM 231 N VAL A 481 0.143 -13.334 9.254 1.00 47.39 N ATOM 232 CA VAL A 481 1.274 -14.047 9.908 1.00 49.76 C ATOM 233 C VAL A 481 2.092 -13.021 10.695 1.00 48.87 C ATOM 234 O VAL A 481 2.527 -12.015 10.096 1.00 49.09 O ATOM 235 CB VAL A 481 2.135 -14.797 8.874 1.00 48.00 C ATOM 236 CG1 VAL A 481 3.354 -15.445 9.515 1.00 47.62 C ATOM 237 CG2 VAL A 481 1.314 -15.819 8.107 1.00 47.58 C ATOM 238 H VAL A 481 0.373 -12.523 8.645 1.00 0.00 H ATOM 239 N VAL A 482 2.297 -13.260 11.989 1.00 46.62 N ATOM 240 CA VAL A 482 3.069 -12.330 12.858 1.00 48.87 C ATOM 241 C VAL A 482 4.258 -13.083 13.450 1.00 48.60 C ATOM 242 O VAL A 482 4.151 -14.295 13.730 1.00 50.76 O ATOM 243 CB VAL A 482 2.188 -11.664 13.935 1.00 51.53 C ATOM 244 CG1 VAL A 482 0.907 -11.101 13.335 1.00 53.32 C ATOM 245 CG2 VAL A 482 1.865 -12.599 15.085 1.00 52.86 C ATOM 246 H VAL A 482 1.904 -14.127 12.407 1.00 0.00 H ATOM 247 N ARG A 483 5.369 -12.373 13.578 1.00 44.85 N ATOM 248 CA ARG A 483 6.560 -12.793 14.347 1.00 47.24 C ATOM 249 C ARG A 483 6.168 -12.819 15.829 1.00 46.66 C ATOM 250 O ARG A 483 5.284 -12.026 16.212 1.00 48.91 O ATOM 251 CB ARG A 483 7.673 -11.800 14.018 1.00 51.62 C ATOM 252 CG ARG A 483 9.058 -12.198 14.483 1.00 55.25 C ATOM 253 CD ARG A 483 10.018 -11.238 13.822 1.00 60.66 C ATOM 254 NE ARG A 483 11.363 -11.411 14.328 1.00 65.40 N ATOM 255 CZ ARG A 483 12.439 -10.828 13.817 1.00 69.92 C ATOM 256 NH1 ARG A 483 12.330 -10.021 12.772 1.00 69.71 N ATOM 257 NH2 ARG A 483 13.622 -11.060 14.358 1.00 70.91 N ATOM 258 HE ARG A 483 11.495 -12.036 15.149 1.00 0.00 H ATOM 259 HH12 ARG A 483 13.177 -9.566 12.375 1.00 0.00 H ATOM 260 HH11 ARG A 483 11.397 -9.842 12.348 1.00 0.00 H ATOM 261 HH22 ARG A 483 14.472 -10.607 13.964 1.00 0.00 H ATOM 262 HH21 ARG A 483 13.704 -11.695 15.177 1.00 0.00 H ATOM 263 H ARG A 483 5.406 -11.450 13.101 1.00 0.00 H ATOM 264 N ALA A 484 6.766 -13.709 16.624 1.00 43.61 N ATOM 265 CA ALA A 484 6.469 -13.848 18.069 1.00 43.77 C ATOM 266 C ALA A 484 7.687 -14.391 18.818 1.00 43.13 C ATOM 267 O ALA A 484 8.567 -15.018 18.194 1.00 39.47 O ATOM 268 CB ALA A 484 5.265 -14.737 18.272 1.00 42.05 C ATOM 269 H ALA A 484 7.480 -14.340 16.206 1.00 0.00 H ATOM 270 N GLU A 485 7.726 -14.129 20.123 1.00 45.59 N ATOM 271 CA GLU A 485 8.632 -14.807 21.083 1.00 48.02 C ATOM 272 C GLU A 485 7.814 -15.888 21.792 1.00 44.65 C ATOM 273 O GLU A 485 6.723 -15.569 22.312 1.00 46.50 O ATOM 274 CB GLU A 485 9.248 -13.806 22.066 1.00 51.60 C ATOM 275 CG GLU A 485 10.284 -12.894 21.423 1.00 58.66 C ATOM 276 CD GLU A 485 11.469 -13.599 20.778 1.00 60.82 C ATOM 277 OE1 GLU A 485 12.156 -14.380 21.476 1.00 65.89 O ATOM 278 OE2 GLU A 485 11.700 -13.371 19.569 1.00 67.42 O ATOM 279 H GLU A 485 7.080 -13.403 20.493 1.00 0.00 H ATOM 280 N ALA A 486 8.298 -17.127 21.766 1.00 42.11 N ATOM 281 CA ALA A 486 7.675 -18.274 22.464 1.00 42.50 C ATOM 282 C ALA A 486 8.593 -18.683 23.611 1.00 43.73 C ATOM 283 O ALA A 486 9.801 -18.855 23.355 1.00 47.89 O ATOM 284 CB ALA A 486 7.447 -19.409 21.496 1.00 41.64 C ATOM 285 H ALA A 486 9.167 -17.300 21.222 1.00 0.00 H ATOM 286 N PHE A 487 8.047 -18.816 24.822 1.00 45.57 N ATOM 287 CA PHE A 487 8.795 -19.265 26.024 1.00 47.18 C ATOM 288 C PHE A 487 8.425 -20.720 26.317 1.00 47.08 C ATOM 289 O PHE A 487 7.242 -21.002 26.580 1.00 45.84 O ATOM 290 CB PHE A 487 8.515 -18.335 27.208 1.00 50.49 C ATOM 291 CG PHE A 487 8.994 -16.922 26.989 1.00 54.32 C ATOM 292 CD1 PHE A 487 10.288 -16.552 27.329 1.00 55.92 C ATOM 293 CD2 PHE A 487 8.167 -15.977 26.397 1.00 56.24 C ATOM 294 CE1 PHE A 487 10.738 -15.261 27.103 1.00 54.67 C ATOM 295 CE2 PHE A 487 8.619 -14.684 26.176 1.00 59.86 C ATOM 296 CZ PHE A 487 9.902 -14.329 26.530 1.00 56.37 C ATOM 297 H PHE A 487 7.037 -18.592 24.930 1.00 0.00 H ATOM 298 N GLY A 488 9.411 -21.609 26.234 1.00 47.45 N ATOM 299 CA GLY A 488 9.268 -23.027 26.610 1.00 54.63 C ATOM 300 C GLY A 488 9.018 -23.939 25.421 1.00 52.72 C ATOM 301 O GLY A 488 8.606 -25.081 25.666 1.00 53.24 O ATOM 302 H GLY A 488 10.335 -21.285 25.884 1.00 0.00 H ATOM 303 N MET A 489 9.290 -23.487 24.188 1.00 52.64 N ATOM 304 CA MET A 489 9.242 -24.358 22.979 1.00 54.31 C ATOM 305 C MET A 489 10.211 -25.531 23.159 1.00 56.61 C ATOM 306 O MET A 489 9.964 -26.577 22.550 1.00 58.94 O ATOM 307 CB MET A 489 9.609 -23.610 21.693 1.00 51.67 C ATOM 308 CG MET A 489 8.422 -23.007 20.994 1.00 50.82 C ATOM 309 SD MET A 489 7.079 -24.200 20.751 1.00 46.98 S ATOM 310 CE MET A 489 5.760 -23.093 20.261 1.00 45.44 C ATOM 311 H MET A 489 9.545 -22.486 24.070 1.00 0.00 H ATOM 312 N ASP A 490 11.279 -25.343 23.939 1.00 57.70 N ATOM 313 CA ASP A 490 12.158 -26.428 24.451 1.00 60.20 C ATOM 314 C ASP A 490 11.700 -26.791 25.864 1.00 59.47 C ATOM 315 O ASP A 490 11.962 -26.054 26.812 1.00 56.50 O ATOM 316 CB ASP A 490 13.634 -26.014 24.405 1.00 65.24 C ATOM 317 CG ASP A 490 14.600 -27.141 24.737 1.00 71.67 C ATOM 318 OD1 ASP A 490 14.149 -28.304 24.784 1.00 80.50 O ATOM 319 OD2 ASP A 490 15.796 -26.852 24.952 1.00 72.81 O ATOM 320 H ASP A 490 11.513 -24.366 24.208 1.00 0.00 H ATOM 321 N PRO A 491 10.965 -27.913 26.049 1.00 61.74 N ATOM 322 CA PRO A 491 10.645 -28.428 27.384 1.00 63.73 C ATOM 323 C PRO A 491 11.847 -28.627 28.324 1.00 65.66 C ATOM 324 O PRO A 491 11.658 -28.537 29.517 1.00 72.86 O ATOM 325 CB PRO A 491 10.004 -29.792 27.086 1.00 64.39 C ATOM 326 CG PRO A 491 9.375 -29.612 25.725 1.00 64.06 C ATOM 327 CD PRO A 491 10.334 -28.705 24.982 1.00 63.76 C ATOM 328 N ALA A 492 13.036 -28.900 27.781 1.00 71.95 N ATOM 329 CA ALA A 492 14.302 -29.021 28.547 1.00 75.53 C ATOM 330 C ALA A 492 14.579 -27.709 29.298 1.00 77.98 C ATOM 331 O ALA A 492 14.694 -27.761 30.539 1.00 82.63 O ATOM 332 CB ALA A 492 15.439 -29.388 27.622 1.00 78.13 C ATOM 333 H ALA A 492 13.078 -29.037 26.751 1.00 0.00 H ATOM 334 N ARG A 493 14.659 -26.586 28.571 1.00 72.32 N ATOM 335 CA ARG A 493 14.889 -25.217 29.110 1.00 67.88 C ATOM 336 C ARG A 493 13.609 -24.394 28.952 1.00 66.44 C ATOM 337 O ARG A 493 13.491 -23.588 28.032 1.00 60.19 O ATOM 338 CB ARG A 493 16.077 -24.569 28.389 1.00 67.72 C ATOM 339 H ARG A 493 14.551 -26.679 27.541 1.00 0.00 H ATOM 340 N PRO A 494 12.601 -24.567 29.840 1.00 64.66 N ATOM 341 CA PRO A 494 11.291 -23.936 29.652 1.00 64.71 C ATOM 342 C PRO A 494 11.272 -22.403 29.776 1.00 67.58 C ATOM 343 O PRO A 494 10.302 -21.798 29.336 1.00 68.71 O ATOM 344 CB PRO A 494 10.417 -24.560 30.752 1.00 64.31 C ATOM 345 CG PRO A 494 11.399 -25.014 31.808 1.00 65.15 C ATOM 346 CD PRO A 494 12.658 -25.393 31.055 1.00 64.61 C ATOM 347 N ASP A 495 12.318 -21.814 30.364 1.00 68.31 N ATOM 348 CA ASP A 495 12.465 -20.344 30.546 1.00 68.99 C ATOM 349 C ASP A 495 12.873 -19.700 29.208 1.00 68.42 C ATOM 350 O ASP A 495 12.453 -18.548 28.971 1.00 67.53 O ATOM 351 CB ASP A 495 13.463 -20.031 31.667 1.00 65.00 C ATOM 352 H ASP A 495 13.081 -22.425 30.719 1.00 0.00 H ATOM 353 N GLN A 496 13.627 -20.424 28.365 1.00 62.53 N ATOM 354 CA GLN A 496 14.346 -19.890 27.169 1.00 59.58 C ATOM 355 C GLN A 496 13.346 -19.440 26.092 1.00 58.48 C ATOM 356 O GLN A 496 12.348 -20.158 25.838 1.00 49.57 O ATOM 357 CB GLN A 496 15.318 -20.932 26.604 1.00 56.48 C ATOM 358 H GLN A 496 13.718 -21.441 28.561 1.00 0.00 H ATOM 359 N ALA A 497 13.623 -18.290 25.473 1.00 54.55 N ATOM 360 CA ALA A 497 12.829 -17.687 24.378 1.00 53.74 C ATOM 361 C ALA A 497 13.333 -18.202 23.023 1.00 51.53 C ATOM 362 O ALA A 497 14.521 -18.538 22.897 1.00 49.79 O ATOM 363 CB ALA A 497 12.921 -16.186 24.450 1.00 55.94 C ATOM 364 H ALA A 497 14.469 -17.773 25.787 1.00 0.00 H ATOM 365 N SER A 498 12.441 -18.262 22.040 1.00 49.89 N ATOM 366 CA SER A 498 12.774 -18.560 20.625 1.00 47.20 C ATOM 367 C SER A 498 11.823 -17.766 19.729 1.00 42.17 C ATOM 368 O SER A 498 10.653 -17.558 20.120 1.00 43.84 O ATOM 369 CB SER A 498 12.707 -20.045 20.352 1.00 48.11 C ATOM 370 OG SER A 498 11.385 -20.526 20.551 1.00 48.42 O ATOM 371 HG SER A 498 10.768 -20.056 19.936 1.00 0.00 H ATOM 372 H SER A 498 11.444 -18.089 22.278 1.00 0.00 H ATOM 373 N THR A 499 12.311 -17.323 18.576 1.00 39.98 N ATOM 374 CA THR A 499 11.518 -16.536 17.605 1.00 42.62 C ATOM 375 C THR A 499 10.768 -17.524 16.714 1.00 38.72 C ATOM 376 O THR A 499 11.402 -18.420 16.167 1.00 40.84 O ATOM 377 CB THR A 499 12.399 -15.561 16.815 1.00 44.23 C ATOM 378 OG1 THR A 499 13.092 -14.765 17.777 1.00 46.37 O ATOM 379 CG2 THR A 499 11.607 -14.676 15.877 1.00 45.63 C ATOM 380 HG1 THR A 499 12.435 -14.276 18.334 1.00 0.00 H ATOM 381 H THR A 499 13.301 -17.540 18.343 1.00 0.00 H ATOM 382 N VAL A 500 9.461 -17.344 16.592 1.00 38.05 N ATOM 383 CA VAL A 500 8.576 -18.242 15.800 1.00 40.04 C ATOM 384 C VAL A 500 7.697 -17.361 14.923 1.00 40.84 C ATOM 385 O VAL A 500 7.729 -16.116 15.082 1.00 38.91 O ATOM 386 CB VAL A 500 7.752 -19.158 16.726 1.00 37.43 C ATOM 387 CG1 VAL A 500 8.659 -20.006 17.605 1.00 37.34 C ATOM 388 CG2 VAL A 500 6.762 -18.375 17.573 1.00 39.26 C ATOM 389 H VAL A 500 9.030 -16.531 17.076 1.00 0.00 H ATOM 390 N ALA A 501 6.964 -17.985 14.013 1.00 37.64 N ATOM 391 CA ALA A 501 5.954 -17.313 13.177 1.00 38.54 C ATOM 392 C ALA A 501 4.583 -17.852 13.580 1.00 38.08 C ATOM 393 O ALA A 501 4.469 -19.058 13.838 1.00 38.61 O ATOM 394 CB ALA A 501 6.255 -17.544 11.719 1.00 36.89 C ATOM 395 H ALA A 501 7.110 -19.006 13.881 1.00 0.00 H ATOM 396 N VAL A 502 3.576 -16.994 13.630 1.00 38.07 N ATOM 397 CA VAL A 502 2.212 -17.382 14.076 1.00 38.01 C ATOM 398 C VAL A 502 1.249 -17.038 12.954 1.00 40.49 C ATOM 399 O VAL A 502 1.225 -15.862 12.554 1.00 41.82 O ATOM 400 CB VAL A 502 1.834 -16.679 15.391 1.00 40.12 C ATOM 401 CG1 VAL A 502 0.487 -17.164 15.914 1.00 41.85 C ATOM 402 CG2 VAL A 502 2.929 -16.833 16.438 1.00 39.61 C ATOM 403 H VAL A 502 3.746 -16.008 13.346 1.00 0.00 H ATOM 404 N LYS A 503 0.510 -18.030 12.456 1.00 40.12 N ATOM 405 CA LYS A 503 -0.585 -17.816 11.480 1.00 41.82 C ATOM 406 C LYS A 503 -1.907 -17.718 12.243 1.00 43.70 C ATOM 407 O LYS A 503 -2.124 -18.495 13.197 1.00 42.28 O ATOM 408 CB LYS A 503 -0.656 -18.922 10.424 1.00 44.15 C ATOM 409 CG LYS A 503 -1.641 -18.628 9.302 1.00 44.90 C ATOM 410 CD LYS A 503 -1.684 -19.663 8.206 1.00 45.12 C ATOM 411 CE LYS A 503 -0.647 -19.463 7.131 1.00 46.93 C ATOM 412 NZ LYS A 503 -1.099 -20.075 5.859 1.00 47.86 N ATOM 413 HZ1 LYS A 503 -1.250 -21.094 6.000 1.00 0.00 H ATOM 414 HZ2 LYS A 503 -1.990 -19.630 5.559 1.00 0.00 H ATOM 415 HZ3 LYS A 503 -0.374 -19.929 5.128 1.00 0.00 H ATOM 416 H LYS A 503 0.712 -19.001 12.768 1.00 0.00 H ATOM 417 N MET A 504 -2.758 -16.784 11.827 1.00 44.95 N ATOM 418 CA MET A 504 -4.066 -16.523 12.469 1.00 47.43 C ATOM 419 C MET A 504 -4.996 -15.895 11.435 1.00 48.08 C ATOM 420 O MET A 504 -4.503 -15.495 10.364 1.00 46.78 O ATOM 421 CB MET A 504 -3.906 -15.596 13.678 1.00 50.67 C ATOM 422 CG MET A 504 -3.380 -14.214 13.335 1.00 51.52 C ATOM 423 SD MET A 504 -3.038 -13.232 14.813 1.00 54.69 S ATOM 424 CE MET A 504 -1.372 -13.751 15.214 1.00 50.87 C ATOM 425 H MET A 504 -2.490 -16.205 11.006 1.00 0.00 H ATOM 426 N LEU A 505 -6.292 -15.855 11.751 1.00 52.43 N ATOM 427 CA LEU A 505 -7.351 -15.224 10.923 1.00 56.86 C ATOM 428 C LEU A 505 -7.451 -13.735 11.288 1.00 60.39 C ATOM 429 O LEU A 505 -7.001 -13.352 12.401 1.00 57.33 O ATOM 430 CB LEU A 505 -8.677 -15.951 11.173 1.00 57.73 C ATOM 431 CG LEU A 505 -8.694 -17.442 10.835 1.00 58.17 C ATOM 432 CD1 LEU A 505 -9.931 -18.107 11.411 1.00 59.53 C ATOM 433 CD2 LEU A 505 -8.619 -17.672 9.335 1.00 57.30 C ATOM 434 H LEU A 505 -6.582 -16.300 12.645 1.00 0.00 H ATOM 435 N LYS A 506 -7.988 -12.931 10.365 1.00 66.83 N ATOM 436 CA LYS A 506 -8.431 -11.530 10.603 1.00 71.09 C ATOM 437 C LYS A 506 -9.944 -11.558 10.825 1.00 71.13 C ATOM 438 O LYS A 506 -10.583 -12.496 10.317 1.00 63.08 O ATOM 439 CB LYS A 506 -8.040 -10.622 9.431 1.00 72.61 C ATOM 440 CG LYS A 506 -6.614 -10.087 9.484 1.00 74.49 C ATOM 441 CD LYS A 506 -5.999 -9.830 8.123 1.00 76.67 C ATOM 442 CE LYS A 506 -6.794 -8.875 7.257 1.00 76.26 C ATOM 443 NZ LYS A 506 -6.177 -8.737 5.918 1.00 77.10 N ATOM 444 HZ1 LYS A 506 -5.209 -8.370 6.020 1.00 0.00 H ATOM 445 HZ2 LYS A 506 -6.149 -9.667 5.453 1.00 0.00 H ATOM 446 HZ3 LYS A 506 -6.741 -8.078 5.344 1.00 0.00 H ATOM 447 H LYS A 506 -8.106 -13.314 9.405 1.00 0.00 H ATOM 448 N ASP A 507 -10.480 -10.558 11.535 1.00 76.54 N ATOM 449 CA ASP A 507 -11.902 -10.475 11.979 1.00 80.44 C ATOM 450 C ASP A 507 -12.857 -10.717 10.797 1.00 80.10 C ATOM 451 O ASP A 507 -13.924 -11.325 11.026 1.00 79.71 O ATOM 452 CB ASP A 507 -12.201 -9.130 12.654 1.00 84.29 C ATOM 453 CG ASP A 507 -11.410 -8.882 13.930 1.00 83.31 C ATOM 454 OD1 ASP A 507 -10.164 -8.829 13.850 1.00 84.39 O ATOM 455 OD2 ASP A 507 -12.045 -8.742 14.995 1.00 84.44 O ATOM 456 H ASP A 507 -9.852 -9.772 11.800 1.00 0.00 H ATOM 457 N ASN A 508 -12.481 -10.291 9.583 1.00 77.95 N ATOM 458 CA ASN A 508 -13.321 -10.376 8.355 1.00 79.02 C ATOM 459 C ASN A 508 -13.435 -11.824 7.849 1.00 78.92 C ATOM 460 O ASN A 508 -14.106 -12.018 6.818 1.00 80.63 O ATOM 461 CB ASN A 508 -12.775 -9.468 7.248 1.00 76.39 C ATOM 462 H ASN A 508 -11.534 -9.871 9.491 1.00 0.00 H ATOM 463 N ALA A 509 -12.830 -12.803 8.537 1.00 78.85 N ATOM 464 CA ALA A 509 -12.685 -14.206 8.072 1.00 73.98 C ATOM 465 C ALA A 509 -14.014 -14.957 8.195 1.00 71.26 C ATOM 466 O ALA A 509 -14.682 -14.807 9.235 1.00 71.32 O ATOM 467 CB ALA A 509 -11.603 -14.911 8.851 1.00 74.62 C ATOM 468 H ALA A 509 -12.432 -12.562 9.467 1.00 0.00 H ATOM 469 N SER A 510 -14.353 -15.757 7.177 1.00 69.33 N ATOM 470 CA SER A 510 -15.576 -16.600 7.108 1.00 67.91 C ATOM 471 C SER A 510 -15.318 -17.964 7.759 1.00 71.63 C ATOM 472 O SER A 510 -14.165 -18.230 8.176 1.00 72.71 O ATOM 473 CB SER A 510 -16.051 -16.754 5.680 1.00 66.94 C ATOM 474 OG SER A 510 -15.255 -17.691 4.969 1.00 64.90 O ATOM 475 HG SER A 510 -14.315 -17.381 4.957 1.00 0.00 H ATOM 476 H SER A 510 -13.705 -15.792 6.364 1.00 0.00 H ATOM 477 N ASP A 511 -16.361 -18.797 7.830 1.00 71.18 N ATOM 478 CA ASP A 511 -16.324 -20.175 8.390 1.00 68.53 C ATOM 479 C ASP A 511 -15.346 -21.023 7.563 1.00 65.53 C ATOM 480 O ASP A 511 -14.657 -21.876 8.157 1.00 60.87 O ATOM 481 CB ASP A 511 -17.734 -20.775 8.440 1.00 66.38 C ATOM 482 H ASP A 511 -17.272 -18.454 7.464 1.00 0.00 H ATOM 483 N LYS A 512 -15.287 -20.786 6.246 1.00 65.27 N ATOM 484 CA LYS A 512 -14.417 -21.521 5.287 1.00 63.68 C ATOM 485 C LYS A 512 -12.951 -21.149 5.539 1.00 62.75 C ATOM 486 O LYS A 512 -12.102 -22.053 5.466 1.00 61.30 O ATOM 487 CB LYS A 512 -14.810 -21.220 3.837 1.00 61.50 C ATOM 488 H LYS A 512 -15.894 -20.032 5.865 1.00 0.00 H ATOM 489 N ASP A 513 -12.669 -19.871 5.813 1.00 62.14 N ATOM 490 CA ASP A 513 -11.304 -19.374 6.134 1.00 60.93 C ATOM 491 C ASP A 513 -10.782 -20.150 7.348 1.00 57.77 C ATOM 492 O ASP A 513 -9.612 -20.569 7.312 1.00 51.73 O ATOM 493 CB ASP A 513 -11.282 -17.863 6.391 1.00 64.04 C ATOM 494 CG ASP A 513 -11.644 -17.004 5.187 1.00 65.29 C ATOM 495 OD1 ASP A 513 -11.318 -17.405 4.053 1.00 64.33 O ATOM 496 OD2 ASP A 513 -12.244 -15.932 5.397 1.00 66.21 O ATOM 497 H ASP A 513 -13.450 -19.184 5.801 1.00 0.00 H ATOM 498 N LEU A 514 -11.628 -20.346 8.367 1.00 53.69 N ATOM 499 CA LEU A 514 -11.271 -21.075 9.614 1.00 54.96 C ATOM 500 C LEU A 514 -11.012 -22.548 9.281 1.00 51.48 C ATOM 501 O LEU A 514 -9.973 -23.067 9.725 1.00 49.65 O ATOM 502 CB LEU A 514 -12.388 -20.922 10.654 1.00 54.18 C ATOM 503 CG LEU A 514 -12.209 -21.745 11.929 1.00 56.20 C ATOM 504 CD1 LEU A 514 -11.015 -21.249 12.735 1.00 55.77 C ATOM 505 CD2 LEU A 514 -13.474 -21.719 12.773 1.00 57.47 C ATOM 506 H LEU A 514 -12.592 -19.966 8.282 1.00 0.00 H ATOM 507 N ALA A 515 -11.920 -23.181 8.528 1.00 51.27 N ATOM 508 CA ALA A 515 -11.835 -24.594 8.082 1.00 52.50 C ATOM 509 C ALA A 515 -10.507 -24.834 7.350 1.00 49.46 C ATOM 510 O ALA A 515 -9.912 -25.888 7.584 1.00 48.36 O ATOM 511 CB ALA A 515 -13.016 -24.947 7.205 1.00 50.68 C ATOM 512 H ALA A 515 -12.755 -22.637 8.231 1.00 0.00 H ATOM 513 N ASP A 516 -10.073 -23.884 6.510 1.00 49.51 N ATOM 514 CA ASP A 516 -8.805 -23.946 5.730 1.00 48.98 C ATOM 515 C ASP A 516 -7.593 -23.906 6.665 1.00 47.46 C ATOM 516 O ASP A 516 -6.639 -24.660 6.411 1.00 45.75 O ATOM 517 CB ASP A 516 -8.702 -22.797 4.726 1.00 51.49 C ATOM 518 CG ASP A 516 -9.723 -22.884 3.607 1.00 57.84 C ATOM 519 OD1 ASP A 516 -10.247 -23.995 3.384 1.00 57.65 O ATOM 520 OD2 ASP A 516 -9.989 -21.838 2.973 1.00 63.61 O ATOM 521 H ASP A 516 -10.667 -23.038 6.394 1.00 0.00 H ATOM 522 N LEU A 517 -7.602 -23.036 7.679 1.00 43.75 N ATOM 523 CA LEU A 517 -6.478 -22.918 8.646 1.00 43.57 C ATOM 524 C LEU A 517 -6.446 -24.159 9.553 1.00 43.09 C ATOM 525 O LEU A 517 -5.337 -24.604 9.907 1.00 40.59 O ATOM 526 CB LEU A 517 -6.629 -21.629 9.459 1.00 43.18 C ATOM 527 CG LEU A 517 -5.512 -21.363 10.464 1.00 43.26 C ATOM 528 CD1 LEU A 517 -4.159 -21.350 9.773 1.00 42.39 C ATOM 529 CD2 LEU A 517 -5.747 -20.058 11.206 1.00 44.07 C ATOM 530 H LEU A 517 -8.429 -22.416 7.797 1.00 0.00 H ATOM 531 N VAL A 518 -7.606 -24.703 9.932 1.00 41.54 N ATOM 532 CA VAL A 518 -7.685 -25.974 10.713 1.00 40.10 C ATOM 533 C VAL A 518 -7.110 -27.107 9.846 1.00 38.27 C ATOM 534 O VAL A 518 -6.318 -27.929 10.352 1.00 36.83 O ATOM 535 CB VAL A 518 -9.127 -26.268 11.169 1.00 40.35 C ATOM 536 CG1 VAL A 518 -9.258 -27.667 11.749 1.00 40.81 C ATOM 537 CG2 VAL A 518 -9.620 -25.230 12.168 1.00 41.63 C ATOM 538 H VAL A 518 -8.491 -24.222 9.673 1.00 0.00 H ATOM 539 N SER A 519 -7.463 -27.137 8.568 1.00 36.82 N ATOM 540 CA SER A 519 -6.974 -28.165 7.614 1.00 39.30 C ATOM 541 C SER A 519 -5.446 -28.083 7.512 1.00 36.97 C ATOM 542 O SER A 519 -4.790 -29.133 7.597 1.00 32.49 O ATOM 543 CB SER A 519 -7.638 -28.041 6.270 1.00 41.56 C ATOM 544 OG SER A 519 -6.972 -28.861 5.324 1.00 44.86 O ATOM 545 HG SER A 519 -6.027 -28.576 5.249 1.00 0.00 H ATOM 546 H SER A 519 -8.114 -26.405 8.217 1.00 0.00 H ATOM 547 N GLU A 520 -4.880 -26.885 7.392 1.00 37.68 N ATOM 548 CA GLU A 520 -3.404 -26.723 7.263 1.00 35.27 C ATOM 549 C GLU A 520 -2.726 -27.215 8.553 1.00 34.54 C ATOM 550 O GLU A 520 -1.743 -27.987 8.455 1.00 33.51 O ATOM 551 CB GLU A 520 -3.042 -25.280 6.913 1.00 37.64 C ATOM 552 CG GLU A 520 -1.545 -25.076 6.742 1.00 40.97 C ATOM 553 CD GLU A 520 -1.154 -23.680 6.297 1.00 46.03 C ATOM 554 OE1 GLU A 520 -2.036 -22.786 6.342 1.00 44.33 O ATOM 555 OE2 GLU A 520 0.032 -23.493 5.917 1.00 43.73 O ATOM 556 H GLU A 520 -5.484 -26.038 7.388 1.00 0.00 H ATOM 557 N MET A 521 -3.244 -26.820 9.719 1.00 33.83 N ATOM 558 CA MET A 521 -2.766 -27.287 11.048 1.00 34.15 C ATOM 559 C MET A 521 -2.803 -28.823 11.087 1.00 32.60 C ATOM 560 O MET A 521 -1.777 -29.439 11.408 1.00 30.68 O ATOM 561 CB MET A 521 -3.632 -26.696 12.168 1.00 37.26 C ATOM 562 CG MET A 521 -3.389 -27.310 13.527 1.00 41.09 C ATOM 563 SD MET A 521 -4.462 -26.604 14.812 1.00 42.31 S ATOM 564 CE MET A 521 -6.057 -27.280 14.350 1.00 45.93 C ATOM 565 H MET A 521 -4.032 -26.142 9.696 1.00 0.00 H ATOM 566 N GLU A 522 -3.937 -29.438 10.756 1.00 33.44 N ATOM 567 CA GLU A 522 -4.104 -30.913 10.857 1.00 33.68 C ATOM 568 C GLU A 522 -3.171 -31.627 9.880 1.00 30.69 C ATOM 569 O GLU A 522 -2.603 -32.674 10.277 1.00 30.41 O ATOM 570 CB GLU A 522 -5.567 -31.308 10.655 1.00 36.58 C ATOM 571 CG GLU A 522 -6.427 -30.957 11.861 1.00 39.15 C ATOM 572 CD GLU A 522 -5.882 -31.485 13.178 1.00 40.91 C ATOM 573 OE1 GLU A 522 -5.538 -32.681 13.242 1.00 49.67 O ATOM 574 OE2 GLU A 522 -5.766 -30.701 14.123 1.00 44.47 O ATOM 575 H GLU A 522 -4.735 -28.866 10.414 1.00 0.00 H ATOM 576 N VAL A 523 -3.011 -31.133 8.654 1.00 31.83 N ATOM 577 CA VAL A 523 -2.114 -31.825 7.678 1.00 34.51 C ATOM 578 C VAL A 523 -0.665 -31.704 8.170 1.00 31.79 C ATOM 579 O VAL A 523 0.065 -32.688 8.010 1.00 31.97 O ATOM 580 CB VAL A 523 -2.275 -31.368 6.212 1.00 38.23 C ATOM 581 CG1 VAL A 523 -3.690 -31.592 5.696 1.00 39.97 C ATOM 582 CG2 VAL A 523 -1.840 -29.934 5.979 1.00 41.07 C ATOM 583 H VAL A 523 -3.511 -30.265 8.375 1.00 0.00 H ATOM 584 N MET A 524 -0.272 -30.578 8.770 1.00 30.91 N ATOM 585 CA MET A 524 1.124 -30.401 9.268 1.00 30.77 C ATOM 586 C MET A 524 1.410 -31.362 10.434 1.00 30.56 C ATOM 587 O MET A 524 2.509 -31.943 10.482 1.00 28.29 O ATOM 588 CB MET A 524 1.377 -28.949 9.671 1.00 30.64 C ATOM 589 CG MET A 524 1.472 -28.049 8.449 1.00 31.63 C ATOM 590 SD MET A 524 1.959 -26.365 8.874 1.00 34.15 S ATOM 591 CE MET A 524 3.676 -26.623 9.324 1.00 31.72 C ATOM 592 H MET A 524 -0.956 -29.804 8.894 1.00 0.00 H ATOM 593 N LYS A 525 0.447 -31.561 11.335 1.00 33.52 N ATOM 594 CA LYS A 525 0.576 -32.559 12.430 1.00 32.10 C ATOM 595 C LYS A 525 0.824 -33.941 11.823 1.00 29.71 C ATOM 596 O LYS A 525 1.770 -34.613 12.263 1.00 33.02 O ATOM 597 CB LYS A 525 -0.681 -32.615 13.298 1.00 35.19 C ATOM 598 CG LYS A 525 -0.999 -31.386 14.131 1.00 35.74 C ATOM 599 CD LYS A 525 -2.239 -31.641 14.969 1.00 36.70 C ATOM 600 CE LYS A 525 -2.691 -30.477 15.817 1.00 37.02 C ATOM 601 NZ LYS A 525 -3.947 -30.833 16.530 1.00 39.33 N ATOM 602 HZ1 LYS A 525 -4.686 -31.061 15.835 1.00 0.00 H ATOM 603 HZ2 LYS A 525 -3.776 -31.658 17.140 1.00 0.00 H ATOM 604 HZ3 LYS A 525 -4.254 -30.028 17.112 1.00 0.00 H ATOM 605 H LYS A 525 -0.425 -30.998 11.270 1.00 0.00 H ATOM 606 N LEU A 526 0.002 -34.359 10.863 1.00 30.36 N ATOM 607 CA LEU A 526 0.080 -35.722 10.266 1.00 33.17 C ATOM 608 C LEU A 526 1.395 -35.894 9.494 1.00 35.22 C ATOM 609 O LEU A 526 2.022 -36.962 9.597 1.00 31.44 O ATOM 610 CB LEU A 526 -1.132 -35.939 9.362 1.00 38.64 C ATOM 611 CG LEU A 526 -1.216 -37.310 8.689 1.00 42.47 C ATOM 612 CD1 LEU A 526 -1.398 -38.416 9.722 1.00 44.54 C ATOM 613 CD2 LEU A 526 -2.346 -37.331 7.674 1.00 46.83 C ATOM 614 H LEU A 526 -0.727 -33.705 10.514 1.00 0.00 H ATOM 615 N ILE A 527 1.817 -34.900 8.706 1.00 32.32 N ATOM 616 CA ILE A 527 3.067 -35.029 7.899 1.00 31.97 C ATOM 617 C ILE A 527 4.274 -35.248 8.829 1.00 30.69 C ATOM 618 O ILE A 527 5.202 -35.993 8.439 1.00 31.39 O ATOM 619 CB ILE A 527 3.254 -33.809 6.969 1.00 31.61 C ATOM 620 CG1 ILE A 527 2.278 -33.860 5.790 1.00 34.19 C ATOM 621 CG2 ILE A 527 4.703 -33.708 6.517 1.00 32.25 C ATOM 622 CD1 ILE A 527 2.181 -32.563 5.002 1.00 35.35 C ATOM 623 H ILE A 527 1.265 -34.020 8.654 1.00 0.00 H ATOM 624 N GLY A 528 4.299 -34.599 9.994 1.00 31.02 N ATOM 625 CA GLY A 528 5.382 -34.761 10.986 1.00 31.42 C ATOM 626 C GLY A 528 6.602 -33.938 10.602 1.00 33.80 C ATOM 627 O GLY A 528 6.524 -33.174 9.606 1.00 31.05 O ATOM 628 H GLY A 528 3.519 -33.948 10.215 1.00 0.00 H ATOM 629 N ARG A 529 7.707 -34.086 11.330 1.00 32.29 N ATOM 630 CA ARG A 529 8.819 -33.104 11.250 1.00 37.54 C ATOM 631 C ARG A 529 9.964 -33.594 10.354 1.00 34.18 C ATOM 632 O ARG A 529 10.198 -34.803 10.229 1.00 32.24 O ATOM 633 CB ARG A 529 9.284 -32.706 12.651 1.00 39.94 C ATOM 634 CG ARG A 529 10.266 -33.651 13.318 1.00 45.74 C ATOM 635 CD ARG A 529 11.007 -32.920 14.431 1.00 50.21 C ATOM 636 NE ARG A 529 11.809 -31.829 13.890 1.00 54.16 N ATOM 637 CZ ARG A 529 12.966 -31.986 13.234 1.00 60.00 C ATOM 638 NH1 ARG A 529 13.479 -33.194 13.043 1.00 59.40 N ATOM 639 NH2 ARG A 529 13.612 -30.927 12.771 1.00 54.08 N ATOM 640 HE ARG A 529 11.457 -30.859 14.023 1.00 0.00 H ATOM 641 HH12 ARG A 529 14.378 -33.302 12.532 1.00 0.00 H ATOM 642 HH11 ARG A 529 12.982 -34.033 13.404 1.00 0.00 H ATOM 643 HH22 ARG A 529 14.511 -31.048 12.261 1.00 0.00 H ATOM 644 HH21 ARG A 529 13.221 -29.974 12.917 1.00 0.00 H ATOM 645 H ARG A 529 7.793 -34.904 11.966 1.00 0.00 H ATOM 646 N HIS A 530 10.667 -32.644 9.745 1.00 30.56 N ATOM 647 CA HIS A 530 11.889 -32.893 8.949 1.00 29.34 C ATOM 648 C HIS A 530 12.760 -31.639 8.997 1.00 28.72 C ATOM 649 O HIS A 530 12.199 -30.530 9.043 1.00 29.90 O ATOM 650 CB HIS A 530 11.527 -33.295 7.514 1.00 28.23 C ATOM 651 CG HIS A 530 12.693 -33.792 6.732 1.00 26.92 C ATOM 652 ND1 HIS A 530 13.488 -32.952 5.982 1.00 27.44 N ATOM 653 CD2 HIS A 530 13.207 -35.030 6.577 1.00 29.40 C ATOM 654 CE1 HIS A 530 14.451 -33.650 5.415 1.00 28.10 C ATOM 655 NE2 HIS A 530 14.300 -34.932 5.759 1.00 27.32 N ATOM 656 H HIS A 530 10.336 -31.662 9.834 1.00 0.00 H ATOM 657 N LYS A 531 14.070 -31.829 8.938 1.00 30.71 N ATOM 658 CA LYS A 531 15.086 -30.747 8.932 1.00 34.62 C ATOM 659 C LYS A 531 14.770 -29.721 7.829 1.00 32.27 C ATOM 660 O LYS A 531 14.956 -28.511 8.067 1.00 29.66 O ATOM 661 CB LYS A 531 16.471 -31.365 8.713 1.00 41.47 C ATOM 662 CG LYS A 531 17.623 -30.372 8.814 1.00 49.32 C ATOM 663 CD LYS A 531 18.984 -31.003 9.090 1.00 56.69 C ATOM 664 CE LYS A 531 20.103 -29.980 9.191 1.00 59.47 C ATOM 665 NZ LYS A 531 19.849 -28.988 10.267 1.00 57.02 N ATOM 666 HZ1 LYS A 531 18.962 -28.483 10.069 1.00 0.00 H ATOM 667 HZ2 LYS A 531 19.773 -29.480 11.180 1.00 0.00 H ATOM 668 HZ3 LYS A 531 20.635 -28.308 10.303 1.00 0.00 H ATOM 669 H LYS A 531 14.412 -32.810 8.892 1.00 0.00 H ATOM 670 N ASN A 532 14.311 -30.178 6.663 1.00 30.53 N ATOM 671 CA ASN A 532 14.228 -29.335 5.438 1.00 29.29 C ATOM 672 C ASN A 532 12.786 -28.913 5.126 1.00 28.70 C ATOM 673 O ASN A 532 12.501 -28.581 3.939 1.00 28.27 O ATOM 674 CB ASN A 532 14.922 -30.044 4.282 1.00 29.67 C ATOM 675 CG ASN A 532 16.384 -30.298 4.567 1.00 29.72 C ATOM 676 OD1 ASN A 532 16.813 -31.448 4.601 1.00 29.45 O ATOM 677 ND2 ASN A 532 17.146 -29.237 4.788 1.00 30.69 N ATOM 678 HD22 ASN A 532 16.734 -28.283 4.747 1.00 0.00 H ATOM 679 HD21 ASN A 532 18.157 -29.358 5.002 1.00 0.00 H ATOM 680 H ASN A 532 13.997 -31.168 6.607 1.00 0.00 H ATOM 681 N ILE A 533 11.907 -28.868 6.136 1.00 27.99 N ATOM 682 CA ILE A 533 10.563 -28.241 6.027 1.00 26.26 C ATOM 683 C ILE A 533 10.378 -27.263 7.196 1.00 26.30 C ATOM 684 O ILE A 533 11.099 -27.384 8.186 1.00 28.60 O ATOM 685 CB ILE A 533 9.449 -29.303 5.926 1.00 28.09 C ATOM 686 CG1 ILE A 533 9.203 -30.033 7.249 1.00 28.45 C ATOM 687 CG2 ILE A 533 9.756 -30.287 4.803 1.00 28.66 C ATOM 688 CD1 ILE A 533 8.074 -31.042 7.182 1.00 30.16 C ATOM 689 H ILE A 533 12.179 -29.294 7.045 1.00 0.00 H ATOM 690 N ILE A 534 9.488 -26.286 7.029 1.00 28.60 N ATOM 691 CA ILE A 534 9.031 -25.356 8.103 1.00 29.48 C ATOM 692 C ILE A 534 8.101 -26.168 9.006 1.00 28.80 C ATOM 693 O ILE A 534 7.042 -26.617 8.530 1.00 29.99 O ATOM 694 CB ILE A 534 8.344 -24.112 7.511 1.00 30.77 C ATOM 695 CG1 ILE A 534 9.331 -23.221 6.743 1.00 30.21 C ATOM 696 CG2 ILE A 534 7.615 -23.332 8.587 1.00 31.88 C ATOM 697 CD1 ILE A 534 10.364 -22.543 7.615 1.00 27.41 C ATOM 698 H ILE A 534 9.081 -26.162 6.080 1.00 0.00 H ATOM 699 N ASN A 535 8.535 -26.431 10.228 1.00 29.77 N ATOM 700 CA ASN A 535 7.869 -27.419 11.112 1.00 30.28 C ATOM 701 C ASN A 535 6.811 -26.723 11.961 1.00 31.50 C ATOM 702 O ASN A 535 7.008 -25.548 12.354 1.00 31.53 O ATOM 703 CB ASN A 535 8.888 -28.188 11.950 1.00 30.92 C ATOM 704 CG ASN A 535 9.694 -29.140 11.103 1.00 30.26 C ATOM 705 OD1 ASN A 535 9.125 -30.056 10.503 1.00 31.62 O ATOM 706 ND2 ASN A 535 11.004 -28.933 11.047 1.00 29.32 N ATOM 707 HD22 ASN A 535 11.429 -28.144 11.575 1.00 0.00 H ATOM 708 HD21 ASN A 535 11.606 -29.560 10.476 1.00 0.00 H ATOM 709 H ASN A 535 9.373 -25.927 10.582 1.00 0.00 H ATOM 710 N LEU A 536 5.722 -27.438 12.233 1.00 31.27 N ATOM 711 CA LEU A 536 4.735 -27.047 13.262 1.00 29.16 C ATOM 712 C LEU A 536 5.421 -27.146 14.625 1.00 30.65 C ATOM 713 O LEU A 536 6.142 -28.128 14.843 1.00 29.49 O ATOM 714 CB LEU A 536 3.523 -27.972 13.159 1.00 29.74 C ATOM 715 CG LEU A 536 2.371 -27.632 14.094 1.00 29.83 C ATOM 716 CD1 LEU A 536 1.740 -26.308 13.702 1.00 29.97 C ATOM 717 CD2 LEU A 536 1.330 -28.747 14.078 1.00 33.06 C ATOM 718 H LEU A 536 5.557 -28.313 11.696 1.00 0.00 H ATOM 719 N LEU A 537 5.222 -26.152 15.496 1.00 30.20 N ATOM 720 CA LEU A 537 5.841 -26.096 16.851 1.00 30.75 C ATOM 721 C LEU A 537 4.771 -26.199 17.942 1.00 31.44 C ATOM 722 O LEU A 537 5.103 -26.684 19.038 1.00 32.30 O ATOM 723 CB LEU A 537 6.635 -24.791 16.974 1.00 31.66 C ATOM 724 CG LEU A 537 7.848 -24.674 16.057 1.00 30.89 C ATOM 725 CD1 LEU A 537 8.589 -23.368 16.330 1.00 34.46 C ATOM 726 CD2 LEU A 537 8.787 -25.861 16.217 1.00 31.91 C ATOM 727 H LEU A 537 4.598 -25.370 15.211 1.00 0.00 H ATOM 728 N GLY A 538 3.547 -25.762 17.662 1.00 32.51 N ATOM 729 CA GLY A 538 2.475 -25.716 18.666 1.00 33.35 C ATOM 730 C GLY A 538 1.272 -24.971 18.144 1.00 34.80 C ATOM 731 O GLY A 538 1.365 -24.357 17.062 1.00 35.43 O ATOM 732 H GLY A 538 3.340 -25.440 16.695 1.00 0.00 H ATOM 733 N VAL A 539 0.170 -25.033 18.884 1.00 32.87 N ATOM 734 CA VAL A 539 -1.118 -24.412 18.483 1.00 35.31 C ATOM 735 C VAL A 539 -1.747 -23.800 19.736 1.00 35.30 C ATOM 736 O VAL A 539 -1.465 -24.286 20.852 1.00 39.72 O ATOM 737 CB VAL A 539 -2.057 -25.420 17.788 1.00 35.25 C ATOM 738 CG1 VAL A 539 -1.430 -25.980 16.515 1.00 36.01 C ATOM 739 CG2 VAL A 539 -2.474 -26.547 18.720 1.00 35.64 C ATOM 740 H VAL A 539 0.212 -25.542 19.790 1.00 0.00 H ATOM 741 N CYS A 540 -2.518 -22.741 19.543 1.00 38.30 N ATOM 742 CA CYS A 540 -3.429 -22.160 20.565 1.00 41.15 C ATOM 743 C CYS A 540 -4.845 -22.252 20.000 1.00 41.00 C ATOM 744 O CYS A 540 -5.116 -21.583 18.988 1.00 43.32 O ATOM 745 CB CYS A 540 -3.029 -20.728 20.907 1.00 40.28 C ATOM 746 SG CYS A 540 -1.308 -20.579 21.450 1.00 42.86 S ATOM 747 H CYS A 540 -2.484 -22.283 18.610 1.00 0.00 H ATOM 748 N THR A 541 -5.677 -23.122 20.576 1.00 40.79 N ATOM 749 CA THR A 541 -7.033 -23.440 20.062 1.00 43.34 C ATOM 750 C THR A 541 -8.128 -23.092 21.081 1.00 43.97 C ATOM 751 O THR A 541 -9.299 -23.065 20.666 1.00 46.05 O ATOM 752 CB THR A 541 -7.118 -24.922 19.686 1.00 45.20 C ATOM 753 OG1 THR A 541 -6.958 -25.661 20.897 1.00 43.24 O ATOM 754 CG2 THR A 541 -6.080 -25.315 18.653 1.00 44.26 C ATOM 755 HG1 THR A 541 -6.078 -25.448 21.298 1.00 0.00 H ATOM 756 H THR A 541 -5.356 -23.607 21.438 1.00 0.00 H ATOM 757 N GLN A 542 -7.775 -22.850 22.347 1.00 47.01 N ATOM 758 CA GLN A 542 -8.746 -22.733 23.472 1.00 51.52 C ATOM 759 C GLN A 542 -8.846 -21.275 23.932 1.00 52.96 C ATOM 760 O GLN A 542 -7.810 -20.574 23.941 1.00 51.74 O ATOM 761 CB GLN A 542 -8.330 -23.621 24.646 1.00 51.17 C ATOM 762 CG GLN A 542 -8.094 -25.077 24.269 1.00 53.31 C ATOM 763 CD GLN A 542 -9.330 -25.751 23.728 1.00 56.03 C ATOM 764 OE1 GLN A 542 -10.301 -25.969 24.445 1.00 59.05 O ATOM 765 NE2 GLN A 542 -9.301 -26.099 22.450 1.00 52.10 N ATOM 766 HE22 GLN A 542 -8.458 -25.897 21.875 1.00 0.00 H ATOM 767 HE21 GLN A 542 -10.121 -26.575 22.022 1.00 0.00 H ATOM 768 H GLN A 542 -6.763 -22.737 22.560 1.00 0.00 H ATOM 769 N GLU A 543 -10.058 -20.845 24.297 1.00 55.54 N ATOM 770 CA GLU A 543 -10.322 -19.548 24.974 1.00 54.44 C ATOM 771 C GLU A 543 -9.565 -18.439 24.236 1.00 55.19 C ATOM 772 O GLU A 543 -8.678 -17.808 24.862 1.00 55.47 O ATOM 773 CB GLU A 543 -9.896 -19.643 26.442 1.00 55.45 C ATOM 774 H GLU A 543 -10.872 -21.460 24.093 1.00 0.00 H ATOM 775 N GLY A 544 -9.872 -18.243 22.949 1.00 52.34 N ATOM 776 CA GLY A 544 -9.237 -17.215 22.101 1.00 52.08 C ATOM 777 C GLY A 544 -9.043 -17.691 20.666 1.00 52.32 C ATOM 778 O GLY A 544 -9.375 -18.823 20.330 1.00 51.55 O ATOM 779 H GLY A 544 -10.600 -18.850 22.521 1.00 0.00 H ATOM 780 N PRO A 545 -8.502 -16.833 19.775 1.00 53.18 N ATOM 781 CA PRO A 545 -8.414 -17.159 18.352 1.00 53.98 C ATOM 782 C PRO A 545 -7.425 -18.303 18.066 1.00 48.44 C ATOM 783 O PRO A 545 -6.529 -18.521 18.865 1.00 44.43 O ATOM 784 CB PRO A 545 -7.940 -15.848 17.700 1.00 55.24 C ATOM 785 CG PRO A 545 -7.240 -15.096 18.815 1.00 55.62 C ATOM 786 CD PRO A 545 -7.954 -15.504 20.087 1.00 54.66 C ATOM 787 N LEU A 546 -7.629 -19.005 16.946 1.00 47.30 N ATOM 788 CA LEU A 546 -6.728 -20.088 16.467 1.00 45.56 C ATOM 789 C LEU A 546 -5.369 -19.468 16.139 1.00 43.12 C ATOM 790 O LEU A 546 -5.324 -18.568 15.273 1.00 42.78 O ATOM 791 CB LEU A 546 -7.329 -20.783 15.238 1.00 45.51 C ATOM 792 CG LEU A 546 -6.499 -21.934 14.660 1.00 46.18 C ATOM 793 CD1 LEU A 546 -6.171 -22.973 15.726 1.00 45.87 C ATOM 794 CD2 LEU A 546 -7.209 -22.589 13.482 1.00 46.54 C ATOM 795 H LEU A 546 -8.469 -18.780 16.375 1.00 0.00 H ATOM 796 N TYR A 547 -4.322 -19.907 16.837 1.00 39.48 N ATOM 797 CA TYR A 547 -2.908 -19.635 16.483 1.00 39.99 C ATOM 798 C TYR A 547 -2.266 -20.945 16.026 1.00 38.16 C ATOM 799 O TYR A 547 -2.382 -21.959 16.744 1.00 37.26 O ATOM 800 CB TYR A 547 -2.117 -19.063 17.659 1.00 41.33 C ATOM 801 CG TYR A 547 -2.550 -17.700 18.144 1.00 43.83 C ATOM 802 CD1 TYR A 547 -3.345 -16.864 17.375 1.00 43.92 C ATOM 803 CD2 TYR A 547 -2.125 -17.232 19.378 1.00 48.05 C ATOM 804 CE1 TYR A 547 -3.724 -15.610 17.826 1.00 48.13 C ATOM 805 CE2 TYR A 547 -2.492 -15.980 19.846 1.00 49.94 C ATOM 806 CZ TYR A 547 -3.296 -15.167 19.066 1.00 50.68 C ATOM 807 OH TYR A 547 -3.651 -13.929 19.518 1.00 57.94 O ATOM 808 HH TYR A 547 -4.223 -13.484 18.843 1.00 0.00 H ATOM 809 H TYR A 547 -4.509 -20.478 17.686 1.00 0.00 H ATOM 810 N VAL A 548 -1.607 -20.912 14.870 1.00 37.23 N ATOM 811 CA VAL A 548 -0.737 -22.018 14.380 1.00 35.65 C ATOM 812 C VAL A 548 0.707 -21.514 14.408 1.00 33.96 C ATOM 813 O VAL A 548 1.040 -20.586 13.639 1.00 36.12 O ATOM 814 CB VAL A 548 -1.175 -22.503 12.988 1.00 36.08 C ATOM 815 CG1 VAL A 548 -0.354 -23.700 12.531 1.00 36.15 C ATOM 816 CG2 VAL A 548 -2.663 -22.827 12.962 1.00 37.28 C ATOM 817 H VAL A 548 -1.705 -20.065 14.274 1.00 0.00 H ATOM 818 N ILE A 549 1.528 -22.099 15.277 1.00 32.98 N ATOM 819 CA ILE A 549 2.921 -21.649 15.544 1.00 34.04 C ATOM 820 C ILE A 549 3.891 -22.534 14.762 1.00 34.05 C ATOM 821 O ILE A 549 3.872 -23.763 14.969 1.00 31.21 O ATOM 822 CB ILE A 549 3.229 -21.675 17.048 1.00 34.35 C ATOM 823 CG1 ILE A 549 2.109 -21.031 17.867 1.00 36.59 C ATOM 824 CG2 ILE A 549 4.581 -21.024 17.311 1.00 36.45 C ATOM 825 CD1 ILE A 549 2.167 -21.368 19.339 1.00 36.51 C ATOM 826 H ILE A 549 1.173 -22.923 15.803 1.00 0.00 H ATOM 827 N VAL A 550 4.758 -21.925 13.950 1.00 31.95 N ATOM 828 CA VAL A 550 5.749 -22.649 13.108 1.00 30.68 C ATOM 829 C VAL A 550 7.145 -22.026 13.273 1.00 32.74 C ATOM 830 O VAL A 550 7.270 -20.928 13.888 1.00 33.21 O ATOM 831 CB VAL A 550 5.279 -22.673 11.641 1.00 32.75 C ATOM 832 CG1 VAL A 550 3.888 -23.268 11.511 1.00 31.70 C ATOM 833 CG2 VAL A 550 5.328 -21.296 10.986 1.00 34.65 C ATOM 834 H VAL A 550 4.740 -20.886 13.903 1.00 0.00 H ATOM 835 N GLU A 551 8.163 -22.722 12.767 1.00 31.27 N ATOM 836 CA GLU A 551 9.571 -22.258 12.759 1.00 34.34 C ATOM 837 C GLU A 551 9.658 -20.955 11.953 1.00 35.64 C ATOM 838 O GLU A 551 8.956 -20.820 10.941 1.00 33.15 O ATOM 839 CB GLU A 551 10.511 -23.326 12.205 1.00 35.33 C ATOM 840 CG GLU A 551 10.724 -24.509 13.141 1.00 35.55 C ATOM 841 CD GLU A 551 11.451 -25.681 12.509 1.00 36.26 C ATOM 842 OE1 GLU A 551 11.287 -25.882 11.288 1.00 34.53 O ATOM 843 OE2 GLU A 551 12.164 -26.408 13.232 1.00 40.09 O ATOM 844 H GLU A 551 7.956 -23.652 12.350 1.00 0.00 H ATOM 845 N CYS A 552 10.484 -20.019 12.415 1.00 35.80 N ATOM 846 CA CYS A 552 10.735 -18.709 11.753 1.00 35.32 C ATOM 847 C CYS A 552 12.166 -18.737 11.208 1.00 33.91 C ATOM 848 O CYS A 552 13.097 -18.923 12.015 1.00 35.08 O ATOM 849 CB CYS A 552 10.521 -17.557 12.728 1.00 37.54 C ATOM 850 SG CYS A 552 10.422 -15.944 11.905 1.00 41.47 S ATOM 851 H CYS A 552 10.990 -20.217 13.302 1.00 0.00 H ATOM 852 N ALA A 553 12.310 -18.693 9.883 1.00 35.77 N ATOM 853 CA ALA A 553 13.597 -18.753 9.157 1.00 37.42 C ATOM 854 C ALA A 553 14.161 -17.330 9.098 1.00 35.87 C ATOM 855 O ALA A 553 13.509 -16.473 8.493 1.00 37.63 O ATOM 856 CB ALA A 553 13.395 -19.331 7.777 1.00 36.58 C ATOM 857 H ALA A 553 11.445 -18.609 9.312 1.00 0.00 H ATOM 858 N ALA A 554 15.319 -17.112 9.719 1.00 40.04 N ATOM 859 CA ALA A 554 15.910 -15.774 9.963 1.00 41.90 C ATOM 860 C ALA A 554 16.221 -15.060 8.638 1.00 41.20 C ATOM 861 O ALA A 554 16.062 -13.822 8.586 1.00 44.41 O ATOM 862 CB ALA A 554 17.139 -15.931 10.827 1.00 41.48 C ATOM 863 H ALA A 554 15.848 -17.941 10.058 1.00 0.00 H ATOM 864 N LYS A 555 16.646 -15.792 7.601 1.00 41.69 N ATOM 865 CA LYS A 555 17.251 -15.189 6.379 1.00 40.47 C ATOM 866 C LYS A 555 16.259 -15.120 5.216 1.00 39.76 C ATOM 867 O LYS A 555 16.717 -14.931 4.082 1.00 43.73 O ATOM 868 CB LYS A 555 18.519 -15.954 6.002 1.00 42.83 C ATOM 869 CG LYS A 555 19.671 -15.737 6.970 1.00 43.37 C ATOM 870 CD LYS A 555 20.965 -16.314 6.486 1.00 45.00 C ATOM 871 CE LYS A 555 22.107 -16.043 7.438 1.00 46.70 C ATOM 872 NZ LYS A 555 23.364 -16.617 6.911 1.00 48.87 N ATOM 873 HZ1 LYS A 555 23.253 -17.645 6.797 1.00 0.00 H ATOM 874 HZ2 LYS A 555 23.581 -16.186 5.989 1.00 0.00 H ATOM 875 HZ3 LYS A 555 24.139 -16.422 7.577 1.00 0.00 H ATOM 876 H LYS A 555 16.550 -16.826 7.650 1.00 0.00 H ATOM 877 N GLY A 556 14.955 -15.214 5.477 1.00 36.72 N ATOM 878 CA GLY A 556 13.912 -14.987 4.461 1.00 36.78 C ATOM 879 C GLY A 556 13.873 -16.074 3.411 1.00 35.73 C ATOM 880 O GLY A 556 14.422 -17.189 3.665 1.00 38.60 O ATOM 881 H GLY A 556 14.660 -15.459 6.444 1.00 0.00 H ATOM 882 N ASN A 557 13.226 -15.797 2.275 1.00 33.99 N ATOM 883 CA ASN A 557 13.007 -16.817 1.218 1.00 33.05 C ATOM 884 C ASN A 557 14.284 -16.944 0.375 1.00 36.80 C ATOM 885 O ASN A 557 15.155 -16.032 0.424 1.00 37.11 O ATOM 886 CB ASN A 557 11.694 -16.610 0.457 1.00 33.43 C ATOM 887 CG ASN A 557 11.739 -15.570 -0.641 1.00 33.67 C ATOM 888 OD1 ASN A 557 12.721 -15.458 -1.368 1.00 35.60 O ATOM 889 ND2 ASN A 557 10.654 -14.832 -0.781 1.00 37.99 N ATOM 890 HD22 ASN A 557 9.848 -14.966 -0.138 1.00 0.00 H ATOM 891 HD21 ASN A 557 10.605 -14.117 -1.534 1.00 0.00 H ATOM 892 H ASN A 557 12.863 -14.834 2.126 1.00 0.00 H ATOM 893 N LEU A 558 14.418 -18.079 -0.311 1.00 32.64 N ATOM 894 CA LEU A 558 15.642 -18.466 -1.057 1.00 32.59 C ATOM 895 C LEU A 558 15.827 -17.519 -2.248 1.00 33.44 C ATOM 896 O LEU A 558 16.992 -17.182 -2.555 1.00 35.53 O ATOM 897 CB LEU A 558 15.523 -19.914 -1.531 1.00 33.00 C ATOM 898 CG LEU A 558 16.713 -20.431 -2.335 1.00 32.62 C ATOM 899 CD1 LEU A 558 17.988 -20.347 -1.522 1.00 32.26 C ATOM 900 CD2 LEU A 558 16.471 -21.858 -2.805 1.00 33.17 C ATOM 901 H LEU A 558 13.612 -18.737 -0.325 1.00 0.00 H ATOM 902 N ARG A 559 14.742 -17.112 -2.901 1.00 32.67 N ATOM 903 CA ARG A 559 14.852 -16.157 -4.036 1.00 36.44 C ATOM 904 C ARG A 559 15.607 -14.905 -3.574 1.00 37.98 C ATOM 905 O ARG A 559 16.607 -14.549 -4.219 1.00 40.05 O ATOM 906 CB ARG A 559 13.480 -15.779 -4.579 1.00 40.26 C ATOM 907 CG ARG A 559 13.547 -14.853 -5.782 1.00 45.61 C ATOM 908 CD ARG A 559 12.179 -14.569 -6.353 1.00 47.45 C ATOM 909 NE ARG A 559 12.344 -13.949 -7.654 1.00 54.50 N ATOM 910 CZ ARG A 559 12.633 -12.667 -7.853 1.00 62.26 C ATOM 911 NH1 ARG A 559 12.769 -12.208 -9.087 1.00 62.15 N ATOM 912 NH2 ARG A 559 12.789 -11.848 -6.826 1.00 64.20 N ATOM 913 HE ARG A 559 12.228 -14.552 -8.493 1.00 0.00 H ATOM 914 HH12 ARG A 559 12.995 -11.206 -9.247 1.00 0.00 H ATOM 915 HH11 ARG A 559 12.650 -12.850 -9.897 1.00 0.00 H ATOM 916 HH22 ARG A 559 13.015 -10.846 -6.990 1.00 0.00 H ATOM 917 HH21 ARG A 559 12.686 -12.206 -5.855 1.00 0.00 H ATOM 918 H ARG A 559 13.807 -17.465 -2.615 1.00 0.00 H ATOM 919 N GLU A 560 15.143 -14.271 -2.497 1.00 38.67 N ATOM 920 CA GLU A 560 15.686 -12.983 -1.990 1.00 41.04 C ATOM 921 C GLU A 560 17.097 -13.203 -1.439 1.00 42.57 C ATOM 922 O GLU A 560 17.945 -12.318 -1.633 1.00 38.69 O ATOM 923 CB GLU A 560 14.755 -12.370 -0.940 1.00 44.00 C ATOM 924 CG GLU A 560 13.389 -11.966 -1.481 1.00 49.65 C ATOM 925 CD GLU A 560 13.375 -11.141 -2.762 1.00 54.38 C ATOM 926 OE1 GLU A 560 14.291 -10.305 -2.958 1.00 59.06 O ATOM 927 OE2 GLU A 560 12.446 -11.335 -3.567 1.00 58.82 O ATOM 928 H GLU A 560 14.352 -14.704 -1.979 1.00 0.00 H ATOM 929 N PHE A 561 17.340 -14.337 -0.782 1.00 39.30 N ATOM 930 CA PHE A 561 18.662 -14.729 -0.233 1.00 37.73 C ATOM 931 C PHE A 561 19.692 -14.764 -1.364 1.00 38.80 C ATOM 932 O PHE A 561 20.799 -14.218 -1.193 1.00 41.21 O ATOM 933 CB PHE A 561 18.561 -16.078 0.483 1.00 37.69 C ATOM 934 CG PHE A 561 19.874 -16.674 0.918 1.00 34.62 C ATOM 935 CD1 PHE A 561 20.411 -16.370 2.157 1.00 36.22 C ATOM 936 CD2 PHE A 561 20.559 -17.559 0.098 1.00 34.64 C ATOM 937 CE1 PHE A 561 21.613 -16.928 2.563 1.00 36.42 C ATOM 938 CE2 PHE A 561 21.761 -18.118 0.503 1.00 36.10 C ATOM 939 CZ PHE A 561 22.290 -17.796 1.732 1.00 36.66 C ATOM 940 H PHE A 561 16.546 -14.994 -0.644 1.00 0.00 H ATOM 941 N LEU A 562 19.349 -15.398 -2.486 1.00 37.58 N ATOM 942 CA LEU A 562 20.251 -15.515 -3.660 1.00 37.47 C ATOM 943 C LEU A 562 20.460 -14.132 -4.305 1.00 38.75 C ATOM 944 O LEU A 562 21.623 -13.781 -4.588 1.00 39.81 O ATOM 945 CB LEU A 562 19.644 -16.492 -4.665 1.00 37.18 C ATOM 946 CG LEU A 562 19.564 -17.952 -4.218 1.00 35.43 C ATOM 947 CD1 LEU A 562 18.749 -18.753 -5.223 1.00 35.72 C ATOM 948 CD2 LEU A 562 20.942 -18.548 -4.044 1.00 35.54 C ATOM 949 H LEU A 562 18.405 -15.831 -2.541 1.00 0.00 H ATOM 950 N ARG A 563 19.380 -13.377 -4.522 1.00 38.50 N ATOM 951 CA ARG A 563 19.428 -12.063 -5.222 1.00 41.48 C ATOM 952 C ARG A 563 20.300 -11.086 -4.417 1.00 44.53 C ATOM 953 O ARG A 563 21.116 -10.401 -5.043 1.00 44.27 O ATOM 954 CB ARG A 563 18.014 -11.539 -5.466 1.00 41.50 C ATOM 955 CG ARG A 563 17.287 -12.274 -6.577 1.00 42.74 C ATOM 956 CD ARG A 563 15.863 -11.785 -6.743 1.00 48.25 C ATOM 957 NE ARG A 563 15.831 -10.509 -7.446 1.00 51.32 N ATOM 958 CZ ARG A 563 15.971 -10.359 -8.763 1.00 53.10 C ATOM 959 NH1 ARG A 563 16.151 -11.408 -9.547 1.00 49.21 N ATOM 960 NH2 ARG A 563 15.933 -9.148 -9.293 1.00 57.04 N ATOM 961 HE ARG A 563 15.688 -9.650 -6.877 1.00 0.00 H ATOM 962 HH12 ARG A 563 16.259 -11.278 -10.573 1.00 0.00 H ATOM 963 HH11 ARG A 563 16.185 -12.363 -9.138 1.00 0.00 H ATOM 964 HH22 ARG A 563 16.042 -9.026 -10.320 1.00 0.00 H ATOM 965 HH21 ARG A 563 15.794 -8.317 -8.683 1.00 0.00 H ATOM 966 H ARG A 563 18.459 -13.724 -4.185 1.00 0.00 H ATOM 967 N ALA A 564 20.192 -11.092 -3.084 1.00 42.16 N ATOM 968 CA ALA A 564 20.967 -10.236 -2.156 1.00 44.24 C ATOM 969 C ALA A 564 22.451 -10.601 -2.183 1.00 45.16 C ATOM 970 O ALA A 564 23.240 -9.777 -1.722 1.00 47.15 O ATOM 971 CB ALA A 564 20.427 -10.346 -0.752 1.00 46.67 C ATOM 972 H ALA A 564 19.507 -11.752 -2.664 1.00 0.00 H ATOM 973 N ARG A 565 22.818 -11.785 -2.681 1.00 44.50 N ATOM 974 CA ARG A 565 24.221 -12.278 -2.664 1.00 44.68 C ATOM 975 C ARG A 565 24.795 -12.306 -4.089 1.00 42.40 C ATOM 976 O ARG A 565 25.891 -12.860 -4.262 1.00 41.17 O ATOM 977 CB ARG A 565 24.282 -13.625 -1.936 1.00 45.17 C ATOM 978 CG ARG A 565 24.249 -13.481 -0.421 1.00 48.93 C ATOM 979 CD ARG A 565 23.820 -14.733 0.323 1.00 47.34 C ATOM 980 NE ARG A 565 23.644 -14.457 1.745 1.00 47.62 N ATOM 981 CZ ARG A 565 22.589 -13.851 2.294 1.00 47.16 C ATOM 982 NH1 ARG A 565 21.563 -13.459 1.551 1.00 44.26 N ATOM 983 NH2 ARG A 565 22.560 -13.653 3.602 1.00 48.43 N ATOM 984 HE ARG A 565 24.406 -14.758 2.386 1.00 0.00 H ATOM 985 HH12 ARG A 565 20.749 -12.988 1.995 1.00 0.00 H ATOM 986 HH11 ARG A 565 21.572 -13.622 0.524 1.00 0.00 H ATOM 987 HH22 ARG A 565 21.742 -13.182 4.039 1.00 0.00 H ATOM 988 HH21 ARG A 565 23.355 -13.969 4.193 1.00 0.00 H ATOM 989 H ARG A 565 22.086 -12.392 -3.102 1.00 0.00 H ATOM 990 N ARG A 566 24.106 -11.683 -5.053 1.00 43.86 N ATOM 991 CA ARG A 566 24.635 -11.403 -6.412 1.00 44.40 C ATOM 992 C ARG A 566 25.837 -10.468 -6.284 1.00 47.48 C ATOM 993 O ARG A 566 25.761 -9.455 -5.591 1.00 46.70 O ATOM 994 CB ARG A 566 23.555 -10.772 -7.291 1.00 43.50 C ATOM 995 CG ARG A 566 22.451 -11.744 -7.673 1.00 44.34 C ATOM 996 CD ARG A 566 21.291 -11.104 -8.402 1.00 45.28 C ATOM 997 NE ARG A 566 20.568 -12.095 -9.188 1.00 42.52 N ATOM 998 CZ ARG A 566 19.726 -11.818 -10.168 1.00 46.27 C ATOM 999 NH1 ARG A 566 19.469 -10.562 -10.497 1.00 48.47 N ATOM 1000 NH2 ARG A 566 19.144 -12.802 -10.826 1.00 44.47 N ATOM 1001 HE ARG A 566 20.727 -13.097 -8.960 1.00 0.00 H ATOM 1002 HH12 ARG A 566 18.805 -10.352 -11.270 1.00 0.00 H ATOM 1003 HH11 ARG A 566 19.931 -9.785 -9.983 1.00 0.00 H ATOM 1004 HH22 ARG A 566 18.480 -12.590 -11.598 1.00 0.00 H ATOM 1005 HH21 ARG A 566 19.349 -13.790 -10.573 1.00 0.00 H ATOM 1006 H ARG A 566 23.137 -11.375 -4.836 1.00 0.00 H ATOM 1007 N PRO A 567 26.990 -10.797 -6.908 1.00 47.14 N ATOM 1008 CA PRO A 567 28.151 -9.906 -6.898 1.00 47.20 C ATOM 1009 C PRO A 567 27.927 -8.762 -7.880 1.00 47.26 C ATOM 1010 O PRO A 567 27.039 -8.854 -8.722 1.00 45.65 O ATOM 1011 CB PRO A 567 29.288 -10.822 -7.369 1.00 48.02 C ATOM 1012 CG PRO A 567 28.604 -11.817 -8.291 1.00 48.10 C ATOM 1013 CD PRO A 567 27.234 -12.029 -7.677 1.00 48.50 C ATOM 1014 N PRO A 568 28.722 -7.666 -7.829 1.00 49.56 N ATOM 1015 CA PRO A 568 28.669 -6.645 -8.876 1.00 50.11 C ATOM 1016 C PRO A 568 29.236 -7.187 -10.200 1.00 50.03 C ATOM 1017 O PRO A 568 30.346 -7.717 -10.206 1.00 48.23 O ATOM 1018 CB PRO A 568 29.511 -5.491 -8.309 1.00 49.36 C ATOM 1019 CG PRO A 568 30.463 -6.169 -7.344 1.00 52.47 C ATOM 1020 CD PRO A 568 29.703 -7.355 -6.781 1.00 49.70 C ATOM 1021 N GLY A 569 28.448 -7.072 -11.274 1.00 55.36 N ATOM 1022 CA GLY A 569 28.793 -7.506 -12.644 1.00 58.50 C ATOM 1023 C GLY A 569 29.438 -8.879 -12.666 1.00 60.92 C ATOM 1024 O GLY A 569 28.814 -9.827 -12.158 1.00 66.05 O ATOM 1025 H GLY A 569 27.512 -6.640 -11.133 1.00 0.00 H ATOM 1026 N SER A 570 30.664 -8.972 -13.191 1.00 61.68 N ATOM 1027 CA SER A 570 31.366 -10.242 -13.526 1.00 63.43 C ATOM 1028 C SER A 570 32.306 -10.697 -12.398 1.00 58.87 C ATOM 1029 O SER A 570 33.054 -11.662 -12.635 1.00 64.23 O ATOM 1030 CB SER A 570 32.113 -10.102 -14.837 1.00 63.48 C ATOM 1031 OG SER A 570 32.978 -8.973 -14.808 1.00 67.80 O ATOM 1032 HG SER A 570 33.455 -8.902 -15.673 1.00 0.00 H ATOM 1033 H SER A 570 31.170 -8.083 -13.381 1.00 0.00 H ATOM 1034 N SER A 571 32.263 -10.074 -11.212 1.00 54.21 N ATOM 1035 CA SER A 571 33.108 -10.463 -10.048 1.00 56.89 C ATOM 1036 C SER A 571 32.537 -11.728 -9.385 1.00 58.99 C ATOM 1037 O SER A 571 31.387 -12.107 -9.704 1.00 53.53 O ATOM 1038 CB SER A 571 33.291 -9.327 -9.048 1.00 55.04 C ATOM 1039 OG SER A 571 32.067 -8.932 -8.449 1.00 53.12 O ATOM 1040 HG SER A 571 31.441 -8.624 -9.152 1.00 0.00 H ATOM 1041 H SER A 571 31.605 -9.277 -11.098 1.00 0.00 H ATOM 1042 N GLU A 572 33.332 -12.365 -8.518 1.00 63.80 N ATOM 1043 CA GLU A 572 32.966 -13.606 -7.777 1.00 61.86 C ATOM 1044 C GLU A 572 32.071 -13.218 -6.595 1.00 59.10 C ATOM 1045 O GLU A 572 32.396 -12.225 -5.912 1.00 59.20 O ATOM 1046 CB GLU A 572 34.219 -14.352 -7.309 1.00 61.59 C ATOM 1047 H GLU A 572 34.277 -11.964 -8.348 1.00 0.00 H ATOM 1048 N GLY A 573 30.969 -13.951 -6.398 1.00 57.83 N ATOM 1049 CA GLY A 573 30.013 -13.761 -5.290 1.00 56.46 C ATOM 1050 C GLY A 573 30.402 -14.602 -4.078 1.00 54.49 C ATOM 1051 O GLY A 573 31.229 -15.504 -4.181 1.00 50.10 O ATOM 1052 H GLY A 573 30.771 -14.713 -7.078 1.00 0.00 H ATOM 1053 N PRO A 574 29.817 -14.339 -2.891 1.00 54.37 N ATOM 1054 CA PRO A 574 30.108 -15.151 -1.712 1.00 57.39 C ATOM 1055 C PRO A 574 29.583 -16.594 -1.831 1.00 54.45 C ATOM 1056 O PRO A 574 30.032 -17.404 -1.054 1.00 56.70 O ATOM 1057 CB PRO A 574 29.425 -14.380 -0.568 1.00 57.91 C ATOM 1058 CG PRO A 574 28.321 -13.595 -1.244 1.00 58.94 C ATOM 1059 CD PRO A 574 28.863 -13.254 -2.617 1.00 57.86 C ATOM 1060 N LEU A 575 28.686 -16.887 -2.789 1.00 53.07 N ATOM 1061 CA LEU A 575 28.000 -18.208 -2.915 1.00 49.62 C ATOM 1062 C LEU A 575 28.776 -19.130 -3.861 1.00 44.53 C ATOM 1063 O LEU A 575 28.642 -18.983 -5.077 1.00 44.39 O ATOM 1064 CB LEU A 575 26.560 -18.015 -3.406 1.00 50.49 C ATOM 1065 CG LEU A 575 25.617 -17.320 -2.424 1.00 51.16 C ATOM 1066 CD1 LEU A 575 24.213 -17.224 -2.996 1.00 53.96 C ATOM 1067 CD2 LEU A 575 25.599 -18.026 -1.075 1.00 53.20 C ATOM 1068 H LEU A 575 28.456 -16.149 -3.485 1.00 0.00 H ATOM 1069 N SER A 576 29.506 -20.091 -3.297 1.00 40.79 N ATOM 1070 CA SER A 576 30.319 -21.090 -4.037 1.00 43.87 C ATOM 1071 C SER A 576 29.392 -22.117 -4.691 1.00 43.78 C ATOM 1072 O SER A 576 28.210 -22.204 -4.287 1.00 40.20 O ATOM 1073 CB SER A 576 31.320 -21.757 -3.124 1.00 44.35 C ATOM 1074 OG SER A 576 30.661 -22.589 -2.176 1.00 47.45 O ATOM 1075 HG SER A 576 31.334 -23.016 -1.589 1.00 0.00 H ATOM 1076 H SER A 576 29.507 -20.146 -2.258 1.00 0.00 H ATOM 1077 N PHE A 577 29.919 -22.845 -5.674 1.00 40.30 N ATOM 1078 CA PHE A 577 29.243 -23.979 -6.345 1.00 41.16 C ATOM 1079 C PHE A 577 28.767 -24.988 -5.296 1.00 39.63 C ATOM 1080 O PHE A 577 27.606 -25.376 -5.322 1.00 40.94 O ATOM 1081 CB PHE A 577 30.153 -24.603 -7.405 1.00 40.05 C ATOM 1082 CG PHE A 577 29.597 -25.847 -8.047 1.00 39.12 C ATOM 1083 CD1 PHE A 577 28.497 -25.774 -8.883 1.00 42.06 C ATOM 1084 CD2 PHE A 577 30.168 -27.088 -7.815 1.00 40.53 C ATOM 1085 CE1 PHE A 577 27.975 -26.918 -9.468 1.00 40.68 C ATOM 1086 CE2 PHE A 577 29.649 -28.231 -8.409 1.00 41.40 C ATOM 1087 CZ PHE A 577 28.560 -28.143 -9.243 1.00 41.07 C ATOM 1088 H PHE A 577 30.877 -22.599 -5.994 1.00 0.00 H ATOM 1089 N PRO A 578 29.608 -25.463 -4.348 1.00 41.55 N ATOM 1090 CA PRO A 578 29.147 -26.451 -3.368 1.00 40.05 C ATOM 1091 C PRO A 578 27.971 -25.935 -2.527 1.00 39.20 C ATOM 1092 O PRO A 578 27.097 -26.724 -2.192 1.00 37.22 O ATOM 1093 CB PRO A 578 30.382 -26.742 -2.498 1.00 42.71 C ATOM 1094 CG PRO A 578 31.551 -26.302 -3.355 1.00 42.54 C ATOM 1095 CD PRO A 578 31.034 -25.143 -4.186 1.00 40.36 C ATOM 1096 N VAL A 579 27.936 -24.635 -2.230 1.00 37.46 N ATOM 1097 CA VAL A 579 26.846 -24.031 -1.406 1.00 38.25 C ATOM 1098 C VAL A 579 25.557 -24.021 -2.234 1.00 35.01 C ATOM 1099 O VAL A 579 24.495 -24.359 -1.678 1.00 31.97 O ATOM 1100 CB VAL A 579 27.218 -22.632 -0.875 1.00 42.08 C ATOM 1101 CG1 VAL A 579 26.014 -21.897 -0.300 1.00 43.71 C ATOM 1102 CG2 VAL A 579 28.324 -22.717 0.167 1.00 44.46 C ATOM 1103 H VAL A 579 28.695 -24.019 -2.585 1.00 0.00 H ATOM 1104 N LEU A 580 25.633 -23.676 -3.521 1.00 34.76 N ATOM 1105 CA LEU A 580 24.443 -23.667 -4.412 1.00 33.94 C ATOM 1106 C LEU A 580 23.906 -25.098 -4.556 1.00 33.64 C ATOM 1107 O LEU A 580 22.677 -25.288 -4.479 1.00 31.17 O ATOM 1108 CB LEU A 580 24.807 -23.069 -5.776 1.00 34.84 C ATOM 1109 CG LEU A 580 25.139 -21.577 -5.776 1.00 35.38 C ATOM 1110 CD1 LEU A 580 25.529 -21.121 -7.175 1.00 37.65 C ATOM 1111 CD2 LEU A 580 23.977 -20.750 -5.251 1.00 37.24 C ATOM 1112 H LEU A 580 26.557 -23.404 -3.914 1.00 0.00 H ATOM 1113 N VAL A 581 24.791 -26.073 -4.750 1.00 32.24 N ATOM 1114 CA VAL A 581 24.389 -27.496 -4.927 1.00 32.54 C ATOM 1115 C VAL A 581 23.780 -28.005 -3.616 1.00 31.45 C ATOM 1116 O VAL A 581 22.820 -28.784 -3.687 1.00 30.41 O ATOM 1117 CB VAL A 581 25.547 -28.382 -5.409 1.00 31.66 C ATOM 1118 CG1 VAL A 581 25.131 -29.845 -5.495 1.00 31.38 C ATOM 1119 CG2 VAL A 581 26.081 -27.916 -6.751 1.00 33.56 C ATOM 1120 H VAL A 581 25.802 -25.832 -4.779 1.00 0.00 H ATOM 1121 N SER A 582 24.329 -27.581 -2.470 1.00 30.03 N ATOM 1122 CA SER A 582 23.829 -27.921 -1.113 1.00 31.19 C ATOM 1123 C SER A 582 22.392 -27.408 -0.942 1.00 30.97 C ATOM 1124 O SER A 582 21.555 -28.162 -0.404 1.00 28.82 O ATOM 1125 CB SER A 582 24.750 -27.392 -0.032 1.00 31.66 C ATOM 1126 OG SER A 582 24.125 -27.470 1.241 1.00 30.45 O ATOM 1127 HG SER A 582 24.742 -27.120 1.932 1.00 0.00 H ATOM 1128 H SER A 582 25.167 -26.969 -2.535 1.00 0.00 H ATOM 1129 N CYS A 583 22.108 -26.182 -1.394 1.00 31.25 N ATOM 1130 CA CYS A 583 20.744 -25.592 -1.391 1.00 31.99 C ATOM 1131 C CYS A 583 19.800 -26.518 -2.163 1.00 30.18 C ATOM 1132 O CYS A 583 18.748 -26.863 -1.608 1.00 30.19 O ATOM 1133 CB CYS A 583 20.701 -24.184 -1.974 1.00 34.46 C ATOM 1134 SG CYS A 583 21.501 -22.961 -0.903 1.00 41.39 S ATOM 1135 H CYS A 583 22.889 -25.607 -1.770 1.00 0.00 H ATOM 1136 N ALA A 584 20.185 -26.922 -3.373 1.00 27.59 N ATOM 1137 CA ALA A 584 19.390 -27.832 -4.231 1.00 29.13 C ATOM 1138 C ALA A 584 19.208 -29.191 -3.527 1.00 27.61 C ATOM 1139 O ALA A 584 18.071 -29.701 -3.509 1.00 27.83 O ATOM 1140 CB ALA A 584 20.046 -27.994 -5.574 1.00 29.03 C ATOM 1141 H ALA A 584 21.097 -26.579 -3.737 1.00 0.00 H ATOM 1142 N TYR A 585 20.284 -29.762 -2.978 1.00 27.92 N ATOM 1143 CA TYR A 585 20.268 -31.075 -2.270 1.00 27.21 C ATOM 1144 C TYR A 585 19.271 -31.030 -1.100 1.00 26.02 C ATOM 1145 O TYR A 585 18.432 -31.939 -0.965 1.00 26.09 O ATOM 1146 CB TYR A 585 21.678 -31.465 -1.805 1.00 28.62 C ATOM 1147 CG TYR A 585 21.702 -32.713 -0.964 1.00 27.86 C ATOM 1148 CD1 TYR A 585 21.753 -33.965 -1.551 1.00 30.99 C ATOM 1149 CD2 TYR A 585 21.621 -32.648 0.415 1.00 30.78 C ATOM 1150 CE1 TYR A 585 21.754 -35.129 -0.790 1.00 30.49 C ATOM 1151 CE2 TYR A 585 21.626 -33.799 1.193 1.00 30.61 C ATOM 1152 CZ TYR A 585 21.707 -35.041 0.592 1.00 31.57 C ATOM 1153 OH TYR A 585 21.696 -36.177 1.353 1.00 32.23 O ATOM 1154 HH TYR A 585 21.761 -36.969 0.763 1.00 0.00 H ATOM 1155 H TYR A 585 21.191 -29.259 -3.049 1.00 0.00 H ATOM 1156 N GLN A 586 19.335 -29.998 -0.268 1.00 25.19 N ATOM 1157 CA GLN A 586 18.449 -29.846 0.914 1.00 27.80 C ATOM 1158 C GLN A 586 16.986 -29.749 0.479 1.00 28.11 C ATOM 1159 O GLN A 586 16.138 -30.354 1.142 1.00 27.15 O ATOM 1160 CB GLN A 586 18.858 -28.632 1.741 1.00 28.92 C ATOM 1161 CG GLN A 586 20.174 -28.835 2.483 1.00 33.39 C ATOM 1162 CD GLN A 586 20.517 -27.584 3.247 1.00 34.68 C ATOM 1163 OE1 GLN A 586 19.706 -27.072 4.007 1.00 37.52 O ATOM 1164 NE2 GLN A 586 21.705 -27.060 3.007 1.00 42.79 N ATOM 1165 HE22 GLN A 586 22.360 -27.534 2.352 1.00 0.00 H ATOM 1166 HE21 GLN A 586 21.986 -26.174 3.473 1.00 0.00 H ATOM 1167 H GLN A 586 20.042 -29.258 -0.453 1.00 0.00 H ATOM 1168 N VAL A 587 16.687 -28.990 -0.577 1.00 26.18 N ATOM 1169 CA VAL A 587 15.296 -28.884 -1.095 1.00 28.11 C ATOM 1170 C VAL A 587 14.857 -30.272 -1.591 1.00 25.30 C ATOM 1171 O VAL A 587 13.688 -30.636 -1.355 1.00 26.81 O ATOM 1172 CB VAL A 587 15.152 -27.795 -2.179 1.00 28.36 C ATOM 1173 CG1 VAL A 587 13.768 -27.825 -2.803 1.00 30.98 C ATOM 1174 CG2 VAL A 587 15.437 -26.414 -1.608 1.00 29.83 C ATOM 1175 H VAL A 587 17.446 -28.459 -1.050 1.00 0.00 H ATOM 1176 N ALA A 588 15.719 -31.009 -2.289 1.00 25.46 N ATOM 1177 CA ALA A 588 15.365 -32.358 -2.792 1.00 27.05 C ATOM 1178 C ALA A 588 15.071 -33.293 -1.600 1.00 26.03 C ATOM 1179 O ALA A 588 14.088 -34.065 -1.673 1.00 25.22 O ATOM 1180 CB ALA A 588 16.440 -32.912 -3.695 1.00 26.58 C ATOM 1181 H ALA A 588 16.666 -30.628 -2.487 1.00 0.00 H ATOM 1182 N ARG A 589 15.864 -33.212 -0.536 1.00 27.53 N ATOM 1183 CA ARG A 589 15.666 -34.036 0.697 1.00 29.73 C ATOM 1184 C ARG A 589 14.319 -33.710 1.349 1.00 28.27 C ATOM 1185 O ARG A 589 13.612 -34.653 1.727 1.00 26.16 O ATOM 1186 CB ARG A 589 16.795 -33.797 1.701 1.00 33.42 C ATOM 1187 CG ARG A 589 18.114 -34.459 1.330 1.00 37.76 C ATOM 1188 CD ARG A 589 18.109 -35.975 1.478 1.00 42.78 C ATOM 1189 NE ARG A 589 17.832 -36.479 2.817 1.00 49.80 N ATOM 1190 CZ ARG A 589 18.705 -36.540 3.821 1.00 53.91 C ATOM 1191 NH1 ARG A 589 19.939 -36.092 3.679 1.00 55.83 N ATOM 1192 NH2 ARG A 589 18.327 -37.031 4.988 1.00 57.46 N ATOM 1193 HE ARG A 589 16.868 -36.821 3.005 1.00 0.00 H ATOM 1194 HH12 ARG A 589 20.607 -36.148 4.474 1.00 0.00 H ATOM 1195 HH11 ARG A 589 20.243 -35.683 2.772 1.00 0.00 H ATOM 1196 HH22 ARG A 589 19.005 -37.081 5.775 1.00 0.00 H ATOM 1197 HH21 ARG A 589 17.352 -37.368 5.119 1.00 0.00 H ATOM 1198 H ARG A 589 16.660 -32.544 -0.562 1.00 0.00 H ATOM 1199 N GLY A 590 13.975 -32.421 1.462 1.00 26.40 N ATOM 1200 CA GLY A 590 12.662 -31.962 1.960 1.00 27.18 C ATOM 1201 C GLY A 590 11.515 -32.505 1.118 1.00 27.82 C ATOM 1202 O GLY A 590 10.518 -33.003 1.692 1.00 24.80 O ATOM 1203 H GLY A 590 14.672 -31.701 1.183 1.00 0.00 H ATOM 1204 N MET A 591 11.629 -32.420 -0.212 1.00 27.81 N ATOM 1205 CA MET A 591 10.549 -32.871 -1.125 1.00 26.73 C ATOM 1206 C MET A 591 10.432 -34.394 -1.040 1.00 25.89 C ATOM 1207 O MET A 591 9.302 -34.890 -1.067 1.00 25.77 O ATOM 1208 CB MET A 591 10.810 -32.423 -2.568 1.00 26.93 C ATOM 1209 CG MET A 591 10.635 -30.912 -2.738 1.00 27.13 C ATOM 1210 SD MET A 591 9.004 -30.279 -2.265 1.00 29.87 S ATOM 1211 CE MET A 591 7.955 -31.173 -3.408 1.00 26.73 C ATOM 1212 H MET A 591 12.501 -32.026 -0.619 1.00 0.00 H ATOM 1213 N GLN A 592 11.555 -35.097 -0.911 1.00 25.69 N ATOM 1214 CA GLN A 592 11.576 -36.579 -0.788 1.00 27.19 C ATOM 1215 C GLN A 592 10.783 -36.963 0.463 1.00 24.48 C ATOM 1216 O GLN A 592 9.922 -37.885 0.386 1.00 24.31 O ATOM 1217 CB GLN A 592 13.009 -37.113 -0.759 1.00 29.03 C ATOM 1218 CG GLN A 592 13.090 -38.619 -0.507 1.00 29.69 C ATOM 1219 CD GLN A 592 14.505 -39.115 -0.338 1.00 29.25 C ATOM 1220 OE1 GLN A 592 15.355 -38.463 0.270 1.00 31.91 O ATOM 1221 NE2 GLN A 592 14.776 -40.276 -0.906 1.00 27.85 N ATOM 1222 HE22 GLN A 592 14.029 -40.795 -1.410 1.00 0.00 H ATOM 1223 HE21 GLN A 592 15.736 -40.671 -0.849 1.00 0.00 H ATOM 1224 H GLN A 592 12.461 -34.586 -0.895 1.00 0.00 H ATOM 1225 N TYR A 593 11.014 -36.255 1.561 1.00 26.38 N ATOM 1226 CA TYR A 593 10.297 -36.487 2.840 1.00 26.84 C ATOM 1227 C TYR A 593 8.803 -36.210 2.642 1.00 28.72 C ATOM 1228 O TYR A 593 7.977 -37.060 2.985 1.00 25.18 O ATOM 1229 CB TYR A 593 10.855 -35.642 3.983 1.00 27.91 C ATOM 1230 CG TYR A 593 10.071 -35.864 5.249 1.00 28.35 C ATOM 1231 CD1 TYR A 593 10.255 -37.031 5.980 1.00 31.03 C ATOM 1232 CD2 TYR A 593 9.074 -34.992 5.651 1.00 28.21 C ATOM 1233 CE1 TYR A 593 9.506 -37.295 7.111 1.00 29.64 C ATOM 1234 CE2 TYR A 593 8.312 -35.248 6.781 1.00 30.58 C ATOM 1235 CZ TYR A 593 8.537 -36.403 7.516 1.00 28.66 C ATOM 1236 OH TYR A 593 7.802 -36.676 8.635 1.00 29.71 O ATOM 1237 HH TYR A 593 6.844 -36.738 8.392 1.00 0.00 H ATOM 1238 H TYR A 593 11.731 -35.502 1.524 1.00 0.00 H ATOM 1239 N LEU A 594 8.436 -35.031 2.131 1.00 27.09 N ATOM 1240 CA LEU A 594 7.010 -34.675 1.938 1.00 26.96 C ATOM 1241 C LEU A 594 6.342 -35.750 1.077 1.00 28.44 C ATOM 1242 O LEU A 594 5.198 -36.154 1.411 1.00 28.35 O ATOM 1243 CB LEU A 594 6.885 -33.283 1.303 1.00 26.92 C ATOM 1244 CG LEU A 594 7.242 -32.118 2.224 1.00 27.62 C ATOM 1245 CD1 LEU A 594 7.158 -30.788 1.494 1.00 29.48 C ATOM 1246 CD2 LEU A 594 6.351 -32.097 3.458 1.00 29.59 C ATOM 1247 H LEU A 594 9.170 -34.345 1.862 1.00 0.00 H ATOM 1248 N GLU A 595 7.022 -36.187 0.015 1.00 28.41 N ATOM 1249 CA GLU A 595 6.511 -37.221 -0.909 1.00 30.28 C ATOM 1250 C GLU A 595 6.231 -38.504 -0.114 1.00 29.41 C ATOM 1251 O GLU A 595 5.178 -39.110 -0.358 1.00 29.78 O ATOM 1252 CB GLU A 595 7.502 -37.481 -2.033 1.00 31.27 C ATOM 1253 CG GLU A 595 7.105 -38.644 -2.921 1.00 33.83 C ATOM 1254 CD GLU A 595 8.109 -38.883 -4.033 1.00 38.62 C ATOM 1255 OE1 GLU A 595 9.334 -38.912 -3.745 1.00 42.51 O ATOM 1256 OE2 GLU A 595 7.669 -39.027 -5.172 1.00 40.10 O ATOM 1257 H GLU A 595 7.960 -35.779 -0.172 1.00 0.00 H ATOM 1258 N SER A 596 7.128 -38.872 0.806 1.00 29.93 N ATOM 1259 CA SER A 596 7.020 -40.082 1.663 1.00 31.42 C ATOM 1260 C SER A 596 5.815 -39.945 2.596 1.00 33.88 C ATOM 1261 O SER A 596 5.328 -40.983 3.069 1.00 34.62 O ATOM 1262 CB SER A 596 8.299 -40.332 2.427 1.00 31.56 C ATOM 1263 OG SER A 596 8.394 -39.479 3.555 1.00 29.65 O ATOM 1264 HG SER A 596 8.382 -38.535 3.256 1.00 0.00 H ATOM 1265 H SER A 596 7.964 -38.267 0.932 1.00 0.00 H ATOM 1266 N ARG A 597 5.344 -38.718 2.854 1.00 29.92 N ATOM 1267 CA ARG A 597 4.175 -38.446 3.728 1.00 32.34 C ATOM 1268 C ARG A 597 2.954 -38.093 2.870 1.00 31.17 C ATOM 1269 O ARG A 597 2.018 -37.486 3.419 1.00 32.06 O ATOM 1270 CB ARG A 597 4.547 -37.342 4.726 1.00 32.18 C ATOM 1271 CG ARG A 597 5.812 -37.637 5.520 1.00 33.84 C ATOM 1272 CD ARG A 597 5.711 -38.848 6.438 1.00 38.04 C ATOM 1273 NE ARG A 597 4.519 -38.685 7.251 1.00 41.86 N ATOM 1274 CZ ARG A 597 3.819 -39.661 7.814 1.00 50.55 C ATOM 1275 NH1 ARG A 597 2.724 -39.360 8.494 1.00 48.03 N ATOM 1276 NH2 ARG A 597 4.198 -40.923 7.693 1.00 52.78 N ATOM 1277 HE ARG A 597 4.183 -37.713 7.406 1.00 0.00 H ATOM 1278 HH12 ARG A 597 2.165 -40.115 8.941 1.00 0.00 H ATOM 1279 HH11 ARG A 597 2.422 -38.369 8.582 1.00 0.00 H ATOM 1280 HH22 ARG A 597 3.640 -41.679 8.139 1.00 0.00 H ATOM 1281 HH21 ARG A 597 5.054 -41.159 7.151 1.00 0.00 H ATOM 1282 H ARG A 597 5.826 -37.907 2.416 1.00 0.00 H ATOM 1283 N LYS A 598 2.978 -38.463 1.582 1.00 31.89 N ATOM 1284 CA LYS A 598 1.859 -38.349 0.605 1.00 33.89 C ATOM 1285 C LYS A 598 1.481 -36.877 0.418 1.00 34.55 C ATOM 1286 O LYS A 598 0.295 -36.584 0.172 1.00 35.53 O ATOM 1287 CB LYS A 598 0.664 -39.200 1.048 1.00 38.97 C ATOM 1288 CG LYS A 598 1.025 -40.631 1.431 1.00 43.88 C ATOM 1289 CD LYS A 598 -0.167 -41.527 1.689 1.00 51.76 C ATOM 1290 CE LYS A 598 -0.670 -42.195 0.427 1.00 57.23 C ATOM 1291 NZ LYS A 598 -1.875 -43.017 0.684 1.00 65.08 N ATOM 1292 HZ1 LYS A 598 -1.647 -43.757 1.378 1.00 0.00 H ATOM 1293 HZ2 LYS A 598 -2.633 -42.411 1.058 1.00 0.00 H ATOM 1294 HZ3 LYS A 598 -2.189 -43.458 -0.204 1.00 0.00 H ATOM 1295 H LYS A 598 3.867 -38.871 1.229 1.00 0.00 H ATOM 1296 N CYS A 599 2.465 -35.982 0.474 1.00 32.35 N ATOM 1297 CA CYS A 599 2.253 -34.525 0.305 1.00 31.31 C ATOM 1298 C CYS A 599 2.755 -34.096 -1.074 1.00 32.28 C ATOM 1299 O CYS A 599 3.960 -34.195 -1.312 1.00 29.00 O ATOM 1300 CB CYS A 599 2.956 -33.761 1.412 1.00 33.35 C ATOM 1301 SG CYS A 599 2.851 -31.968 1.210 1.00 34.12 S ATOM 1302 H CYS A 599 3.433 -36.323 0.645 1.00 0.00 H ATOM 1303 N ILE A 600 1.840 -33.670 -1.942 1.00 30.55 N ATOM 1304 CA ILE A 600 2.137 -32.980 -3.231 1.00 34.02 C ATOM 1305 C ILE A 600 2.131 -31.475 -2.929 1.00 32.28 C ATOM 1306 O ILE A 600 1.140 -30.978 -2.360 1.00 32.27 O ATOM 1307 CB ILE A 600 1.120 -33.393 -4.318 1.00 34.20 C ATOM 1308 CG1 ILE A 600 1.109 -34.909 -4.517 1.00 35.33 C ATOM 1309 CG2 ILE A 600 1.389 -32.665 -5.626 1.00 34.62 C ATOM 1310 CD1 ILE A 600 -0.084 -35.431 -5.281 1.00 36.45 C ATOM 1311 H ILE A 600 0.841 -33.831 -1.703 1.00 0.00 H ATOM 1312 N HIS A 601 3.224 -30.780 -3.231 1.00 30.06 N ATOM 1313 CA HIS A 601 3.394 -29.350 -2.880 1.00 29.84 C ATOM 1314 C HIS A 601 2.492 -28.483 -3.771 1.00 31.85 C ATOM 1315 O HIS A 601 1.742 -27.649 -3.218 1.00 30.04 O ATOM 1316 CB HIS A 601 4.864 -28.928 -2.954 1.00 30.20 C ATOM 1317 CG HIS A 601 5.073 -27.590 -2.330 1.00 31.15 C ATOM 1318 ND1 HIS A 601 4.607 -26.432 -2.915 1.00 32.38 N ATOM 1319 CD2 HIS A 601 5.608 -27.228 -1.147 1.00 30.57 C ATOM 1320 CE1 HIS A 601 4.899 -25.404 -2.140 1.00 31.86 C ATOM 1321 NE2 HIS A 601 5.495 -25.865 -1.042 1.00 29.99 N ATOM 1322 H HIS A 601 3.995 -31.262 -3.737 1.00 0.00 H ATOM 1323 N ARG A 602 2.629 -28.615 -5.089 1.00 31.25 N ATOM 1324 CA ARG A 602 1.825 -27.892 -6.109 1.00 34.23 C ATOM 1325 C ARG A 602 2.424 -26.506 -6.426 1.00 35.10 C ATOM 1326 O ARG A 602 2.081 -25.968 -7.485 1.00 34.43 O ATOM 1327 CB ARG A 602 0.363 -27.773 -5.653 1.00 36.49 C ATOM 1328 H ARG A 602 3.355 -29.276 -5.432 1.00 0.00 H ATOM 1329 N ASP A 603 3.296 -25.931 -5.597 1.00 33.75 N ATOM 1330 CA ASP A 603 3.834 -24.566 -5.873 1.00 35.06 C ATOM 1331 C ASP A 603 5.287 -24.467 -5.400 1.00 31.63 C ATOM 1332 O ASP A 603 5.645 -23.485 -4.736 1.00 32.24 O ATOM 1333 CB ASP A 603 2.912 -23.492 -5.277 1.00 39.54 C ATOM 1334 CG ASP A 603 3.226 -22.067 -5.726 1.00 46.09 C ATOM 1335 OD1 ASP A 603 3.954 -21.898 -6.724 1.00 43.46 O ATOM 1336 OD2 ASP A 603 2.763 -21.135 -5.050 1.00 54.38 O ATOM 1337 H ASP A 603 3.606 -26.441 -4.745 1.00 0.00 H ATOM 1338 N LEU A 604 6.113 -25.452 -5.742 1.00 31.84 N ATOM 1339 CA LEU A 604 7.544 -25.444 -5.356 1.00 29.94 C ATOM 1340 C LEU A 604 8.251 -24.403 -6.226 1.00 32.20 C ATOM 1341 O LEU A 604 8.113 -24.466 -7.472 1.00 33.99 O ATOM 1342 CB LEU A 604 8.162 -26.827 -5.557 1.00 30.29 C ATOM 1343 CG LEU A 604 9.660 -26.917 -5.273 1.00 30.06 C ATOM 1344 CD1 LEU A 604 9.957 -26.518 -3.844 1.00 31.14 C ATOM 1345 CD2 LEU A 604 10.187 -28.311 -5.572 1.00 29.37 C ATOM 1346 H LEU A 604 5.744 -26.251 -6.296 1.00 0.00 H ATOM 1347 N ALA A 605 8.953 -23.480 -5.579 1.00 31.61 N ATOM 1348 CA ALA A 605 9.692 -22.372 -6.223 1.00 32.03 C ATOM 1349 C ALA A 605 10.597 -21.766 -5.160 1.00 32.21 C ATOM 1350 O ALA A 605 10.320 -21.989 -3.955 1.00 31.83 O ATOM 1351 CB ALA A 605 8.708 -21.367 -6.776 1.00 32.45 C ATOM 1352 H ALA A 605 8.986 -23.541 -4.541 1.00 0.00 H ATOM 1353 N ALA A 606 11.608 -20.998 -5.555 1.00 31.51 N ATOM 1354 CA ALA A 606 12.584 -20.434 -4.603 1.00 31.79 C ATOM 1355 C ALA A 606 11.851 -19.515 -3.620 1.00 31.73 C ATOM 1356 O ALA A 606 12.294 -19.448 -2.457 1.00 32.63 O ATOM 1357 CB ALA A 606 13.701 -19.740 -5.329 1.00 30.89 C ATOM 1358 H ALA A 606 11.714 -20.788 -6.568 1.00 0.00 H ATOM 1359 N ARG A 607 10.740 -18.890 -4.037 1.00 32.00 N ATOM 1360 CA ARG A 607 9.967 -17.973 -3.150 1.00 34.76 C ATOM 1361 C ARG A 607 9.338 -18.793 -2.011 1.00 34.13 C ATOM 1362 O ARG A 607 9.059 -18.205 -0.938 1.00 34.17 O ATOM 1363 CB ARG A 607 8.911 -17.173 -3.926 1.00 37.86 C ATOM 1364 CG ARG A 607 7.771 -18.000 -4.500 1.00 41.20 C ATOM 1365 CD ARG A 607 6.741 -17.238 -5.329 1.00 46.45 C ATOM 1366 NE ARG A 607 5.885 -18.211 -6.014 1.00 47.88 N ATOM 1367 CZ ARG A 607 6.096 -18.707 -7.237 1.00 48.27 C ATOM 1368 NH1 ARG A 607 7.113 -18.291 -7.975 1.00 46.77 N ATOM 1369 NH2 ARG A 607 5.276 -19.621 -7.728 1.00 49.16 N ATOM 1370 HE ARG A 607 5.041 -18.544 -5.505 1.00 0.00 H ATOM 1371 HH12 ARG A 607 7.263 -18.687 -8.925 1.00 0.00 H ATOM 1372 HH11 ARG A 607 7.762 -17.568 -7.605 1.00 0.00 H ATOM 1373 HH22 ARG A 607 5.439 -20.008 -8.679 1.00 0.00 H ATOM 1374 HH21 ARG A 607 4.469 -19.953 -7.163 1.00 0.00 H ATOM 1375 H ARG A 607 10.407 -19.050 -5.009 1.00 0.00 H ATOM 1376 N ASN A 608 9.174 -20.099 -2.209 1.00 32.85 N ATOM 1377 CA ASN A 608 8.483 -21.006 -1.246 1.00 32.97 C ATOM 1378 C ASN A 608 9.484 -21.917 -0.538 1.00 33.54 C ATOM 1379 O ASN A 608 9.049 -22.950 0.036 1.00 32.47 O ATOM 1380 CB ASN A 608 7.381 -21.796 -1.946 1.00 33.16 C ATOM 1381 CG ASN A 608 6.152 -20.948 -2.178 1.00 38.34 C ATOM 1382 OD1 ASN A 608 5.884 -20.031 -1.406 1.00 42.79 O ATOM 1383 ND2 ASN A 608 5.416 -21.224 -3.240 1.00 37.03 N ATOM 1384 HD22 ASN A 608 5.681 -22.011 -3.866 1.00 0.00 H ATOM 1385 HD21 ASN A 608 4.571 -20.655 -3.450 1.00 0.00 H ATOM 1386 H ASN A 608 9.550 -20.512 -3.087 1.00 0.00 H ATOM 1387 N VAL A 609 10.760 -21.543 -0.547 1.00 29.77 N ATOM 1388 CA VAL A 609 11.815 -22.181 0.282 1.00 29.97 C ATOM 1389 C VAL A 609 12.388 -21.075 1.156 1.00 33.00 C ATOM 1390 O VAL A 609 12.720 -20.000 0.605 1.00 30.88 O ATOM 1391 CB VAL A 609 12.903 -22.856 -0.573 1.00 29.98 C ATOM 1392 CG1 VAL A 609 13.998 -23.455 0.292 1.00 29.25 C ATOM 1393 CG2 VAL A 609 12.330 -23.898 -1.519 1.00 30.31 C ATOM 1394 H VAL A 609 11.036 -20.758 -1.171 1.00 0.00 H ATOM 1395 N LEU A 610 12.501 -21.317 2.458 1.00 30.55 N ATOM 1396 CA LEU A 610 13.031 -20.317 3.414 1.00 31.20 C ATOM 1397 C LEU A 610 14.407 -20.772 3.883 1.00 32.88 C ATOM 1398 O LEU A 610 14.768 -21.964 3.691 1.00 32.33 O ATOM 1399 CB LEU A 610 12.042 -20.114 4.567 1.00 32.42 C ATOM 1400 CG LEU A 610 10.602 -19.800 4.167 1.00 33.08 C ATOM 1401 CD1 LEU A 610 9.790 -19.437 5.383 1.00 33.36 C ATOM 1402 CD2 LEU A 610 10.524 -18.692 3.124 1.00 35.06 C ATOM 1403 H LEU A 610 12.205 -22.246 2.820 1.00 0.00 H ATOM 1404 N VAL A 611 15.175 -19.833 4.429 1.00 32.83 N ATOM 1405 CA VAL A 611 16.607 -20.034 4.775 1.00 31.95 C ATOM 1406 C VAL A 611 16.811 -19.654 6.239 1.00 32.25 C ATOM 1407 O VAL A 611 16.441 -18.520 6.611 1.00 34.41 O ATOM 1408 CB VAL A 611 17.509 -19.200 3.850 1.00 35.26 C ATOM 1409 CG1 VAL A 611 18.976 -19.441 4.160 1.00 34.76 C ATOM 1410 CG2 VAL A 611 17.186 -19.458 2.387 1.00 36.61 C ATOM 1411 H VAL A 611 14.749 -18.905 4.625 1.00 0.00 H ATOM 1412 N THR A 612 17.365 -20.574 7.030 1.00 35.80 N ATOM 1413 CA THR A 612 17.605 -20.405 8.486 1.00 36.41 C ATOM 1414 C THR A 612 18.917 -19.638 8.698 1.00 39.85 C ATOM 1415 O THR A 612 19.652 -19.434 7.703 1.00 37.43 O ATOM 1416 CB THR A 612 17.688 -21.740 9.240 1.00 35.16 C ATOM 1417 OG1 THR A 612 18.955 -22.322 8.947 1.00 36.25 O ATOM 1418 CG2 THR A 612 16.572 -22.708 8.908 1.00 36.14 C ATOM 1419 HG1 THR A 612 19.037 -23.187 9.421 1.00 0.00 H ATOM 1420 H THR A 612 17.650 -21.475 6.596 1.00 0.00 H ATOM 1421 N GLU A 613 19.196 -19.275 9.955 1.00 43.24 N ATOM 1422 CA GLU A 613 20.443 -18.596 10.413 1.00 45.58 C ATOM 1423 C GLU A 613 21.666 -19.377 9.919 1.00 46.74 C ATOM 1424 O GLU A 613 22.650 -18.738 9.539 1.00 48.64 O ATOM 1425 CB GLU A 613 20.458 -18.460 11.940 1.00 47.84 C ATOM 1426 H GLU A 613 18.479 -19.485 10.678 1.00 0.00 H ATOM 1427 N ASP A 614 21.599 -20.709 9.886 1.00 47.61 N ATOM 1428 CA ASP A 614 22.743 -21.576 9.496 1.00 48.81 C ATOM 1429 C ASP A 614 22.573 -22.041 8.044 1.00 42.88 C ATOM 1430 O ASP A 614 23.131 -23.091 7.700 1.00 45.19 O ATOM 1431 CB ASP A 614 22.883 -22.735 10.483 1.00 55.79 C ATOM 1432 CG ASP A 614 22.720 -22.279 11.923 1.00 65.71 C ATOM 1433 OD1 ASP A 614 23.593 -21.525 12.399 1.00 71.16 O ATOM 1434 OD2 ASP A 614 21.699 -22.640 12.539 1.00 76.02 O ATOM 1435 H ASP A 614 20.701 -21.164 10.146 1.00 0.00 H ATOM 1436 N ASN A 615 21.843 -21.286 7.218 1.00 43.06 N ATOM 1437 CA ASN A 615 21.698 -21.547 5.760 1.00 41.84 C ATOM 1438 C ASN A 615 21.112 -22.943 5.513 1.00 40.55 C ATOM 1439 O ASN A 615 21.518 -23.596 4.522 1.00 40.54 O ATOM 1440 CB ASN A 615 23.030 -21.364 5.025 1.00 43.92 C ATOM 1441 CG ASN A 615 23.501 -19.929 5.056 1.00 48.09 C ATOM 1442 OD1 ASN A 615 22.760 -19.036 5.465 1.00 54.81 O ATOM 1443 ND2 ASN A 615 24.725 -19.694 4.616 1.00 52.94 N ATOM 1444 HD22 ASN A 615 25.317 -20.480 4.279 1.00 0.00 H ATOM 1445 HD21 ASN A 615 25.097 -18.723 4.606 1.00 0.00 H ATOM 1446 H ASN A 615 21.345 -20.465 7.619 1.00 0.00 H ATOM 1447 N VAL A 616 20.170 -23.382 6.354 1.00 36.34 N ATOM 1448 CA VAL A 616 19.396 -24.630 6.090 1.00 36.17 C ATOM 1449 C VAL A 616 18.165 -24.232 5.269 1.00 31.13 C ATOM 1450 O VAL A 616 17.502 -23.258 5.639 1.00 33.00 O ATOM 1451 CB VAL A 616 19.024 -25.375 7.388 1.00 36.38 C ATOM 1452 CG1 VAL A 616 18.124 -26.573 7.121 1.00 36.22 C ATOM 1453 CG2 VAL A 616 20.271 -25.802 8.154 1.00 38.24 C ATOM 1454 H VAL A 616 19.971 -22.838 7.218 1.00 0.00 H ATOM 1455 N MET A 617 17.882 -24.974 4.202 1.00 30.61 N ATOM 1456 CA MET A 617 16.683 -24.780 3.343 1.00 30.55 C ATOM 1457 C MET A 617 15.467 -25.430 4.022 1.00 32.39 C ATOM 1458 O MET A 617 15.565 -26.605 4.423 1.00 29.91 O ATOM 1459 CB MET A 617 16.879 -25.429 1.975 1.00 31.04 C ATOM 1460 CG MET A 617 18.149 -25.023 1.270 1.00 33.83 C ATOM 1461 SD MET A 617 18.122 -23.287 0.763 1.00 35.49 S ATOM 1462 CE MET A 617 19.216 -22.570 1.982 1.00 36.34 C ATOM 1463 H MET A 617 18.541 -25.739 3.952 1.00 0.00 H ATOM 1464 N LYS A 618 14.350 -24.709 4.110 1.00 30.24 N ATOM 1465 CA LYS A 618 13.080 -25.236 4.660 1.00 30.43 C ATOM 1466 C LYS A 618 11.946 -24.928 3.682 1.00 30.27 C ATOM 1467 O LYS A 618 11.658 -23.747 3.429 1.00 30.51 O ATOM 1468 CB LYS A 618 12.839 -24.689 6.069 1.00 29.84 C ATOM 1469 CG LYS A 618 13.765 -25.238 7.142 1.00 31.13 C ATOM 1470 CD LYS A 618 13.422 -24.752 8.530 1.00 30.65 C ATOM 1471 CE LYS A 618 14.163 -25.497 9.622 1.00 32.61 C ATOM 1472 NZ LYS A 618 13.621 -26.867 9.806 1.00 29.92 N ATOM 1473 HZ1 LYS A 618 12.616 -26.809 10.068 1.00 0.00 H ATOM 1474 HZ2 LYS A 618 13.718 -27.399 8.918 1.00 0.00 H ATOM 1475 HZ3 LYS A 618 14.150 -27.349 10.560 1.00 0.00 H ATOM 1476 H LYS A 618 14.371 -23.725 3.775 1.00 0.00 H ATOM 1477 N ILE A 619 11.310 -25.974 3.155 1.00 29.31 N ATOM 1478 CA ILE A 619 10.132 -25.844 2.255 1.00 29.68 C ATOM 1479 C ILE A 619 8.967 -25.251 3.045 1.00 30.82 C ATOM 1480 O ILE A 619 8.681 -25.727 4.155 1.00 29.04 O ATOM 1481 CB ILE A 619 9.801 -27.189 1.591 1.00 31.09 C ATOM 1482 CG1 ILE A 619 10.983 -27.671 0.745 1.00 31.86 C ATOM 1483 CG2 ILE A 619 8.516 -27.092 0.791 1.00 29.47 C ATOM 1484 CD1 ILE A 619 11.026 -29.154 0.582 1.00 34.74 C ATOM 1485 H ILE A 619 11.654 -26.928 3.384 1.00 0.00 H ATOM 1486 N ALA A 620 8.328 -24.219 2.486 1.00 29.20 N ATOM 1487 CA ALA A 620 7.229 -23.470 3.126 1.00 31.01 C ATOM 1488 C ALA A 620 5.910 -23.863 2.468 1.00 30.33 C ATOM 1489 O ALA A 620 5.933 -24.311 1.325 1.00 29.36 O ATOM 1490 CB ALA A 620 7.482 -21.988 2.996 1.00 33.71 C ATOM 1491 H ALA A 620 8.626 -23.923 1.534 1.00 0.00 H ATOM 1492 N ASP A 621 4.797 -23.690 3.185 1.00 32.59 N ATOM 1493 CA ASP A 621 3.424 -23.673 2.617 1.00 35.43 C ATOM 1494 C ASP A 621 3.111 -24.992 1.908 1.00 35.83 C ATOM 1495 O ASP A 621 2.460 -24.953 0.861 1.00 36.50 O ATOM 1496 CB ASP A 621 3.257 -22.494 1.661 1.00 37.90 C ATOM 1497 CG ASP A 621 3.288 -21.148 2.359 1.00 41.64 C ATOM 1498 OD1 ASP A 621 3.293 -21.128 3.614 1.00 41.29 O ATOM 1499 OD2 ASP A 621 3.277 -20.134 1.641 1.00 45.67 O ATOM 1500 H ASP A 621 4.898 -23.558 4.212 1.00 0.00 H ATOM 1501 N PHE A 622 3.530 -26.119 2.479 1.00 35.01 N ATOM 1502 CA PHE A 622 3.309 -27.461 1.888 1.00 35.03 C ATOM 1503 C PHE A 622 1.956 -28.022 2.345 1.00 34.69 C ATOM 1504 O PHE A 622 1.573 -29.063 1.829 1.00 35.11 O ATOM 1505 CB PHE A 622 4.470 -28.396 2.233 1.00 33.37 C ATOM 1506 CG PHE A 622 4.742 -28.540 3.705 1.00 31.19 C ATOM 1507 CD1 PHE A 622 3.982 -29.397 4.485 1.00 32.33 C ATOM 1508 CD2 PHE A 622 5.748 -27.805 4.314 1.00 32.03 C ATOM 1509 CE1 PHE A 622 4.221 -29.509 5.846 1.00 30.36 C ATOM 1510 CE2 PHE A 622 5.999 -27.936 5.670 1.00 31.51 C ATOM 1511 CZ PHE A 622 5.231 -28.784 6.435 1.00 30.75 C ATOM 1512 H PHE A 622 4.038 -26.055 3.385 1.00 0.00 H ATOM 1513 N GLY A 623 1.263 -27.372 3.280 1.00 38.22 N ATOM 1514 CA GLY A 623 0.024 -27.912 3.874 1.00 43.11 C ATOM 1515 C GLY A 623 -1.228 -27.152 3.461 1.00 46.78 C ATOM 1516 O GLY A 623 -2.277 -27.409 4.075 1.00 47.83 O ATOM 1517 H GLY A 623 1.609 -26.447 3.604 1.00 0.00 H ATOM 1518 N LEU A 624 -1.141 -26.261 2.467 1.00 50.86 N ATOM 1519 CA LEU A 624 -2.227 -25.296 2.118 1.00 57.29 C ATOM 1520 C LEU A 624 -3.379 -26.021 1.416 1.00 61.16 C ATOM 1521 O LEU A 624 -3.097 -26.891 0.574 1.00 62.39 O ATOM 1522 CB LEU A 624 -1.680 -24.179 1.224 1.00 55.73 C ATOM 1523 CG LEU A 624 -1.217 -22.918 1.953 1.00 58.08 C ATOM 1524 CD1 LEU A 624 0.024 -23.205 2.769 1.00 60.59 C ATOM 1525 CD2 LEU A 624 -0.956 -21.784 0.972 1.00 56.29 C ATOM 1526 H LEU A 624 -0.267 -26.239 1.904 1.00 0.00 H ATOM 1527 N ALA A 625 -4.619 -25.640 1.749 1.00 69.56 N ATOM 1528 CA ALA A 625 -5.882 -26.146 1.154 1.00 74.98 C ATOM 1529 C ALA A 625 -5.997 -25.677 -0.306 1.00 76.27 C ATOM 1530 O ALA A 625 -5.637 -24.515 -0.582 1.00 75.46 O ATOM 1531 CB ALA A 625 -7.059 -25.678 1.982 1.00 74.88 C ATOM 1532 H ALA A 625 -4.706 -24.921 2.496 1.00 0.00 H ATOM 1533 N ARG A 626 -6.474 -26.555 -1.199 1.00 81.35 N ATOM 1534 CA ARG A 626 -6.678 -26.277 -2.649 1.00 81.32 C ATOM 1535 C ARG A 626 -7.950 -25.437 -2.823 1.00 81.79 C ATOM 1536 O ARG A 626 -7.898 -24.246 -2.454 1.00 78.03 O ATOM 1537 CB ARG A 626 -6.765 -27.585 -3.446 1.00 80.58 C ATOM 1538 H ARG A 626 -6.721 -27.504 -0.853 1.00 0.00 H TER 1539 ARG A 626 ATOM 1540 N LEU A 642 -1.575 -16.961 -11.122 1.00 73.86 N ATOM 1541 CA LEU A 642 -1.222 -18.399 -11.289 1.00 74.53 C ATOM 1542 C LEU A 642 0.235 -18.516 -11.742 1.00 74.61 C ATOM 1543 O LEU A 642 0.597 -18.020 -12.806 1.00 80.62 O ATOM 1544 CB LEU A 642 -2.176 -19.045 -12.301 1.00 71.04 C ATOM 1545 HN3 LEU A 642 -1.452 -16.468 -12.029 1.00 0.00 H ATOM 1546 HN2 LEU A 642 -0.953 -16.533 -10.406 1.00 0.00 H ATOM 1547 HN1 LEU A 642 -2.565 -16.882 -10.814 1.00 0.00 H ATOM 1548 N PRO A 643 1.113 -19.185 -10.956 1.00 69.59 N ATOM 1549 CA PRO A 643 2.549 -19.242 -11.254 1.00 60.49 C ATOM 1550 C PRO A 643 2.867 -20.272 -12.350 1.00 52.54 C ATOM 1551 O PRO A 643 3.511 -21.307 -12.090 1.00 39.94 O ATOM 1552 CB PRO A 643 3.133 -19.638 -9.897 1.00 63.91 C ATOM 1553 CG PRO A 643 2.079 -20.550 -9.310 1.00 66.49 C ATOM 1554 CD PRO A 643 0.763 -19.939 -9.742 1.00 68.28 C ATOM 1555 N VAL A 644 2.426 -19.961 -13.568 1.00 45.67 N ATOM 1556 CA VAL A 644 2.432 -20.904 -14.722 1.00 42.62 C ATOM 1557 C VAL A 644 3.870 -21.231 -15.122 1.00 36.99 C ATOM 1558 O VAL A 644 4.056 -22.277 -15.741 1.00 37.97 O ATOM 1559 CB VAL A 644 1.634 -20.374 -15.933 1.00 46.78 C ATOM 1560 CG1 VAL A 644 0.173 -20.164 -15.581 1.00 50.84 C ATOM 1561 CG2 VAL A 644 2.239 -19.110 -16.532 1.00 47.73 C ATOM 1562 H VAL A 644 2.055 -19.002 -13.723 1.00 0.00 H ATOM 1563 N LYS A 645 4.841 -20.360 -14.837 1.00 37.56 N ATOM 1564 CA LYS A 645 6.248 -20.567 -15.284 1.00 37.61 C ATOM 1565 C LYS A 645 6.913 -21.692 -14.473 1.00 36.92 C ATOM 1566 O LYS A 645 7.970 -22.175 -14.909 1.00 36.81 O ATOM 1567 CB LYS A 645 7.030 -19.258 -15.200 1.00 41.01 C ATOM 1568 CG LYS A 645 6.604 -18.237 -16.245 1.00 46.69 C ATOM 1569 CD LYS A 645 7.441 -16.975 -16.262 1.00 49.53 C ATOM 1570 CE LYS A 645 7.013 -16.027 -17.361 1.00 52.80 C ATOM 1571 NZ LYS A 645 7.855 -14.811 -17.384 1.00 56.31 N ATOM 1572 HZ1 LYS A 645 7.774 -14.318 -16.472 1.00 0.00 H ATOM 1573 HZ2 LYS A 645 8.846 -15.080 -17.547 1.00 0.00 H ATOM 1574 HZ3 LYS A 645 7.534 -14.183 -18.149 1.00 0.00 H ATOM 1575 H LYS A 645 4.608 -19.510 -14.285 1.00 0.00 H ATOM 1576 N TRP A 646 6.283 -22.142 -13.387 1.00 35.62 N ATOM 1577 CA TRP A 646 6.784 -23.253 -12.528 1.00 35.69 C ATOM 1578 C TRP A 646 5.998 -24.545 -12.778 1.00 35.29 C ATOM 1579 O TRP A 646 6.422 -25.609 -12.259 1.00 34.12 O ATOM 1580 CB TRP A 646 6.732 -22.816 -11.061 1.00 34.84 C ATOM 1581 CG TRP A 646 7.864 -21.920 -10.667 1.00 33.53 C ATOM 1582 CD1 TRP A 646 9.033 -22.307 -10.086 1.00 35.57 C ATOM 1583 CD2 TRP A 646 7.966 -20.495 -10.861 1.00 35.85 C ATOM 1584 NE1 TRP A 646 9.838 -21.224 -9.871 1.00 34.68 N ATOM 1585 CE2 TRP A 646 9.212 -20.094 -10.335 1.00 35.51 C ATOM 1586 CE3 TRP A 646 7.126 -19.514 -11.406 1.00 38.08 C ATOM 1587 CZ2 TRP A 646 9.641 -18.763 -10.350 1.00 37.51 C ATOM 1588 CZ3 TRP A 646 7.549 -18.198 -11.417 1.00 39.08 C ATOM 1589 CH2 TRP A 646 8.790 -17.826 -10.898 1.00 37.67 C ATOM 1590 HE1 TRP A 646 10.777 -21.252 -9.426 1.00 0.00 H ATOM 1591 H TRP A 646 5.385 -21.689 -13.122 1.00 0.00 H ATOM 1592 N MET A 647 4.934 -24.505 -13.585 1.00 34.70 N ATOM 1593 CA MET A 647 3.957 -25.622 -13.665 1.00 36.38 C ATOM 1594 C MET A 647 4.330 -26.628 -14.759 1.00 35.32 C ATOM 1595 O MET A 647 4.670 -26.232 -15.887 1.00 34.16 O ATOM 1596 CB MET A 647 2.542 -25.098 -13.915 1.00 39.39 C ATOM 1597 CG MET A 647 1.996 -24.340 -12.735 1.00 42.43 C ATOM 1598 SD MET A 647 0.409 -23.543 -13.099 1.00 45.36 S ATOM 1599 CE MET A 647 -0.622 -24.976 -13.395 1.00 40.59 C ATOM 1600 H MET A 647 4.784 -23.663 -14.177 1.00 0.00 H ATOM 1601 N ALA A 648 4.216 -27.912 -14.442 1.00 32.74 N ATOM 1602 CA ALA A 648 4.361 -29.015 -15.410 1.00 33.84 C ATOM 1603 C ALA A 648 3.262 -28.876 -16.461 1.00 34.42 C ATOM 1604 O ALA A 648 2.171 -28.404 -16.156 1.00 36.47 O ATOM 1605 CB ALA A 648 4.276 -30.342 -14.706 1.00 33.40 C ATOM 1606 H ALA A 648 4.012 -28.155 -13.451 1.00 0.00 H ATOM 1607 N PRO A 649 3.508 -29.299 -17.715 1.00 37.14 N ATOM 1608 CA PRO A 649 2.497 -29.192 -18.769 1.00 37.69 C ATOM 1609 C PRO A 649 1.175 -29.879 -18.383 1.00 37.15 C ATOM 1610 O PRO A 649 0.144 -29.301 -18.646 1.00 35.07 O ATOM 1611 CB PRO A 649 3.131 -29.836 -20.011 1.00 39.91 C ATOM 1612 CG PRO A 649 4.469 -30.414 -19.563 1.00 41.07 C ATOM 1613 CD PRO A 649 4.777 -29.865 -18.187 1.00 38.10 C ATOM 1614 N GLU A 650 1.225 -31.068 -17.763 1.00 34.43 N ATOM 1615 CA GLU A 650 0.000 -31.801 -17.339 1.00 35.71 C ATOM 1616 C GLU A 650 -0.794 -30.950 -16.335 1.00 33.98 C ATOM 1617 O GLU A 650 -2.016 -31.106 -16.301 1.00 39.05 O ATOM 1618 CB GLU A 650 0.326 -33.206 -16.815 1.00 37.47 C ATOM 1619 CG GLU A 650 1.064 -33.236 -15.487 1.00 36.51 C ATOM 1620 CD GLU A 650 2.585 -33.244 -15.584 1.00 36.16 C ATOM 1621 OE1 GLU A 650 3.127 -32.875 -16.651 1.00 34.06 O ATOM 1622 OE2 GLU A 650 3.224 -33.641 -14.591 1.00 35.85 O ATOM 1623 H GLU A 650 2.154 -31.494 -17.571 1.00 0.00 H ATOM 1624 N ALA A 651 -0.143 -30.098 -15.540 1.00 35.83 N ATOM 1625 CA ALA A 651 -0.810 -29.172 -14.591 1.00 38.47 C ATOM 1626 C ALA A 651 -1.375 -27.965 -15.356 1.00 43.14 C ATOM 1627 O ALA A 651 -2.510 -27.558 -15.058 1.00 40.44 O ATOM 1628 CB ALA A 651 0.142 -28.724 -13.511 1.00 38.40 C ATOM 1629 H ALA A 651 0.896 -30.082 -15.589 1.00 0.00 H ATOM 1630 N LEU A 652 -0.593 -27.386 -16.271 1.00 43.54 N ATOM 1631 CA LEU A 652 -1.037 -26.249 -17.122 1.00 47.20 C ATOM 1632 C LEU A 652 -2.332 -26.669 -17.812 1.00 46.55 C ATOM 1633 O LEU A 652 -3.383 -26.075 -17.519 1.00 51.71 O ATOM 1634 CB LEU A 652 0.021 -25.913 -18.180 1.00 45.12 C ATOM 1635 CG LEU A 652 1.308 -25.252 -17.700 1.00 45.88 C ATOM 1636 CD1 LEU A 652 2.337 -25.231 -18.823 1.00 45.99 C ATOM 1637 CD2 LEU A 652 1.048 -23.842 -17.195 1.00 46.53 C ATOM 1638 H LEU A 652 0.374 -27.748 -16.395 1.00 0.00 H ATOM 1639 N PHE A 653 -2.239 -27.728 -18.622 1.00 48.82 N ATOM 1640 CA PHE A 653 -3.216 -28.096 -19.678 1.00 49.51 C ATOM 1641 C PHE A 653 -4.311 -29.008 -19.109 1.00 54.79 C ATOM 1642 O PHE A 653 -5.454 -28.876 -19.620 1.00 52.93 O ATOM 1643 CB PHE A 653 -2.502 -28.715 -20.889 1.00 48.71 C ATOM 1644 CG PHE A 653 -1.402 -27.862 -21.477 1.00 44.96 C ATOM 1645 CD1 PHE A 653 -1.619 -26.519 -21.760 1.00 44.67 C ATOM 1646 CD2 PHE A 653 -0.148 -28.395 -21.743 1.00 43.16 C ATOM 1647 CE1 PHE A 653 -0.610 -25.727 -22.286 1.00 42.40 C ATOM 1648 CE2 PHE A 653 0.862 -27.599 -22.259 1.00 42.05 C ATOM 1649 CZ PHE A 653 0.627 -26.270 -22.538 1.00 42.77 C ATOM 1650 H PHE A 653 -1.412 -28.347 -18.503 1.00 0.00 H ATOM 1651 N ASP A 654 -4.009 -29.864 -18.112 1.00 49.48 N ATOM 1652 CA ASP A 654 -4.971 -30.885 -17.600 1.00 48.60 C ATOM 1653 C ASP A 654 -5.303 -30.698 -16.105 1.00 48.62 C ATOM 1654 O ASP A 654 -6.095 -31.513 -15.588 1.00 47.58 O ATOM 1655 CB ASP A 654 -4.472 -32.304 -17.886 1.00 48.76 C ATOM 1656 CG ASP A 654 -5.582 -33.318 -18.127 1.00 52.11 C ATOM 1657 OD1 ASP A 654 -6.704 -32.889 -18.490 1.00 51.08 O ATOM 1658 OD2 ASP A 654 -5.314 -34.532 -17.971 1.00 49.78 O ATOM 1659 H ASP A 654 -3.064 -29.811 -17.680 1.00 0.00 H ATOM 1660 N ARG A 655 -4.761 -29.669 -15.445 1.00 49.61 N ATOM 1661 CA ARG A 655 -5.023 -29.327 -14.014 1.00 52.83 C ATOM 1662 C ARG A 655 -4.675 -30.516 -13.100 1.00 51.13 C ATOM 1663 O ARG A 655 -5.218 -30.576 -11.981 1.00 47.73 O ATOM 1664 CB ARG A 655 -6.482 -28.891 -13.828 1.00 54.68 C ATOM 1665 CG ARG A 655 -6.941 -27.814 -14.805 1.00 61.65 C ATOM 1666 CD ARG A 655 -6.173 -26.504 -14.685 1.00 68.21 C ATOM 1667 NE ARG A 655 -6.214 -25.949 -13.328 1.00 74.92 N ATOM 1668 CZ ARG A 655 -5.160 -25.697 -12.540 1.00 75.17 C ATOM 1669 NH1 ARG A 655 -3.920 -25.913 -12.949 1.00 73.94 N ATOM 1670 NH2 ARG A 655 -5.356 -25.208 -11.328 1.00 77.58 N ATOM 1671 HE ARG A 655 -7.153 -25.730 -12.939 1.00 0.00 H ATOM 1672 HH12 ARG A 655 -3.121 -25.708 -12.316 1.00 0.00 H ATOM 1673 HH11 ARG A 655 -3.745 -26.287 -13.903 1.00 0.00 H ATOM 1674 HH22 ARG A 655 -4.544 -25.009 -10.710 1.00 0.00 H ATOM 1675 HH21 ARG A 655 -6.323 -25.022 -10.992 1.00 0.00 H ATOM 1676 H ARG A 655 -4.104 -29.057 -15.970 1.00 0.00 H ATOM 1677 N VAL A 656 -3.785 -31.417 -13.533 1.00 48.71 N ATOM 1678 CA VAL A 656 -3.362 -32.603 -12.725 1.00 48.18 C ATOM 1679 C VAL A 656 -2.035 -32.265 -12.034 1.00 42.03 C ATOM 1680 O VAL A 656 -1.078 -31.880 -12.739 1.00 43.00 O ATOM 1681 CB VAL A 656 -3.280 -33.892 -13.569 1.00 51.33 C ATOM 1682 CG1 VAL A 656 -4.566 -34.146 -14.344 1.00 53.44 C ATOM 1683 CG2 VAL A 656 -2.092 -33.916 -14.509 1.00 53.83 C ATOM 1684 H VAL A 656 -3.367 -31.286 -14.476 1.00 0.00 H ATOM 1685 N TYR A 657 -1.987 -32.375 -10.704 1.00 42.69 N ATOM 1686 CA TYR A 657 -0.754 -32.207 -9.888 1.00 42.33 C ATOM 1687 C TYR A 657 -0.400 -33.551 -9.248 1.00 40.06 C ATOM 1688 O TYR A 657 -1.278 -34.169 -8.611 1.00 33.41 O ATOM 1689 CB TYR A 657 -0.913 -31.152 -8.795 1.00 43.11 C ATOM 1690 CG TYR A 657 -1.156 -29.749 -9.282 1.00 45.24 C ATOM 1691 CD1 TYR A 657 -2.432 -29.330 -9.626 1.00 49.68 C ATOM 1692 CD2 TYR A 657 -0.119 -28.835 -9.387 1.00 42.77 C ATOM 1693 CE1 TYR A 657 -2.670 -28.037 -10.068 1.00 51.05 C ATOM 1694 CE2 TYR A 657 -0.339 -27.541 -9.831 1.00 44.59 C ATOM 1695 CZ TYR A 657 -1.620 -27.139 -10.160 1.00 48.37 C ATOM 1696 OH TYR A 657 -1.856 -25.865 -10.578 1.00 53.78 O ATOM 1697 HH TYR A 657 -2.821 -25.755 -10.768 1.00 0.00 H ATOM 1698 H TYR A 657 -2.872 -32.593 -10.204 1.00 0.00 H ATOM 1699 N THR A 658 0.842 -33.986 -9.454 1.00 36.35 N ATOM 1700 CA THR A 658 1.414 -35.245 -8.921 1.00 34.73 C ATOM 1701 C THR A 658 2.792 -34.941 -8.338 1.00 33.60 C ATOM 1702 O THR A 658 3.257 -33.777 -8.473 1.00 29.42 O ATOM 1703 CB THR A 658 1.523 -36.318 -10.011 1.00 36.92 C ATOM 1704 OG1 THR A 658 2.420 -35.840 -11.022 1.00 34.99 O ATOM 1705 CG2 THR A 658 0.179 -36.681 -10.605 1.00 38.63 C ATOM 1706 HG1 THR A 658 2.503 -36.521 -11.736 1.00 0.00 H ATOM 1707 H THR A 658 1.463 -33.391 -10.039 1.00 0.00 H ATOM 1708 N HIS A 659 3.432 -35.947 -7.735 1.00 30.55 N ATOM 1709 CA HIS A 659 4.849 -35.846 -7.300 1.00 30.07 C ATOM 1710 C HIS A 659 5.712 -35.507 -8.519 1.00 28.94 C ATOM 1711 O HIS A 659 6.639 -34.712 -8.381 1.00 30.16 O ATOM 1712 CB HIS A 659 5.294 -37.120 -6.579 1.00 30.79 C ATOM 1713 CG HIS A 659 4.512 -37.350 -5.337 1.00 30.74 C ATOM 1714 ND1 HIS A 659 4.531 -36.454 -4.287 1.00 29.51 N ATOM 1715 CD2 HIS A 659 3.644 -38.333 -4.998 1.00 32.83 C ATOM 1716 CE1 HIS A 659 3.724 -36.894 -3.336 1.00 33.94 C ATOM 1717 NE2 HIS A 659 3.167 -38.045 -3.752 1.00 30.95 N ATOM 1718 H HIS A 659 2.918 -36.835 -7.564 1.00 0.00 H ATOM 1719 N GLN A 660 5.374 -36.047 -9.680 1.00 29.17 N ATOM 1720 CA GLN A 660 6.217 -35.830 -10.887 1.00 29.63 C ATOM 1721 C GLN A 660 5.987 -34.411 -11.437 1.00 30.36 C ATOM 1722 O GLN A 660 6.954 -33.893 -12.022 1.00 29.90 O ATOM 1723 CB GLN A 660 6.037 -36.945 -11.921 1.00 29.23 C ATOM 1724 CG GLN A 660 6.666 -38.278 -11.509 1.00 27.87 C ATOM 1725 CD GLN A 660 8.040 -38.181 -10.880 1.00 25.80 C ATOM 1726 OE1 GLN A 660 8.193 -38.265 -9.667 1.00 24.57 O ATOM 1727 NE2 GLN A 660 9.061 -38.029 -11.702 1.00 24.17 N ATOM 1728 HE22 GLN A 660 8.898 -37.961 -12.727 1.00 0.00 H ATOM 1729 HE21 GLN A 660 10.029 -37.977 -11.325 1.00 0.00 H ATOM 1730 H GLN A 660 4.513 -36.627 -9.749 1.00 0.00 H ATOM 1731 N SER A 661 4.820 -33.775 -11.220 1.00 30.52 N ATOM 1732 CA SER A 661 4.598 -32.326 -11.505 1.00 32.55 C ATOM 1733 C SER A 661 5.519 -31.495 -10.605 1.00 33.58 C ATOM 1734 O SER A 661 6.116 -30.507 -11.080 1.00 31.61 O ATOM 1735 CB SER A 661 3.157 -31.908 -11.295 1.00 33.27 C ATOM 1736 OG SER A 661 2.250 -32.855 -11.836 1.00 35.06 O ATOM 1737 HG SER A 661 2.410 -32.945 -12.809 1.00 0.00 H ATOM 1738 H SER A 661 4.027 -34.325 -10.831 1.00 0.00 H ATOM 1739 N ASP A 662 5.638 -31.905 -9.344 1.00 29.52 N ATOM 1740 CA ASP A 662 6.541 -31.221 -8.385 1.00 28.13 C ATOM 1741 C ASP A 662 7.982 -31.324 -8.887 1.00 25.86 C ATOM 1742 O ASP A 662 8.748 -30.360 -8.654 1.00 24.69 O ATOM 1743 CB ASP A 662 6.381 -31.777 -6.963 1.00 30.77 C ATOM 1744 CG ASP A 662 5.190 -31.225 -6.192 1.00 33.08 C ATOM 1745 OD1 ASP A 662 4.646 -30.182 -6.603 1.00 29.88 O ATOM 1746 OD2 ASP A 662 4.830 -31.837 -5.153 1.00 32.26 O ATOM 1747 H ASP A 662 5.085 -32.725 -9.023 1.00 0.00 H ATOM 1748 N VAL A 663 8.369 -32.447 -9.510 1.00 26.17 N ATOM 1749 CA VAL A 663 9.753 -32.647 -10.026 1.00 26.50 C ATOM 1750 C VAL A 663 10.015 -31.620 -11.143 1.00 26.78 C ATOM 1751 O VAL A 663 11.111 -31.053 -11.192 1.00 26.32 O ATOM 1752 CB VAL A 663 10.015 -34.092 -10.500 1.00 25.42 C ATOM 1753 CG1 VAL A 663 11.308 -34.186 -11.294 1.00 26.76 C ATOM 1754 CG2 VAL A 663 10.059 -35.064 -9.314 1.00 26.89 C ATOM 1755 H VAL A 663 7.674 -33.210 -9.638 1.00 0.00 H ATOM 1756 N TRP A 664 9.035 -31.360 -12.000 1.00 27.56 N ATOM 1757 CA TRP A 664 9.168 -30.297 -13.036 1.00 28.41 C ATOM 1758 C TRP A 664 9.496 -28.959 -12.357 1.00 27.00 C ATOM 1759 O TRP A 664 10.496 -28.309 -12.752 1.00 28.47 O ATOM 1760 CB TRP A 664 7.904 -30.233 -13.895 1.00 28.83 C ATOM 1761 CG TRP A 664 7.952 -29.150 -14.922 1.00 28.85 C ATOM 1762 CD1 TRP A 664 7.936 -27.804 -14.702 1.00 30.31 C ATOM 1763 CD2 TRP A 664 8.018 -29.331 -16.346 1.00 29.26 C ATOM 1764 NE1 TRP A 664 7.999 -27.133 -15.894 1.00 29.21 N ATOM 1765 CE2 TRP A 664 8.050 -28.043 -16.918 1.00 29.77 C ATOM 1766 CE3 TRP A 664 8.037 -30.450 -17.185 1.00 30.13 C ATOM 1767 CZ2 TRP A 664 8.119 -27.850 -18.298 1.00 30.33 C ATOM 1768 CZ3 TRP A 664 8.106 -30.257 -18.549 1.00 32.19 C ATOM 1769 CH2 TRP A 664 8.138 -28.971 -19.091 1.00 29.66 C ATOM 1770 HE1 TRP A 664 8.007 -26.099 -16.005 1.00 0.00 H ATOM 1771 H TRP A 664 8.154 -31.911 -11.947 1.00 0.00 H ATOM 1772 N SER A 665 8.708 -28.570 -11.353 1.00 28.12 N ATOM 1773 CA SER A 665 8.900 -27.324 -10.571 1.00 27.95 C ATOM 1774 C SER A 665 10.292 -27.326 -9.928 1.00 28.04 C ATOM 1775 O SER A 665 10.935 -26.259 -9.876 1.00 26.56 O ATOM 1776 CB SER A 665 7.819 -27.137 -9.529 1.00 28.73 C ATOM 1777 OG SER A 665 6.541 -27.362 -10.076 1.00 28.09 O ATOM 1778 HG SER A 665 6.382 -26.723 -10.815 1.00 0.00 H ATOM 1779 H SER A 665 7.905 -29.181 -11.102 1.00 0.00 H ATOM 1780 N PHE A 666 10.758 -28.475 -9.430 1.00 28.13 N ATOM 1781 CA PHE A 666 12.108 -28.565 -8.826 1.00 26.74 C ATOM 1782 C PHE A 666 13.142 -28.163 -9.890 1.00 27.17 C ATOM 1783 O PHE A 666 14.110 -27.464 -9.569 1.00 27.86 O ATOM 1784 CB PHE A 666 12.391 -29.958 -8.264 1.00 27.58 C ATOM 1785 CG PHE A 666 13.765 -30.057 -7.652 1.00 26.56 C ATOM 1786 CD1 PHE A 666 13.979 -29.666 -6.341 1.00 26.80 C ATOM 1787 CD2 PHE A 666 14.841 -30.513 -8.393 1.00 27.69 C ATOM 1788 CE1 PHE A 666 15.250 -29.710 -5.787 1.00 27.95 C ATOM 1789 CE2 PHE A 666 16.106 -30.585 -7.828 1.00 29.64 C ATOM 1790 CZ PHE A 666 16.307 -30.180 -6.530 1.00 28.94 C ATOM 1791 H PHE A 666 10.160 -29.325 -9.467 1.00 0.00 H ATOM 1792 N GLY A 667 12.970 -28.633 -11.122 1.00 26.72 N ATOM 1793 CA GLY A 667 13.857 -28.257 -12.240 1.00 29.64 C ATOM 1794 C GLY A 667 13.891 -26.749 -12.436 1.00 29.30 C ATOM 1795 O GLY A 667 14.984 -26.205 -12.626 1.00 28.82 O ATOM 1796 H GLY A 667 12.183 -29.288 -11.304 1.00 0.00 H ATOM 1797 N ILE A 668 12.736 -26.084 -12.365 1.00 31.45 N ATOM 1798 CA ILE A 668 12.649 -24.596 -12.489 1.00 31.74 C ATOM 1799 C ILE A 668 13.366 -23.969 -11.287 1.00 32.31 C ATOM 1800 O ILE A 668 14.161 -23.030 -11.473 1.00 29.63 O ATOM 1801 CB ILE A 668 11.192 -24.110 -12.619 1.00 32.93 C ATOM 1802 CG1 ILE A 668 10.451 -24.786 -13.780 1.00 33.29 C ATOM 1803 CG2 ILE A 668 11.145 -22.586 -12.726 1.00 33.28 C ATOM 1804 CD1 ILE A 668 10.980 -24.438 -15.166 1.00 33.12 C ATOM 1805 H ILE A 668 11.859 -26.623 -12.217 1.00 0.00 H ATOM 1806 N LEU A 669 13.173 -24.518 -10.086 1.00 31.46 N ATOM 1807 CA LEU A 669 13.865 -24.027 -8.864 1.00 31.78 C ATOM 1808 C LEU A 669 15.384 -24.158 -9.034 1.00 30.15 C ATOM 1809 O LEU A 669 16.099 -23.235 -8.598 1.00 29.81 O ATOM 1810 CB LEU A 669 13.362 -24.820 -7.649 1.00 33.27 C ATOM 1811 CG LEU A 669 13.866 -24.347 -6.286 1.00 37.05 C ATOM 1812 CD1 LEU A 669 12.857 -24.693 -5.200 1.00 40.81 C ATOM 1813 CD2 LEU A 669 15.201 -24.965 -5.957 1.00 39.16 C ATOM 1814 H LEU A 669 12.515 -25.319 -10.001 1.00 0.00 H ATOM 1815 N LEU A 670 15.862 -25.269 -9.601 1.00 29.37 N ATOM 1816 CA LEU A 670 17.313 -25.510 -9.823 1.00 32.51 C ATOM 1817 C LEU A 670 17.877 -24.376 -10.693 1.00 31.42 C ATOM 1818 O LEU A 670 18.962 -23.868 -10.401 1.00 31.01 O ATOM 1819 CB LEU A 670 17.515 -26.846 -10.535 1.00 33.78 C ATOM 1820 CG LEU A 670 18.043 -28.023 -9.722 1.00 40.35 C ATOM 1821 CD1 LEU A 670 18.416 -29.145 -10.680 1.00 38.95 C ATOM 1822 CD2 LEU A 670 19.241 -27.645 -8.857 1.00 41.36 C ATOM 1823 H LEU A 670 15.187 -26.001 -9.902 1.00 0.00 H ATOM 1824 N TRP A 671 17.144 -24.019 -11.741 1.00 32.29 N ATOM 1825 CA TRP A 671 17.474 -22.887 -12.650 1.00 31.89 C ATOM 1826 C TRP A 671 17.481 -21.563 -11.869 1.00 31.99 C ATOM 1827 O TRP A 671 18.456 -20.784 -12.027 1.00 35.09 O ATOM 1828 CB TRP A 671 16.511 -22.904 -13.837 1.00 31.72 C ATOM 1829 CG TRP A 671 16.898 -21.951 -14.922 1.00 34.51 C ATOM 1830 CD1 TRP A 671 17.623 -22.220 -16.044 1.00 35.34 C ATOM 1831 CD2 TRP A 671 16.577 -20.556 -14.969 1.00 34.51 C ATOM 1832 NE1 TRP A 671 17.752 -21.084 -16.803 1.00 33.39 N ATOM 1833 CE2 TRP A 671 17.133 -20.047 -16.163 1.00 35.33 C ATOM 1834 CE3 TRP A 671 15.872 -19.691 -14.125 1.00 36.49 C ATOM 1835 CZ2 TRP A 671 16.996 -18.711 -16.531 1.00 38.57 C ATOM 1836 CZ3 TRP A 671 15.756 -18.366 -14.482 1.00 39.88 C ATOM 1837 CH2 TRP A 671 16.314 -17.887 -15.667 1.00 37.67 C ATOM 1838 HE1 TRP A 671 18.242 -21.022 -17.718 1.00 0.00 H ATOM 1839 H TRP A 671 16.282 -24.566 -11.940 1.00 0.00 H ATOM 1840 N GLU A 672 16.519 -21.342 -10.967 1.00 32.96 N ATOM 1841 CA GLU A 672 16.509 -20.153 -10.075 1.00 32.83 C ATOM 1842 C GLU A 672 17.793 -20.125 -9.244 1.00 32.93 C ATOM 1843 O GLU A 672 18.353 -19.040 -9.064 1.00 32.92 O ATOM 1844 CB GLU A 672 15.305 -20.138 -9.131 1.00 34.21 C ATOM 1845 CG GLU A 672 13.978 -19.834 -9.793 1.00 34.47 C ATOM 1846 CD GLU A 672 12.823 -19.807 -8.803 1.00 37.67 C ATOM 1847 OE1 GLU A 672 12.453 -18.698 -8.353 1.00 34.89 O ATOM 1848 OE2 GLU A 672 12.316 -20.911 -8.442 1.00 33.72 O ATOM 1849 H GLU A 672 15.745 -22.031 -10.886 1.00 0.00 H ATOM 1850 N ILE A 673 18.253 -21.270 -8.738 1.00 31.90 N ATOM 1851 CA ILE A 673 19.436 -21.317 -7.834 1.00 31.25 C ATOM 1852 C ILE A 673 20.674 -20.916 -8.653 1.00 31.66 C ATOM 1853 O ILE A 673 21.462 -20.077 -8.167 1.00 33.12 O ATOM 1854 CB ILE A 673 19.599 -22.699 -7.157 1.00 31.90 C ATOM 1855 CG1 ILE A 673 18.521 -22.950 -6.096 1.00 33.62 C ATOM 1856 CG2 ILE A 673 20.997 -22.839 -6.572 1.00 31.93 C ATOM 1857 CD1 ILE A 673 18.502 -24.373 -5.561 1.00 32.58 C ATOM 1858 H ILE A 673 17.770 -22.158 -8.982 1.00 0.00 H ATOM 1859 N PHE A 674 20.827 -21.464 -9.859 1.00 31.81 N ATOM 1860 CA PHE A 674 22.053 -21.287 -10.684 1.00 34.61 C ATOM 1861 C PHE A 674 21.992 -19.994 -11.518 1.00 36.30 C ATOM 1862 O PHE A 674 22.979 -19.742 -12.242 1.00 40.46 O ATOM 1863 CB PHE A 674 22.326 -22.559 -11.486 1.00 36.78 C ATOM 1864 CG PHE A 674 22.951 -23.606 -10.605 1.00 37.29 C ATOM 1865 CD1 PHE A 674 24.311 -23.576 -10.348 1.00 41.20 C ATOM 1866 CD2 PHE A 674 22.169 -24.533 -9.935 1.00 38.37 C ATOM 1867 CE1 PHE A 674 24.885 -24.492 -9.481 1.00 41.44 C ATOM 1868 CE2 PHE A 674 22.747 -25.445 -9.066 1.00 39.82 C ATOM 1869 CZ PHE A 674 24.103 -25.425 -8.847 1.00 43.29 C ATOM 1870 H PHE A 674 20.052 -22.043 -10.241 1.00 0.00 H ATOM 1871 N THR A 675 20.925 -19.194 -11.388 1.00 35.98 N ATOM 1872 CA THR A 675 20.840 -17.785 -11.884 1.00 36.90 C ATOM 1873 C THR A 675 20.830 -16.820 -10.695 1.00 36.86 C ATOM 1874 O THR A 675 20.550 -15.646 -10.903 1.00 36.07 O ATOM 1875 CB THR A 675 19.606 -17.566 -12.770 1.00 35.21 C ATOM 1876 OG1 THR A 675 18.424 -17.925 -12.052 1.00 36.88 O ATOM 1877 CG2 THR A 675 19.675 -18.353 -14.054 1.00 35.46 C ATOM 1878 HG1 THR A 675 18.475 -18.879 -11.791 1.00 0.00 H ATOM 1879 H THR A 675 20.090 -19.583 -10.904 1.00 0.00 H ATOM 1880 N LEU A 676 21.093 -17.311 -9.481 1.00 34.73 N ATOM 1881 CA LEU A 676 21.027 -16.532 -8.219 1.00 38.10 C ATOM 1882 C LEU A 676 19.707 -15.753 -8.149 1.00 38.09 C ATOM 1883 O LEU A 676 19.726 -14.550 -7.820 1.00 35.12 O ATOM 1884 CB LEU A 676 22.252 -15.616 -8.111 1.00 39.63 C ATOM 1885 CG LEU A 676 23.607 -16.316 -8.014 1.00 42.08 C ATOM 1886 CD1 LEU A 676 24.735 -15.296 -7.900 1.00 43.21 C ATOM 1887 CD2 LEU A 676 23.660 -17.276 -6.833 1.00 42.85 C ATOM 1888 H LEU A 676 21.364 -18.313 -9.415 1.00 0.00 H ATOM 1889 N GLY A 677 18.588 -16.434 -8.405 1.00 36.81 N ATOM 1890 CA GLY A 677 17.240 -15.873 -8.211 1.00 35.42 C ATOM 1891 C GLY A 677 16.707 -15.182 -9.458 1.00 35.31 C ATOM 1892 O GLY A 677 15.925 -14.235 -9.299 1.00 34.60 O ATOM 1893 H GLY A 677 18.672 -17.408 -8.759 1.00 0.00 H ATOM 1894 N GLY A 678 17.066 -15.678 -10.643 1.00 36.55 N ATOM 1895 CA GLY A 678 16.578 -15.186 -11.945 1.00 39.06 C ATOM 1896 C GLY A 678 15.103 -15.481 -12.152 1.00 44.39 C ATOM 1897 O GLY A 678 14.596 -16.465 -11.561 1.00 40.84 O ATOM 1898 H GLY A 678 17.740 -16.470 -10.649 1.00 0.00 H ATOM 1899 N SER A 679 14.431 -14.650 -12.954 1.00 44.87 N ATOM 1900 CA SER A 679 13.029 -14.854 -13.404 1.00 45.66 C ATOM 1901 C SER A 679 13.033 -15.844 -14.561 1.00 44.54 C ATOM 1902 O SER A 679 13.725 -15.621 -15.550 1.00 44.09 O ATOM 1903 CB SER A 679 12.387 -13.555 -13.807 1.00 49.07 C ATOM 1904 OG SER A 679 12.593 -12.572 -12.806 1.00 51.87 O ATOM 1905 HG SER A 679 12.165 -11.724 -13.085 1.00 0.00 H ATOM 1906 H SER A 679 14.925 -13.798 -13.288 1.00 0.00 H ATOM 1907 N PRO A 680 12.283 -16.970 -14.472 1.00 44.89 N ATOM 1908 CA PRO A 680 12.287 -17.989 -15.523 1.00 42.49 C ATOM 1909 C PRO A 680 11.701 -17.489 -16.852 1.00 43.07 C ATOM 1910 O PRO A 680 10.880 -16.609 -16.818 1.00 43.31 O ATOM 1911 CB PRO A 680 11.375 -19.103 -14.993 1.00 43.59 C ATOM 1912 CG PRO A 680 11.208 -18.813 -13.519 1.00 46.69 C ATOM 1913 CD PRO A 680 11.392 -17.317 -13.356 1.00 45.19 C ATOM 1914 N TYR A 681 12.088 -18.100 -17.972 1.00 41.91 N ATOM 1915 CA TYR A 681 11.627 -17.724 -19.335 1.00 45.44 C ATOM 1916 C TYR A 681 11.686 -16.203 -19.474 1.00 49.62 C ATOM 1917 O TYR A 681 10.666 -15.556 -19.723 1.00 51.80 O ATOM 1918 CB TYR A 681 10.218 -18.272 -19.581 1.00 42.75 C ATOM 1919 CG TYR A 681 10.096 -19.756 -19.337 1.00 40.29 C ATOM 1920 CD1 TYR A 681 10.505 -20.673 -20.286 1.00 36.18 C ATOM 1921 CD2 TYR A 681 9.603 -20.242 -18.136 1.00 41.04 C ATOM 1922 CE1 TYR A 681 10.413 -22.036 -20.066 1.00 39.44 C ATOM 1923 CE2 TYR A 681 9.495 -21.603 -17.902 1.00 35.89 C ATOM 1924 CZ TYR A 681 9.916 -22.502 -18.859 1.00 37.68 C ATOM 1925 OH TYR A 681 9.794 -23.838 -18.624 1.00 37.73 O ATOM 1926 HH TYR A 681 8.840 -24.061 -18.482 1.00 0.00 H ATOM 1927 H TYR A 681 12.757 -18.892 -17.887 1.00 0.00 H ATOM 1928 N PRO A 682 12.876 -15.591 -19.273 1.00 53.55 N ATOM 1929 CA PRO A 682 12.990 -14.135 -19.215 1.00 59.05 C ATOM 1930 C PRO A 682 12.668 -13.524 -20.587 1.00 64.00 C ATOM 1931 O PRO A 682 13.294 -13.922 -21.561 1.00 58.66 O ATOM 1932 CB PRO A 682 14.449 -13.902 -18.794 1.00 58.93 C ATOM 1933 CG PRO A 682 15.179 -15.130 -19.300 1.00 57.42 C ATOM 1934 CD PRO A 682 14.182 -16.260 -19.138 1.00 54.21 C ATOM 1935 N GLY A 683 11.687 -12.613 -20.622 1.00 66.86 N ATOM 1936 CA GLY A 683 11.196 -11.940 -21.838 1.00 72.92 C ATOM 1937 C GLY A 683 9.906 -12.572 -22.325 1.00 79.44 C ATOM 1938 O GLY A 683 8.910 -11.839 -22.481 1.00 79.48 O ATOM 1939 H GLY A 683 11.236 -12.360 -19.720 1.00 0.00 H ATOM 1940 N ILE A 684 9.922 -13.893 -22.528 1.00 80.48 N ATOM 1941 CA ILE A 684 8.789 -14.680 -23.099 1.00 81.48 C ATOM 1942 C ILE A 684 7.551 -14.432 -22.243 1.00 86.63 C ATOM 1943 O ILE A 684 7.541 -14.771 -21.061 1.00 92.92 O ATOM 1944 CB ILE A 684 9.138 -16.180 -23.184 1.00 77.02 C ATOM 1945 CG1 ILE A 684 10.274 -16.443 -24.178 1.00 76.72 C ATOM 1946 CG2 ILE A 684 7.899 -16.998 -23.516 1.00 77.75 C ATOM 1947 CD1 ILE A 684 10.986 -17.758 -23.966 1.00 75.86 C ATOM 1948 H ILE A 684 10.786 -14.410 -22.269 1.00 0.00 H ATOM 1949 N PRO A 685 6.479 -13.827 -22.805 1.00 92.78 N ATOM 1950 CA PRO A 685 5.243 -13.604 -22.054 1.00 90.70 C ATOM 1951 C PRO A 685 4.452 -14.909 -21.881 1.00 88.59 C ATOM 1952 O PRO A 685 4.506 -15.740 -22.772 1.00 88.14 O ATOM 1953 CB PRO A 685 4.482 -12.590 -22.923 1.00 92.97 C ATOM 1954 CG PRO A 685 4.957 -12.878 -24.335 1.00 92.07 C ATOM 1955 CD PRO A 685 6.397 -13.325 -24.188 1.00 90.91 C ATOM 1956 N VAL A 686 3.730 -15.046 -20.763 1.00 86.66 N ATOM 1957 CA VAL A 686 2.937 -16.262 -20.403 1.00 87.89 C ATOM 1958 C VAL A 686 2.217 -16.803 -21.651 1.00 89.23 C ATOM 1959 O VAL A 686 2.046 -18.035 -21.740 1.00 96.16 O ATOM 1960 CB VAL A 686 1.944 -15.972 -19.259 1.00 85.76 C ATOM 1961 H VAL A 686 3.719 -14.249 -20.095 1.00 0.00 H ATOM 1962 N GLU A 687 1.825 -15.923 -22.581 1.00 83.12 N ATOM 1963 CA GLU A 687 1.099 -16.271 -23.833 1.00 75.84 C ATOM 1964 C GLU A 687 1.902 -17.282 -24.662 1.00 70.33 C ATOM 1965 O GLU A 687 1.304 -18.288 -25.081 1.00 73.79 O ATOM 1966 CB GLU A 687 0.825 -15.008 -24.654 1.00 76.65 C ATOM 1967 H GLU A 687 2.045 -14.920 -22.416 1.00 0.00 H ATOM 1968 N GLU A 688 3.197 -17.020 -24.891 1.00 69.20 N ATOM 1969 CA GLU A 688 4.075 -17.800 -25.814 1.00 66.51 C ATOM 1970 C GLU A 688 4.702 -19.013 -25.101 1.00 65.34 C ATOM 1971 O GLU A 688 5.298 -19.866 -25.810 1.00 63.30 O ATOM 1972 CB GLU A 688 5.177 -16.903 -26.389 1.00 68.75 C ATOM 1973 H GLU A 688 3.621 -16.214 -24.389 1.00 0.00 H ATOM 1974 N LEU A 689 4.600 -19.090 -23.767 1.00 58.05 N ATOM 1975 CA LEU A 689 5.237 -20.162 -22.950 1.00 52.73 C ATOM 1976 C LEU A 689 4.698 -21.526 -23.383 1.00 49.43 C ATOM 1977 O LEU A 689 5.504 -22.402 -23.727 1.00 48.51 O ATOM 1978 CB LEU A 689 4.953 -19.933 -21.463 1.00 53.88 C ATOM 1979 CG LEU A 689 5.420 -21.059 -20.536 1.00 53.10 C ATOM 1980 CD1 LEU A 689 6.896 -21.365 -20.749 1.00 51.65 C ATOM 1981 CD2 LEU A 689 5.149 -20.720 -19.077 1.00 54.98 C ATOM 1982 H LEU A 689 4.045 -18.361 -23.274 1.00 0.00 H ATOM 1983 N PHE A 690 3.376 -21.683 -23.364 1.00 50.93 N ATOM 1984 CA PHE A 690 2.662 -22.974 -23.554 1.00 52.37 C ATOM 1985 C PHE A 690 3.042 -23.588 -24.908 1.00 51.77 C ATOM 1986 O PHE A 690 3.270 -24.808 -24.979 1.00 47.64 O ATOM 1987 CB PHE A 690 1.156 -22.755 -23.399 1.00 56.29 C ATOM 1988 CG PHE A 690 0.803 -21.773 -22.310 1.00 61.16 C ATOM 1989 CD1 PHE A 690 1.275 -21.956 -21.016 1.00 62.01 C ATOM 1990 CD2 PHE A 690 0.044 -20.642 -22.581 1.00 58.95 C ATOM 1991 CE1 PHE A 690 0.975 -21.042 -20.015 1.00 61.26 C ATOM 1992 CE2 PHE A 690 -0.258 -19.733 -21.578 1.00 61.81 C ATOM 1993 CZ PHE A 690 0.206 -19.934 -20.297 1.00 62.53 C ATOM 1994 H PHE A 690 2.796 -20.835 -23.203 1.00 0.00 H ATOM 1995 N SER A 691 3.115 -22.756 -25.953 1.00 54.07 N ATOM 1996 CA SER A 691 3.522 -23.146 -27.328 1.00 50.56 C ATOM 1997 C SER A 691 5.008 -23.523 -27.352 1.00 47.05 C ATOM 1998 O SER A 691 5.347 -24.503 -28.045 1.00 45.35 O ATOM 1999 CB SER A 691 3.213 -22.046 -28.324 1.00 53.16 C ATOM 2000 OG SER A 691 3.876 -22.278 -29.558 1.00 51.62 O ATOM 2001 HG SER A 691 3.659 -21.548 -30.190 1.00 0.00 H ATOM 2002 H SER A 691 2.868 -21.759 -25.791 1.00 0.00 H ATOM 2003 N LEU A 692 5.860 -22.763 -26.649 1.00 44.44 N ATOM 2004 CA LEU A 692 7.317 -23.049 -26.515 1.00 44.65 C ATOM 2005 C LEU A 692 7.493 -24.474 -25.981 1.00 41.71 C ATOM 2006 O LEU A 692 8.229 -25.264 -26.602 1.00 38.69 O ATOM 2007 CB LEU A 692 7.963 -22.030 -25.569 1.00 45.10 C ATOM 2008 H LEU A 692 5.481 -21.922 -26.168 1.00 0.00 H ATOM 2009 N LEU A 693 6.824 -24.791 -24.868 1.00 44.61 N ATOM 2010 CA LEU A 693 6.953 -26.111 -24.193 1.00 41.38 C ATOM 2011 C LEU A 693 6.452 -27.203 -25.134 1.00 40.47 C ATOM 2012 O LEU A 693 7.132 -28.241 -25.264 1.00 37.89 O ATOM 2013 CB LEU A 693 6.165 -26.092 -22.879 1.00 41.91 C ATOM 2014 CG LEU A 693 6.697 -25.133 -21.820 1.00 41.01 C ATOM 2015 CD1 LEU A 693 5.864 -25.237 -20.551 1.00 43.85 C ATOM 2016 CD2 LEU A 693 8.170 -25.401 -21.524 1.00 40.94 C ATOM 2017 H LEU A 693 6.184 -24.083 -24.455 1.00 0.00 H ATOM 2018 N ARG A 694 5.331 -26.961 -25.821 1.00 41.52 N ATOM 2019 CA ARG A 694 4.710 -27.980 -26.710 1.00 42.35 C ATOM 2020 C ARG A 694 5.637 -28.340 -27.873 1.00 43.35 C ATOM 2021 O ARG A 694 5.594 -29.503 -28.314 1.00 45.45 O ATOM 2022 CB ARG A 694 3.366 -27.480 -27.238 1.00 43.92 C ATOM 2023 CG ARG A 694 2.215 -27.884 -26.338 1.00 43.35 C ATOM 2024 CD ARG A 694 0.984 -27.068 -26.632 1.00 43.14 C ATOM 2025 NE ARG A 694 -0.134 -27.591 -25.874 1.00 41.23 N ATOM 2026 CZ ARG A 694 -1.270 -26.937 -25.688 1.00 44.34 C ATOM 2027 NH1 ARG A 694 -2.240 -27.489 -24.979 1.00 43.16 N ATOM 2028 NH2 ARG A 694 -1.443 -25.743 -26.233 1.00 42.54 N ATOM 2029 HE ARG A 694 -0.039 -28.536 -25.451 1.00 0.00 H ATOM 2030 HH12 ARG A 694 -3.133 -26.977 -24.832 1.00 0.00 H ATOM 2031 HH11 ARG A 694 -2.110 -28.436 -24.568 1.00 0.00 H ATOM 2032 HH22 ARG A 694 -2.335 -25.229 -26.087 1.00 0.00 H ATOM 2033 HH21 ARG A 694 -0.687 -25.319 -26.807 1.00 0.00 H ATOM 2034 H ARG A 694 4.878 -26.029 -25.731 1.00 0.00 H ATOM 2035 N GLU A 695 6.432 -27.383 -28.351 1.00 43.78 N ATOM 2036 CA GLU A 695 7.329 -27.577 -29.519 1.00 51.82 C ATOM 2037 C GLU A 695 8.740 -27.929 -29.019 1.00 52.83 C ATOM 2038 O GLU A 695 9.687 -27.804 -29.806 1.00 54.82 O ATOM 2039 CB GLU A 695 7.211 -26.353 -30.437 1.00 55.34 C ATOM 2040 CG GLU A 695 5.841 -26.269 -31.122 1.00 58.84 C ATOM 2041 CD GLU A 695 5.446 -24.934 -31.744 1.00 61.79 C ATOM 2042 OE1 GLU A 695 4.243 -24.768 -32.106 1.00 54.48 O ATOM 2043 OE2 GLU A 695 6.330 -24.063 -31.875 1.00 64.42 O ATOM 2044 H GLU A 695 6.424 -26.454 -27.883 1.00 0.00 H ATOM 2045 N GLY A 696 8.869 -28.370 -27.757 1.00 51.53 N ATOM 2046 CA GLY A 696 10.069 -29.048 -27.227 1.00 47.23 C ATOM 2047 C GLY A 696 11.126 -28.094 -26.694 1.00 45.16 C ATOM 2048 O GLY A 696 12.216 -28.575 -26.356 1.00 47.57 O ATOM 2049 H GLY A 696 8.069 -28.224 -27.109 1.00 0.00 H ATOM 2050 N HIS A 697 10.834 -26.797 -26.583 1.00 47.50 N ATOM 2051 CA HIS A 697 11.816 -25.778 -26.132 1.00 49.23 C ATOM 2052 C HIS A 697 11.790 -25.663 -24.603 1.00 45.28 C ATOM 2053 O HIS A 697 10.714 -25.836 -23.995 1.00 39.05 O ATOM 2054 CB HIS A 697 11.588 -24.431 -26.832 1.00 56.02 C ATOM 2055 CG HIS A 697 11.801 -24.506 -28.310 1.00 64.02 C ATOM 2056 ND1 HIS A 697 10.933 -23.922 -29.220 1.00 68.31 N ATOM 2057 CD2 HIS A 697 12.745 -25.142 -29.042 1.00 65.14 C ATOM 2058 CE1 HIS A 697 11.349 -24.176 -30.444 1.00 68.13 C ATOM 2059 NE2 HIS A 697 12.459 -24.927 -30.361 1.00 64.90 N ATOM 2060 H HIS A 697 9.872 -26.484 -26.824 1.00 0.00 H ATOM 2061 N ARG A 698 12.952 -25.365 -24.030 1.00 39.60 N ATOM 2062 CA ARG A 698 13.186 -25.232 -22.570 1.00 38.06 C ATOM 2063 C ARG A 698 14.179 -24.094 -22.364 1.00 41.08 C ATOM 2064 O ARG A 698 14.864 -23.730 -23.343 1.00 38.62 O ATOM 2065 CB ARG A 698 13.748 -26.546 -22.016 1.00 33.87 C ATOM 2066 CG ARG A 698 12.896 -27.767 -22.325 1.00 32.90 C ATOM 2067 CD ARG A 698 11.638 -27.772 -21.492 1.00 30.67 C ATOM 2068 NE ARG A 698 10.927 -29.029 -21.584 1.00 31.42 N ATOM 2069 CZ ARG A 698 9.979 -29.325 -22.466 1.00 33.59 C ATOM 2070 NH1 ARG A 698 9.605 -28.450 -23.394 1.00 35.78 N ATOM 2071 NH2 ARG A 698 9.402 -30.508 -22.412 1.00 31.58 N ATOM 2072 HE ARG A 698 11.181 -29.768 -20.897 1.00 0.00 H ATOM 2073 HH12 ARG A 698 8.861 -28.701 -24.076 1.00 0.00 H ATOM 2074 HH11 ARG A 698 10.057 -27.514 -23.439 1.00 0.00 H ATOM 2075 HH22 ARG A 698 8.658 -30.755 -23.095 1.00 0.00 H ATOM 2076 HH21 ARG A 698 9.690 -31.195 -21.686 1.00 0.00 H ATOM 2077 H ARG A 698 13.767 -25.212 -24.658 1.00 0.00 H ATOM 2078 N MET A 699 14.293 -23.593 -21.136 1.00 41.34 N ATOM 2079 CA MET A 699 15.305 -22.572 -20.783 1.00 42.33 C ATOM 2080 C MET A 699 16.706 -23.098 -21.122 1.00 45.04 C ATOM 2081 O MET A 699 16.958 -24.328 -21.019 1.00 41.33 O ATOM 2082 CB MET A 699 15.222 -22.177 -19.310 1.00 42.17 C ATOM 2083 CG MET A 699 13.985 -21.381 -19.012 1.00 43.21 C ATOM 2084 SD MET A 699 13.970 -20.698 -17.365 1.00 44.76 S ATOM 2085 CE MET A 699 13.565 -22.173 -16.426 1.00 43.42 C ATOM 2086 H MET A 699 13.646 -23.932 -20.396 1.00 0.00 H ATOM 2087 N ASP A 700 17.566 -22.179 -21.564 1.00 46.46 N ATOM 2088 CA ASP A 700 18.978 -22.442 -21.934 1.00 47.80 C ATOM 2089 C ASP A 700 19.780 -22.588 -20.643 1.00 41.58 C ATOM 2090 O ASP A 700 19.318 -22.091 -19.607 1.00 42.05 O ATOM 2091 CB ASP A 700 19.560 -21.307 -22.787 1.00 51.34 C ATOM 2092 CG ASP A 700 18.811 -21.042 -24.084 1.00 53.84 C ATOM 2093 OD1 ASP A 700 18.323 -22.014 -24.691 1.00 56.61 O ATOM 2094 OD2 ASP A 700 18.710 -19.862 -24.464 1.00 58.53 O ATOM 2095 H ASP A 700 17.220 -21.203 -21.656 1.00 0.00 H ATOM 2096 N ARG A 701 20.928 -23.252 -20.724 1.00 43.78 N ATOM 2097 CA ARG A 701 21.883 -23.403 -19.599 1.00 46.09 C ATOM 2098 C ARG A 701 22.291 -22.017 -19.123 1.00 48.08 C ATOM 2099 O ARG A 701 22.817 -21.233 -19.905 1.00 48.26 O ATOM 2100 CB ARG A 701 23.115 -24.199 -20.028 1.00 46.42 C ATOM 2101 CG ARG A 701 24.087 -24.466 -18.891 1.00 48.77 C ATOM 2102 CD ARG A 701 25.089 -25.537 -19.269 1.00 52.81 C ATOM 2103 NE ARG A 701 25.992 -25.055 -20.299 1.00 53.15 N ATOM 2104 CZ ARG A 701 26.973 -24.177 -20.107 1.00 58.05 C ATOM 2105 NH1 ARG A 701 27.200 -23.661 -18.910 1.00 59.61 N ATOM 2106 NH2 ARG A 701 27.733 -23.812 -21.123 1.00 60.25 N ATOM 2107 HE ARG A 701 25.862 -25.425 -21.262 1.00 0.00 H ATOM 2108 HH12 ARG A 701 27.971 -22.976 -18.777 1.00 0.00 H ATOM 2109 HH11 ARG A 701 26.607 -23.941 -18.102 1.00 0.00 H ATOM 2110 HH22 ARG A 701 28.501 -23.126 -20.978 1.00 0.00 H ATOM 2111 HH21 ARG A 701 27.564 -24.211 -22.069 1.00 0.00 H ATOM 2112 H ARG A 701 21.172 -23.694 -21.633 1.00 0.00 H ATOM 2113 N PRO A 702 22.042 -21.662 -17.845 1.00 48.85 N ATOM 2114 CA PRO A 702 22.442 -20.353 -17.343 1.00 50.54 C ATOM 2115 C PRO A 702 23.964 -20.233 -17.281 1.00 51.99 C ATOM 2116 O PRO A 702 24.665 -21.239 -17.147 1.00 46.82 O ATOM 2117 CB PRO A 702 21.792 -20.239 -15.959 1.00 49.26 C ATOM 2118 CG PRO A 702 21.416 -21.660 -15.566 1.00 48.55 C ATOM 2119 CD PRO A 702 21.351 -22.480 -16.837 1.00 47.84 C ATOM 2120 N PRO A 703 24.513 -18.999 -17.390 1.00 54.96 N ATOM 2121 CA PRO A 703 25.962 -18.791 -17.379 1.00 56.42 C ATOM 2122 C PRO A 703 26.644 -19.424 -16.156 1.00 54.87 C ATOM 2123 O PRO A 703 26.120 -19.328 -15.058 1.00 48.03 O ATOM 2124 CB PRO A 703 26.113 -17.262 -17.358 1.00 59.19 C ATOM 2125 CG PRO A 703 24.826 -16.751 -17.981 1.00 58.80 C ATOM 2126 CD PRO A 703 23.766 -17.739 -17.544 1.00 57.10 C ATOM 2127 N HIS A 704 27.780 -20.081 -16.389 1.00 57.69 N ATOM 2128 CA HIS A 704 28.658 -20.677 -15.346 1.00 64.50 C ATOM 2129 C HIS A 704 27.968 -21.867 -14.658 1.00 59.31 C ATOM 2130 O HIS A 704 28.519 -22.351 -13.655 1.00 63.69 O ATOM 2131 CB HIS A 704 29.098 -19.606 -14.333 1.00 70.13 C ATOM 2132 CG HIS A 704 29.563 -18.332 -14.957 1.00 78.68 C ATOM 2133 ND1 HIS A 704 30.583 -18.295 -15.896 1.00 82.65 N ATOM 2134 CD2 HIS A 704 29.156 -17.054 -14.783 1.00 83.37 C ATOM 2135 CE1 HIS A 704 30.778 -17.048 -16.278 1.00 84.81 C ATOM 2136 NE2 HIS A 704 29.914 -16.266 -15.610 1.00 84.64 N ATOM 2137 H HIS A 704 28.077 -20.186 -17.380 1.00 0.00 H ATOM 2138 N CYS A 705 26.828 -22.340 -15.172 1.00 55.26 N ATOM 2139 CA CYS A 705 26.150 -23.576 -14.690 1.00 51.07 C ATOM 2140 C CYS A 705 26.810 -24.792 -15.332 1.00 49.09 C ATOM 2141 O CYS A 705 26.751 -24.950 -16.552 1.00 47.45 O ATOM 2142 CB CYS A 705 24.666 -23.595 -15.035 1.00 52.54 C ATOM 2143 SG CYS A 705 23.837 -25.112 -14.488 1.00 48.43 S ATOM 2144 H CYS A 705 26.389 -21.814 -15.954 1.00 0.00 H ATOM 2145 N PRO A 706 27.445 -25.693 -14.548 1.00 46.65 N ATOM 2146 CA PRO A 706 28.078 -26.877 -15.120 1.00 48.12 C ATOM 2147 C PRO A 706 27.066 -27.757 -15.850 1.00 46.68 C ATOM 2148 O PRO A 706 25.894 -27.821 -15.470 1.00 44.63 O ATOM 2149 CB PRO A 706 28.725 -27.630 -13.946 1.00 47.53 C ATOM 2150 CG PRO A 706 28.270 -26.917 -12.694 1.00 49.24 C ATOM 2151 CD PRO A 706 27.597 -25.617 -13.092 1.00 48.71 C ATOM 2152 N PRO A 707 27.483 -28.407 -16.959 1.00 52.58 N ATOM 2153 CA PRO A 707 26.617 -29.317 -17.712 1.00 51.34 C ATOM 2154 C PRO A 707 25.891 -30.400 -16.900 1.00 48.59 C ATOM 2155 O PRO A 707 24.790 -30.719 -17.278 1.00 45.96 O ATOM 2156 CB PRO A 707 27.599 -29.983 -18.686 1.00 54.59 C ATOM 2157 CG PRO A 707 28.616 -28.900 -18.953 1.00 55.85 C ATOM 2158 CD PRO A 707 28.792 -28.219 -17.611 1.00 54.77 C ATOM 2159 N GLU A 708 26.516 -30.944 -15.846 1.00 47.49 N ATOM 2160 CA GLU A 708 25.918 -32.012 -14.994 1.00 47.28 C ATOM 2161 C GLU A 708 24.601 -31.485 -14.405 1.00 40.72 C ATOM 2162 O GLU A 708 23.607 -32.222 -14.407 1.00 43.82 O ATOM 2163 CB GLU A 708 26.886 -32.472 -13.893 1.00 47.15 C ATOM 2164 H GLU A 708 27.470 -30.603 -15.610 1.00 0.00 H ATOM 2165 N LEU A 709 24.580 -30.240 -13.944 1.00 37.48 N ATOM 2166 CA LEU A 709 23.386 -29.689 -13.272 1.00 37.89 C ATOM 2167 C LEU A 709 22.368 -29.202 -14.300 1.00 36.85 C ATOM 2168 O LEU A 709 21.175 -29.353 -14.023 1.00 34.01 O ATOM 2169 CB LEU A 709 23.787 -28.612 -12.273 1.00 40.82 C ATOM 2170 CG LEU A 709 24.110 -29.216 -10.910 1.00 45.08 C ATOM 2171 CD1 LEU A 709 25.588 -29.111 -10.611 1.00 45.29 C ATOM 2172 CD2 LEU A 709 23.270 -28.578 -9.832 1.00 47.80 C ATOM 2173 H LEU A 709 25.422 -29.640 -14.059 1.00 0.00 H ATOM 2174 N TYR A 710 22.796 -28.678 -15.449 1.00 37.32 N ATOM 2175 CA TYR A 710 21.847 -28.343 -16.542 1.00 35.52 C ATOM 2176 C TYR A 710 21.192 -29.641 -17.016 1.00 34.99 C ATOM 2177 O TYR A 710 19.985 -29.657 -17.283 1.00 35.86 O ATOM 2178 CB TYR A 710 22.527 -27.616 -17.703 1.00 37.34 C ATOM 2179 CG TYR A 710 21.559 -27.191 -18.778 1.00 37.86 C ATOM 2180 CD1 TYR A 710 20.514 -26.326 -18.490 1.00 37.59 C ATOM 2181 CD2 TYR A 710 21.666 -27.668 -20.076 1.00 38.80 C ATOM 2182 CE1 TYR A 710 19.601 -25.939 -19.463 1.00 38.70 C ATOM 2183 CE2 TYR A 710 20.756 -27.301 -21.055 1.00 41.56 C ATOM 2184 CZ TYR A 710 19.721 -26.432 -20.751 1.00 40.44 C ATOM 2185 OH TYR A 710 18.842 -26.036 -21.721 1.00 40.41 O ATOM 2186 HH TYR A 710 18.174 -25.420 -21.328 1.00 0.00 H ATOM 2187 H TYR A 710 23.812 -28.501 -15.582 1.00 0.00 H ATOM 2188 N GLY A 711 21.981 -30.710 -17.114 1.00 35.71 N ATOM 2189 CA GLY A 711 21.490 -32.058 -17.451 1.00 36.73 C ATOM 2190 C GLY A 711 20.342 -32.480 -16.541 1.00 36.86 C ATOM 2191 O GLY A 711 19.353 -33.032 -17.054 1.00 33.63 O ATOM 2192 H GLY A 711 22.999 -30.586 -16.943 1.00 0.00 H ATOM 2193 N LEU A 712 20.461 -32.237 -15.233 1.00 36.73 N ATOM 2194 CA LEU A 712 19.398 -32.568 -14.242 1.00 37.97 C ATOM 2195 C LEU A 712 18.158 -31.701 -14.479 1.00 33.72 C ATOM 2196 O LEU A 712 17.050 -32.243 -14.389 1.00 32.52 O ATOM 2197 CB LEU A 712 19.905 -32.354 -12.813 1.00 40.24 C ATOM 2198 CG LEU A 712 20.629 -33.530 -12.173 1.00 42.96 C ATOM 2199 CD1 LEU A 712 20.982 -33.188 -10.732 1.00 44.43 C ATOM 2200 CD2 LEU A 712 19.790 -34.802 -12.233 1.00 44.43 C ATOM 2201 H LEU A 712 21.338 -31.796 -14.889 1.00 0.00 H ATOM 2202 N MET A 713 18.336 -30.403 -14.729 1.00 33.90 N ATOM 2203 CA MET A 713 17.199 -29.498 -15.035 1.00 35.12 C ATOM 2204 C MET A 713 16.414 -30.078 -16.214 1.00 35.12 C ATOM 2205 O MET A 713 15.186 -30.188 -16.100 1.00 32.96 O ATOM 2206 CB MET A 713 17.648 -28.084 -15.399 1.00 35.73 C ATOM 2207 CG MET A 713 18.339 -27.362 -14.300 1.00 36.61 C ATOM 2208 SD MET A 713 18.903 -25.771 -14.924 1.00 37.81 S ATOM 2209 CE MET A 713 20.236 -25.439 -13.779 1.00 35.55 C ATOM 2210 H MET A 713 19.300 -30.013 -14.709 1.00 0.00 H ATOM 2211 N ARG A 714 17.104 -30.443 -17.302 1.00 36.90 N ATOM 2212 CA ARG A 714 16.463 -30.909 -18.559 1.00 36.10 C ATOM 2213 C ARG A 714 15.754 -32.251 -18.330 1.00 36.24 C ATOM 2214 O ARG A 714 14.723 -32.484 -18.966 1.00 33.31 O ATOM 2215 CB ARG A 714 17.493 -30.978 -19.693 1.00 39.28 C ATOM 2216 CG ARG A 714 18.010 -29.611 -20.117 1.00 39.95 C ATOM 2217 CD ARG A 714 16.948 -28.710 -20.727 1.00 41.88 C ATOM 2218 NE ARG A 714 16.327 -29.361 -21.875 1.00 45.57 N ATOM 2219 CZ ARG A 714 16.607 -29.110 -23.148 1.00 46.13 C ATOM 2220 NH1 ARG A 714 17.484 -28.178 -23.479 1.00 44.48 N ATOM 2221 NH2 ARG A 714 15.979 -29.782 -24.093 1.00 49.39 N ATOM 2222 HE ARG A 714 15.604 -30.083 -21.680 1.00 0.00 H ATOM 2223 HH12 ARG A 714 17.693 -27.993 -24.481 1.00 0.00 H ATOM 2224 HH11 ARG A 714 17.965 -27.630 -22.738 1.00 0.00 H ATOM 2225 HH22 ARG A 714 16.191 -29.593 -25.094 1.00 0.00 H ATOM 2226 HH21 ARG A 714 15.272 -30.501 -23.838 1.00 0.00 H ATOM 2227 H ARG A 714 18.142 -30.398 -17.265 1.00 0.00 H ATOM 2228 N GLU A 715 16.256 -33.103 -17.440 1.00 32.16 N ATOM 2229 CA GLU A 715 15.562 -34.364 -17.094 1.00 33.40 C ATOM 2230 C GLU A 715 14.256 -34.041 -16.364 1.00 30.67 C ATOM 2231 O GLU A 715 13.256 -34.737 -16.624 1.00 32.45 O ATOM 2232 CB GLU A 715 16.445 -35.258 -16.225 1.00 38.31 C ATOM 2233 CG GLU A 715 17.671 -35.769 -16.945 1.00 44.53 C ATOM 2234 CD GLU A 715 18.469 -36.779 -16.135 1.00 54.00 C ATOM 2235 OE1 GLU A 715 17.906 -37.853 -15.811 1.00 56.41 O ATOM 2236 OE2 GLU A 715 19.637 -36.479 -15.810 1.00 62.21 O ATOM 2237 H GLU A 715 17.159 -32.877 -16.976 1.00 0.00 H ATOM 2238 N CYS A 716 14.275 -33.066 -15.448 1.00 29.83 N ATOM 2239 CA CYS A 716 13.073 -32.614 -14.695 1.00 29.97 C ATOM 2240 C CYS A 716 12.018 -32.072 -15.677 1.00 31.87 C ATOM 2241 O CYS A 716 10.823 -32.089 -15.334 1.00 28.75 O ATOM 2242 CB CYS A 716 13.427 -31.546 -13.667 1.00 32.11 C ATOM 2243 SG CYS A 716 14.428 -32.175 -12.291 1.00 30.64 S ATOM 2244 H CYS A 716 15.182 -32.597 -15.251 1.00 0.00 H ATOM 2245 N TRP A 717 12.443 -31.604 -16.857 1.00 32.14 N ATOM 2246 CA TRP A 717 11.544 -30.943 -17.841 1.00 32.77 C ATOM 2247 C TRP A 717 11.195 -31.865 -19.014 1.00 33.52 C ATOM 2248 O TRP A 717 10.754 -31.328 -20.050 1.00 32.94 O ATOM 2249 CB TRP A 717 12.141 -29.625 -18.338 1.00 33.41 C ATOM 2250 CG TRP A 717 12.484 -28.638 -17.268 1.00 31.83 C ATOM 2251 CD1 TRP A 717 11.853 -28.447 -16.074 1.00 30.50 C ATOM 2252 CD2 TRP A 717 13.514 -27.643 -17.340 1.00 30.95 C ATOM 2253 NE1 TRP A 717 12.454 -27.436 -15.377 1.00 30.72 N ATOM 2254 CE2 TRP A 717 13.469 -26.914 -16.133 1.00 30.18 C ATOM 2255 CE3 TRP A 717 14.471 -27.298 -18.304 1.00 31.78 C ATOM 2256 CZ2 TRP A 717 14.347 -25.864 -15.868 1.00 32.16 C ATOM 2257 CZ3 TRP A 717 15.343 -26.264 -18.035 1.00 31.34 C ATOM 2258 CH2 TRP A 717 15.274 -25.554 -16.837 1.00 32.02 C ATOM 2259 HE1 TRP A 717 12.184 -27.115 -14.425 1.00 0.00 H ATOM 2260 H TRP A 717 13.450 -31.707 -17.097 1.00 0.00 H ATOM 2261 N HIS A 718 11.353 -33.183 -18.881 1.00 33.08 N ATOM 2262 CA HIS A 718 10.804 -34.153 -19.863 1.00 36.90 C ATOM 2263 C HIS A 718 9.282 -33.983 -19.899 1.00 36.92 C ATOM 2264 O HIS A 718 8.675 -33.815 -18.826 1.00 31.67 O ATOM 2265 CB HIS A 718 11.207 -35.598 -19.547 1.00 40.49 C ATOM 2266 CG HIS A 718 12.625 -35.909 -19.883 1.00 48.72 C ATOM 2267 ND1 HIS A 718 13.288 -36.991 -19.351 1.00 53.35 N ATOM 2268 CD2 HIS A 718 13.520 -35.267 -20.668 1.00 56.93 C ATOM 2269 CE1 HIS A 718 14.524 -37.015 -19.805 1.00 53.42 C ATOM 2270 NE2 HIS A 718 14.693 -35.967 -20.613 1.00 53.99 N ATOM 2271 H HIS A 718 11.880 -33.544 -18.060 1.00 0.00 H ATOM 2272 N ALA A 719 8.686 -34.023 -21.089 1.00 36.97 N ATOM 2273 CA ALA A 719 7.226 -33.864 -21.281 1.00 37.07 C ATOM 2274 C ALA A 719 6.498 -34.995 -20.547 1.00 37.33 C ATOM 2275 O ALA A 719 5.469 -34.721 -19.907 1.00 37.39 O ATOM 2276 CB ALA A 719 6.889 -33.857 -22.753 1.00 37.71 C ATOM 2277 H ALA A 719 9.278 -34.174 -21.930 1.00 0.00 H ATOM 2278 N ALA A 720 7.020 -36.218 -20.645 1.00 36.96 N ATOM 2279 CA ALA A 720 6.445 -37.435 -20.029 1.00 38.10 C ATOM 2280 C ALA A 720 6.781 -37.439 -18.539 1.00 37.15 C ATOM 2281 O ALA A 720 7.959 -37.511 -18.186 1.00 32.96 O ATOM 2282 CB ALA A 720 6.988 -38.659 -20.728 1.00 39.14 C ATOM 2283 H ALA A 720 7.896 -36.325 -21.195 1.00 0.00 H ATOM 2284 N PRO A 721 5.780 -37.350 -17.626 1.00 36.05 N ATOM 2285 CA PRO A 721 6.043 -37.365 -16.186 1.00 37.16 C ATOM 2286 C PRO A 721 6.893 -38.559 -15.724 1.00 37.61 C ATOM 2287 O PRO A 721 7.709 -38.369 -14.839 1.00 32.59 O ATOM 2288 CB PRO A 721 4.652 -37.460 -15.539 1.00 37.65 C ATOM 2289 CG PRO A 721 3.700 -36.895 -16.581 1.00 39.27 C ATOM 2290 CD PRO A 721 4.345 -37.204 -17.919 1.00 37.67 C ATOM 2291 N SER A 722 6.699 -39.729 -16.347 1.00 36.88 N ATOM 2292 CA SER A 722 7.348 -41.013 -15.975 1.00 37.35 C ATOM 2293 C SER A 722 8.828 -41.000 -16.355 1.00 37.80 C ATOM 2294 O SER A 722 9.549 -41.836 -15.817 1.00 41.18 O ATOM 2295 CB SER A 722 6.654 -42.185 -16.613 1.00 39.60 C ATOM 2296 OG SER A 722 6.949 -42.220 -17.996 1.00 41.23 O ATOM 2297 HG SER A 722 6.636 -41.382 -18.420 1.00 0.00 H ATOM 2298 H SER A 722 6.043 -39.739 -17.154 1.00 0.00 H ATOM 2299 N GLN A 723 9.251 -40.111 -17.260 1.00 36.47 N ATOM 2300 CA GLN A 723 10.656 -40.003 -17.725 1.00 38.32 C ATOM 2301 C GLN A 723 11.398 -38.956 -16.886 1.00 35.51 C ATOM 2302 O GLN A 723 12.608 -38.824 -17.059 1.00 36.17 O ATOM 2303 CB GLN A 723 10.728 -39.630 -19.206 1.00 41.07 C ATOM 2304 CG GLN A 723 10.337 -40.759 -20.148 1.00 46.51 C ATOM 2305 CD GLN A 723 10.387 -40.317 -21.594 1.00 54.51 C ATOM 2306 OE1 GLN A 723 10.948 -39.271 -21.929 1.00 57.48 O ATOM 2307 NE2 GLN A 723 9.769 -41.102 -22.467 1.00 58.62 N ATOM 2308 HE22 GLN A 723 9.308 -41.976 -22.144 1.00 0.00 H ATOM 2309 HE21 GLN A 723 9.746 -40.843 -23.474 1.00 0.00 H ATOM 2310 H GLN A 723 8.552 -39.455 -17.663 1.00 0.00 H ATOM 2311 N ARG A 724 10.704 -38.213 -16.031 1.00 33.25 N ATOM 2312 CA ARG A 724 11.376 -37.267 -15.110 1.00 32.15 C ATOM 2313 C ARG A 724 12.019 -38.096 -14.006 1.00 33.17 C ATOM 2314 O ARG A 724 11.522 -39.178 -13.692 1.00 30.20 O ATOM 2315 CB ARG A 724 10.392 -36.241 -14.548 1.00 31.46 C ATOM 2316 CG ARG A 724 9.709 -35.409 -15.621 1.00 30.74 C ATOM 2317 CD ARG A 724 8.680 -34.450 -15.082 1.00 32.19 C ATOM 2318 NE ARG A 724 7.783 -34.107 -16.178 1.00 32.24 N ATOM 2319 CZ ARG A 724 6.516 -33.748 -16.043 1.00 32.89 C ATOM 2320 NH1 ARG A 724 5.967 -33.653 -14.841 1.00 30.35 N ATOM 2321 NH2 ARG A 724 5.797 -33.492 -17.127 1.00 31.88 N ATOM 2322 HE ARG A 724 8.169 -34.147 -17.143 1.00 0.00 H ATOM 2323 HH12 ARG A 724 4.971 -33.370 -14.745 1.00 0.00 H ATOM 2324 HH11 ARG A 724 6.532 -33.861 -13.993 1.00 0.00 H ATOM 2325 HH22 ARG A 724 4.800 -33.209 -17.035 1.00 0.00 H ATOM 2326 HH21 ARG A 724 6.229 -33.574 -18.069 1.00 0.00 H ATOM 2327 H ARG A 724 9.668 -38.297 -16.008 1.00 0.00 H ATOM 2328 N PRO A 725 13.120 -37.624 -13.378 1.00 30.48 N ATOM 2329 CA PRO A 725 13.653 -38.295 -12.197 1.00 31.45 C ATOM 2330 C PRO A 725 12.651 -38.260 -11.032 1.00 31.77 C ATOM 2331 O PRO A 725 11.796 -37.374 -10.989 1.00 28.88 O ATOM 2332 CB PRO A 725 14.910 -37.499 -11.806 1.00 31.75 C ATOM 2333 CG PRO A 725 15.169 -36.546 -12.947 1.00 33.71 C ATOM 2334 CD PRO A 725 13.869 -36.410 -13.721 1.00 33.08 C ATOM 2335 N THR A 726 12.785 -39.204 -10.098 1.00 30.10 N ATOM 2336 CA THR A 726 12.099 -39.178 -8.793 1.00 30.09 C ATOM 2337 C THR A 726 12.904 -38.269 -7.858 1.00 27.36 C ATOM 2338 O THR A 726 14.114 -38.034 -8.111 1.00 27.85 O ATOM 2339 CB THR A 726 11.935 -40.585 -8.199 1.00 30.89 C ATOM 2340 OG1 THR A 726 13.239 -41.035 -7.845 1.00 29.70 O ATOM 2341 CG2 THR A 726 11.305 -41.578 -9.150 1.00 33.75 C ATOM 2342 HG1 THR A 726 13.179 -41.943 -7.456 1.00 0.00 H ATOM 2343 H THR A 726 13.412 -40.008 -10.303 1.00 0.00 H ATOM 2344 N PHE A 727 12.290 -37.814 -6.776 1.00 28.83 N ATOM 2345 CA PHE A 727 13.003 -37.018 -5.743 1.00 29.06 C ATOM 2346 C PHE A 727 14.145 -37.869 -5.170 1.00 28.24 C ATOM 2347 O PHE A 727 15.222 -37.328 -4.939 1.00 28.10 O ATOM 2348 CB PHE A 727 12.022 -36.458 -4.710 1.00 30.45 C ATOM 2349 CG PHE A 727 11.322 -35.212 -5.178 1.00 29.55 C ATOM 2350 CD1 PHE A 727 12.051 -34.062 -5.439 1.00 30.33 C ATOM 2351 CD2 PHE A 727 9.960 -35.200 -5.423 1.00 28.93 C ATOM 2352 CE1 PHE A 727 11.421 -32.914 -5.896 1.00 30.39 C ATOM 2353 CE2 PHE A 727 9.330 -34.046 -5.875 1.00 29.75 C ATOM 2354 CZ PHE A 727 10.064 -32.908 -6.118 1.00 27.56 C ATOM 2355 H PHE A 727 11.279 -38.020 -6.645 1.00 0.00 H ATOM 2356 N LYS A 728 13.946 -39.180 -5.031 1.00 29.70 N ATOM 2357 CA LYS A 728 15.010 -40.116 -4.561 1.00 31.06 C ATOM 2358 C LYS A 728 16.209 -40.046 -5.517 1.00 30.05 C ATOM 2359 O LYS A 728 17.348 -39.898 -5.039 1.00 29.27 O ATOM 2360 CB LYS A 728 14.459 -41.540 -4.444 1.00 32.32 C ATOM 2361 CG LYS A 728 15.461 -42.577 -3.952 1.00 38.91 C ATOM 2362 CD LYS A 728 14.793 -43.867 -3.514 1.00 42.61 C ATOM 2363 CE LYS A 728 15.690 -44.757 -2.679 1.00 47.52 C ATOM 2364 NZ LYS A 728 16.886 -45.174 -3.447 1.00 50.67 N ATOM 2365 HZ1 LYS A 728 16.587 -45.700 -4.293 1.00 0.00 H ATOM 2366 HZ2 LYS A 728 17.424 -44.331 -3.733 1.00 0.00 H ATOM 2367 HZ3 LYS A 728 17.484 -45.783 -2.852 1.00 0.00 H ATOM 2368 H LYS A 728 13.009 -39.568 -5.260 1.00 0.00 H ATOM 2369 N GLN A 729 15.968 -40.087 -6.829 1.00 29.39 N ATOM 2370 CA GLN A 729 17.036 -39.994 -7.861 1.00 28.84 C ATOM 2371 C GLN A 729 17.657 -38.586 -7.876 1.00 27.66 C ATOM 2372 O GLN A 729 18.870 -38.492 -8.101 1.00 29.06 O ATOM 2373 CB GLN A 729 16.508 -40.371 -9.244 1.00 31.25 C ATOM 2374 CG GLN A 729 16.196 -41.851 -9.409 1.00 32.95 C ATOM 2375 CD GLN A 729 15.400 -42.121 -10.666 1.00 37.86 C ATOM 2376 OE1 GLN A 729 14.555 -41.328 -11.083 1.00 32.50 O ATOM 2377 NE2 GLN A 729 15.682 -43.247 -11.299 1.00 41.24 N ATOM 2378 HE22 GLN A 729 16.402 -43.892 -10.916 1.00 0.00 H ATOM 2379 HE21 GLN A 729 15.184 -43.487 -12.180 1.00 0.00 H ATOM 2380 H GLN A 729 14.983 -40.189 -7.147 1.00 0.00 H ATOM 2381 N LEU A 730 16.894 -37.524 -7.605 1.00 27.78 N ATOM 2382 CA LEU A 730 17.470 -36.155 -7.531 1.00 28.14 C ATOM 2383 C LEU A 730 18.399 -36.056 -6.312 1.00 28.26 C ATOM 2384 O LEU A 730 19.502 -35.517 -6.438 1.00 30.74 O ATOM 2385 CB LEU A 730 16.344 -35.132 -7.458 1.00 29.05 C ATOM 2386 CG LEU A 730 15.596 -34.941 -8.778 1.00 27.91 C ATOM 2387 CD1 LEU A 730 14.337 -34.130 -8.544 1.00 29.87 C ATOM 2388 CD2 LEU A 730 16.494 -34.285 -9.814 1.00 30.99 C ATOM 2389 H LEU A 730 15.875 -37.657 -7.442 1.00 0.00 H ATOM 2390 N VAL A 731 17.967 -36.558 -5.161 1.00 28.82 N ATOM 2391 CA VAL A 731 18.816 -36.571 -3.930 1.00 28.95 C ATOM 2392 C VAL A 731 20.130 -37.286 -4.269 1.00 27.79 C ATOM 2393 O VAL A 731 21.208 -36.729 -3.973 1.00 28.72 O ATOM 2394 CB VAL A 731 18.074 -37.231 -2.752 1.00 29.74 C ATOM 2395 CG1 VAL A 731 18.987 -37.492 -1.564 1.00 31.83 C ATOM 2396 CG2 VAL A 731 16.885 -36.390 -2.312 1.00 30.50 C ATOM 2397 H VAL A 731 17.007 -36.955 -5.114 1.00 0.00 H ATOM 2398 N GLU A 732 20.042 -38.473 -4.868 1.00 28.63 N ATOM 2399 CA GLU A 732 21.210 -39.327 -5.212 1.00 32.35 C ATOM 2400 C GLU A 732 22.122 -38.578 -6.187 1.00 34.13 C ATOM 2401 O GLU A 732 23.347 -38.602 -5.966 1.00 32.92 O ATOM 2402 CB GLU A 732 20.762 -40.687 -5.750 1.00 34.19 C ATOM 2403 CG GLU A 732 20.127 -41.554 -4.671 1.00 41.30 C ATOM 2404 CD GLU A 732 19.426 -42.827 -5.132 1.00 47.21 C ATOM 2405 OE1 GLU A 732 18.993 -43.602 -4.243 1.00 46.63 O ATOM 2406 OE2 GLU A 732 19.295 -43.041 -6.371 1.00 49.88 O ATOM 2407 H GLU A 732 19.094 -38.825 -5.111 1.00 0.00 H ATOM 2408 N ALA A 733 21.563 -37.913 -7.203 1.00 32.17 N ATOM 2409 CA ALA A 733 22.352 -37.194 -8.229 1.00 31.20 C ATOM 2410 C ALA A 733 23.090 -36.020 -7.585 1.00 30.02 C ATOM 2411 O ALA A 733 24.277 -35.834 -7.877 1.00 31.60 O ATOM 2412 CB ALA A 733 21.476 -36.746 -9.373 1.00 33.85 C ATOM 2413 H ALA A 733 20.526 -37.900 -7.276 1.00 0.00 H ATOM 2414 N LEU A 734 22.409 -35.244 -6.748 1.00 29.82 N ATOM 2415 CA LEU A 734 22.996 -34.041 -6.117 1.00 29.48 C ATOM 2416 C LEU A 734 24.034 -34.484 -5.075 1.00 32.01 C ATOM 2417 O LEU A 734 25.090 -33.826 -4.959 1.00 30.66 O ATOM 2418 CB LEU A 734 21.857 -33.199 -5.538 1.00 30.68 C ATOM 2419 CG LEU A 734 20.951 -32.545 -6.591 1.00 31.13 C ATOM 2420 CD1 LEU A 734 19.698 -31.966 -5.948 1.00 29.75 C ATOM 2421 CD2 LEU A 734 21.703 -31.467 -7.364 1.00 32.64 C ATOM 2422 H LEU A 734 21.423 -35.492 -6.528 1.00 0.00 H ATOM 2423 N ASP A 735 23.763 -35.588 -4.376 1.00 32.09 N ATOM 2424 CA ASP A 735 24.725 -36.217 -3.433 1.00 32.85 C ATOM 2425 C ASP A 735 26.028 -36.517 -4.182 1.00 32.83 C ATOM 2426 O ASP A 735 27.095 -36.145 -3.682 1.00 35.78 O ATOM 2427 CB ASP A 735 24.149 -37.501 -2.835 1.00 33.50 C ATOM 2428 CG ASP A 735 25.047 -38.128 -1.789 1.00 38.24 C ATOM 2429 OD1 ASP A 735 25.705 -37.353 -1.065 1.00 36.34 O ATOM 2430 OD2 ASP A 735 25.052 -39.379 -1.691 1.00 38.29 O ATOM 2431 H ASP A 735 22.830 -36.032 -4.497 1.00 0.00 H ATOM 2432 N LYS A 736 25.928 -37.169 -5.339 1.00 32.68 N ATOM 2433 CA LYS A 736 27.097 -37.581 -6.159 1.00 36.08 C ATOM 2434 C LYS A 736 27.921 -36.340 -6.548 1.00 35.75 C ATOM 2435 O LYS A 736 29.156 -36.424 -6.491 1.00 35.63 O ATOM 2436 CB LYS A 736 26.617 -38.424 -7.342 1.00 39.02 C ATOM 2437 CG LYS A 736 27.718 -38.929 -8.258 1.00 47.21 C ATOM 2438 CD LYS A 736 27.255 -39.992 -9.233 1.00 52.15 C ATOM 2439 CE LYS A 736 27.993 -39.946 -10.559 1.00 57.06 C ATOM 2440 NZ LYS A 736 29.467 -39.930 -10.381 1.00 60.69 N ATOM 2441 HZ1 LYS A 736 29.739 -39.091 -9.830 1.00 0.00 H ATOM 2442 HZ2 LYS A 736 29.763 -40.789 -9.876 1.00 0.00 H ATOM 2443 HZ3 LYS A 736 29.927 -39.898 -11.313 1.00 0.00 H ATOM 2444 H LYS A 736 24.977 -37.403 -5.689 1.00 0.00 H ATOM 2445 N VAL A 737 27.285 -35.213 -6.891 1.00 33.85 N ATOM 2446 CA VAL A 737 27.981 -33.929 -7.225 1.00 34.21 C ATOM 2447 C VAL A 737 28.737 -33.407 -5.994 1.00 36.63 C ATOM 2448 O VAL A 737 29.915 -33.041 -6.136 1.00 38.95 O ATOM 2449 CB VAL A 737 27.012 -32.863 -7.774 1.00 33.06 C ATOM 2450 CG1 VAL A 737 27.702 -31.512 -7.941 1.00 34.27 C ATOM 2451 CG2 VAL A 737 26.397 -33.305 -9.087 1.00 32.91 C ATOM 2452 H VAL A 737 26.246 -35.230 -6.928 1.00 0.00 H ATOM 2453 N LEU A 738 28.087 -33.372 -4.832 1.00 35.94 N ATOM 2454 CA LEU A 738 28.678 -32.874 -3.566 1.00 37.49 C ATOM 2455 C LEU A 738 29.834 -33.784 -3.126 1.00 39.56 C ATOM 2456 O LEU A 738 30.835 -33.244 -2.622 1.00 38.43 O ATOM 2457 CB LEU A 738 27.573 -32.796 -2.510 1.00 36.04 C ATOM 2458 CG LEU A 738 26.567 -31.671 -2.730 1.00 36.64 C ATOM 2459 CD1 LEU A 738 25.339 -31.845 -1.853 1.00 37.56 C ATOM 2460 CD2 LEU A 738 27.207 -30.318 -2.486 1.00 37.41 C ATOM 2461 H LEU A 738 27.105 -33.715 -4.811 1.00 0.00 H ATOM 2462 N LEU A 739 29.721 -35.103 -3.318 1.00 38.52 N ATOM 2463 CA LEU A 739 30.792 -36.064 -2.932 1.00 42.26 C ATOM 2464 C LEU A 739 32.003 -35.871 -3.854 1.00 44.32 C ATOM 2465 O LEU A 739 33.128 -36.076 -3.388 1.00 44.56 O ATOM 2466 CB LEU A 739 30.265 -37.500 -2.999 1.00 44.99 C ATOM 2467 CG LEU A 739 29.277 -37.908 -1.905 1.00 48.17 C ATOM 2468 CD1 LEU A 739 28.630 -39.247 -2.226 1.00 48.98 C ATOM 2469 CD2 LEU A 739 29.952 -37.974 -0.552 1.00 48.46 C ATOM 2470 H LEU A 739 28.852 -35.472 -3.754 1.00 0.00 H ATOM 2471 N ALA A 740 31.789 -35.466 -5.107 1.00 42.76 N ATOM 2472 CA ALA A 740 32.860 -35.325 -6.121 1.00 47.37 C ATOM 2473 C ALA A 740 33.729 -34.095 -5.836 1.00 52.17 C ATOM 2474 O ALA A 740 34.881 -34.104 -6.287 1.00 57.80 O ATOM 2475 CB ALA A 740 32.278 -35.279 -7.511 1.00 46.79 C ATOM 2476 H ALA A 740 30.814 -35.236 -5.388 1.00 0.00 H ATOM 2477 N VAL A 741 33.225 -33.073 -5.136 1.00 59.54 N ATOM 2478 CA VAL A 741 34.033 -31.857 -4.799 1.00 64.77 C ATOM 2479 C VAL A 741 34.813 -32.111 -3.499 1.00 68.27 C ATOM 2480 O VAL A 741 34.510 -32.985 -2.681 1.00 68.55 O ATOM 2481 CB VAL A 741 33.182 -30.570 -4.723 1.00 68.98 C ATOM 2482 CG1 VAL A 741 32.492 -30.277 -6.048 1.00 69.72 C ATOM 2483 CG2 VAL A 741 32.169 -30.580 -3.586 1.00 69.58 C ATOM 2484 H VAL A 741 32.237 -33.124 -4.814 1.00 0.00 H TER 2485 VAL A 741 HETATM 2486 O HOH 1 14.035 -15.853 -22.382 1.00 46.73 O HETATM 2487 O HOH 2 -6.490 -27.320 -18.282 1.00 59.15 O HETATM 2488 O HOH 3 5.416 -22.964 -8.191 1.00 53.51 O HETATM 2489 O HOH 4 19.785 -42.832 -8.670 1.00 46.98 O HETATM 2490 O HOH 5 2.308 -35.934 -13.474 1.00 40.83 O HETATM 2491 O HOH 6 -8.014 -33.827 21.483 1.00 48.54 O HETATM 2492 O HOH 7 29.840 -19.732 -0.195 1.00 50.81 O HETATM 2493 O HOH 8 11.146 -40.310 -4.768 1.00 34.01 O HETATM 2494 O HOH 9 7.259 -27.887 19.486 1.00 39.97 O HETATM 2495 O HOH 10 5.409 -23.899 -17.120 1.00 35.05 O HETATM 2496 O HOH 11 13.657 -16.480 -9.212 1.00 49.20 O HETATM 2497 O HOH 12 -2.691 -35.233 17.199 1.00 43.94 O HETATM 2498 O HOH 13 30.537 -38.552 -6.353 1.00 37.34 O HETATM 2499 O HOH 14 3.303 -35.236 14.206 1.00 37.65 O HETATM 2500 O HOH 15 -4.812 -28.293 4.067 1.00 46.67 O HETATM 2501 O HOH 16 22.522 -38.351 0.270 1.00 33.27 O HETATM 2502 O HOH 17 5.781 -40.768 -5.187 1.00 64.04 O HETATM 2503 O HOH 18 19.104 -24.072 10.826 1.00 45.42 O HETATM 2504 O HOH 19 15.761 -37.258 5.037 1.00 47.97 O HETATM 2505 O HOH 20 10.425 -18.202 -6.835 1.00 33.41 O HETATM 2506 O HOH 21 24.127 -18.009 -14.082 1.00 50.21 O HETATM 2507 O HOH 22 9.318 -38.357 -7.048 1.00 34.76 O HETATM 2508 O HOH 23 2.927 -29.983 -8.788 1.00 40.24 O HETATM 2509 O HOH 24 16.033 -14.008 -15.631 1.00 54.09 O HETATM 2510 O HOH 25 14.555 -36.929 2.583 1.00 32.70 O HETATM 2511 O HOH 26 -11.263 -27.973 8.387 1.00 47.40 O HETATM 2512 O HOH 27 -4.868 -28.433 20.386 1.00 44.46 O HETATM 2513 O HOH 28 -0.185 -29.843 25.117 1.00 44.14 O HETATM 2514 O HOH 29 8.378 -8.682 16.341 1.00 56.36 O HETATM 2515 O HOH 30 14.183 -31.049 -21.110 1.00 33.95 O HETATM 2516 O HOH 31 9.933 -39.949 -1.261 1.00 33.06 O HETATM 2517 O HOH 32 13.462 -43.659 -7.588 1.00 44.83 O HETATM 2518 O HOH 33 -3.806 -34.288 12.049 1.00 34.35 O HETATM 2519 O HOH 34 31.087 -32.359 -8.410 1.00 51.33 O HETATM 2520 O HOH 35 -7.268 -17.115 14.209 1.00 46.57 O HETATM 2521 O HOH 36 4.676 -31.194 9.149 1.00 32.93 O HETATM 2522 O HOH 37 8.060 -24.243 -16.648 1.00 33.92 O HETATM 2523 O HOH 38 3.517 -30.905 -29.222 1.00 44.64 O HETATM 2524 O HOH 39 16.705 -38.534 -18.091 1.00 69.89 O HETATM 2525 O HOH 40 13.986 -28.052 12.189 1.00 39.27 O HETATM 2526 O HOH 41 17.546 -39.299 1.542 1.00 39.25 O HETATM 2527 O HOH 42 16.900 -9.882 -1.977 1.00 47.94 O HETATM 2528 O HOH 43 20.190 -40.404 -9.432 1.00 34.41 O HETATM 2529 O HOH 44 12.310 -23.094 25.669 1.00 54.41 O HETATM 2530 O HOH 45 21.615 -24.416 -23.049 1.00 50.64 O HETATM 2531 O HOH 46 19.390 -33.996 -19.566 1.00 45.11 O HETATM 2532 O HOH 47 9.462 -37.050 -22.350 1.00 46.14 O HETATM 2533 O HOH 48 23.186 -34.754 -15.265 1.00 60.49 O HETATM 2534 O HOH 49 11.623 -20.894 15.091 1.00 42.07 O HETATM 2535 O HOH 50 5.941 -34.121 -4.210 1.00 33.79 O HETATM 2536 O HOH 51 24.243 -30.485 -19.926 1.00 51.74 O HETATM 2537 O HOH 52 1.656 -25.607 5.311 1.00 43.07 O HETATM 2538 O HOH 53 -5.142 -28.651 17.639 1.00 41.78 O HETATM 2539 O HOH 54 25.304 -20.965 -13.027 1.00 52.78 O HETATM 2540 O HOH 55 9.148 -40.902 5.806 1.00 42.41 O HETATM 2541 O HOH 56 10.884 -29.308 14.565 1.00 44.91 O HETATM 2542 O HOH 57 25.090 -36.667 -10.391 1.00 39.62 O HETATM 2543 O HOH 58 10.526 -13.324 -3.327 1.00 52.59 O HETATM 2544 O HOH 59 16.124 -32.956 12.212 1.00 59.35 O HETATM 2545 O HOH 60 5.146 -27.625 -7.592 1.00 28.81 O HETATM 2546 O HOH 61 3.450 -26.044 -9.940 1.00 47.02 O HETATM 2547 O HOH 62 23.686 -41.525 -2.938 1.00 52.95 O HETATM 2548 O HOH 63 2.307 -26.509 -30.979 1.00 51.52 O HETATM 2549 O HOH 64 -0.850 -33.488 -1.017 1.00 41.62 O HETATM 2550 O HOH 65 14.982 -34.501 9.516 1.00 32.45 O HETATM 2551 O HOH 66 12.414 -24.873 -19.268 1.00 34.66 O HETATM 2552 O HOH 67 3.330 -23.309 -9.999 1.00 50.78 O HETATM 2553 O HOH 68 14.307 -8.921 -5.507 1.00 61.17 O HETATM 2554 O HOH 69 6.769 -33.923 -2.102 1.00 54.34 O HETATM 2555 O HOH 70 12.581 -36.369 9.642 1.00 41.73 O HETATM 2556 O HOH 71 -2.456 -34.550 -18.555 1.00 46.12 O HETATM 2557 O HOH 72 -1.736 -31.110 -2.984 1.00 50.08 O HETATM 2558 O HOH 73 6.232 -30.188 11.059 1.00 28.86 O HETATM 2559 O HOH 74 16.485 -19.202 11.445 1.00 36.36 O HETATM 2560 O HOH 75 4.010 -28.476 -11.477 1.00 33.83 O HETATM 2561 O HOH 76 4.601 -40.350 -18.346 1.00 43.83 O HETATM 2562 O HOH 77 16.522 -19.393 -21.665 1.00 49.12 O HETATM 2563 O HOH 78 31.734 -20.879 -16.849 1.00 76.65 O HETATM 2564 O HOH 79 14.812 -21.326 11.562 1.00 47.24 O HETATM 2565 O HOH 80 18.941 -13.071 3.248 1.00 54.76 O HETATM 2566 O HOH 81 4.697 -17.752 -13.327 1.00 49.34 O HETATM 2567 O HOH 82 10.569 -34.132 -23.465 1.00 42.26 O HETATM 2568 O HOH 83 1.368 -38.208 -7.424 1.00 42.12 O HETATM 2569 O HOH 84 12.502 -12.785 2.100 1.00 47.04 O HETATM 2570 O HOH 85 9.264 -15.828 -7.580 1.00 42.25 O HETATM 2571 O HOH 86 30.216 -23.440 -11.032 1.00 48.97 O HETATM 2572 O HOH 87 1.879 -20.818 -1.857 1.00 62.64 O HETATM 2573 O HOH 88 23.887 -25.898 5.447 1.00 57.65 O HETATM 2574 O HOH 89 16.436 -7.359 -6.206 1.00 63.70 O HETATM 2575 O HOH 90 37.643 -34.657 -4.233 1.00 66.63 O HETATM 2576 O HOH 91 22.813 -40.409 -9.407 1.00 45.53 O HETATM 2577 O HOH 92 7.907 -41.854 -1.047 1.00 40.26 O HETATM 2578 O HOH 93 12.663 -38.932 3.577 1.00 41.87 O HETATM 2579 O HOH 94 29.617 -20.836 -19.586 1.00 59.07 O HETATM 2580 O HOH 95 3.171 -41.103 -16.802 1.00 49.34 O HETATM 2581 O HOH 96 8.930 -13.909 -5.876 1.00 50.45 O HETATM 2582 O HOH 97 27.810 -19.296 2.191 1.00 58.83 O HETATM 2583 O HOH 98 10.231 -42.958 4.401 1.00 56.89 O HETATM 2584 O HOH 99 28.467 -22.259 -9.599 1.00 48.74 O HETATM 2585 O HOH 100 -0.924 -33.039 1.827 1.00 44.13 O HETATM 2586 O HOH 101 13.775 -18.679 -21.819 1.00 40.22 O HETATM 2587 O HOH 102 23.262 -34.391 5.387 1.00 46.65 O HETATM 2588 O HOH 103 -7.408 -35.673 24.718 1.00 42.86 O HETATM 2589 O HOH 104 12.090 -41.142 2.385 1.00 53.29 O HETATM 2590 O HOH 105 24.060 -38.953 -11.141 1.00 44.34 O HETATM 2591 O HOH 106 1.171 -39.595 -16.143 1.00 55.00 O HETATM 2592 C1 XL A 6 2.741 -21.369 8.420 1.00 0.09 C HETATM 2593 C2 XL A 6 3.422 -20.150 8.411 1.00 0.06 C HETATM 2594 C3 XL A 6 4.569 -19.967 7.642 1.00 -0.00 C HETATM 2595 C4 XL A 6 4.995 -21.028 6.873 1.00 0.06 C HETATM 2596 C5 XL A 6 4.337 -22.252 6.859 1.00 0.09 C HETATM 2597 C6 XL A 6 3.198 -22.412 7.627 1.00 -0.01 C HETATM 2598 H1 XL A 6 2.661 -23.354 7.609 1.00 0.04 H HETATM 2599 O2 XL A 6 4.858 -23.227 6.063 1.00 -0.32 O HETATM 2600 C8 XL A 6 4.726 -24.588 6.480 1.00 0.06 C HETATM 2601 H5 XL A 6 5.195 -25.247 5.734 1.00 0.06 H HETATM 2602 H6 XL A 6 3.660 -24.841 6.574 1.00 0.06 H HETATM 2603 H7 XL A 6 5.222 -24.723 7.452 1.00 0.06 H HETATM 2604 CL2 XL A 6 6.402 -20.817 5.902 1.00 -0.10 CL HETATM 2605 C9 XL A 6 5.338 -18.672 7.634 1.00 0.10 C HETATM 2606 O3 XL A 6 6.475 -18.804 8.497 1.00 -0.30 O HETATM 2607 C10 XL A 6 7.593 -18.035 8.266 1.00 0.13 C HETATM 2608 C11 XL A 6 8.824 -18.549 8.621 1.00 0.04 C HETATM 2609 N1 XL A 6 9.955 -17.858 8.444 1.00 -0.26 N HETATM 2610 C12 XL A 6 9.824 -16.622 7.908 1.00 0.20 C HETATM 2611 N2 XL A 6 8.660 -16.052 7.535 1.00 -0.26 N HETATM 2612 C13 XL A 6 7.544 -16.756 7.731 1.00 0.04 C HETATM 2613 H11 XL A 6 6.586 -16.323 7.469 1.00 0.08 H HETATM 2614 N3 XL A 6 10.957 -15.906 7.681 1.00 -0.26 N HETATM 2615 C14 XL A 6 11.097 -14.566 7.229 1.00 0.09 C HETATM 2616 C15 XL A 6 11.633 -13.609 8.107 1.00 0.09 C HETATM 2617 C16 XL A 6 11.781 -12.272 7.649 1.00 -0.06 C HETATM 2618 C17 XL A 6 11.360 -11.923 6.391 1.00 -0.09 C HETATM 2619 C18 XL A 6 10.820 -12.876 5.546 1.00 -0.08 C HETATM 2620 C19 XL A 6 10.683 -14.205 5.938 1.00 -0.03 C HETATM 2621 C20 XL A 6 10.092 -15.198 4.973 1.00 -0.04 C HETATM 2622 H16 XL A 6 10.059 -16.192 5.444 1.00 0.04 H HETATM 2623 H17 XL A 6 10.713 -15.243 4.066 1.00 0.04 H HETATM 2624 H18 XL A 6 9.072 -14.885 4.704 1.00 0.04 H HETATM 2625 H15 XL A 6 10.496 -12.581 4.555 1.00 0.04 H HETATM 2626 H14 XL A 6 11.451 -10.896 6.057 1.00 0.05 H HETATM 2627 H13 XL A 6 12.228 -11.526 8.296 1.00 0.04 H HETATM 2628 N4 XL A 6 12.090 -14.025 9.379 1.00 -0.24 N HETATM 2629 C21 XL A 6 11.958 -13.374 10.553 1.00 0.20 C HETATM 2630 C22 XL A 6 12.592 -14.075 11.734 1.00 0.04 C HETATM 2631 C23 XL A 6 12.194 -15.520 11.876 1.00 -0.05 C HETATM 2632 H22 XL A 6 12.695 -15.954 12.754 1.00 0.03 H HETATM 2633 H23 XL A 6 12.492 -16.073 10.973 1.00 0.03 H HETATM 2634 H24 XL A 6 11.104 -15.589 12.005 1.00 0.03 H HETATM 2635 H20 XL A 6 12.297 -13.543 12.651 1.00 0.05 H HETATM 2636 H21 XL A 6 13.685 -14.027 11.618 1.00 0.05 H HETATM 2637 O4 XL A 6 11.387 -12.300 10.657 1.00 -0.39 O HETATM 2638 H19 XL A 6 12.566 -14.904 9.412 1.00 0.22 H HETATM 2639 H12 XL A 6 11.839 -16.406 7.862 1.00 0.21 H HETATM 2640 H10 XL A 6 8.875 -19.541 9.056 1.00 0.08 H HETATM 2641 H8 XL A 6 4.693 -17.857 7.994 1.00 0.08 H HETATM 2642 H9 XL A 6 5.675 -18.448 6.611 1.00 0.08 H HETATM 2643 CL1 XL A 6 2.877 -18.858 9.431 1.00 -0.10 CL HETATM 2644 O1 XL A 6 1.631 -21.480 9.212 1.00 -0.32 O HETATM 2645 C7 XL A 6 0.860 -22.680 9.146 1.00 0.06 C HETATM 2646 H2 XL A 6 0.009 -22.608 9.839 1.00 0.06 H HETATM 2647 H3 XL A 6 1.490 -23.537 9.427 1.00 0.06 H HETATM 2648 H4 XL A 6 0.487 -22.820 8.121 1.00 0.06 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 212 213 216 217 218 CONECT 216 212 CONECT 217 212 CONECT 218 212 CONECT 1540 1541 1545 1546 1547 CONECT 1545 1540 CONECT 1546 1540 CONECT 1547 1540 CONECT 2592 2593 2597 2644 CONECT 2593 2592 2594 2643 CONECT 2594 2593 2595 2605 CONECT 2595 2594 2596 2604 CONECT 2596 2595 2597 2599 CONECT 2597 2592 2596 2598 CONECT 2598 2597 CONECT 2599 2596 2600 CONECT 2600 2599 2601 2602 2603 CONECT 2601 2600 CONECT 2602 2600 CONECT 2603 2600 CONECT 2604 2595 CONECT 2605 2594 2606 2641 2642 CONECT 2606 2605 2607 CONECT 2607 2606 2608 2612 CONECT 2608 2607 2609 2640 CONECT 2609 2608 2610 CONECT 2610 2609 2611 2614 CONECT 2611 2610 2612 CONECT 2612 2607 2611 2613 CONECT 2613 2612 CONECT 2614 2610 2615 2639 CONECT 2615 2614 2616 2620 CONECT 2616 2615 2617 2628 CONECT 2617 2616 2618 2627 CONECT 2618 2617 2619 2626 CONECT 2619 2618 2620 2625 CONECT 2620 2615 2619 2621 CONECT 2621 2620 2622 2623 2624 CONECT 2622 2621 CONECT 2623 2621 CONECT 2624 2621 CONECT 2625 2619 CONECT 2626 2618 CONECT 2627 2617 CONECT 2628 2616 2629 2638 CONECT 2629 2628 2630 2637 CONECT 2630 2629 2631 2635 2636 CONECT 2631 2630 2632 2633 2634 CONECT 2632 2631 CONECT 2633 2631 CONECT 2634 2631 CONECT 2635 2630 CONECT 2636 2630 CONECT 2637 2629 CONECT 2638 2628 CONECT 2639 2614 CONECT 2640 2608 CONECT 2641 2605 CONECT 2642 2605 CONECT 2643 2593 CONECT 2644 2592 2645 CONECT 2645 2644 2646 2647 2648 CONECT 2646 2645 CONECT 2647 2645 CONECT 2648 2645 MASTER 0 0 0 0 0 0 0 0 2645 3 69 22 END
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PDBbind
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
6nvl
RCSB PDB
PDBbind
XL6
Entry Information
PDB ID
6nvh
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
FGFR4
Ligand Name
XL6
EC.Number
E.C.2.7.10.1
Resolution
1.9(Å)
Affinity (Kd/Ki/IC50)
IC50=11.1nM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) Acs Med.Chem.Lett. Vol. 10: pp. 1180-1186
Ligand Properties
Formula
C
2
3
H
2
4
Cl
2
N
4
O
4
Molecular Weight
491.367
Exact Mass
490.117
No. of atoms
57
No. of bonds
59
Polar Surface Area
94.6
LOGP Value
4.75 (
Computed with XLOGP3
)
5.93 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 10
No. of Nitrogen and Oxygen Atoms: 8
No. of Rings: 3
Canonical SMILES
CCC(=O)Nc1cccc(c1Nc1ncc(cn1)OCc1c(Cl)c(OC)cc(c1Cl)OC)C
InChI String
InChI=1S/C23H24Cl2N4O4/c1-5-19(30)28-16-8-6-7-13(2)22(16)29-23-26-10-14(11-27-23)33-12-15-20(24)17(31-3)9-18(32-4)21(15)25/h6-11H,5,12H2,1-4H3,(H,28,30)(H,26,27,29)
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):
P22455
Entrez Gene ID
NCBI Entrez Gene ID:
2264
ASD
Information of known allosteric effects of PDB entries
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