Browse entries in the PDBbind-CN Database
HEADER 6E6W_COMPLEX COMPND 6E6W_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 54 MET ALA MET GLU ASP PHE VAL ARG GLN CYS PHE ASN PRO SEQRES 2 A 54 MET ILE VAL GLU LEU ALA GLU LYS ALA MET LYS GLU TYR SEQRES 3 A 54 GLY GLU ASP PRO LYS ILE GLU THR ASN LYS PHE ALA ALA SEQRES 4 A 54 ILE CYS THR HIS LEU GLU VAL CYS PHE MET TYR SER ASP SEQRES 5 A 54 PHE GLY SEQRES 1 A 65 HIS ARG PHE GLU ILE ILE GLU GLY ARG ASP ARG ILE MET SEQRES 2 A 65 ALA TRP THR VAL VAL ASN SER ILE CYS ASN THR THR GLY SEQRES 3 A 65 VAL GLU LYS PRO LYS PHE LEU PRO ASP LEU TYR ASP TYR SEQRES 4 A 65 LYS GLU ASN ARG PHE ILE GLU ILE GLY VAL THR ARG ARG SEQRES 5 A 65 GLU VAL HIS ILE TYR TYR LEU GLU LYS ALA ASN LYS ILE SEQRES 1 A 55 GLU LYS THR HIS ILE HIS ILE PHE SER PHE THR GLY GLU SEQRES 2 A 55 GLU MET ALA THR LYS ALA ASP TYR THR LEU ASP GLU GLU SEQRES 3 A 55 SER ARG ALA ARG ILE LYS THR ARG LEU PHE THR ILE ARG SEQRES 4 A 55 GLN GLU MET ALA SER ARG SER LEU TRP ASP SER PHE ARG SEQRES 5 A 55 GLN SER GLU HET MN A 1 1 HET MN A 2 1 HET HWJ A 193 33 ATOM 1 N MET A -1 -40.619 8.303 145.091 1.00 59.96 N ATOM 2 CA MET A -1 -40.451 9.324 144.003 1.00 62.25 C ATOM 3 C MET A -1 -40.436 8.659 142.646 1.00 58.41 C ATOM 4 O MET A -1 -39.684 7.710 142.391 1.00 59.00 O ATOM 5 CB MET A -1 -39.193 10.203 144.187 1.00 64.26 C ATOM 6 CG MET A -1 -39.196 11.564 143.488 1.00 74.25 C ATOM 7 SD MET A -1 -40.722 12.586 143.384 1.00 88.70 S ATOM 8 CE MET A -1 -41.563 12.325 144.963 1.00 80.79 C ATOM 9 HN3 MET A -1 -39.829 7.627 145.055 1.00 0.00 H ATOM 10 HN2 MET A -1 -41.517 7.796 144.954 1.00 0.00 H ATOM 11 HN1 MET A -1 -40.627 8.781 146.015 1.00 0.00 H ATOM 12 N ALA A 0 -41.329 9.152 141.792 1.00 57.65 N ATOM 13 CA ALA A 0 -41.469 8.671 140.440 1.00 51.87 C ATOM 14 C ALA A 0 -40.178 8.975 139.679 1.00 49.83 C ATOM 15 O ALA A 0 -39.753 8.187 138.828 1.00 51.79 O ATOM 16 CB ALA A 0 -42.677 9.313 139.789 1.00 53.48 C ATOM 17 H ALA A 0 -41.954 9.918 142.114 1.00 0.00 H ATOM 18 N MET A 1 -39.510 10.065 140.048 1.00 48.14 N ATOM 19 CA MET A 1 -38.254 10.441 139.411 1.00 50.59 C ATOM 20 C MET A 1 -37.196 9.404 139.610 1.00 49.78 C ATOM 21 O MET A 1 -36.506 9.030 138.661 1.00 57.96 O ATOM 22 CB MET A 1 -37.768 11.841 139.838 1.00 49.39 C ATOM 23 CG MET A 1 -36.480 12.289 139.150 1.00 53.70 C ATOM 24 SD MET A 1 -36.500 12.141 137.348 1.00 52.75 S ATOM 25 CE MET A 1 -37.053 13.765 136.877 1.00 54.70 C ATOM 26 H MET A 1 -39.893 10.662 140.808 1.00 0.00 H ATOM 27 N GLU A 2 -37.091 8.912 140.824 1.00 53.54 N ATOM 28 CA GLU A 2 -36.156 7.837 141.107 1.00 57.51 C ATOM 29 C GLU A 2 -36.504 6.558 140.315 1.00 57.26 C ATOM 30 O GLU A 2 -35.643 5.939 139.699 1.00 52.36 O ATOM 31 CB GLU A 2 -36.162 7.573 142.603 1.00 63.29 C ATOM 32 CG GLU A 2 -35.096 6.572 143.010 1.00 72.78 C ATOM 33 CD GLU A 2 -35.308 5.982 144.391 1.00 70.46 C ATOM 34 OE1 GLU A 2 -35.959 6.622 145.226 1.00 77.77 O ATOM 35 OE2 GLU A 2 -34.798 4.881 144.648 1.00 75.49 O ATOM 36 H GLU A 2 -37.682 9.296 141.589 1.00 0.00 H ATOM 37 N ASP A 3 -37.785 6.183 140.322 1.00 59.79 N ATOM 38 CA ASP A 3 -38.254 5.027 139.558 1.00 56.32 C ATOM 39 C ASP A 3 -38.005 5.242 138.089 1.00 54.01 C ATOM 40 O ASP A 3 -37.536 4.334 137.445 1.00 53.63 O ATOM 41 CB ASP A 3 -39.744 4.753 139.769 1.00 61.46 C ATOM 42 CG ASP A 3 -40.102 4.521 141.232 1.00 66.88 C ATOM 43 OD1 ASP A 3 -39.235 4.090 142.021 1.00 67.40 O ATOM 44 OD2 ASP A 3 -41.254 4.804 141.596 1.00 74.46 O ATOM 45 H ASP A 3 -38.468 6.728 140.886 1.00 0.00 H ATOM 46 N PHE A 4 -38.278 6.442 137.566 1.00 46.79 N ATOM 47 CA PHE A 4 -38.068 6.709 136.153 1.00 41.97 C ATOM 48 C PHE A 4 -36.621 6.425 135.720 1.00 40.29 C ATOM 49 O PHE A 4 -36.371 5.767 134.684 1.00 38.19 O ATOM 50 CB PHE A 4 -38.490 8.152 135.776 1.00 48.99 C ATOM 51 CG PHE A 4 -37.770 8.672 134.579 1.00 43.68 C ATOM 52 CD1 PHE A 4 -38.150 8.253 133.300 1.00 45.65 C ATOM 53 CD2 PHE A 4 -36.653 9.460 134.724 1.00 41.23 C ATOM 54 CE1 PHE A 4 -37.450 8.654 132.172 1.00 44.99 C ATOM 55 CE2 PHE A 4 -35.941 9.866 133.591 1.00 50.58 C ATOM 56 CZ PHE A 4 -36.346 9.472 132.307 1.00 47.35 C ATOM 57 H PHE A 4 -38.646 7.196 138.180 1.00 0.00 H ATOM 58 N VAL A 5 -35.675 6.868 136.543 1.00 38.95 N ATOM 59 CA VAL A 5 -34.251 6.693 136.245 1.00 40.72 C ATOM 60 C VAL A 5 -33.883 5.234 136.213 1.00 45.38 C ATOM 61 O VAL A 5 -33.099 4.774 135.361 1.00 49.65 O ATOM 62 CB VAL A 5 -33.382 7.404 137.300 1.00 43.99 C ATOM 63 CG1 VAL A 5 -31.897 7.035 137.173 1.00 49.16 C ATOM 64 CG2 VAL A 5 -33.546 8.913 137.182 1.00 45.78 C ATOM 65 H VAL A 5 -35.953 7.351 137.421 1.00 0.00 H ATOM 66 N ARG A 6 -34.415 4.526 137.198 1.00 52.55 N ATOM 67 CA ARG A 6 -34.324 3.083 137.265 1.00 53.32 C ATOM 68 C ARG A 6 -34.854 2.408 136.010 1.00 52.22 C ATOM 69 O ARG A 6 -34.233 1.501 135.496 1.00 55.90 O ATOM 70 CB ARG A 6 -35.093 2.572 138.488 1.00 58.98 C ATOM 71 CG ARG A 6 -34.226 2.090 139.624 1.00 65.16 C ATOM 72 CD ARG A 6 -33.953 3.139 140.684 1.00 64.87 C ATOM 73 NE ARG A 6 -32.602 2.923 141.211 1.00 76.25 N ATOM 74 CZ ARG A 6 -32.098 3.475 142.309 1.00 73.59 C ATOM 75 NH1 ARG A 6 -32.813 4.286 143.075 1.00 68.95 N ATOM 76 NH2 ARG A 6 -30.850 3.204 142.637 1.00 71.77 N ATOM 77 HE ARG A 6 -31.983 2.280 140.677 1.00 0.00 H ATOM 78 HH12 ARG A 6 -32.390 4.703 143.929 1.00 0.00 H ATOM 79 HH11 ARG A 6 -33.798 4.506 142.823 1.00 0.00 H ATOM 80 HH22 ARG A 6 -30.434 3.625 143.492 1.00 0.00 H ATOM 81 HH21 ARG A 6 -30.282 2.570 142.040 1.00 0.00 H ATOM 82 H ARG A 6 -34.920 5.029 137.956 1.00 0.00 H ATOM 83 N GLN A 7 -36.013 2.846 135.535 1.00 58.31 N ATOM 84 CA GLN A 7 -36.640 2.250 134.366 1.00 57.38 C ATOM 85 C GLN A 7 -35.891 2.590 133.093 1.00 54.58 C ATOM 86 O GLN A 7 -35.682 1.721 132.286 1.00 57.70 O ATOM 87 CB GLN A 7 -38.123 2.669 134.245 1.00 69.74 C ATOM 88 CG GLN A 7 -39.150 1.650 134.787 1.00 78.67 C ATOM 89 CD GLN A 7 -39.590 1.869 136.240 1.00 78.21 C ATOM 90 OE1 GLN A 7 -40.433 2.729 136.528 1.00 82.95 O ATOM 91 NE2 GLN A 7 -39.061 1.056 137.153 1.00 77.45 N ATOM 92 HE22 GLN A 7 -38.355 0.346 136.871 1.00 0.00 H ATOM 93 HE21 GLN A 7 -39.354 1.131 138.148 1.00 0.00 H ATOM 94 H GLN A 7 -36.487 3.639 136.013 1.00 0.00 H ATOM 95 N CYS A 8 -35.460 3.845 132.932 1.00 60.38 N ATOM 96 CA CYS A 8 -34.935 4.347 131.632 1.00 56.22 C ATOM 97 C CYS A 8 -33.428 4.317 131.368 1.00 53.11 C ATOM 98 O CYS A 8 -33.023 4.495 130.237 1.00 52.85 O ATOM 99 CB CYS A 8 -35.444 5.752 131.314 1.00 56.03 C ATOM 100 SG CYS A 8 -36.542 5.727 129.904 1.00 60.48 S ATOM 101 H CYS A 8 -35.492 4.494 133.744 1.00 0.00 H ATOM 102 N PHE A 9 -32.590 4.131 132.368 1.00 48.54 N ATOM 103 CA PHE A 9 -31.160 4.002 132.076 1.00 51.02 C ATOM 104 C PHE A 9 -30.710 2.640 132.525 1.00 51.87 C ATOM 105 O PHE A 9 -31.323 2.068 133.437 1.00 50.84 O ATOM 106 CB PHE A 9 -30.369 5.065 132.804 1.00 47.39 C ATOM 107 CG PHE A 9 -30.737 6.459 132.424 1.00 43.76 C ATOM 108 CD1 PHE A 9 -30.166 7.058 131.306 1.00 44.16 C ATOM 109 CD2 PHE A 9 -31.629 7.183 133.191 1.00 40.44 C ATOM 110 CE1 PHE A 9 -30.496 8.362 130.973 1.00 45.13 C ATOM 111 CE2 PHE A 9 -31.948 8.465 132.856 1.00 42.17 C ATOM 112 CZ PHE A 9 -31.380 9.057 131.747 1.00 38.98 C ATOM 113 H PHE A 9 -32.937 4.077 133.347 1.00 0.00 H ATOM 114 N ASN A 10 -29.652 2.134 131.904 1.00 49.40 N ATOM 115 CA ASN A 10 -29.230 0.796 132.193 1.00 54.22 C ATOM 116 C ASN A 10 -28.398 0.761 133.447 1.00 55.52 C ATOM 117 O ASN A 10 -27.719 1.756 133.791 1.00 53.48 O ATOM 118 CB ASN A 10 -28.595 0.079 130.986 1.00 63.56 C ATOM 119 CG ASN A 10 -27.159 0.432 130.738 1.00 67.55 C ATOM 120 OD1 ASN A 10 -26.345 0.568 131.647 1.00 77.90 O ATOM 121 ND2 ASN A 10 -26.817 0.509 129.465 1.00 75.35 N ATOM 122 HD22 ASN A 10 -27.537 0.388 128.725 1.00 0.00 H ATOM 123 HD21 ASN A 10 -25.827 0.691 129.203 1.00 0.00 H ATOM 124 H ASN A 10 -29.131 2.707 131.210 1.00 0.00 H ATOM 125 N PRO A 11 -28.444 -0.387 134.146 1.00 51.76 N ATOM 126 CA PRO A 11 -27.924 -0.446 135.493 1.00 48.76 C ATOM 127 C PRO A 11 -26.531 0.136 135.690 1.00 43.07 C ATOM 128 O PRO A 11 -26.243 0.717 136.733 1.00 45.21 O ATOM 129 CB PRO A 11 -27.962 -1.964 135.803 1.00 48.58 C ATOM 130 CG PRO A 11 -29.173 -2.425 135.086 1.00 50.27 C ATOM 131 CD PRO A 11 -29.129 -1.650 133.786 1.00 54.12 C ATOM 132 N MET A 12 -25.659 -0.034 134.714 1.00 47.91 N ATOM 133 CA MET A 12 -24.305 0.484 134.821 1.00 50.89 C ATOM 134 C MET A 12 -24.345 1.991 134.973 1.00 49.64 C ATOM 135 O MET A 12 -23.702 2.523 135.869 1.00 51.57 O ATOM 136 CB MET A 12 -23.504 0.128 133.591 1.00 55.13 C ATOM 137 CG MET A 12 -22.060 0.598 133.638 1.00 65.89 C ATOM 138 SD MET A 12 -21.182 0.274 132.088 1.00 89.73 S ATOM 139 CE MET A 12 -22.399 0.584 130.784 1.00 83.16 C ATOM 140 H MET A 12 -25.945 -0.546 133.855 1.00 0.00 H ATOM 141 N ILE A 13 -25.101 2.672 134.107 1.00 48.38 N ATOM 142 CA ILE A 13 -25.187 4.137 134.181 1.00 48.50 C ATOM 143 C ILE A 13 -25.760 4.487 135.548 1.00 42.99 C ATOM 144 O ILE A 13 -25.202 5.297 136.253 1.00 37.87 O ATOM 145 CB ILE A 13 -26.015 4.747 133.018 1.00 53.95 C ATOM 146 CG1 ILE A 13 -25.190 4.676 131.721 1.00 56.07 C ATOM 147 CG2 ILE A 13 -26.405 6.199 133.338 1.00 52.81 C ATOM 148 CD1 ILE A 13 -25.965 4.955 130.455 1.00 56.99 C ATOM 149 H ILE A 13 -25.633 2.161 133.374 1.00 0.00 H ATOM 150 N VAL A 14 -26.840 3.813 135.934 1.00 41.50 N ATOM 151 CA VAL A 14 -27.509 4.118 137.198 1.00 45.97 C ATOM 152 C VAL A 14 -26.503 3.983 138.362 1.00 47.33 C ATOM 153 O VAL A 14 -26.383 4.861 139.213 1.00 46.45 O ATOM 154 CB VAL A 14 -28.749 3.199 137.419 1.00 43.78 C ATOM 155 CG1 VAL A 14 -29.297 3.321 138.849 1.00 43.67 C ATOM 156 CG2 VAL A 14 -29.841 3.477 136.381 1.00 42.88 C ATOM 157 H VAL A 14 -27.215 3.057 135.327 1.00 0.00 H ATOM 158 N GLU A 15 -25.755 2.893 138.344 1.00 48.45 N ATOM 159 CA GLU A 15 -24.836 2.552 139.422 1.00 51.93 C ATOM 160 C GLU A 15 -23.672 3.519 139.452 1.00 44.26 C ATOM 161 O GLU A 15 -23.270 3.995 140.534 1.00 38.47 O ATOM 162 CB GLU A 15 -24.325 1.114 139.247 1.00 58.29 C ATOM 163 CG GLU A 15 -23.631 0.587 140.492 1.00 69.36 C ATOM 164 CD GLU A 15 -22.469 -0.333 140.192 1.00 81.38 C ATOM 165 OE1 GLU A 15 -21.526 0.120 139.503 1.00 93.77 O ATOM 166 OE2 GLU A 15 -22.484 -1.495 140.669 1.00 85.44 O ATOM 167 H GLU A 15 -25.825 2.253 137.527 1.00 0.00 H ATOM 168 N LEU A 16 -23.120 3.790 138.266 1.00 40.98 N ATOM 169 CA LEU A 16 -22.105 4.813 138.143 1.00 45.97 C ATOM 170 C LEU A 16 -22.631 6.156 138.665 1.00 46.70 C ATOM 171 O LEU A 16 -21.937 6.839 139.428 1.00 41.96 O ATOM 172 CB LEU A 16 -21.585 4.924 136.696 1.00 48.63 C ATOM 173 CG LEU A 16 -20.472 3.896 136.376 1.00 48.99 C ATOM 174 CD1 LEU A 16 -20.127 3.860 134.892 1.00 44.46 C ATOM 175 CD2 LEU A 16 -19.221 4.181 137.216 1.00 48.45 C ATOM 176 H LEU A 16 -23.423 3.261 137.424 1.00 0.00 H ATOM 177 N ALA A 17 -23.869 6.510 138.323 1.00 46.61 N ATOM 178 CA ALA A 17 -24.400 7.793 138.764 1.00 48.54 C ATOM 179 C ALA A 17 -24.595 7.778 140.278 1.00 47.52 C ATOM 180 O ALA A 17 -24.266 8.745 140.980 1.00 44.92 O ATOM 181 CB ALA A 17 -25.690 8.129 138.024 1.00 49.55 C ATOM 182 H ALA A 17 -24.453 5.874 137.744 1.00 0.00 H ATOM 183 N GLU A 18 -25.090 6.664 140.794 1.00 51.00 N ATOM 184 CA GLU A 18 -25.289 6.538 142.241 1.00 54.95 C ATOM 185 C GLU A 18 -24.036 6.640 143.061 1.00 55.68 C ATOM 186 O GLU A 18 -24.055 7.234 144.165 1.00 50.40 O ATOM 187 CB GLU A 18 -25.981 5.229 142.590 1.00 56.40 C ATOM 188 CG GLU A 18 -27.472 5.390 142.510 1.00 62.95 C ATOM 189 CD GLU A 18 -28.202 4.256 143.142 1.00 67.39 C ATOM 190 OE1 GLU A 18 -27.963 3.120 142.687 1.00 66.37 O ATOM 191 OE2 GLU A 18 -29.060 4.511 144.032 1.00 69.25 O ATOM 192 H GLU A 18 -25.340 5.872 140.168 1.00 0.00 H ATOM 193 N LYS A 19 -22.986 6.002 142.538 1.00 58.78 N ATOM 194 CA LYS A 19 -21.659 5.965 143.157 1.00 59.97 C ATOM 195 C LYS A 19 -21.162 7.395 143.290 1.00 56.88 C ATOM 196 O LYS A 19 -20.856 7.857 144.388 1.00 62.77 O ATOM 197 CB LYS A 19 -20.716 5.099 142.291 1.00 71.60 C ATOM 198 CG LYS A 19 -19.226 5.107 142.660 1.00 77.26 C ATOM 199 CD LYS A 19 -18.454 3.986 141.957 1.00 78.22 C ATOM 200 CE LYS A 19 -17.082 3.737 142.579 1.00 82.24 C ATOM 201 NZ LYS A 19 -16.161 4.896 142.391 1.00 87.91 N ATOM 202 HZ1 LYS A 19 -16.029 5.071 141.374 1.00 0.00 H ATOM 203 HZ2 LYS A 19 -16.572 5.740 142.839 1.00 0.00 H ATOM 204 HZ3 LYS A 19 -15.242 4.682 142.829 1.00 0.00 H ATOM 205 H LYS A 19 -23.118 5.501 141.636 1.00 0.00 H ATOM 206 N ALA A 20 -21.156 8.103 142.169 1.00 49.96 N ATOM 207 CA ALA A 20 -20.723 9.470 142.118 1.00 51.64 C ATOM 208 C ALA A 20 -21.456 10.238 143.193 1.00 53.15 C ATOM 209 O ALA A 20 -20.834 10.850 144.022 1.00 57.50 O ATOM 210 CB ALA A 20 -20.994 10.077 140.745 1.00 49.08 C ATOM 211 H ALA A 20 -21.478 7.649 141.291 1.00 0.00 H ATOM 212 N MET A 21 -22.775 10.154 143.226 1.00 50.90 N ATOM 213 CA MET A 21 -23.508 10.902 144.239 1.00 51.70 C ATOM 214 C MET A 21 -23.149 10.468 145.668 1.00 53.80 C ATOM 215 O MET A 21 -22.771 11.303 146.506 1.00 52.89 O ATOM 216 CB MET A 21 -24.989 10.815 144.000 1.00 46.46 C ATOM 217 CG MET A 21 -25.389 11.527 142.725 1.00 47.92 C ATOM 218 SD MET A 21 -27.177 11.530 142.522 1.00 52.69 S ATOM 219 CE MET A 21 -27.574 12.842 143.660 1.00 47.20 C ATOM 220 H MET A 21 -23.283 9.562 142.538 1.00 0.00 H ATOM 221 N LYS A 22 -23.221 9.168 145.922 1.00 54.88 N ATOM 222 CA LYS A 22 -23.129 8.665 147.291 1.00 60.41 C ATOM 223 C LYS A 22 -21.732 8.848 147.893 1.00 61.46 C ATOM 224 O LYS A 22 -21.617 9.235 149.036 1.00 69.35 O ATOM 225 CB LYS A 22 -23.622 7.219 147.359 1.00 62.40 C ATOM 226 CG LYS A 22 -25.134 7.115 147.161 1.00 62.21 C ATOM 227 CD LYS A 22 -25.570 5.748 146.648 1.00 68.55 C ATOM 228 CE LYS A 22 -25.358 4.628 147.652 1.00 67.85 C ATOM 229 NZ LYS A 22 -25.505 3.300 146.980 1.00 68.82 N ATOM 230 HZ1 LYS A 22 -26.460 3.221 146.576 1.00 0.00 H ATOM 231 HZ2 LYS A 22 -24.799 3.217 146.221 1.00 0.00 H ATOM 232 HZ3 LYS A 22 -25.358 2.542 147.677 1.00 0.00 H ATOM 233 H LYS A 22 -23.345 8.498 145.136 1.00 0.00 H ATOM 234 N GLU A 23 -20.684 8.682 147.106 1.00 58.08 N ATOM 235 CA GLU A 23 -19.337 8.962 147.588 1.00 61.52 C ATOM 236 C GLU A 23 -19.073 10.408 148.053 1.00 63.74 C ATOM 237 O GLU A 23 -18.206 10.638 148.898 1.00 63.83 O ATOM 238 CB GLU A 23 -18.319 8.548 146.529 1.00 64.59 C ATOM 239 CG GLU A 23 -18.258 7.033 146.370 1.00 66.34 C ATOM 240 CD GLU A 23 -17.090 6.559 145.535 1.00 73.00 C ATOM 241 OE1 GLU A 23 -16.865 5.323 145.531 1.00 66.73 O ATOM 242 OE2 GLU A 23 -16.402 7.411 144.901 1.00 74.43 O ATOM 243 H GLU A 23 -20.822 8.348 146.131 1.00 0.00 H ATOM 244 N TYR A 24 -19.815 11.369 147.520 1.00 62.79 N ATOM 245 CA TYR A 24 -19.728 12.751 147.988 1.00 67.94 C ATOM 246 C TYR A 24 -20.902 13.136 148.904 1.00 68.83 C ATOM 247 O TYR A 24 -21.137 14.319 149.126 1.00 71.45 O ATOM 248 CB TYR A 24 -19.612 13.689 146.783 1.00 69.11 C ATOM 249 CG TYR A 24 -18.479 13.262 145.870 1.00 75.65 C ATOM 250 CD1 TYR A 24 -17.152 13.567 146.173 1.00 80.18 C ATOM 251 CD2 TYR A 24 -18.722 12.520 144.723 1.00 76.18 C ATOM 252 CE1 TYR A 24 -16.105 13.159 145.347 1.00 76.89 C ATOM 253 CE2 TYR A 24 -17.687 12.109 143.879 1.00 78.16 C ATOM 254 CZ TYR A 24 -16.377 12.430 144.203 1.00 76.98 C ATOM 255 OH TYR A 24 -15.330 12.035 143.404 1.00 74.13 O ATOM 256 HH TYR A 24 -14.479 12.355 143.795 1.00 0.00 H ATOM 257 H TYR A 24 -20.474 11.134 146.751 1.00 0.00 H ATOM 258 N GLY A 25 -21.615 12.133 149.436 1.00 64.55 N ATOM 259 CA GLY A 25 -22.633 12.315 150.468 1.00 58.70 C ATOM 260 C GLY A 25 -23.997 12.767 150.000 1.00 61.56 C ATOM 261 O GLY A 25 -24.793 13.263 150.799 1.00 65.42 O ATOM 262 H GLY A 25 -21.433 11.168 149.094 1.00 0.00 H ATOM 263 N GLU A 26 -24.293 12.611 148.716 1.00 64.35 N ATOM 264 CA GLU A 26 -25.572 13.076 148.182 1.00 62.08 C ATOM 265 C GLU A 26 -26.483 11.888 147.991 1.00 60.64 C ATOM 266 O GLU A 26 -26.142 10.927 147.301 1.00 60.10 O ATOM 267 CB GLU A 26 -25.386 13.782 146.857 1.00 61.68 C ATOM 268 CG GLU A 26 -24.615 15.079 146.969 1.00 72.69 C ATOM 269 CD GLU A 26 -23.808 15.416 145.721 1.00 81.07 C ATOM 270 OE1 GLU A 26 -23.814 16.593 145.332 1.00 87.64 O ATOM 271 OE2 GLU A 26 -23.141 14.524 145.139 1.00 90.66 O ATOM 272 H GLU A 26 -23.607 12.153 148.082 1.00 0.00 H ATOM 273 N ASP A 27 -27.665 11.958 148.579 1.00 60.21 N ATOM 274 CA ASP A 27 -28.611 10.882 148.444 1.00 57.14 C ATOM 275 C ASP A 27 -29.369 11.035 147.106 1.00 52.98 C ATOM 276 O ASP A 27 -30.110 11.995 146.916 1.00 43.69 O ATOM 277 CB ASP A 27 -29.555 10.897 149.638 1.00 59.66 C ATOM 278 CG ASP A 27 -30.379 9.647 149.742 1.00 61.07 C ATOM 279 OD1 ASP A 27 -30.417 8.866 148.771 1.00 66.15 O ATOM 280 OD2 ASP A 27 -31.023 9.453 150.793 1.00 71.45 O ATOM 281 H ASP A 27 -27.913 12.796 149.143 1.00 0.00 H ATOM 282 N PRO A 28 -29.207 10.071 146.186 1.00 53.03 N ATOM 283 CA PRO A 28 -29.976 10.149 144.942 1.00 53.17 C ATOM 284 C PRO A 28 -31.490 10.079 145.116 1.00 54.48 C ATOM 285 O PRO A 28 -32.211 10.418 144.195 1.00 53.73 O ATOM 286 CB PRO A 28 -29.489 8.933 144.147 1.00 54.66 C ATOM 287 CG PRO A 28 -28.230 8.477 144.799 1.00 55.14 C ATOM 288 CD PRO A 28 -28.397 8.837 146.241 1.00 56.27 C ATOM 289 N LYS A 29 -31.965 9.623 146.273 1.00 58.14 N ATOM 290 CA LYS A 29 -33.411 9.606 146.572 1.00 53.08 C ATOM 291 C LYS A 29 -33.961 10.969 146.969 1.00 47.69 C ATOM 292 O LYS A 29 -35.154 11.185 146.914 1.00 47.79 O ATOM 293 CB LYS A 29 -33.706 8.583 147.661 1.00 55.71 C ATOM 294 CG LYS A 29 -33.466 7.164 147.179 1.00 59.51 C ATOM 295 CD LYS A 29 -33.259 6.130 148.285 1.00 66.98 C ATOM 296 CE LYS A 29 -34.110 4.865 148.068 1.00 71.04 C ATOM 297 NZ LYS A 29 -33.263 3.646 147.952 1.00 75.12 N ATOM 298 HZ1 LYS A 29 -32.617 3.750 147.144 1.00 0.00 H ATOM 299 HZ2 LYS A 29 -32.711 3.525 148.825 1.00 0.00 H ATOM 300 HZ3 LYS A 29 -33.871 2.815 147.807 1.00 0.00 H ATOM 301 H LYS A 29 -31.298 9.268 146.988 1.00 0.00 H ATOM 302 N ILE A 30 -33.098 11.896 147.349 1.00 50.58 N ATOM 303 CA ILE A 30 -33.502 13.279 147.674 1.00 51.49 C ATOM 304 C ILE A 30 -33.183 14.223 146.507 1.00 47.32 C ATOM 305 O ILE A 30 -34.008 15.081 146.153 1.00 41.66 O ATOM 306 CB ILE A 30 -32.773 13.757 148.954 1.00 51.15 C ATOM 307 CG1 ILE A 30 -33.241 12.947 150.165 1.00 59.28 C ATOM 308 CG2 ILE A 30 -32.962 15.251 149.191 1.00 52.45 C ATOM 309 CD1 ILE A 30 -32.259 12.960 151.328 1.00 63.68 C ATOM 310 H ILE A 30 -32.093 11.641 147.422 1.00 0.00 H ATOM 311 N GLU A 31 -31.968 14.104 145.963 1.00 43.20 N ATOM 312 CA GLU A 31 -31.522 14.934 144.843 1.00 44.16 C ATOM 313 C GLU A 31 -31.795 14.223 143.506 1.00 41.52 C ATOM 314 O GLU A 31 -30.905 13.937 142.724 1.00 37.53 O ATOM 315 CB GLU A 31 -30.058 15.311 145.036 1.00 52.41 C ATOM 316 CG GLU A 31 -29.787 16.064 146.352 1.00 61.89 C ATOM 317 CD GLU A 31 -28.618 17.042 146.245 1.00 77.08 C ATOM 318 OE1 GLU A 31 -28.850 18.180 145.766 1.00 90.98 O ATOM 319 OE2 GLU A 31 -27.472 16.688 146.632 1.00 77.76 O ATOM 320 H GLU A 31 -31.314 13.394 146.351 1.00 0.00 H ATOM 321 N THR A 32 -33.076 13.959 143.276 1.00 41.46 N ATOM 322 CA THR A 32 -33.529 13.073 142.231 1.00 43.48 C ATOM 323 C THR A 32 -33.292 13.708 140.851 1.00 43.77 C ATOM 324 O THR A 32 -32.957 12.974 139.905 1.00 38.10 O ATOM 325 CB THR A 32 -35.010 12.700 142.432 1.00 43.84 C ATOM 326 OG1 THR A 32 -35.763 13.886 142.610 1.00 47.98 O ATOM 327 CG2 THR A 32 -35.208 11.828 143.679 1.00 43.54 C ATOM 328 HG1 THR A 32 -36.717 13.654 142.740 1.00 0.00 H ATOM 329 H THR A 32 -33.790 14.414 143.880 1.00 0.00 H ATOM 330 N ASN A 33 -33.397 15.050 140.768 1.00 34.10 N ATOM 331 CA ASN A 33 -33.140 15.763 139.528 1.00 39.11 C ATOM 332 C ASN A 33 -31.682 15.737 139.175 1.00 37.42 C ATOM 333 O ASN A 33 -31.350 15.530 138.019 1.00 38.29 O ATOM 334 CB ASN A 33 -33.689 17.201 139.513 1.00 38.21 C ATOM 335 CG ASN A 33 -35.198 17.238 139.414 1.00 40.82 C ATOM 336 OD1 ASN A 33 -35.824 16.271 139.002 1.00 45.44 O ATOM 337 ND2 ASN A 33 -35.793 18.357 139.785 1.00 44.82 N ATOM 338 HD22 ASN A 33 -35.226 19.158 140.130 1.00 0.00 H ATOM 339 HD21 ASN A 33 -36.829 18.438 139.732 1.00 0.00 H ATOM 340 H ASN A 33 -33.669 15.589 141.614 1.00 0.00 H ATOM 341 N LYS A 34 -30.828 15.909 140.165 1.00 40.09 N ATOM 342 CA LYS A 34 -29.403 15.748 139.972 1.00 41.63 C ATOM 343 C LYS A 34 -29.065 14.338 139.445 1.00 44.23 C ATOM 344 O LYS A 34 -28.310 14.197 138.477 1.00 43.74 O ATOM 345 CB LYS A 34 -28.635 16.007 141.259 1.00 41.86 C ATOM 346 CG LYS A 34 -27.124 15.969 141.037 1.00 48.38 C ATOM 347 CD LYS A 34 -26.294 16.162 142.294 1.00 52.88 C ATOM 348 CE LYS A 34 -25.768 17.572 142.398 1.00 56.78 C ATOM 349 NZ LYS A 34 -25.160 17.857 143.724 1.00 65.23 N ATOM 350 HZ1 LYS A 34 -25.875 17.726 144.467 1.00 0.00 H ATOM 351 HZ2 LYS A 34 -24.366 17.206 143.887 1.00 0.00 H ATOM 352 HZ3 LYS A 34 -24.815 18.838 143.742 1.00 0.00 H ATOM 353 H LYS A 34 -31.187 16.166 141.106 1.00 0.00 H ATOM 354 N PHE A 35 -29.626 13.329 140.104 1.00 40.71 N ATOM 355 CA PHE A 35 -29.469 11.925 139.750 1.00 39.94 C ATOM 356 C PHE A 35 -29.837 11.715 138.264 1.00 35.21 C ATOM 357 O PHE A 35 -29.026 11.214 137.481 1.00 33.46 O ATOM 358 CB PHE A 35 -30.369 11.118 140.730 1.00 42.26 C ATOM 359 CG PHE A 35 -30.285 9.628 140.621 1.00 41.04 C ATOM 360 CD1 PHE A 35 -29.079 8.968 140.332 1.00 43.92 C ATOM 361 CD2 PHE A 35 -31.435 8.859 140.886 1.00 46.96 C ATOM 362 CE1 PHE A 35 -29.044 7.569 140.242 1.00 47.26 C ATOM 363 CE2 PHE A 35 -31.409 7.465 140.813 1.00 48.09 C ATOM 364 CZ PHE A 35 -30.206 6.824 140.489 1.00 48.81 C ATOM 365 H PHE A 35 -30.217 13.558 140.928 1.00 0.00 H ATOM 366 N ALA A 36 -31.046 12.124 137.889 1.00 35.37 N ATOM 367 CA ALA A 36 -31.484 12.075 136.495 1.00 36.37 C ATOM 368 C ALA A 36 -30.544 12.822 135.544 1.00 37.00 C ATOM 369 O ALA A 36 -30.305 12.337 134.466 1.00 43.18 O ATOM 370 CB ALA A 36 -32.896 12.605 136.338 1.00 35.80 C ATOM 371 H ALA A 36 -31.700 12.490 138.610 1.00 0.00 H ATOM 372 N ALA A 37 -30.015 13.982 135.926 1.00 33.89 N ATOM 373 CA ALA A 37 -29.112 14.729 135.042 1.00 30.97 C ATOM 374 C ALA A 37 -27.793 14.047 134.876 1.00 30.80 C ATOM 375 O ALA A 37 -27.246 14.078 133.800 1.00 29.90 O ATOM 376 CB ALA A 37 -28.854 16.106 135.554 1.00 28.67 C ATOM 377 H ALA A 37 -30.245 14.365 136.865 1.00 0.00 H ATOM 378 N ILE A 38 -27.253 13.496 135.968 1.00 31.95 N ATOM 379 CA ILE A 38 -25.997 12.797 135.922 1.00 35.29 C ATOM 380 C ILE A 38 -26.157 11.552 135.022 1.00 39.10 C ATOM 381 O ILE A 38 -25.297 11.301 134.188 1.00 35.81 O ATOM 382 CB ILE A 38 -25.532 12.410 137.310 1.00 40.06 C ATOM 383 CG1 ILE A 38 -25.069 13.664 138.041 1.00 41.02 C ATOM 384 CG2 ILE A 38 -24.401 11.380 137.253 1.00 38.60 C ATOM 385 CD1 ILE A 38 -24.760 13.443 139.518 1.00 39.12 C ATOM 386 H ILE A 38 -27.755 13.575 136.875 1.00 0.00 H ATOM 387 N CYS A 39 -27.262 10.807 135.167 1.00 37.33 N ATOM 388 CA CYS A 39 -27.536 9.666 134.273 1.00 34.85 C ATOM 389 C CYS A 39 -27.567 10.092 132.841 1.00 35.93 C ATOM 390 O CYS A 39 -26.874 9.489 132.007 1.00 35.40 O ATOM 391 CB CYS A 39 -28.843 8.967 134.622 1.00 37.12 C ATOM 392 SG CYS A 39 -28.667 8.058 136.175 1.00 42.73 S ATOM 393 H CYS A 39 -27.938 11.037 135.923 1.00 0.00 H ATOM 394 N THR A 40 -28.320 11.172 132.575 1.00 34.77 N ATOM 395 CA THR A 40 -28.520 11.691 131.216 1.00 32.67 C ATOM 396 C THR A 40 -27.205 12.020 130.633 1.00 32.56 C ATOM 397 O THR A 40 -26.894 11.530 129.561 1.00 34.78 O ATOM 398 CB THR A 40 -29.465 12.905 131.145 1.00 35.06 C ATOM 399 OG1 THR A 40 -30.759 12.534 131.640 1.00 35.91 O ATOM 400 CG2 THR A 40 -29.663 13.397 129.724 1.00 34.92 C ATOM 401 HG1 THR A 40 -30.678 12.233 132.580 1.00 0.00 H ATOM 402 H THR A 40 -28.782 11.663 133.367 1.00 0.00 H ATOM 403 N HIS A 41 -26.403 12.796 131.353 1.00 34.62 N ATOM 404 CA HIS A 41 -25.112 13.207 130.859 1.00 33.70 C ATOM 405 C HIS A 41 -24.152 12.014 130.654 1.00 37.32 C ATOM 406 O HIS A 41 -23.416 11.972 129.663 1.00 35.34 O ATOM 407 CB HIS A 41 -24.498 14.195 131.817 1.00 31.66 C ATOM 408 CG HIS A 41 -23.131 14.641 131.416 1.00 31.53 C ATOM 409 ND1 HIS A 41 -21.974 14.131 131.974 1.00 33.42 N ATOM 410 CD2 HIS A 41 -22.737 15.552 130.508 1.00 33.21 C ATOM 411 CE1 HIS A 41 -20.926 14.704 131.419 1.00 34.01 C ATOM 412 NE2 HIS A 41 -21.362 15.576 130.526 1.00 36.81 N ATOM 413 H HIS A 41 -26.713 13.114 132.293 1.00 0.00 H ATOM 414 N LEU A 42 -24.120 11.073 131.595 1.00 37.73 N ATOM 415 CA LEU A 42 -23.287 9.874 131.410 1.00 38.90 C ATOM 416 C LEU A 42 -23.652 9.145 130.131 1.00 36.32 C ATOM 417 O LEU A 42 -22.790 8.841 129.303 1.00 37.58 O ATOM 418 CB LEU A 42 -23.387 8.886 132.572 1.00 42.54 C ATOM 419 CG LEU A 42 -22.154 8.720 133.447 1.00 46.93 C ATOM 420 CD1 LEU A 42 -22.420 7.617 134.457 1.00 53.87 C ATOM 421 CD2 LEU A 42 -20.902 8.383 132.655 1.00 47.96 C ATOM 422 H LEU A 42 -24.684 11.185 132.462 1.00 0.00 H ATOM 423 N GLU A 43 -24.935 8.883 129.979 1.00 34.00 N ATOM 424 CA GLU A 43 -25.411 8.267 128.788 1.00 37.51 C ATOM 425 C GLU A 43 -25.023 8.950 127.503 1.00 38.34 C ATOM 426 O GLU A 43 -24.575 8.276 126.591 1.00 41.77 O ATOM 427 CB GLU A 43 -26.918 8.108 128.771 1.00 41.81 C ATOM 428 CG GLU A 43 -27.348 7.144 127.667 1.00 48.54 C ATOM 429 CD GLU A 43 -28.657 6.461 127.953 1.00 56.19 C ATOM 430 OE1 GLU A 43 -29.690 7.084 127.682 1.00 57.43 O ATOM 431 OE2 GLU A 43 -28.655 5.313 128.459 1.00 72.63 O ATOM 432 H GLU A 43 -25.605 9.129 130.736 1.00 0.00 H ATOM 433 N VAL A 44 -25.242 10.260 127.396 1.00 34.99 N ATOM 434 CA VAL A 44 -24.771 10.998 126.242 1.00 30.73 C ATOM 435 C VAL A 44 -23.305 10.749 126.039 1.00 29.66 C ATOM 436 O VAL A 44 -22.876 10.525 124.908 1.00 31.36 O ATOM 437 CB VAL A 44 -25.027 12.524 126.331 1.00 31.81 C ATOM 438 CG1 VAL A 44 -24.273 13.266 125.244 1.00 32.04 C ATOM 439 CG2 VAL A 44 -26.489 12.809 126.149 1.00 31.60 C ATOM 440 H VAL A 44 -25.757 10.758 128.150 1.00 0.00 H ATOM 441 N CYS A 45 -22.527 10.802 127.105 1.00 30.06 N ATOM 442 CA CYS A 45 -21.082 10.586 126.970 1.00 33.93 C ATOM 443 C CYS A 45 -20.727 9.185 126.432 1.00 38.19 C ATOM 444 O CYS A 45 -19.804 9.067 125.616 1.00 34.71 O ATOM 445 CB CYS A 45 -20.356 10.784 128.287 1.00 34.72 C ATOM 446 SG CYS A 45 -20.198 12.524 128.722 1.00 38.22 S ATOM 447 H CYS A 45 -22.939 10.997 128.040 1.00 0.00 H ATOM 448 N PHE A 46 -21.431 8.157 126.927 1.00 35.36 N ATOM 449 CA PHE A 46 -21.223 6.780 126.509 1.00 36.84 C ATOM 450 C PHE A 46 -21.704 6.607 125.090 1.00 38.77 C ATOM 451 O PHE A 46 -21.016 5.961 124.299 1.00 39.23 O ATOM 452 CB PHE A 46 -21.924 5.775 127.447 1.00 36.48 C ATOM 453 CG PHE A 46 -21.274 5.645 128.807 1.00 40.11 C ATOM 454 CD1 PHE A 46 -20.098 6.320 129.146 1.00 46.36 C ATOM 455 CD2 PHE A 46 -21.802 4.800 129.730 1.00 44.06 C ATOM 456 CE1 PHE A 46 -19.515 6.173 130.399 1.00 44.92 C ATOM 457 CE2 PHE A 46 -21.227 4.644 130.958 1.00 41.14 C ATOM 458 CZ PHE A 46 -20.101 5.332 131.304 1.00 42.80 C ATOM 459 H PHE A 46 -22.159 8.354 127.643 1.00 0.00 H ATOM 460 N MET A 47 -22.820 7.238 124.731 1.00 36.96 N ATOM 461 CA MET A 47 -23.304 7.134 123.371 1.00 35.42 C ATOM 462 C MET A 47 -22.324 7.741 122.393 1.00 39.66 C ATOM 463 O MET A 47 -22.151 7.214 121.290 1.00 39.01 O ATOM 464 CB MET A 47 -24.649 7.794 123.171 1.00 37.81 C ATOM 465 CG MET A 47 -25.841 6.985 123.616 1.00 41.46 C ATOM 466 SD MET A 47 -27.277 8.087 123.545 1.00 42.75 S ATOM 467 CE MET A 47 -27.839 7.691 121.893 1.00 46.24 C ATOM 468 H MET A 47 -23.344 7.805 125.428 1.00 0.00 H ATOM 469 N TYR A 48 -21.700 8.847 122.798 1.00 38.69 N ATOM 470 CA TYR A 48 -20.867 9.634 121.927 1.00 36.45 C ATOM 471 C TYR A 48 -19.586 8.857 121.608 1.00 40.54 C ATOM 472 O TYR A 48 -19.131 8.849 120.447 1.00 40.71 O ATOM 473 CB TYR A 48 -20.551 10.934 122.628 1.00 35.58 C ATOM 474 CG TYR A 48 -20.026 12.118 121.815 1.00 36.34 C ATOM 475 CD1 TYR A 48 -18.787 12.103 121.191 1.00 36.37 C ATOM 476 CD2 TYR A 48 -20.765 13.293 121.758 1.00 37.13 C ATOM 477 CE1 TYR A 48 -18.314 13.230 120.514 1.00 37.43 C ATOM 478 CE2 TYR A 48 -20.312 14.400 121.085 1.00 39.97 C ATOM 479 CZ TYR A 48 -19.090 14.378 120.472 1.00 40.07 C ATOM 480 OH TYR A 48 -18.700 15.536 119.823 1.00 39.67 O ATOM 481 HH TYR A 48 -19.355 15.751 119.112 1.00 0.00 H ATOM 482 H TYR A 48 -21.820 9.154 123.784 1.00 0.00 H ATOM 483 N SER A 49 -18.985 8.249 122.636 1.00 41.57 N ATOM 484 CA SER A 49 -17.859 7.307 122.435 1.00 45.26 C ATOM 485 C SER A 49 -18.210 6.128 121.581 1.00 42.60 C ATOM 486 O SER A 49 -17.429 5.743 120.741 1.00 55.01 O ATOM 487 CB SER A 49 -17.283 6.792 123.744 1.00 46.78 C ATOM 488 OG SER A 49 -18.293 6.269 124.562 1.00 56.98 O ATOM 489 HG SER A 49 -18.955 6.978 124.761 1.00 0.00 H ATOM 490 H SER A 49 -19.317 8.442 123.603 1.00 0.00 H ATOM 491 N ASP A 50 -19.376 5.555 121.802 1.00 44.89 N ATOM 492 CA ASP A 50 -19.812 4.405 121.027 1.00 52.27 C ATOM 493 C ASP A 50 -19.940 4.666 119.545 1.00 55.78 C ATOM 494 O ASP A 50 -19.664 3.785 118.742 1.00 54.28 O ATOM 495 CB ASP A 50 -21.153 3.876 121.529 1.00 50.94 C ATOM 496 CG ASP A 50 -21.021 3.109 122.804 1.00 52.92 C ATOM 497 OD1 ASP A 50 -19.884 2.848 123.288 1.00 58.80 O ATOM 498 OD2 ASP A 50 -22.080 2.789 123.352 1.00 61.10 O ATOM 499 H ASP A 50 -19.997 5.933 122.546 1.00 0.00 H ATOM 500 N PHE A 51 -20.300 5.879 119.162 1.00 64.93 N ATOM 501 CA PHE A 51 -20.251 6.241 117.749 1.00 67.89 C ATOM 502 C PHE A 51 -18.813 6.573 117.319 1.00 70.72 C ATOM 503 O PHE A 51 -18.593 7.589 116.698 1.00 83.14 O ATOM 504 CB PHE A 51 -21.249 7.360 117.432 1.00 67.69 C ATOM 505 CG PHE A 51 -22.661 7.056 117.874 1.00 69.66 C ATOM 506 CD1 PHE A 51 -23.278 5.869 117.523 1.00 72.41 C ATOM 507 CD2 PHE A 51 -23.378 7.959 118.652 1.00 71.51 C ATOM 508 CE1 PHE A 51 -24.568 5.587 117.942 1.00 73.10 C ATOM 509 CE2 PHE A 51 -24.675 7.674 119.067 1.00 69.23 C ATOM 510 CZ PHE A 51 -25.266 6.486 118.717 1.00 69.08 C ATOM 511 H PHE A 51 -20.618 6.575 119.867 1.00 0.00 H ATOM 512 N GLY A 52 -17.857 5.692 117.646 1.00 73.25 N ATOM 513 CA GLY A 52 -16.471 5.767 117.189 1.00 72.86 C ATOM 514 C GLY A 52 -15.786 4.412 117.336 1.00 75.06 C ATOM 515 O GLY A 52 -16.372 3.364 117.040 1.00 77.22 O ATOM 516 H GLY A 52 -18.120 4.901 118.268 1.00 0.00 H TER 517 GLY A 52 ATOM 518 N HIS A 74 -11.543 2.346 118.113 1.00 78.32 N ATOM 519 CA HIS A 74 -12.184 3.337 118.960 1.00 75.36 C ATOM 520 C HIS A 74 -11.596 4.766 118.751 1.00 67.90 C ATOM 521 O HIS A 74 -10.422 5.048 119.037 1.00 65.56 O ATOM 522 CB HIS A 74 -12.185 2.867 120.432 1.00 81.83 C ATOM 523 CG HIS A 74 -10.845 2.922 121.121 1.00 87.61 C ATOM 524 ND1 HIS A 74 -10.692 3.393 122.411 1.00 85.81 N ATOM 525 CD2 HIS A 74 -9.606 2.556 120.710 1.00 86.90 C ATOM 526 CE1 HIS A 74 -9.423 3.315 122.765 1.00 82.89 C ATOM 527 NE2 HIS A 74 -8.741 2.818 121.747 1.00 89.21 N ATOM 528 HN3 HIS A 74 -10.527 2.311 118.331 1.00 0.00 H ATOM 529 HN2 HIS A 74 -11.676 2.606 117.115 1.00 0.00 H ATOM 530 HN1 HIS A 74 -11.969 1.414 118.289 1.00 0.00 H ATOM 531 N ARG A 75 -12.422 5.638 118.178 1.00 54.57 N ATOM 532 CA ARG A 75 -12.084 7.041 117.987 1.00 49.81 C ATOM 533 C ARG A 75 -11.974 7.854 119.302 1.00 47.61 C ATOM 534 O ARG A 75 -11.170 8.762 119.383 1.00 50.93 O ATOM 535 CB ARG A 75 -13.122 7.695 117.086 1.00 49.08 C ATOM 536 CG ARG A 75 -12.779 9.129 116.799 1.00 51.34 C ATOM 537 CD ARG A 75 -13.750 9.800 115.862 1.00 49.51 C ATOM 538 NE ARG A 75 -13.473 11.226 115.878 1.00 46.12 N ATOM 539 CZ ARG A 75 -14.069 12.133 115.119 1.00 53.77 C ATOM 540 NH1 ARG A 75 -15.002 11.790 114.243 1.00 60.42 N ATOM 541 NH2 ARG A 75 -13.714 13.402 115.229 1.00 58.86 N ATOM 542 HE ARG A 75 -12.746 11.563 116.541 1.00 0.00 H ATOM 543 HH12 ARG A 75 -15.458 12.518 113.657 1.00 0.00 H ATOM 544 HH11 ARG A 75 -15.279 10.793 114.142 1.00 0.00 H ATOM 545 HH22 ARG A 75 -14.174 14.124 114.639 1.00 0.00 H ATOM 546 HH21 ARG A 75 -12.974 13.678 115.906 1.00 0.00 H ATOM 547 H ARG A 75 -13.351 5.302 117.852 1.00 0.00 H ATOM 548 N PHE A 76 -12.767 7.503 120.315 1.00 45.76 N ATOM 549 CA PHE A 76 -12.871 8.245 121.542 1.00 42.93 C ATOM 550 C PHE A 76 -12.381 7.490 122.741 1.00 46.43 C ATOM 551 O PHE A 76 -12.591 6.302 122.842 1.00 52.02 O ATOM 552 CB PHE A 76 -14.314 8.618 121.742 1.00 41.29 C ATOM 553 CG PHE A 76 -14.839 9.488 120.641 1.00 41.51 C ATOM 554 CD1 PHE A 76 -14.356 10.774 120.485 1.00 39.46 C ATOM 555 CD2 PHE A 76 -15.811 9.032 119.762 1.00 42.21 C ATOM 556 CE1 PHE A 76 -14.823 11.585 119.466 1.00 43.13 C ATOM 557 CE2 PHE A 76 -16.283 9.842 118.731 1.00 43.04 C ATOM 558 CZ PHE A 76 -15.794 11.124 118.585 1.00 41.14 C ATOM 559 H PHE A 76 -13.343 6.643 120.212 1.00 0.00 H ATOM 560 N GLU A 77 -11.700 8.188 123.646 1.00 50.34 N ATOM 561 CA GLU A 77 -11.462 7.694 125.016 1.00 50.19 C ATOM 562 C GLU A 77 -12.452 8.335 125.947 1.00 49.89 C ATOM 563 O GLU A 77 -12.485 9.533 126.056 1.00 53.88 O ATOM 564 CB GLU A 77 -10.079 8.062 125.540 1.00 49.56 C ATOM 565 CG GLU A 77 -9.673 7.209 126.736 1.00 51.70 C ATOM 566 CD GLU A 77 -9.444 5.779 126.305 1.00 54.05 C ATOM 567 OE1 GLU A 77 -8.645 5.573 125.358 1.00 51.36 O ATOM 568 OE2 GLU A 77 -10.128 4.891 126.844 1.00 58.05 O ATOM 569 H GLU A 77 -11.321 9.118 123.377 1.00 0.00 H ATOM 570 N ILE A 78 -13.232 7.524 126.637 1.00 50.78 N ATOM 571 CA ILE A 78 -14.179 8.011 127.600 1.00 48.25 C ATOM 572 C ILE A 78 -13.415 8.345 128.866 1.00 49.61 C ATOM 573 O ILE A 78 -12.734 7.494 129.439 1.00 45.02 O ATOM 574 CB ILE A 78 -15.304 7.000 127.874 1.00 51.50 C ATOM 575 CG1 ILE A 78 -16.331 7.609 128.824 1.00 60.09 C ATOM 576 CG2 ILE A 78 -14.801 5.723 128.515 1.00 57.58 C ATOM 577 CD1 ILE A 78 -17.211 8.672 128.218 1.00 61.08 C ATOM 578 H ILE A 78 -13.158 6.499 126.478 1.00 0.00 H ATOM 579 N ILE A 79 -13.536 9.592 129.301 1.00 41.90 N ATOM 580 CA ILE A 79 -12.936 10.011 130.551 1.00 44.07 C ATOM 581 C ILE A 79 -13.987 10.033 131.658 1.00 43.40 C ATOM 582 O ILE A 79 -13.729 9.543 132.774 1.00 42.55 O ATOM 583 CB ILE A 79 -12.188 11.346 130.349 1.00 43.62 C ATOM 584 CG1 ILE A 79 -10.978 11.068 129.476 1.00 43.33 C ATOM 585 CG2 ILE A 79 -11.706 11.948 131.670 1.00 43.42 C ATOM 586 CD1 ILE A 79 -10.654 12.198 128.558 1.00 47.96 C ATOM 587 H ILE A 79 -14.071 10.281 128.735 1.00 0.00 H ATOM 588 N GLU A 80 -15.162 10.582 131.338 1.00 40.57 N ATOM 589 CA GLU A 80 -16.296 10.631 132.272 1.00 45.44 C ATOM 590 C GLU A 80 -16.719 9.225 132.693 1.00 43.16 C ATOM 591 O GLU A 80 -16.598 8.275 131.925 1.00 44.70 O ATOM 592 CB GLU A 80 -17.493 11.383 131.655 1.00 45.21 C ATOM 593 CG GLU A 80 -18.655 11.695 132.600 1.00 52.10 C ATOM 594 CD GLU A 80 -18.377 12.713 133.703 1.00 52.77 C ATOM 595 OE1 GLU A 80 -18.298 12.331 134.905 1.00 72.12 O ATOM 596 OE2 GLU A 80 -18.297 13.910 133.391 1.00 44.45 O ATOM 597 H GLU A 80 -15.279 10.992 130.389 1.00 0.00 H ATOM 598 N GLY A 81 -17.154 9.098 133.933 1.00 42.02 N ATOM 599 CA GLY A 81 -17.651 7.834 134.433 1.00 48.40 C ATOM 600 C GLY A 81 -16.621 6.947 135.082 1.00 47.92 C ATOM 601 O GLY A 81 -16.982 5.958 135.712 1.00 56.90 O ATOM 602 H GLY A 81 -17.139 9.924 134.564 1.00 0.00 H ATOM 603 N ARG A 82 -15.347 7.261 134.897 1.00 50.04 N ATOM 604 CA ARG A 82 -14.286 6.588 135.602 1.00 44.47 C ATOM 605 C ARG A 82 -14.135 7.292 136.924 1.00 48.79 C ATOM 606 O ARG A 82 -14.356 8.493 137.007 1.00 45.66 O ATOM 607 CB ARG A 82 -12.979 6.755 134.876 1.00 46.19 C ATOM 608 CG ARG A 82 -12.940 6.168 133.501 1.00 49.73 C ATOM 609 CD ARG A 82 -11.608 6.508 132.870 1.00 50.97 C ATOM 610 NE ARG A 82 -11.642 6.152 131.463 1.00 57.17 N ATOM 611 CZ ARG A 82 -11.507 4.923 130.977 1.00 58.42 C ATOM 612 NH1 ARG A 82 -11.283 3.890 131.781 1.00 59.44 N ATOM 613 NH2 ARG A 82 -11.571 4.735 129.660 1.00 57.95 N ATOM 614 HE ARG A 82 -11.784 6.923 130.779 1.00 0.00 H ATOM 615 HH12 ARG A 82 -11.180 2.934 131.384 1.00 0.00 H ATOM 616 HH11 ARG A 82 -11.211 4.037 132.808 1.00 0.00 H ATOM 617 HH22 ARG A 82 -11.467 3.778 129.266 1.00 0.00 H ATOM 618 HH21 ARG A 82 -11.725 5.545 129.026 1.00 0.00 H ATOM 619 H ARG A 82 -15.106 8.015 134.223 1.00 0.00 H ATOM 620 N ASP A 83 -13.671 6.560 137.934 1.00 52.26 N ATOM 621 CA ASP A 83 -13.162 7.168 139.149 1.00 51.16 C ATOM 622 C ASP A 83 -11.965 8.107 138.790 1.00 51.39 C ATOM 623 O ASP A 83 -11.320 7.971 137.733 1.00 45.01 O ATOM 624 CB ASP A 83 -12.808 6.094 140.186 1.00 53.86 C ATOM 625 CG ASP A 83 -11.343 5.713 140.159 1.00 59.62 C ATOM 626 OD1 ASP A 83 -10.878 5.079 139.185 1.00 62.42 O ATOM 627 OD2 ASP A 83 -10.649 6.092 141.121 1.00 66.26 O ATOM 628 H ASP A 83 -13.673 5.523 137.850 1.00 0.00 H ATOM 629 N ARG A 84 -11.709 9.074 139.662 1.00 49.03 N ATOM 630 CA ARG A 84 -10.818 10.191 139.338 1.00 50.23 C ATOM 631 C ARG A 84 -9.380 9.805 139.089 1.00 51.67 C ATOM 632 O ARG A 84 -8.736 10.384 138.199 1.00 48.86 O ATOM 633 CB ARG A 84 -10.890 11.272 140.415 1.00 53.46 C ATOM 634 CG ARG A 84 -12.132 12.113 140.269 1.00 56.51 C ATOM 635 CD ARG A 84 -12.519 12.856 141.526 1.00 62.21 C ATOM 636 NE ARG A 84 -12.914 14.218 141.167 1.00 69.62 N ATOM 637 CZ ARG A 84 -13.707 15.015 141.870 1.00 72.86 C ATOM 638 NH1 ARG A 84 -14.254 14.637 143.025 1.00 74.59 N ATOM 639 NH2 ARG A 84 -13.948 16.227 141.396 1.00 81.49 N ATOM 640 HE ARG A 84 -12.537 14.597 140.275 1.00 0.00 H ATOM 641 HH12 ARG A 84 -14.871 15.292 143.547 1.00 0.00 H ATOM 642 HH11 ARG A 84 -14.064 13.687 143.404 1.00 0.00 H ATOM 643 HH22 ARG A 84 -14.566 16.878 141.922 1.00 0.00 H ATOM 644 HH21 ARG A 84 -13.520 16.529 140.497 1.00 0.00 H ATOM 645 H ARG A 84 -12.153 9.038 140.602 1.00 0.00 H ATOM 646 N ILE A 85 -8.898 8.825 139.855 1.00 52.03 N ATOM 647 CA ILE A 85 -7.554 8.237 139.671 1.00 49.55 C ATOM 648 C ILE A 85 -7.389 7.732 138.247 1.00 48.69 C ATOM 649 O ILE A 85 -6.439 8.114 137.550 1.00 53.47 O ATOM 650 CB ILE A 85 -7.312 7.055 140.643 1.00 52.87 C ATOM 651 CG1 ILE A 85 -7.318 7.550 142.107 1.00 52.00 C ATOM 652 CG2 ILE A 85 -5.996 6.348 140.317 1.00 52.03 C ATOM 653 CD1 ILE A 85 -7.934 6.576 143.073 1.00 52.19 C ATOM 654 H ILE A 85 -9.498 8.456 140.620 1.00 0.00 H ATOM 655 N MET A 86 -8.327 6.894 137.818 1.00 52.42 N ATOM 656 CA MET A 86 -8.349 6.407 136.430 1.00 56.00 C ATOM 657 C MET A 86 -8.477 7.518 135.377 1.00 50.65 C ATOM 658 O MET A 86 -7.724 7.534 134.392 1.00 50.13 O ATOM 659 CB MET A 86 -9.446 5.322 136.209 1.00 58.08 C ATOM 660 CG MET A 86 -8.936 3.906 136.454 1.00 65.86 C ATOM 661 SD MET A 86 -7.539 3.451 135.355 1.00 75.81 S ATOM 662 CE MET A 86 -8.234 3.504 133.696 1.00 78.77 C ATOM 663 H MET A 86 -9.063 6.575 138.479 1.00 0.00 H ATOM 664 N ALA A 87 -9.422 8.430 135.583 1.00 48.04 N ATOM 665 CA ALA A 87 -9.630 9.538 134.640 1.00 47.43 C ATOM 666 C ALA A 87 -8.342 10.348 134.438 1.00 43.50 C ATOM 667 O ALA A 87 -7.925 10.605 133.287 1.00 39.04 O ATOM 668 CB ALA A 87 -10.742 10.433 135.141 1.00 48.50 C ATOM 669 H ALA A 87 -10.025 8.358 136.427 1.00 0.00 H ATOM 670 N TRP A 88 -7.706 10.716 135.557 1.00 41.38 N ATOM 671 CA TRP A 88 -6.423 11.400 135.493 1.00 43.80 C ATOM 672 C TRP A 88 -5.340 10.532 134.908 1.00 47.07 C ATOM 673 O TRP A 88 -4.543 11.053 134.141 1.00 43.87 O ATOM 674 CB TRP A 88 -5.996 11.999 136.823 1.00 43.62 C ATOM 675 CG TRP A 88 -6.785 13.234 137.099 1.00 46.36 C ATOM 676 CD1 TRP A 88 -7.738 13.408 138.065 1.00 48.43 C ATOM 677 CD2 TRP A 88 -6.742 14.457 136.369 1.00 43.06 C ATOM 678 NE1 TRP A 88 -8.265 14.665 137.988 1.00 45.80 N ATOM 679 CE2 TRP A 88 -7.673 15.331 136.958 1.00 40.85 C ATOM 680 CE3 TRP A 88 -5.995 14.904 135.295 1.00 43.05 C ATOM 681 CZ2 TRP A 88 -7.862 16.608 136.518 1.00 40.54 C ATOM 682 CZ3 TRP A 88 -6.194 16.171 134.850 1.00 42.71 C ATOM 683 CH2 TRP A 88 -7.115 17.015 135.458 1.00 43.79 C ATOM 684 HE1 TRP A 88 -9.000 15.051 138.615 1.00 0.00 H ATOM 685 H TRP A 88 -8.134 10.511 136.483 1.00 0.00 H ATOM 686 N THR A 89 -5.335 9.225 135.200 1.00 44.51 N ATOM 687 CA THR A 89 -4.377 8.332 134.552 1.00 43.76 C ATOM 688 C THR A 89 -4.574 8.341 133.044 1.00 45.00 C ATOM 689 O THR A 89 -3.621 8.369 132.275 1.00 42.05 O ATOM 690 CB THR A 89 -4.475 6.884 135.111 1.00 50.07 C ATOM 691 OG1 THR A 89 -4.209 6.900 136.520 1.00 47.93 O ATOM 692 CG2 THR A 89 -3.446 5.938 134.430 1.00 49.17 C ATOM 693 HG1 THR A 89 -4.874 7.476 136.974 1.00 0.00 H ATOM 694 H THR A 89 -6.014 8.845 135.889 1.00 0.00 H ATOM 695 N VAL A 90 -5.830 8.335 132.612 1.00 46.09 N ATOM 696 CA VAL A 90 -6.126 8.290 131.196 1.00 42.70 C ATOM 697 C VAL A 90 -5.673 9.601 130.547 1.00 43.92 C ATOM 698 O VAL A 90 -4.900 9.604 129.570 1.00 46.90 O ATOM 699 CB VAL A 90 -7.623 7.974 130.963 1.00 40.39 C ATOM 700 CG1 VAL A 90 -7.986 8.062 129.509 1.00 40.55 C ATOM 701 CG2 VAL A 90 -7.977 6.575 131.452 1.00 44.71 C ATOM 702 H VAL A 90 -6.610 8.363 133.299 1.00 0.00 H ATOM 703 N VAL A 91 -6.156 10.711 131.106 1.00 45.97 N ATOM 704 CA VAL A 91 -5.776 12.064 130.651 1.00 46.42 C ATOM 705 C VAL A 91 -4.268 12.227 130.586 1.00 43.08 C ATOM 706 O VAL A 91 -3.739 12.632 129.584 1.00 43.49 O ATOM 707 CB VAL A 91 -6.325 13.171 131.591 1.00 46.61 C ATOM 708 CG1 VAL A 91 -5.704 14.529 131.254 1.00 46.31 C ATOM 709 CG2 VAL A 91 -7.851 13.230 131.520 1.00 46.03 C ATOM 710 H VAL A 91 -6.828 10.620 131.895 1.00 0.00 H ATOM 711 N ASN A 92 -3.598 11.864 131.659 1.00 44.78 N ATOM 712 CA ASN A 92 -2.155 11.938 131.732 1.00 56.97 C ATOM 713 C ASN A 92 -1.455 11.107 130.661 1.00 59.20 C ATOM 714 O ASN A 92 -0.504 11.567 130.018 1.00 57.00 O ATOM 715 CB ASN A 92 -1.691 11.451 133.086 1.00 65.64 C ATOM 716 CG ASN A 92 -0.376 12.020 133.458 1.00 76.74 C ATOM 717 OD1 ASN A 92 0.661 11.453 133.129 1.00 77.72 O ATOM 718 ND2 ASN A 92 -0.398 13.182 134.117 1.00 85.57 N ATOM 719 HD22 ASN A 92 -1.307 13.619 134.371 1.00 0.00 H ATOM 720 HD21 ASN A 92 0.494 13.650 134.376 1.00 0.00 H ATOM 721 H ASN A 92 -4.125 11.511 132.484 1.00 0.00 H ATOM 722 N SER A 93 -1.943 9.887 130.472 1.00 56.84 N ATOM 723 CA SER A 93 -1.383 8.980 129.478 1.00 57.78 C ATOM 724 C SER A 93 -1.601 9.537 128.063 1.00 53.32 C ATOM 725 O SER A 93 -0.735 9.422 127.174 1.00 49.86 O ATOM 726 CB SER A 93 -1.993 7.577 129.647 1.00 63.16 C ATOM 727 OG SER A 93 -1.165 6.585 129.069 1.00 76.77 O ATOM 728 HG SER A 93 -1.582 5.696 129.193 1.00 0.00 H ATOM 729 H SER A 93 -2.748 9.569 131.049 1.00 0.00 H ATOM 730 N ILE A 94 -2.738 10.181 127.865 1.00 47.67 N ATOM 731 CA ILE A 94 -2.970 10.875 126.592 1.00 53.32 C ATOM 732 C ILE A 94 -2.034 12.076 126.361 1.00 50.37 C ATOM 733 O ILE A 94 -1.614 12.311 125.217 1.00 50.81 O ATOM 734 CB ILE A 94 -4.449 11.325 126.439 1.00 49.96 C ATOM 735 CG1 ILE A 94 -5.329 10.081 126.296 1.00 47.21 C ATOM 736 CG2 ILE A 94 -4.630 12.255 125.232 1.00 48.62 C ATOM 737 CD1 ILE A 94 -6.756 10.313 126.695 1.00 46.08 C ATOM 738 H ILE A 94 -3.466 10.196 128.608 1.00 0.00 H ATOM 739 N CYS A 95 -1.744 12.836 127.423 1.00 49.72 N ATOM 740 CA CYS A 95 -0.935 14.055 127.306 1.00 53.47 C ATOM 741 C CYS A 95 0.502 13.689 126.948 1.00 58.72 C ATOM 742 O CYS A 95 1.033 14.198 125.953 1.00 64.61 O ATOM 743 CB CYS A 95 -1.042 14.916 128.576 1.00 59.47 C ATOM 744 SG CYS A 95 -2.694 15.679 128.791 1.00 61.89 S ATOM 745 H CYS A 95 -2.102 12.555 128.358 1.00 0.00 H ATOM 746 N ASN A 96 1.078 12.736 127.685 1.00 57.38 N ATOM 747 CA ASN A 96 2.438 12.261 127.417 1.00 63.37 C ATOM 748 C ASN A 96 2.649 11.586 126.072 1.00 61.68 C ATOM 749 O ASN A 96 3.742 11.672 125.523 1.00 69.10 O ATOM 750 CB ASN A 96 2.919 11.324 128.508 1.00 65.05 C ATOM 751 CG ASN A 96 2.838 11.946 129.881 1.00 69.22 C ATOM 752 OD1 ASN A 96 2.845 13.176 130.042 1.00 66.62 O ATOM 753 ND2 ASN A 96 2.729 11.094 130.890 1.00 73.91 N ATOM 754 HD22 ASN A 96 2.728 10.070 130.708 1.00 0.00 H ATOM 755 HD21 ASN A 96 2.645 11.449 131.864 1.00 0.00 H ATOM 756 H ASN A 96 0.545 12.318 128.474 1.00 0.00 H ATOM 757 N THR A 97 1.633 10.944 125.519 1.00 62.87 N ATOM 758 CA THR A 97 1.812 10.288 124.222 1.00 64.42 C ATOM 759 C THR A 97 1.423 11.144 123.014 1.00 65.94 C ATOM 760 O THR A 97 1.734 10.763 121.883 1.00 67.14 O ATOM 761 CB THR A 97 1.087 8.930 124.137 1.00 67.36 C ATOM 762 OG1 THR A 97 -0.311 9.125 123.870 1.00 67.38 O ATOM 763 CG2 THR A 97 1.314 8.096 125.425 1.00 68.96 C ATOM 764 HG1 THR A 97 -0.713 9.661 124.599 1.00 0.00 H ATOM 765 H THR A 97 0.713 10.905 126.002 1.00 0.00 H ATOM 766 N THR A 98 0.764 12.284 123.243 1.00 69.23 N ATOM 767 CA THR A 98 0.365 13.204 122.158 1.00 64.55 C ATOM 768 C THR A 98 1.013 14.596 122.186 1.00 62.98 C ATOM 769 O THR A 98 1.229 15.208 121.125 1.00 74.13 O ATOM 770 CB THR A 98 -1.142 13.384 122.179 1.00 59.27 C ATOM 771 OG1 THR A 98 -1.522 13.888 123.468 1.00 53.99 O ATOM 772 CG2 THR A 98 -1.800 12.036 121.917 1.00 60.77 C ATOM 773 HG1 THR A 98 -1.248 13.243 124.167 1.00 0.00 H ATOM 774 H THR A 98 0.523 12.533 124.223 1.00 0.00 H ATOM 775 N GLY A 99 1.310 15.101 123.376 1.00 58.09 N ATOM 776 CA GLY A 99 1.838 16.447 123.535 1.00 61.48 C ATOM 777 C GLY A 99 0.785 17.492 123.857 1.00 69.07 C ATOM 778 O GLY A 99 1.140 18.601 124.273 1.00 72.65 O ATOM 779 H GLY A 99 1.161 14.516 124.223 1.00 0.00 H ATOM 780 N VAL A 100 -0.501 17.138 123.705 1.00 71.41 N ATOM 781 CA VAL A 100 -1.612 18.065 123.965 1.00 65.99 C ATOM 782 C VAL A 100 -1.565 18.489 125.429 1.00 62.25 C ATOM 783 O VAL A 100 -1.255 17.678 126.301 1.00 57.95 O ATOM 784 CB VAL A 100 -3.040 17.505 123.603 1.00 65.41 C ATOM 785 CG1 VAL A 100 -3.048 16.626 122.348 1.00 61.80 C ATOM 786 CG2 VAL A 100 -3.699 16.766 124.754 1.00 70.92 C ATOM 787 H VAL A 100 -0.720 16.171 123.391 1.00 0.00 H ATOM 788 N GLU A 101 -1.889 19.757 125.671 1.00 66.51 N ATOM 789 CA GLU A 101 -1.971 20.340 127.016 1.00 69.30 C ATOM 790 C GLU A 101 -2.931 19.593 127.938 1.00 61.78 C ATOM 791 O GLU A 101 -4.017 19.181 127.545 1.00 57.39 O ATOM 792 CB GLU A 101 -2.395 21.823 126.949 1.00 78.83 C ATOM 793 CG GLU A 101 -2.209 22.612 128.248 1.00 81.96 C ATOM 794 CD GLU A 101 -2.657 24.064 128.115 1.00 89.49 C ATOM 795 OE1 GLU A 101 -2.105 24.780 127.244 1.00 89.03 O ATOM 796 OE2 GLU A 101 -3.563 24.492 128.875 1.00 79.81 O ATOM 797 H GLU A 101 -2.097 20.372 124.858 1.00 0.00 H ATOM 798 N LYS A 102 -2.491 19.445 129.177 1.00 64.59 N ATOM 799 CA LYS A 102 -3.246 18.804 130.237 1.00 67.03 C ATOM 800 C LYS A 102 -4.372 19.752 130.667 1.00 65.59 C ATOM 801 O LYS A 102 -4.095 20.835 131.152 1.00 61.16 O ATOM 802 CB LYS A 102 -2.295 18.513 131.409 1.00 67.90 C ATOM 803 CG LYS A 102 -2.919 17.788 132.575 1.00 75.92 C ATOM 804 CD LYS A 102 -1.961 17.650 133.750 1.00 82.35 C ATOM 805 CE LYS A 102 -0.992 16.479 133.614 1.00 82.47 C ATOM 806 NZ LYS A 102 0.161 16.744 132.714 1.00 79.05 N ATOM 807 HZ1 LYS A 102 -0.189 16.964 131.760 1.00 0.00 H ATOM 808 HZ2 LYS A 102 0.706 17.551 133.079 1.00 0.00 H ATOM 809 HZ3 LYS A 102 0.770 15.902 132.676 1.00 0.00 H ATOM 810 H LYS A 102 -1.545 19.811 129.405 1.00 0.00 H ATOM 811 N PRO A 103 -5.642 19.358 130.491 1.00 63.28 N ATOM 812 CA PRO A 103 -6.703 20.254 130.943 1.00 61.36 C ATOM 813 C PRO A 103 -6.687 20.385 132.453 1.00 56.76 C ATOM 814 O PRO A 103 -6.114 19.550 133.132 1.00 56.89 O ATOM 815 CB PRO A 103 -7.966 19.528 130.511 1.00 59.37 C ATOM 816 CG PRO A 103 -7.592 18.098 130.731 1.00 58.68 C ATOM 817 CD PRO A 103 -6.170 18.008 130.248 1.00 61.48 C ATOM 818 N LYS A 104 -7.348 21.422 132.944 1.00 60.04 N ATOM 819 CA LYS A 104 -7.342 21.793 134.348 1.00 58.56 C ATOM 820 C LYS A 104 -8.334 20.956 135.094 1.00 55.42 C ATOM 821 O LYS A 104 -8.142 20.639 136.249 1.00 62.41 O ATOM 822 CB LYS A 104 -7.785 23.245 134.514 1.00 64.07 C ATOM 823 CG LYS A 104 -7.076 24.235 133.609 1.00 71.48 C ATOM 824 CD LYS A 104 -8.029 25.010 132.685 1.00 75.22 C ATOM 825 CE LYS A 104 -7.731 26.510 132.672 1.00 77.10 C ATOM 826 NZ LYS A 104 -6.280 26.867 132.616 1.00 72.61 N ATOM 827 HZ1 LYS A 104 -5.795 26.474 133.448 1.00 0.00 H ATOM 828 HZ2 LYS A 104 -5.860 26.472 131.750 1.00 0.00 H ATOM 829 HZ3 LYS A 104 -6.179 27.902 132.611 1.00 0.00 H ATOM 830 H LYS A 104 -7.904 22.005 132.286 1.00 0.00 H ATOM 831 N PHE A 105 -9.455 20.706 134.443 1.00 52.66 N ATOM 832 CA PHE A 105 -10.488 19.840 134.932 1.00 48.63 C ATOM 833 C PHE A 105 -10.592 18.636 134.019 1.00 43.28 C ATOM 834 O PHE A 105 -10.143 18.641 132.880 1.00 40.95 O ATOM 835 CB PHE A 105 -11.831 20.567 134.906 1.00 60.71 C ATOM 836 CG PHE A 105 -12.010 21.615 135.985 1.00 72.06 C ATOM 837 CD1 PHE A 105 -11.387 21.509 137.247 1.00 78.72 C ATOM 838 CD2 PHE A 105 -12.889 22.686 135.758 1.00 76.91 C ATOM 839 CE1 PHE A 105 -11.613 22.472 138.231 1.00 90.13 C ATOM 840 CE2 PHE A 105 -13.124 23.643 136.740 1.00 82.52 C ATOM 841 CZ PHE A 105 -12.482 23.541 137.975 1.00 88.53 C ATOM 842 H PHE A 105 -9.597 21.165 133.520 1.00 0.00 H ATOM 843 N LEU A 106 -11.209 17.597 134.534 1.00 40.99 N ATOM 844 CA LEU A 106 -11.447 16.420 133.766 1.00 38.71 C ATOM 845 C LEU A 106 -12.501 16.724 132.672 1.00 38.36 C ATOM 846 O LEU A 106 -13.648 17.052 132.966 1.00 38.77 O ATOM 847 CB LEU A 106 -11.909 15.295 134.687 1.00 38.12 C ATOM 848 CG LEU A 106 -10.779 14.712 135.500 1.00 37.56 C ATOM 849 CD1 LEU A 106 -11.344 13.792 136.544 1.00 40.33 C ATOM 850 CD2 LEU A 106 -9.739 13.971 134.672 1.00 39.56 C ATOM 851 H LEU A 106 -11.530 17.634 135.522 1.00 0.00 H ATOM 852 N PRO A 107 -12.114 16.621 131.400 1.00 36.38 N ATOM 853 CA PRO A 107 -13.109 16.639 130.355 1.00 35.34 C ATOM 854 C PRO A 107 -13.806 15.264 130.243 1.00 33.55 C ATOM 855 O PRO A 107 -13.620 14.404 131.099 1.00 28.36 O ATOM 856 CB PRO A 107 -12.295 16.994 129.122 1.00 37.55 C ATOM 857 CG PRO A 107 -10.939 16.579 129.411 1.00 37.21 C ATOM 858 CD PRO A 107 -10.773 16.380 130.865 1.00 37.84 C ATOM 859 N ASP A 108 -14.631 15.112 129.226 1.00 33.33 N ATOM 860 CA ASP A 108 -15.519 13.946 129.092 1.00 38.19 C ATOM 861 C ASP A 108 -14.973 12.833 128.189 1.00 37.78 C ATOM 862 O ASP A 108 -15.197 11.663 128.483 1.00 36.43 O ATOM 863 CB ASP A 108 -16.864 14.415 128.571 1.00 33.13 C ATOM 864 CG ASP A 108 -17.657 15.124 129.637 1.00 37.09 C ATOM 865 OD1 ASP A 108 -17.657 14.667 130.800 1.00 38.11 O ATOM 866 OD2 ASP A 108 -18.302 16.124 129.322 1.00 32.58 O ATOM 867 H ASP A 108 -14.655 15.845 128.489 1.00 0.00 H ATOM 868 N LEU A 109 -14.310 13.239 127.102 1.00 40.15 N ATOM 869 CA LEU A 109 -13.787 12.351 126.050 1.00 43.71 C ATOM 870 C LEU A 109 -12.462 12.884 125.516 1.00 43.95 C ATOM 871 O LEU A 109 -12.124 14.071 125.692 1.00 40.71 O ATOM 872 CB LEU A 109 -14.741 12.218 124.838 1.00 43.97 C ATOM 873 CG LEU A 109 -16.224 11.823 125.027 1.00 45.81 C ATOM 874 CD1 LEU A 109 -17.039 12.004 123.778 1.00 47.73 C ATOM 875 CD2 LEU A 109 -16.380 10.391 125.463 1.00 49.54 C ATOM 876 H LEU A 109 -14.151 14.261 126.990 1.00 0.00 H ATOM 877 N TYR A 110 -11.714 11.998 124.862 1.00 41.18 N ATOM 878 CA TYR A 110 -10.572 12.435 124.055 1.00 43.03 C ATOM 879 C TYR A 110 -10.868 11.965 122.659 1.00 40.85 C ATOM 880 O TYR A 110 -11.445 10.898 122.474 1.00 46.74 O ATOM 881 CB TYR A 110 -9.242 11.908 124.609 1.00 42.61 C ATOM 882 CG TYR A 110 -8.092 12.387 123.784 1.00 48.20 C ATOM 883 CD1 TYR A 110 -7.691 13.707 123.826 1.00 49.04 C ATOM 884 CD2 TYR A 110 -7.427 11.531 122.911 1.00 49.99 C ATOM 885 CE1 TYR A 110 -6.648 14.171 123.047 1.00 49.49 C ATOM 886 CE2 TYR A 110 -6.396 11.982 122.115 1.00 50.23 C ATOM 887 CZ TYR A 110 -5.994 13.300 122.191 1.00 53.73 C ATOM 888 OH TYR A 110 -4.948 13.744 121.397 1.00 59.68 O ATOM 889 HH TYR A 110 -4.787 14.705 121.572 1.00 0.00 H ATOM 890 H TYR A 110 -11.943 10.985 124.925 1.00 0.00 H ATOM 891 N ASP A 111 -10.572 12.798 121.678 1.00 39.91 N ATOM 892 CA ASP A 111 -10.796 12.462 120.286 1.00 41.92 C ATOM 893 C ASP A 111 -9.415 12.197 119.677 1.00 48.03 C ATOM 894 O ASP A 111 -8.609 13.122 119.521 1.00 43.47 O ATOM 895 CB ASP A 111 -11.494 13.623 119.574 1.00 40.29 C ATOM 896 CG ASP A 111 -11.876 13.291 118.153 1.00 42.65 C ATOM 897 OD1 ASP A 111 -11.300 12.340 117.572 1.00 44.01 O ATOM 898 OD2 ASP A 111 -12.741 13.983 117.569 1.00 41.76 O ATOM 899 H ASP A 111 -10.165 13.726 121.912 1.00 0.00 H ATOM 900 N TYR A 112 -9.140 10.931 119.360 1.00 53.55 N ATOM 901 CA TYR A 112 -7.894 10.542 118.670 1.00 52.64 C ATOM 902 C TYR A 112 -7.834 10.967 117.191 1.00 48.90 C ATOM 903 O TYR A 112 -6.750 11.083 116.645 1.00 57.60 O ATOM 904 CB TYR A 112 -7.665 9.029 118.757 1.00 53.40 C ATOM 905 CG TYR A 112 -7.435 8.489 120.158 1.00 46.53 C ATOM 906 CD1 TYR A 112 -6.246 8.704 120.833 1.00 43.20 C ATOM 907 CD2 TYR A 112 -8.387 7.721 120.768 1.00 46.07 C ATOM 908 CE1 TYR A 112 -6.054 8.219 122.103 1.00 40.00 C ATOM 909 CE2 TYR A 112 -8.191 7.216 122.032 1.00 45.62 C ATOM 910 CZ TYR A 112 -7.038 7.472 122.695 1.00 42.25 C ATOM 911 OH TYR A 112 -6.921 6.919 123.975 1.00 47.16 O ATOM 912 HH TYR A 112 -7.648 7.265 124.550 1.00 0.00 H ATOM 913 H TYR A 112 -9.828 10.191 119.608 1.00 0.00 H ATOM 914 N LYS A 113 -8.964 11.194 116.539 1.00 50.57 N ATOM 915 CA LYS A 113 -8.935 11.716 115.163 1.00 54.07 C ATOM 916 C LYS A 113 -8.528 13.182 115.105 1.00 55.67 C ATOM 917 O LYS A 113 -7.653 13.547 114.365 1.00 58.93 O ATOM 918 CB LYS A 113 -10.277 11.527 114.463 1.00 57.57 C ATOM 919 CG LYS A 113 -10.380 12.167 113.077 1.00 58.41 C ATOM 920 CD LYS A 113 -11.576 11.586 112.335 1.00 62.66 C ATOM 921 CE LYS A 113 -12.144 12.563 111.314 1.00 70.35 C ATOM 922 NZ LYS A 113 -13.561 12.228 110.979 1.00 73.11 N ATOM 923 HZ1 LYS A 113 -13.604 11.268 110.581 1.00 0.00 H ATOM 924 HZ2 LYS A 113 -14.140 12.274 111.842 1.00 0.00 H ATOM 925 HZ3 LYS A 113 -13.922 12.910 110.282 1.00 0.00 H ATOM 926 H LYS A 113 -9.876 11.003 117.001 1.00 0.00 H ATOM 927 N GLU A 114 -9.179 14.021 115.889 1.00 58.18 N ATOM 928 CA GLU A 114 -8.889 15.454 115.899 1.00 55.79 C ATOM 929 C GLU A 114 -7.872 15.836 116.958 1.00 50.27 C ATOM 930 O GLU A 114 -7.529 16.996 117.086 1.00 51.37 O ATOM 931 CB GLU A 114 -10.188 16.218 116.142 1.00 56.97 C ATOM 932 CG GLU A 114 -11.275 15.893 115.136 1.00 58.76 C ATOM 933 CD GLU A 114 -10.903 16.295 113.724 1.00 70.02 C ATOM 934 OE1 GLU A 114 -10.057 17.212 113.562 1.00 74.72 O ATOM 935 OE2 GLU A 114 -11.456 15.693 112.772 1.00 80.77 O ATOM 936 H GLU A 114 -9.920 13.652 116.518 1.00 0.00 H ATOM 937 N ASN A 115 -7.441 14.862 117.756 1.00 55.29 N ATOM 938 CA ASN A 115 -6.419 15.052 118.766 1.00 54.31 C ATOM 939 C ASN A 115 -6.759 16.197 119.683 1.00 51.27 C ATOM 940 O ASN A 115 -6.074 17.208 119.716 1.00 52.43 O ATOM 941 CB ASN A 115 -5.065 15.169 118.089 1.00 57.75 C ATOM 942 CG ASN A 115 -4.725 13.897 117.330 1.00 63.75 C ATOM 943 OD1 ASN A 115 -4.344 12.881 117.933 1.00 69.14 O ATOM 944 ND2 ASN A 115 -4.928 13.919 116.019 1.00 62.33 N ATOM 945 HD22 ASN A 115 -5.248 14.794 115.557 1.00 0.00 H ATOM 946 HD21 ASN A 115 -4.768 13.061 115.453 1.00 0.00 H ATOM 947 H ASN A 115 -7.859 13.916 117.649 1.00 0.00 H ATOM 948 N ARG A 116 -7.853 16.006 120.414 1.00 44.74 N ATOM 949 CA ARG A 116 -8.412 17.027 121.326 1.00 44.89 C ATOM 950 C ARG A 116 -9.376 16.403 122.264 1.00 38.79 C ATOM 951 O ARG A 116 -10.161 15.556 121.858 1.00 38.21 O ATOM 952 CB ARG A 116 -9.183 18.158 120.602 1.00 40.73 C ATOM 953 CG ARG A 116 -10.517 17.781 119.938 1.00 42.14 C ATOM 954 CD ARG A 116 -10.816 18.714 118.779 1.00 39.91 C ATOM 955 NE ARG A 116 -12.057 18.391 118.105 1.00 44.37 N ATOM 956 CZ ARG A 116 -12.451 18.897 116.923 1.00 46.08 C ATOM 957 NH1 ARG A 116 -11.704 19.757 116.256 1.00 51.15 N ATOM 958 NH2 ARG A 116 -13.602 18.526 116.387 1.00 45.64 N ATOM 959 HE ARG A 116 -12.694 17.714 118.572 1.00 0.00 H ATOM 960 HH12 ARG A 116 -12.033 20.133 115.344 1.00 0.00 H ATOM 961 HH11 ARG A 116 -10.787 20.059 116.643 1.00 0.00 H ATOM 962 HH22 ARG A 116 -13.901 18.921 115.473 1.00 0.00 H ATOM 963 HH21 ARG A 116 -14.208 17.839 116.880 1.00 0.00 H ATOM 964 H ARG A 116 -8.341 15.091 120.341 1.00 0.00 H ATOM 965 N PHE A 117 -9.322 16.861 123.497 1.00 40.12 N ATOM 966 CA PHE A 117 -10.374 16.628 124.485 1.00 41.40 C ATOM 967 C PHE A 117 -11.686 17.251 124.100 1.00 42.57 C ATOM 968 O PHE A 117 -11.734 18.227 123.332 1.00 41.68 O ATOM 969 CB PHE A 117 -9.952 17.129 125.836 1.00 40.11 C ATOM 970 CG PHE A 117 -8.771 16.394 126.358 1.00 41.58 C ATOM 971 CD1 PHE A 117 -8.922 15.122 126.887 1.00 42.01 C ATOM 972 CD2 PHE A 117 -7.502 16.921 126.232 1.00 40.05 C ATOM 973 CE1 PHE A 117 -7.819 14.413 127.347 1.00 46.14 C ATOM 974 CE2 PHE A 117 -6.402 16.231 126.694 1.00 42.12 C ATOM 975 CZ PHE A 117 -6.557 14.966 127.256 1.00 44.39 C ATOM 976 H PHE A 117 -8.490 17.416 123.782 1.00 0.00 H ATOM 977 N ILE A 118 -12.751 16.627 124.605 1.00 42.13 N ATOM 978 CA ILE A 118 -14.120 17.111 124.416 1.00 41.80 C ATOM 979 C ILE A 118 -14.780 17.234 125.773 1.00 38.08 C ATOM 980 O ILE A 118 -14.688 16.330 126.612 1.00 35.30 O ATOM 981 CB ILE A 118 -14.963 16.147 123.523 1.00 41.89 C ATOM 982 CG1 ILE A 118 -14.347 16.030 122.132 1.00 43.72 C ATOM 983 CG2 ILE A 118 -16.417 16.561 123.447 1.00 38.64 C ATOM 984 CD1 ILE A 118 -14.783 14.768 121.416 1.00 49.34 C ATOM 985 H ILE A 118 -12.603 15.758 125.157 1.00 0.00 H ATOM 986 N GLU A 119 -15.460 18.352 125.968 1.00 38.48 N ATOM 987 CA GLU A 119 -16.373 18.515 127.080 1.00 36.43 C ATOM 988 C GLU A 119 -17.763 18.434 126.500 1.00 36.14 C ATOM 989 O GLU A 119 -18.086 19.163 125.582 1.00 33.27 O ATOM 990 CB GLU A 119 -16.193 19.878 127.743 1.00 35.71 C ATOM 991 CG GLU A 119 -17.254 20.174 128.784 1.00 34.41 C ATOM 992 CD GLU A 119 -17.352 19.128 129.844 1.00 35.32 C ATOM 993 OE1 GLU A 119 -16.320 18.517 130.160 1.00 37.37 O ATOM 994 OE2 GLU A 119 -18.466 18.898 130.352 1.00 35.79 O ATOM 995 H GLU A 119 -15.335 19.140 125.301 1.00 0.00 H ATOM 996 N ILE A 120 -18.576 17.542 127.041 1.00 35.37 N ATOM 997 CA ILE A 120 -19.929 17.366 126.586 1.00 35.89 C ATOM 998 C ILE A 120 -20.880 18.092 127.528 1.00 32.13 C ATOM 999 O ILE A 120 -20.794 17.909 128.736 1.00 30.46 O ATOM 1000 CB ILE A 120 -20.325 15.873 126.598 1.00 40.66 C ATOM 1001 CG1 ILE A 120 -19.395 15.042 125.709 1.00 42.13 C ATOM 1002 CG2 ILE A 120 -21.789 15.713 126.201 1.00 38.38 C ATOM 1003 CD1 ILE A 120 -19.543 15.324 124.236 1.00 46.55 C ATOM 1004 H ILE A 120 -18.226 16.949 127.820 1.00 0.00 H ATOM 1005 N GLY A 121 -21.799 18.877 126.978 1.00 29.33 N ATOM 1006 CA GLY A 121 -22.813 19.542 127.806 1.00 29.91 C ATOM 1007 C GLY A 121 -24.198 19.095 127.404 1.00 30.67 C ATOM 1008 O GLY A 121 -24.483 18.907 126.232 1.00 33.85 O ATOM 1009 H GLY A 121 -21.801 19.023 125.948 1.00 0.00 H ATOM 1010 N VAL A 122 -25.050 18.859 128.380 1.00 31.66 N ATOM 1011 CA VAL A 122 -26.458 18.617 128.125 1.00 34.89 C ATOM 1012 C VAL A 122 -27.242 19.599 128.948 1.00 33.59 C ATOM 1013 O VAL A 122 -27.076 19.659 130.154 1.00 34.13 O ATOM 1014 CB VAL A 122 -26.896 17.169 128.457 1.00 34.43 C ATOM 1015 CG1 VAL A 122 -28.355 16.958 128.057 1.00 33.33 C ATOM 1016 CG2 VAL A 122 -25.993 16.200 127.705 1.00 38.45 C ATOM 1017 H VAL A 122 -24.704 18.846 129.361 1.00 0.00 H ATOM 1018 N THR A 123 -28.089 20.359 128.277 1.00 37.42 N ATOM 1019 CA THR A 123 -28.809 21.450 128.898 1.00 38.07 C ATOM 1020 C THR A 123 -30.304 21.414 128.630 1.00 38.15 C ATOM 1021 O THR A 123 -30.758 21.107 127.535 1.00 38.48 O ATOM 1022 CB THR A 123 -28.265 22.856 128.470 1.00 39.54 C ATOM 1023 OG1 THR A 123 -28.952 23.907 129.204 1.00 39.47 O ATOM 1024 CG2 THR A 123 -28.395 23.090 126.917 1.00 40.21 C ATOM 1025 HG1 THR A 123 -28.801 23.783 130.175 1.00 0.00 H ATOM 1026 H THR A 123 -28.244 20.166 127.267 1.00 0.00 H ATOM 1027 N ARG A 124 -31.032 21.820 129.663 1.00 40.11 N ATOM 1028 CA ARG A 124 -32.433 22.187 129.579 1.00 41.92 C ATOM 1029 C ARG A 124 -32.689 23.633 129.173 1.00 39.57 C ATOM 1030 O ARG A 124 -33.822 23.973 128.936 1.00 44.25 O ATOM 1031 CB ARG A 124 -33.075 21.969 130.940 1.00 40.54 C ATOM 1032 CG ARG A 124 -33.168 20.517 131.296 1.00 43.20 C ATOM 1033 CD ARG A 124 -32.998 20.347 132.779 1.00 44.11 C ATOM 1034 NE ARG A 124 -31.624 20.065 133.106 1.00 44.16 N ATOM 1035 CZ ARG A 124 -31.201 19.826 134.333 1.00 40.01 C ATOM 1036 NH1 ARG A 124 -32.049 19.874 135.355 1.00 45.55 N ATOM 1037 NH2 ARG A 124 -29.927 19.571 134.537 1.00 37.43 N ATOM 1038 HE ARG A 124 -30.928 20.049 132.334 1.00 0.00 H ATOM 1039 HH12 ARG A 124 -31.711 19.685 136.320 1.00 0.00 H ATOM 1040 HH11 ARG A 124 -33.050 20.101 135.190 1.00 0.00 H ATOM 1041 HH22 ARG A 124 -29.582 19.381 135.500 1.00 0.00 H ATOM 1042 HH21 ARG A 124 -29.264 19.559 133.736 1.00 0.00 H ATOM 1043 H ARG A 124 -30.568 21.879 130.592 1.00 0.00 H ATOM 1044 N ARG A 125 -31.660 24.471 129.136 1.00 43.11 N ATOM 1045 CA ARG A 125 -31.777 25.886 128.742 1.00 42.18 C ATOM 1046 C ARG A 125 -31.304 26.063 127.302 1.00 49.34 C ATOM 1047 O ARG A 125 -30.966 25.088 126.651 1.00 53.00 O ATOM 1048 CB ARG A 125 -30.900 26.692 129.647 1.00 42.44 C ATOM 1049 CG ARG A 125 -31.475 26.833 131.041 1.00 47.47 C ATOM 1050 CD ARG A 125 -30.461 27.506 131.952 1.00 50.40 C ATOM 1051 NE ARG A 125 -29.277 26.672 132.138 1.00 48.21 N ATOM 1052 CZ ARG A 125 -28.050 27.121 132.408 1.00 50.62 C ATOM 1053 NH1 ARG A 125 -27.782 28.429 132.519 1.00 50.79 N ATOM 1054 NH2 ARG A 125 -27.061 26.247 132.538 1.00 49.08 N ATOM 1055 HE ARG A 125 -29.400 25.643 132.053 1.00 0.00 H ATOM 1056 HH12 ARG A 125 -26.814 28.745 132.730 1.00 0.00 H ATOM 1057 HH11 ARG A 125 -28.542 29.128 132.394 1.00 0.00 H ATOM 1058 HH22 ARG A 125 -26.098 26.579 132.748 1.00 0.00 H ATOM 1059 HH21 ARG A 125 -27.248 25.230 132.429 1.00 0.00 H ATOM 1060 H ARG A 125 -30.721 24.109 129.399 1.00 0.00 H ATOM 1061 N GLU A 126 -31.265 27.295 126.815 1.00 56.65 N ATOM 1062 CA GLU A 126 -30.713 27.607 125.486 1.00 58.52 C ATOM 1063 C GLU A 126 -29.292 27.078 125.345 1.00 51.66 C ATOM 1064 O GLU A 126 -28.468 27.228 126.257 1.00 48.64 O ATOM 1065 CB GLU A 126 -30.701 29.131 125.236 1.00 65.40 C ATOM 1066 CG GLU A 126 -32.076 29.796 125.100 1.00 73.69 C ATOM 1067 CD GLU A 126 -32.838 29.429 123.816 1.00 82.83 C ATOM 1068 OE1 GLU A 126 -32.224 29.199 122.740 1.00 87.32 O ATOM 1069 OE2 GLU A 126 -34.085 29.397 123.873 1.00 84.79 O ATOM 1070 H GLU A 126 -31.639 28.073 127.395 1.00 0.00 H ATOM 1071 N VAL A 127 -28.996 26.458 124.203 1.00 45.39 N ATOM 1072 CA VAL A 127 -27.665 25.878 124.007 1.00 44.14 C ATOM 1073 C VAL A 127 -26.517 26.867 124.023 1.00 44.15 C ATOM 1074 O VAL A 127 -25.433 26.517 124.476 1.00 40.40 O ATOM 1075 CB VAL A 127 -27.542 25.017 122.719 1.00 45.07 C ATOM 1076 CG1 VAL A 127 -28.446 23.788 122.811 1.00 45.89 C ATOM 1077 CG2 VAL A 127 -27.805 25.824 121.453 1.00 41.48 C ATOM 1078 H VAL A 127 -29.710 26.386 123.451 1.00 0.00 H ATOM 1079 N HIS A 128 -26.717 28.069 123.478 1.00 49.30 N ATOM 1080 CA HIS A 128 -25.654 29.110 123.511 1.00 52.03 C ATOM 1081 C HIS A 128 -25.346 29.507 124.952 1.00 46.25 C ATOM 1082 O HIS A 128 -24.204 29.732 125.318 1.00 42.50 O ATOM 1083 CB HIS A 128 -25.988 30.362 122.638 1.00 58.29 C ATOM 1084 CG HIS A 128 -27.097 31.210 123.183 1.00 62.62 C ATOM 1085 ND1 HIS A 128 -28.402 31.097 122.753 1.00 69.46 N ATOM 1086 CD2 HIS A 128 -27.104 32.158 124.150 1.00 69.65 C ATOM 1087 CE1 HIS A 128 -29.166 31.939 123.425 1.00 67.45 C ATOM 1088 NE2 HIS A 128 -28.404 32.588 124.286 1.00 77.11 N ATOM 1089 H HIS A 128 -27.628 28.281 123.024 1.00 0.00 H ATOM 1090 N ILE A 129 -26.386 29.566 125.764 1.00 47.58 N ATOM 1091 CA ILE A 129 -26.225 29.939 127.155 1.00 50.49 C ATOM 1092 C ILE A 129 -25.326 28.929 127.820 1.00 49.54 C ATOM 1093 O ILE A 129 -24.323 29.331 128.475 1.00 47.28 O ATOM 1094 CB ILE A 129 -27.594 30.060 127.857 1.00 52.53 C ATOM 1095 CG1 ILE A 129 -28.302 31.331 127.330 1.00 58.54 C ATOM 1096 CG2 ILE A 129 -27.437 30.009 129.376 1.00 54.12 C ATOM 1097 CD1 ILE A 129 -29.567 31.722 128.068 1.00 61.45 C ATOM 1098 H ILE A 129 -27.334 29.342 125.400 1.00 0.00 H ATOM 1099 N TYR A 130 -25.655 27.637 127.636 1.00 44.54 N ATOM 1100 CA TYR A 130 -24.846 26.586 128.266 1.00 44.71 C ATOM 1101 C TYR A 130 -23.445 26.527 127.670 1.00 39.77 C ATOM 1102 O TYR A 130 -22.467 26.381 128.402 1.00 35.18 O ATOM 1103 CB TYR A 130 -25.536 25.213 128.270 1.00 46.60 C ATOM 1104 CG TYR A 130 -24.958 24.256 129.296 1.00 44.58 C ATOM 1105 CD1 TYR A 130 -24.822 24.623 130.643 1.00 47.04 C ATOM 1106 CD2 TYR A 130 -24.551 22.987 128.936 1.00 42.94 C ATOM 1107 CE1 TYR A 130 -24.268 23.761 131.578 1.00 46.75 C ATOM 1108 CE2 TYR A 130 -24.037 22.106 129.882 1.00 46.19 C ATOM 1109 CZ TYR A 130 -23.883 22.491 131.184 1.00 45.31 C ATOM 1110 OH TYR A 130 -23.350 21.593 132.077 1.00 48.02 O ATOM 1111 HH TYR A 130 -23.300 22.011 132.973 1.00 0.00 H ATOM 1112 H TYR A 130 -26.477 27.385 127.051 1.00 0.00 H ATOM 1113 N TYR A 131 -23.349 26.723 126.362 1.00 38.49 N ATOM 1114 CA TYR A 131 -22.071 26.746 125.711 1.00 43.93 C ATOM 1115 C TYR A 131 -21.164 27.789 126.357 1.00 46.50 C ATOM 1116 O TYR A 131 -19.983 27.509 126.618 1.00 44.35 O ATOM 1117 CB TYR A 131 -22.205 27.035 124.204 1.00 47.64 C ATOM 1118 CG TYR A 131 -20.858 27.013 123.521 1.00 49.43 C ATOM 1119 CD1 TYR A 131 -20.026 28.142 123.531 1.00 53.36 C ATOM 1120 CD2 TYR A 131 -20.376 25.861 122.923 1.00 47.86 C ATOM 1121 CE1 TYR A 131 -18.761 28.127 122.938 1.00 47.69 C ATOM 1122 CE2 TYR A 131 -19.107 25.835 122.339 1.00 53.18 C ATOM 1123 CZ TYR A 131 -18.318 26.991 122.351 1.00 53.65 C ATOM 1124 OH TYR A 131 -17.077 27.006 121.784 1.00 65.57 O ATOM 1125 HH TYR A 131 -16.504 26.333 122.230 1.00 0.00 H ATOM 1126 H TYR A 131 -24.213 26.862 125.800 1.00 0.00 H ATOM 1127 N LEU A 132 -21.694 28.998 126.585 1.00 46.38 N ATOM 1128 CA LEU A 132 -20.892 30.056 127.232 1.00 47.37 C ATOM 1129 C LEU A 132 -20.460 29.675 128.633 1.00 43.92 C ATOM 1130 O LEU A 132 -19.333 29.942 128.999 1.00 47.38 O ATOM 1131 CB LEU A 132 -21.633 31.407 127.276 1.00 47.83 C ATOM 1132 CG LEU A 132 -21.717 32.002 125.879 1.00 49.52 C ATOM 1133 CD1 LEU A 132 -22.761 33.092 125.860 1.00 51.49 C ATOM 1134 CD2 LEU A 132 -20.357 32.464 125.372 1.00 50.02 C ATOM 1135 H LEU A 132 -22.676 29.193 126.305 1.00 0.00 H ATOM 1136 N GLU A 133 -21.339 29.055 129.409 1.00 42.50 N ATOM 1137 CA GLU A 133 -20.956 28.647 130.735 1.00 44.93 C ATOM 1138 C GLU A 133 -19.789 27.696 130.709 1.00 44.89 C ATOM 1139 O GLU A 133 -18.843 27.844 131.471 1.00 47.40 O ATOM 1140 CB GLU A 133 -22.105 28.008 131.465 1.00 47.57 C ATOM 1141 CG GLU A 133 -23.162 29.007 131.886 1.00 52.55 C ATOM 1142 CD GLU A 133 -24.136 28.432 132.902 1.00 59.88 C ATOM 1143 OE1 GLU A 133 -24.028 27.238 133.255 1.00 63.90 O ATOM 1144 OE2 GLU A 133 -25.007 29.179 133.377 1.00 62.20 O ATOM 1145 H GLU A 133 -22.300 28.865 129.061 1.00 0.00 H ATOM 1146 N LYS A 134 -19.840 26.726 129.808 1.00 46.21 N ATOM 1147 CA LYS A 134 -18.744 25.764 129.679 1.00 46.01 C ATOM 1148 C LYS A 134 -17.469 26.405 129.197 1.00 46.17 C ATOM 1149 O LYS A 134 -16.402 26.117 129.723 1.00 45.38 O ATOM 1150 CB LYS A 134 -19.129 24.618 128.727 1.00 48.97 C ATOM 1151 CG LYS A 134 -20.101 23.635 129.345 1.00 49.32 C ATOM 1152 CD LYS A 134 -19.384 22.753 130.324 1.00 45.78 C ATOM 1153 CE LYS A 134 -20.190 21.530 130.703 1.00 46.96 C ATOM 1154 NZ LYS A 134 -19.484 20.786 131.795 1.00 52.08 N ATOM 1155 HZ1 LYS A 134 -18.544 20.493 131.461 1.00 0.00 H ATOM 1156 HZ2 LYS A 134 -19.381 21.405 132.624 1.00 0.00 H ATOM 1157 HZ3 LYS A 134 -20.039 19.946 132.055 1.00 0.00 H ATOM 1158 H LYS A 134 -20.669 26.647 129.185 1.00 0.00 H ATOM 1159 N ALA A 135 -17.586 27.254 128.169 1.00 53.75 N ATOM 1160 CA ALA A 135 -16.437 27.954 127.604 1.00 51.20 C ATOM 1161 C ALA A 135 -15.858 28.881 128.647 1.00 51.96 C ATOM 1162 O ALA A 135 -14.648 28.918 128.803 1.00 58.34 O ATOM 1163 CB ALA A 135 -16.799 28.697 126.311 1.00 50.98 C ATOM 1164 H ALA A 135 -18.527 27.420 127.759 1.00 0.00 H ATOM 1165 N ASN A 136 -16.706 29.553 129.427 1.00 53.92 N ATOM 1166 CA ASN A 136 -16.193 30.395 130.498 1.00 52.23 C ATOM 1167 C ASN A 136 -15.467 29.544 131.494 1.00 53.16 C ATOM 1168 O ASN A 136 -14.365 29.900 131.891 1.00 57.22 O ATOM 1169 CB ASN A 136 -17.269 31.220 131.220 1.00 56.51 C ATOM 1170 CG ASN A 136 -16.667 32.213 132.225 1.00 57.02 C ATOM 1171 OD1 ASN A 136 -15.569 32.728 132.038 1.00 58.97 O ATOM 1172 ND2 ASN A 136 -17.376 32.469 133.291 1.00 60.43 N ATOM 1173 HD22 ASN A 136 -18.303 32.016 133.420 1.00 0.00 H ATOM 1174 HD21 ASN A 136 -17.014 33.126 134.011 1.00 0.00 H ATOM 1175 H ASN A 136 -17.731 29.476 129.270 1.00 0.00 H ATOM 1176 N LYS A 137 -16.038 28.401 131.870 1.00 55.77 N ATOM 1177 CA LYS A 137 -15.358 27.540 132.850 1.00 59.63 C ATOM 1178 C LYS A 137 -14.016 27.002 132.354 1.00 55.90 C ATOM 1179 O LYS A 137 -13.150 26.783 133.160 1.00 50.49 O ATOM 1180 CB LYS A 137 -16.236 26.396 133.375 1.00 62.10 C ATOM 1181 CG LYS A 137 -15.616 25.733 134.605 1.00 69.89 C ATOM 1182 CD LYS A 137 -16.546 24.772 135.332 1.00 80.19 C ATOM 1183 CE LYS A 137 -17.533 25.477 136.253 1.00 84.87 C ATOM 1184 NZ LYS A 137 -18.155 24.502 137.204 1.00 88.30 N ATOM 1185 HZ1 LYS A 137 -18.660 23.769 136.666 1.00 0.00 H ATOM 1186 HZ2 LYS A 137 -17.411 24.060 137.781 1.00 0.00 H ATOM 1187 HZ3 LYS A 137 -18.824 25.002 137.823 1.00 0.00 H ATOM 1188 H LYS A 137 -16.957 28.119 131.474 1.00 0.00 H ATOM 1189 N ILE A 138 -13.845 26.869 131.040 1.00 56.28 N ATOM 1190 CA ILE A 138 -12.646 26.302 130.417 1.00 60.45 C ATOM 1191 C ILE A 138 -11.679 27.392 129.934 1.00 59.81 C ATOM 1192 O ILE A 138 -10.564 27.092 129.492 1.00 52.72 O ATOM 1193 CB ILE A 138 -13.113 25.398 129.235 1.00 69.63 C ATOM 1194 CG1 ILE A 138 -13.841 24.170 129.781 1.00 69.02 C ATOM 1195 CG2 ILE A 138 -11.980 24.956 128.310 1.00 77.42 C ATOM 1196 CD1 ILE A 138 -14.739 23.511 128.761 1.00 72.02 C ATOM 1197 H ILE A 138 -14.613 27.188 130.415 1.00 0.00 H TER 1198 ILE A 138 ATOM 1199 N GLU A 141 -8.199 24.991 128.347 1.00 79.28 N ATOM 1200 CA GLU A 141 -8.571 26.009 127.369 1.00 80.47 C ATOM 1201 C GLU A 141 -8.433 25.561 125.911 1.00 76.00 C ATOM 1202 O GLU A 141 -8.806 26.316 125.017 1.00 76.04 O ATOM 1203 CB GLU A 141 -7.767 27.299 127.587 1.00 84.03 C ATOM 1204 CG GLU A 141 -7.523 27.661 129.053 1.00 90.06 C ATOM 1205 CD GLU A 141 -7.296 29.151 129.311 1.00 92.97 C ATOM 1206 OE1 GLU A 141 -7.166 29.528 130.502 1.00 85.12 O ATOM 1207 OE2 GLU A 141 -7.231 29.941 128.341 1.00 86.53 O ATOM 1208 HN3 GLU A 141 -7.205 24.721 128.203 1.00 0.00 H ATOM 1209 HN2 GLU A 141 -8.807 24.156 128.225 1.00 0.00 H ATOM 1210 HN1 GLU A 141 -8.321 25.373 129.307 1.00 0.00 H ATOM 1211 N LYS A 142 -7.886 24.363 125.672 1.00 75.30 N ATOM 1212 CA LYS A 142 -7.787 23.773 124.308 1.00 77.29 C ATOM 1213 C LYS A 142 -8.937 22.803 124.022 1.00 63.41 C ATOM 1214 O LYS A 142 -9.010 22.239 122.938 1.00 58.62 O ATOM 1215 CB LYS A 142 -6.448 23.012 124.123 1.00 82.29 C ATOM 1216 CG LYS A 142 -5.183 23.859 124.251 1.00 87.18 C ATOM 1217 CD LYS A 142 -5.023 24.825 123.076 1.00 91.65 C ATOM 1218 CE LYS A 142 -3.904 25.835 123.300 1.00 90.78 C ATOM 1219 NZ LYS A 142 -2.574 25.174 123.287 1.00 95.14 N ATOM 1220 HZ1 LYS A 142 -2.535 24.461 124.043 1.00 0.00 H ATOM 1221 HZ2 LYS A 142 -2.426 24.713 122.367 1.00 0.00 H ATOM 1222 HZ3 LYS A 142 -1.833 25.887 123.442 1.00 0.00 H ATOM 1223 H LYS A 142 -7.513 23.819 126.476 1.00 0.00 H ATOM 1224 N THR A 143 -9.823 22.634 125.001 1.00 55.64 N ATOM 1225 CA THR A 143 -10.885 21.654 124.974 1.00 50.47 C ATOM 1226 C THR A 143 -12.043 22.003 124.038 1.00 51.76 C ATOM 1227 O THR A 143 -12.524 23.123 124.017 1.00 48.15 O ATOM 1228 CB THR A 143 -11.408 21.399 126.395 1.00 51.44 C ATOM 1229 OG1 THR A 143 -10.334 20.898 127.202 1.00 55.83 O ATOM 1230 CG2 THR A 143 -12.563 20.387 126.419 1.00 49.29 C ATOM 1231 HG1 THR A 143 -10.663 20.731 128.121 1.00 0.00 H ATOM 1232 H THR A 143 -9.746 23.246 125.838 1.00 0.00 H ATOM 1233 N HIS A 144 -12.482 20.999 123.270 1.00 48.60 N ATOM 1234 CA HIS A 144 -13.568 21.148 122.349 1.00 42.92 C ATOM 1235 C HIS A 144 -14.860 20.954 123.108 1.00 41.30 C ATOM 1236 O HIS A 144 -14.959 20.086 123.963 1.00 43.93 O ATOM 1237 CB HIS A 144 -13.425 20.144 121.223 1.00 47.61 C ATOM 1238 CG HIS A 144 -14.242 20.469 120.024 1.00 45.27 C ATOM 1239 ND1 HIS A 144 -13.764 21.254 119.001 1.00 47.74 N ATOM 1240 CD2 HIS A 144 -15.508 20.128 119.684 1.00 47.81 C ATOM 1241 CE1 HIS A 144 -14.700 21.375 118.070 1.00 50.20 C ATOM 1242 NE2 HIS A 144 -15.774 20.710 118.467 1.00 46.29 N ATOM 1243 H HIS A 144 -12.015 20.073 123.345 1.00 0.00 H ATOM 1244 N ILE A 145 -15.854 21.786 122.813 1.00 42.90 N ATOM 1245 CA ILE A 145 -17.113 21.774 123.549 1.00 39.39 C ATOM 1246 C ILE A 145 -18.244 21.396 122.620 1.00 37.37 C ATOM 1247 O ILE A 145 -18.303 21.899 121.506 1.00 40.48 O ATOM 1248 CB ILE A 145 -17.427 23.115 124.193 1.00 37.91 C ATOM 1249 CG1 ILE A 145 -16.352 23.474 125.223 1.00 41.73 C ATOM 1250 CG2 ILE A 145 -18.776 23.022 124.885 1.00 35.93 C ATOM 1251 CD1 ILE A 145 -16.522 24.874 125.821 1.00 42.29 C ATOM 1252 H ILE A 145 -15.730 22.465 122.035 1.00 0.00 H ATOM 1253 N HIS A 146 -19.121 20.501 123.076 1.00 32.66 N ATOM 1254 CA HIS A 146 -20.278 20.095 122.300 1.00 33.84 C ATOM 1255 C HIS A 146 -21.408 20.036 123.279 1.00 32.29 C ATOM 1256 O HIS A 146 -21.344 19.290 124.248 1.00 37.47 O ATOM 1257 CB HIS A 146 -20.010 18.728 121.622 1.00 35.38 C ATOM 1258 CG HIS A 146 -20.965 18.398 120.509 1.00 35.45 C ATOM 1259 ND1 HIS A 146 -20.618 17.587 119.449 1.00 39.49 N ATOM 1260 CD2 HIS A 146 -22.252 18.758 120.295 1.00 37.77 C ATOM 1261 CE1 HIS A 146 -21.654 17.465 118.635 1.00 38.14 C ATOM 1262 NE2 HIS A 146 -22.649 18.180 119.116 1.00 36.67 N ATOM 1263 H HIS A 146 -18.971 20.081 124.016 1.00 0.00 H ATOM 1264 N ILE A 147 -22.425 20.846 123.043 1.00 31.66 N ATOM 1265 CA ILE A 147 -23.600 21.010 123.918 1.00 30.80 C ATOM 1266 C ILE A 147 -24.774 20.419 123.185 1.00 32.93 C ATOM 1267 O ILE A 147 -24.945 20.687 121.990 1.00 33.69 O ATOM 1268 CB ILE A 147 -23.938 22.537 124.114 1.00 35.57 C ATOM 1269 CG1 ILE A 147 -22.754 23.286 124.725 1.00 36.71 C ATOM 1270 CG2 ILE A 147 -25.227 22.776 124.900 1.00 34.67 C ATOM 1271 CD1 ILE A 147 -22.188 22.676 125.969 1.00 37.58 C ATOM 1272 H ILE A 147 -22.394 21.412 122.171 1.00 0.00 H ATOM 1273 N PHE A 148 -25.602 19.664 123.900 1.00 33.25 N ATOM 1274 CA PHE A 148 -26.837 19.127 123.382 1.00 34.80 C ATOM 1275 C PHE A 148 -27.958 19.633 124.273 1.00 34.24 C ATOM 1276 O PHE A 148 -27.771 19.859 125.473 1.00 33.55 O ATOM 1277 CB PHE A 148 -26.826 17.596 123.478 1.00 35.89 C ATOM 1278 CG PHE A 148 -25.814 16.941 122.595 1.00 36.14 C ATOM 1279 CD1 PHE A 148 -26.144 16.596 121.292 1.00 36.84 C ATOM 1280 CD2 PHE A 148 -24.559 16.645 123.066 1.00 32.36 C ATOM 1281 CE1 PHE A 148 -25.224 15.996 120.483 1.00 36.36 C ATOM 1282 CE2 PHE A 148 -23.642 16.046 122.259 1.00 36.37 C ATOM 1283 CZ PHE A 148 -23.964 15.724 120.968 1.00 36.11 C ATOM 1284 H PHE A 148 -25.346 19.449 124.885 1.00 0.00 H ATOM 1285 N SER A 149 -29.126 19.818 123.700 1.00 35.00 N ATOM 1286 CA SER A 149 -30.271 20.156 124.508 1.00 38.09 C ATOM 1287 C SER A 149 -31.247 19.014 124.381 1.00 34.75 C ATOM 1288 O SER A 149 -31.005 18.085 123.673 1.00 38.06 O ATOM 1289 CB SER A 149 -30.888 21.448 124.045 1.00 38.48 C ATOM 1290 OG SER A 149 -31.596 21.237 122.859 1.00 39.04 O ATOM 1291 HG SER A 149 -31.999 22.091 122.560 1.00 0.00 H ATOM 1292 H SER A 149 -29.224 19.721 122.669 1.00 0.00 H ATOM 1293 N PHE A 150 -32.340 19.118 125.103 1.00 37.39 N ATOM 1294 CA PHE A 150 -33.487 18.220 124.983 1.00 37.27 C ATOM 1295 C PHE A 150 -34.460 18.676 123.917 1.00 37.63 C ATOM 1296 O PHE A 150 -35.574 18.192 123.863 1.00 44.22 O ATOM 1297 CB PHE A 150 -34.215 18.163 126.317 1.00 36.00 C ATOM 1298 CG PHE A 150 -33.397 17.571 127.389 1.00 33.21 C ATOM 1299 CD1 PHE A 150 -32.470 18.341 128.067 1.00 28.73 C ATOM 1300 CD2 PHE A 150 -33.487 16.205 127.659 1.00 28.52 C ATOM 1301 CE1 PHE A 150 -31.721 17.790 129.070 1.00 29.30 C ATOM 1302 CE2 PHE A 150 -32.728 15.660 128.646 1.00 29.47 C ATOM 1303 CZ PHE A 150 -31.851 16.440 129.367 1.00 29.34 C ATOM 1304 H PHE A 150 -32.392 19.886 125.802 1.00 0.00 H ATOM 1305 N THR A 151 -34.030 19.563 123.033 1.00 40.84 N ATOM 1306 CA THR A 151 -34.918 20.111 122.015 1.00 43.73 C ATOM 1307 C THR A 151 -34.386 19.746 120.659 1.00 42.03 C ATOM 1308 O THR A 151 -34.986 20.123 119.655 1.00 47.89 O ATOM 1309 CB THR A 151 -35.000 21.684 122.116 1.00 39.45 C ATOM 1310 OG1 THR A 151 -33.677 22.237 122.063 1.00 45.06 O ATOM 1311 CG2 THR A 151 -35.640 22.144 123.406 1.00 38.99 C ATOM 1312 HG1 THR A 151 -33.143 21.885 122.819 1.00 0.00 H ATOM 1313 H THR A 151 -33.038 19.875 123.066 1.00 0.00 H ATOM 1314 N GLY A 152 -33.267 19.042 120.584 1.00 41.05 N ATOM 1315 CA GLY A 152 -32.651 18.790 119.270 1.00 41.67 C ATOM 1316 C GLY A 152 -31.698 19.861 118.801 1.00 44.28 C ATOM 1317 O GLY A 152 -31.275 19.849 117.658 1.00 44.81 O ATOM 1318 H GLY A 152 -32.825 18.669 121.448 1.00 0.00 H ATOM 1319 N GLU A 153 -31.351 20.785 119.690 1.00 49.27 N ATOM 1320 CA GLU A 153 -30.386 21.823 119.394 1.00 47.78 C ATOM 1321 C GLU A 153 -29.060 21.360 119.962 1.00 46.55 C ATOM 1322 O GLU A 153 -28.976 20.605 120.947 1.00 46.17 O ATOM 1323 CB GLU A 153 -30.764 23.148 120.034 1.00 56.21 C ATOM 1324 CG GLU A 153 -32.122 23.726 119.634 1.00 65.81 C ATOM 1325 CD GLU A 153 -32.546 24.902 120.520 1.00 78.82 C ATOM 1326 OE1 GLU A 153 -32.150 24.982 121.721 1.00 91.52 O ATOM 1327 OE2 GLU A 153 -33.283 25.771 120.011 1.00 94.69 O ATOM 1328 H GLU A 153 -31.789 20.762 120.633 1.00 0.00 H ATOM 1329 N GLU A 154 -28.016 21.815 119.314 1.00 44.28 N ATOM 1330 CA GLU A 154 -26.692 21.542 119.748 1.00 44.72 C ATOM 1331 C GLU A 154 -25.862 22.725 119.362 1.00 44.55 C ATOM 1332 O GLU A 154 -26.282 23.523 118.533 1.00 46.52 O ATOM 1333 CB GLU A 154 -26.154 20.282 119.098 1.00 48.40 C ATOM 1334 CG GLU A 154 -26.124 20.296 117.586 1.00 50.06 C ATOM 1335 CD GLU A 154 -25.717 18.953 116.994 1.00 49.59 C ATOM 1336 OE1 GLU A 154 -24.929 18.183 117.586 1.00 49.24 O ATOM 1337 OE2 GLU A 154 -26.209 18.651 115.911 1.00 49.70 O ATOM 1338 H GLU A 154 -28.161 22.391 118.460 1.00 0.00 H ATOM 1339 N MET A 155 -24.701 22.829 119.987 1.00 39.16 N ATOM 1340 CA MET A 155 -23.743 23.846 119.649 1.00 39.04 C ATOM 1341 C MET A 155 -22.376 23.316 119.979 1.00 38.49 C ATOM 1342 O MET A 155 -22.172 22.660 120.996 1.00 39.53 O ATOM 1343 CB MET A 155 -24.028 25.133 120.409 1.00 37.85 C ATOM 1344 CG MET A 155 -23.064 26.227 120.079 1.00 43.44 C ATOM 1345 SD MET A 155 -23.529 27.736 120.932 1.00 52.97 S ATOM 1346 CE MET A 155 -22.000 28.677 120.786 1.00 56.60 C ATOM 1347 H MET A 155 -24.474 22.155 120.746 1.00 0.00 H ATOM 1348 N ALA A 156 -21.437 23.604 119.110 1.00 37.47 N ATOM 1349 CA ALA A 156 -20.152 23.013 119.232 1.00 42.56 C ATOM 1350 C ALA A 156 -19.071 24.006 118.813 1.00 42.07 C ATOM 1351 O ALA A 156 -19.300 24.868 117.966 1.00 43.11 O ATOM 1352 CB ALA A 156 -20.103 21.723 118.404 1.00 41.73 C ATOM 1353 H ALA A 156 -21.634 24.265 118.332 1.00 0.00 H ATOM 1354 N THR A 157 -17.902 23.881 119.424 1.00 41.11 N ATOM 1355 CA THR A 157 -16.808 24.772 119.146 1.00 43.53 C ATOM 1356 C THR A 157 -16.566 24.863 117.642 1.00 46.23 C ATOM 1357 O THR A 157 -16.391 23.835 116.952 1.00 44.46 O ATOM 1358 CB THR A 157 -15.554 24.310 119.873 1.00 43.02 C ATOM 1359 OG1 THR A 157 -15.864 24.235 121.257 1.00 42.84 O ATOM 1360 CG2 THR A 157 -14.378 25.271 119.636 1.00 43.83 C ATOM 1361 HG1 THR A 157 -16.142 25.128 121.581 1.00 0.00 H ATOM 1362 H THR A 157 -17.773 23.120 120.121 1.00 0.00 H ATOM 1363 N LYS A 158 -16.608 26.112 117.159 1.00 50.67 N ATOM 1364 CA LYS A 158 -16.370 26.478 115.766 1.00 51.42 C ATOM 1365 C LYS A 158 -17.354 25.788 114.846 1.00 52.43 C ATOM 1366 O LYS A 158 -17.016 25.502 113.710 1.00 54.15 O ATOM 1367 CB LYS A 158 -14.907 26.191 115.345 1.00 57.15 C ATOM 1368 CG LYS A 158 -13.910 27.207 115.882 1.00 65.65 C ATOM 1369 CD LYS A 158 -12.503 26.637 116.021 1.00 73.80 C ATOM 1370 CE LYS A 158 -11.586 27.595 116.780 1.00 81.18 C ATOM 1371 NZ LYS A 158 -10.580 26.885 117.625 1.00 83.08 N ATOM 1372 HZ1 LYS A 158 -11.072 26.294 118.325 1.00 0.00 H ATOM 1373 HZ2 LYS A 158 -9.983 26.285 117.021 1.00 0.00 H ATOM 1374 HZ3 LYS A 158 -9.986 27.584 118.116 1.00 0.00 H ATOM 1375 H LYS A 158 -16.827 26.879 117.827 1.00 0.00 H ATOM 1376 N ALA A 159 -18.564 25.497 115.336 1.00 52.98 N ATOM 1377 CA ALA A 159 -19.565 24.718 114.585 1.00 50.20 C ATOM 1378 C ALA A 159 -19.011 23.423 113.996 1.00 50.48 C ATOM 1379 O ALA A 159 -19.451 22.955 112.962 1.00 56.16 O ATOM 1380 CB ALA A 159 -20.190 25.569 113.498 1.00 49.83 C ATOM 1381 H ALA A 159 -18.809 25.835 116.288 1.00 0.00 H ATOM 1382 N ASP A 160 -18.047 22.837 114.683 1.00 45.23 N ATOM 1383 CA ASP A 160 -17.482 21.602 114.271 1.00 43.65 C ATOM 1384 C ASP A 160 -18.121 20.542 115.227 1.00 47.07 C ATOM 1385 O ASP A 160 -17.807 20.450 116.416 1.00 45.92 O ATOM 1386 CB ASP A 160 -15.969 21.677 114.409 1.00 44.70 C ATOM 1387 CG ASP A 160 -15.312 20.357 114.155 1.00 53.52 C ATOM 1388 OD1 ASP A 160 -16.030 19.390 113.760 1.00 66.28 O ATOM 1389 OD2 ASP A 160 -14.085 20.259 114.372 1.00 53.30 O ATOM 1390 H ASP A 160 -17.693 23.292 115.548 1.00 0.00 H ATOM 1391 N TYR A 161 -19.031 19.760 114.690 1.00 43.72 N ATOM 1392 CA TYR A 161 -19.829 18.857 115.476 1.00 42.49 C ATOM 1393 C TYR A 161 -19.195 17.481 115.696 1.00 44.42 C ATOM 1394 O TYR A 161 -19.814 16.631 116.333 1.00 41.01 O ATOM 1395 CB TYR A 161 -21.207 18.754 114.823 1.00 46.10 C ATOM 1396 CG TYR A 161 -21.902 20.075 114.861 1.00 46.36 C ATOM 1397 CD1 TYR A 161 -22.460 20.522 116.060 1.00 47.17 C ATOM 1398 CD2 TYR A 161 -21.923 20.935 113.755 1.00 47.63 C ATOM 1399 CE1 TYR A 161 -23.063 21.746 116.162 1.00 44.19 C ATOM 1400 CE2 TYR A 161 -22.547 22.174 113.848 1.00 48.14 C ATOM 1401 CZ TYR A 161 -23.123 22.551 115.068 1.00 47.77 C ATOM 1402 OH TYR A 161 -23.715 23.750 115.277 1.00 55.95 O ATOM 1403 HH TYR A 161 -24.049 23.794 116.208 1.00 0.00 H ATOM 1404 H TYR A 161 -19.179 19.795 113.661 1.00 0.00 H ATOM 1405 N THR A 162 -17.971 17.265 115.196 1.00 45.21 N ATOM 1406 CA THR A 162 -17.195 16.067 115.458 1.00 47.80 C ATOM 1407 C THR A 162 -17.809 14.800 114.878 1.00 48.57 C ATOM 1408 O THR A 162 -17.157 14.065 114.167 1.00 49.15 O ATOM 1409 CB THR A 162 -16.963 15.868 116.973 1.00 48.51 C ATOM 1410 OG1 THR A 162 -16.296 17.021 117.511 1.00 48.20 O ATOM 1411 CG2 THR A 162 -16.157 14.589 117.240 1.00 49.49 C ATOM 1412 HG1 THR A 162 -16.148 16.892 118.481 1.00 0.00 H ATOM 1413 H THR A 162 -17.554 17.997 114.586 1.00 0.00 H ATOM 1414 N LEU A 163 -19.040 14.502 115.270 1.00 54.01 N ATOM 1415 CA LEU A 163 -19.727 13.315 114.820 1.00 51.85 C ATOM 1416 C LEU A 163 -20.418 13.595 113.527 1.00 47.79 C ATOM 1417 O LEU A 163 -20.609 14.725 113.131 1.00 39.33 O ATOM 1418 CB LEU A 163 -20.773 12.864 115.834 1.00 55.07 C ATOM 1419 CG LEU A 163 -20.239 12.341 117.153 1.00 55.86 C ATOM 1420 CD1 LEU A 163 -21.417 12.070 118.078 1.00 55.08 C ATOM 1421 CD2 LEU A 163 -19.377 11.112 116.934 1.00 53.55 C ATOM 1422 H LEU A 163 -19.528 15.146 115.925 1.00 0.00 H ATOM 1423 N ASP A 164 -20.825 12.510 112.904 1.00 49.48 N ATOM 1424 CA ASP A 164 -21.625 12.569 111.713 1.00 54.70 C ATOM 1425 C ASP A 164 -23.072 12.727 112.160 1.00 50.57 C ATOM 1426 O ASP A 164 -23.405 12.532 113.348 1.00 41.59 O ATOM 1427 CB ASP A 164 -21.413 11.312 110.869 1.00 59.92 C ATOM 1428 CG ASP A 164 -21.464 10.044 111.709 1.00 71.38 C ATOM 1429 OD1 ASP A 164 -20.467 9.742 112.432 1.00 88.84 O ATOM 1430 OD2 ASP A 164 -22.514 9.399 111.684 1.00 60.36 O ATOM 1431 H ASP A 164 -20.559 11.580 113.286 1.00 0.00 H ATOM 1432 N GLU A 165 -23.916 13.060 111.191 1.00 47.33 N ATOM 1433 CA GLU A 165 -25.255 13.540 111.483 1.00 55.50 C ATOM 1434 C GLU A 165 -26.160 12.474 112.106 1.00 54.47 C ATOM 1435 O GLU A 165 -27.033 12.780 112.915 1.00 48.49 O ATOM 1436 CB GLU A 165 -25.883 14.139 110.229 1.00 59.35 C ATOM 1437 CG GLU A 165 -25.201 15.441 109.861 1.00 71.51 C ATOM 1438 CD GLU A 165 -25.698 16.052 108.572 1.00 89.39 C ATOM 1439 OE1 GLU A 165 -26.911 15.922 108.258 1.00 98.78 O ATOM 1440 OE2 GLU A 165 -24.869 16.691 107.884 1.00100.81 O ATOM 1441 H GLU A 165 -23.611 12.975 110.200 1.00 0.00 H ATOM 1442 N GLU A 166 -25.917 11.226 111.747 1.00 52.82 N ATOM 1443 CA GLU A 166 -26.712 10.121 112.208 1.00 50.29 C ATOM 1444 C GLU A 166 -26.448 9.832 113.689 1.00 44.63 C ATOM 1445 O GLU A 166 -27.374 9.528 114.422 1.00 42.81 O ATOM 1446 CB GLU A 166 -26.396 8.869 111.381 1.00 54.64 C ATOM 1447 CG GLU A 166 -27.434 7.781 111.556 1.00 61.62 C ATOM 1448 CD GLU A 166 -26.844 6.397 111.631 1.00 71.91 C ATOM 1449 OE1 GLU A 166 -26.003 6.048 110.766 1.00 78.70 O ATOM 1450 OE2 GLU A 166 -27.259 5.647 112.541 1.00 85.97 O ATOM 1451 H GLU A 166 -25.120 11.036 111.106 1.00 0.00 H ATOM 1452 N SER A 167 -25.180 9.871 114.091 1.00 38.66 N ATOM 1453 CA SER A 167 -24.817 9.694 115.476 1.00 41.20 C ATOM 1454 C SER A 167 -25.394 10.846 116.326 1.00 43.27 C ATOM 1455 O SER A 167 -25.990 10.628 117.383 1.00 37.89 O ATOM 1456 CB SER A 167 -23.314 9.654 115.574 1.00 42.40 C ATOM 1457 OG SER A 167 -22.845 8.616 114.754 1.00 46.59 O ATOM 1458 HG SER A 167 -23.120 8.786 113.818 1.00 0.00 H ATOM 1459 H SER A 167 -24.431 10.033 113.388 1.00 0.00 H ATOM 1460 N ARG A 168 -25.253 12.064 115.822 1.00 39.23 N ATOM 1461 CA ARG A 168 -25.790 13.197 116.517 1.00 40.35 C ATOM 1462 C ARG A 168 -27.299 13.129 116.664 1.00 39.04 C ATOM 1463 O ARG A 168 -27.834 13.432 117.749 1.00 33.07 O ATOM 1464 CB ARG A 168 -25.386 14.481 115.832 1.00 41.97 C ATOM 1465 CG ARG A 168 -23.902 14.726 115.960 1.00 44.25 C ATOM 1466 CD ARG A 168 -23.614 16.143 115.535 1.00 49.93 C ATOM 1467 NE ARG A 168 -23.482 16.245 114.102 1.00 56.24 N ATOM 1468 CZ ARG A 168 -23.923 17.238 113.333 1.00 55.22 C ATOM 1469 NH1 ARG A 168 -24.591 18.269 113.812 1.00 57.92 N ATOM 1470 NH2 ARG A 168 -23.689 17.175 112.041 1.00 59.68 N ATOM 1471 HE ARG A 168 -22.993 15.463 113.621 1.00 0.00 H ATOM 1472 HH12 ARG A 168 -24.916 19.021 113.171 1.00 0.00 H ATOM 1473 HH11 ARG A 168 -24.793 18.330 114.830 1.00 0.00 H ATOM 1474 HH22 ARG A 168 -24.021 17.936 111.415 1.00 0.00 H ATOM 1475 HH21 ARG A 168 -23.172 16.364 111.645 1.00 0.00 H ATOM 1476 H ARG A 168 -24.752 12.198 114.921 1.00 0.00 H ATOM 1477 N ALA A 169 -27.953 12.687 115.594 1.00 36.23 N ATOM 1478 CA ALA A 169 -29.390 12.475 115.568 1.00 36.95 C ATOM 1479 C ALA A 169 -29.847 11.411 116.564 1.00 38.33 C ATOM 1480 O ALA A 169 -30.922 11.530 117.174 1.00 37.72 O ATOM 1481 CB ALA A 169 -29.824 12.100 114.176 1.00 37.85 C ATOM 1482 H ALA A 169 -27.408 12.483 114.732 1.00 0.00 H ATOM 1483 N ARG A 170 -29.047 10.369 116.719 1.00 36.50 N ATOM 1484 CA ARG A 170 -29.348 9.388 117.735 1.00 42.24 C ATOM 1485 C ARG A 170 -29.263 9.989 119.173 1.00 38.51 C ATOM 1486 O ARG A 170 -30.101 9.718 120.015 1.00 35.12 O ATOM 1487 CB ARG A 170 -28.461 8.141 117.574 1.00 49.57 C ATOM 1488 CG ARG A 170 -28.949 7.201 116.476 1.00 62.00 C ATOM 1489 CD ARG A 170 -28.427 5.765 116.605 1.00 72.96 C ATOM 1490 NE ARG A 170 -27.469 5.402 115.550 1.00 86.23 N ATOM 1491 CZ ARG A 170 -26.747 4.276 115.521 1.00 95.27 C ATOM 1492 NH1 ARG A 170 -26.868 3.359 116.487 1.00 99.11 N ATOM 1493 NH2 ARG A 170 -25.885 4.065 114.520 1.00 88.63 N ATOM 1494 HE ARG A 170 -27.343 6.073 114.765 1.00 0.00 H ATOM 1495 HH12 ARG A 170 -26.300 2.488 116.452 1.00 0.00 H ATOM 1496 HH11 ARG A 170 -27.530 3.517 117.274 1.00 0.00 H ATOM 1497 HH22 ARG A 170 -25.322 3.191 114.494 1.00 0.00 H ATOM 1498 HH21 ARG A 170 -25.778 4.775 113.768 1.00 0.00 H ATOM 1499 H ARG A 170 -28.208 10.257 116.114 1.00 0.00 H ATOM 1500 N ILE A 171 -28.260 10.805 119.442 1.00 35.92 N ATOM 1501 CA ILE A 171 -28.122 11.419 120.762 1.00 38.08 C ATOM 1502 C ILE A 171 -29.332 12.301 121.012 1.00 39.89 C ATOM 1503 O ILE A 171 -29.960 12.234 122.074 1.00 38.13 O ATOM 1504 CB ILE A 171 -26.781 12.191 120.872 1.00 39.40 C ATOM 1505 CG1 ILE A 171 -25.658 11.169 120.957 1.00 37.91 C ATOM 1506 CG2 ILE A 171 -26.737 13.107 122.080 1.00 36.88 C ATOM 1507 CD1 ILE A 171 -24.290 11.738 120.732 1.00 40.68 C ATOM 1508 H ILE A 171 -27.558 11.014 118.704 1.00 0.00 H ATOM 1509 N LYS A 172 -29.722 13.074 120.007 1.00 37.70 N ATOM 1510 CA LYS A 172 -30.786 14.019 120.217 1.00 33.15 C ATOM 1511 C LYS A 172 -32.065 13.294 120.385 1.00 33.93 C ATOM 1512 O LYS A 172 -32.938 13.730 121.158 1.00 32.17 O ATOM 1513 CB LYS A 172 -30.887 14.957 119.051 1.00 34.12 C ATOM 1514 CG LYS A 172 -29.662 15.845 118.851 1.00 35.69 C ATOM 1515 CD LYS A 172 -29.742 16.476 117.502 1.00 36.86 C ATOM 1516 CE LYS A 172 -28.687 17.501 117.360 1.00 43.74 C ATOM 1517 NZ LYS A 172 -28.712 18.030 115.975 1.00 42.72 N ATOM 1518 HZ1 LYS A 172 -28.540 17.253 115.305 1.00 0.00 H ATOM 1519 HZ2 LYS A 172 -29.642 18.454 115.784 1.00 0.00 H ATOM 1520 HZ3 LYS A 172 -27.972 18.752 115.868 1.00 0.00 H ATOM 1521 H LYS A 172 -29.263 12.998 119.077 1.00 0.00 H ATOM 1522 N THR A 173 -32.212 12.176 119.655 1.00 34.28 N ATOM 1523 CA THR A 173 -33.448 11.389 119.781 1.00 31.81 C ATOM 1524 C THR A 173 -33.565 10.819 121.180 1.00 31.85 C ATOM 1525 O THR A 173 -34.658 10.877 121.801 1.00 30.08 O ATOM 1526 CB THR A 173 -33.541 10.275 118.735 1.00 33.48 C ATOM 1527 OG1 THR A 173 -33.556 10.880 117.420 1.00 34.88 O ATOM 1528 CG2 THR A 173 -34.824 9.410 118.950 1.00 30.61 C ATOM 1529 HG1 THR A 173 -32.724 11.400 117.288 1.00 0.00 H ATOM 1530 H THR A 173 -31.459 11.870 119.007 1.00 0.00 H ATOM 1531 N ARG A 174 -32.443 10.309 121.697 1.00 31.30 N ATOM 1532 CA ARG A 174 -32.436 9.747 123.047 1.00 34.70 C ATOM 1533 C ARG A 174 -32.825 10.831 124.095 1.00 33.26 C ATOM 1534 O ARG A 174 -33.682 10.630 125.001 1.00 36.97 O ATOM 1535 CB ARG A 174 -31.091 9.143 123.331 1.00 34.45 C ATOM 1536 CG ARG A 174 -30.946 8.614 124.738 1.00 39.82 C ATOM 1537 CD ARG A 174 -31.758 7.355 124.957 1.00 42.76 C ATOM 1538 NE ARG A 174 -31.611 6.903 126.337 1.00 44.48 N ATOM 1539 CZ ARG A 174 -32.598 6.663 127.206 1.00 42.53 C ATOM 1540 NH1 ARG A 174 -33.879 6.733 126.875 1.00 46.56 N ATOM 1541 NH2 ARG A 174 -32.287 6.295 128.430 1.00 43.79 N ATOM 1542 HE ARG A 174 -30.640 6.752 126.679 1.00 0.00 H ATOM 1543 HH12 ARG A 174 -34.611 6.537 127.587 1.00 0.00 H ATOM 1544 HH11 ARG A 174 -34.152 6.984 125.903 1.00 0.00 H ATOM 1545 HH22 ARG A 174 -33.039 6.103 129.122 1.00 0.00 H ATOM 1546 HH21 ARG A 174 -31.289 6.196 128.705 1.00 0.00 H ATOM 1547 H ARG A 174 -31.568 10.312 121.135 1.00 0.00 H ATOM 1548 N LEU A 175 -32.205 11.975 123.943 1.00 32.04 N ATOM 1549 CA LEU A 175 -32.444 13.123 124.836 1.00 31.97 C ATOM 1550 C LEU A 175 -33.856 13.640 124.720 1.00 30.98 C ATOM 1551 O LEU A 175 -34.508 13.867 125.736 1.00 34.71 O ATOM 1552 CB LEU A 175 -31.499 14.245 124.543 1.00 30.83 C ATOM 1553 CG LEU A 175 -30.058 14.026 124.902 1.00 32.76 C ATOM 1554 CD1 LEU A 175 -29.254 15.139 124.276 1.00 34.51 C ATOM 1555 CD2 LEU A 175 -29.886 14.048 126.397 1.00 32.49 C ATOM 1556 H LEU A 175 -31.521 12.077 123.166 1.00 0.00 H ATOM 1557 N PHE A 176 -34.367 13.789 123.514 1.00 29.30 N ATOM 1558 CA PHE A 176 -35.764 14.177 123.411 1.00 29.57 C ATOM 1559 C PHE A 176 -36.704 13.111 124.024 1.00 31.93 C ATOM 1560 O PHE A 176 -37.742 13.435 124.604 1.00 35.47 O ATOM 1561 CB PHE A 176 -36.110 14.474 121.959 1.00 29.20 C ATOM 1562 CG PHE A 176 -37.472 15.080 121.753 1.00 29.40 C ATOM 1563 CD1 PHE A 176 -37.647 16.477 121.787 1.00 33.07 C ATOM 1564 CD2 PHE A 176 -38.564 14.285 121.500 1.00 28.11 C ATOM 1565 CE1 PHE A 176 -38.913 17.057 121.607 1.00 35.70 C ATOM 1566 CE2 PHE A 176 -39.839 14.858 121.298 1.00 34.28 C ATOM 1567 CZ PHE A 176 -40.015 16.249 121.339 1.00 34.17 C ATOM 1568 H PHE A 176 -33.789 13.634 122.663 1.00 0.00 H ATOM 1569 N THR A 177 -36.365 11.836 123.903 1.00 31.51 N ATOM 1570 CA THR A 177 -37.200 10.770 124.466 1.00 32.03 C ATOM 1571 C THR A 177 -37.168 10.764 125.988 1.00 30.69 C ATOM 1572 O THR A 177 -38.177 10.565 126.628 1.00 31.89 O ATOM 1573 CB THR A 177 -36.691 9.407 123.968 1.00 38.64 C ATOM 1574 OG1 THR A 177 -36.590 9.439 122.532 1.00 38.29 O ATOM 1575 CG2 THR A 177 -37.601 8.252 124.455 1.00 36.90 C ATOM 1576 HG1 THR A 177 -35.957 10.151 122.263 1.00 0.00 H ATOM 1577 H THR A 177 -35.490 11.586 123.399 1.00 0.00 H ATOM 1578 N ILE A 178 -36.009 11.006 126.569 1.00 31.88 N ATOM 1579 CA ILE A 178 -35.916 11.256 128.011 1.00 32.10 C ATOM 1580 C ILE A 178 -36.848 12.374 128.429 1.00 33.69 C ATOM 1581 O ILE A 178 -37.669 12.201 129.346 1.00 32.97 O ATOM 1582 CB ILE A 178 -34.462 11.543 128.472 1.00 33.77 C ATOM 1583 CG1 ILE A 178 -33.573 10.273 128.300 1.00 31.84 C ATOM 1584 CG2 ILE A 178 -34.435 12.004 129.933 1.00 34.49 C ATOM 1585 CD1 ILE A 178 -32.057 10.503 128.418 1.00 33.82 C ATOM 1586 H ILE A 178 -35.143 11.020 125.993 1.00 0.00 H ATOM 1587 N ARG A 179 -36.778 13.508 127.739 1.00 33.32 N ATOM 1588 CA ARG A 179 -37.690 14.600 128.066 1.00 33.43 C ATOM 1589 C ARG A 179 -39.154 14.158 128.077 1.00 34.23 C ATOM 1590 O ARG A 179 -39.926 14.483 128.986 1.00 32.48 O ATOM 1591 CB ARG A 179 -37.509 15.753 127.099 1.00 33.50 C ATOM 1592 CG ARG A 179 -38.647 16.763 127.073 1.00 34.78 C ATOM 1593 CD ARG A 179 -38.201 17.987 126.286 1.00 39.91 C ATOM 1594 NE ARG A 179 -39.337 18.748 125.792 1.00 42.58 N ATOM 1595 CZ ARG A 179 -39.301 19.590 124.768 1.00 44.97 C ATOM 1596 NH1 ARG A 179 -38.165 19.831 124.085 1.00 49.37 N ATOM 1597 NH2 ARG A 179 -40.410 20.215 124.420 1.00 49.55 N ATOM 1598 HE ARG A 179 -40.247 18.623 126.279 1.00 0.00 H ATOM 1599 HH12 ARG A 179 -38.170 20.497 123.286 1.00 0.00 H ATOM 1600 HH11 ARG A 179 -37.283 19.351 124.356 1.00 0.00 H ATOM 1601 HH22 ARG A 179 -40.403 20.879 123.620 1.00 0.00 H ATOM 1602 HH21 ARG A 179 -41.291 20.043 124.946 1.00 0.00 H ATOM 1603 H ARG A 179 -36.081 13.616 126.975 1.00 0.00 H ATOM 1604 N GLN A 180 -39.539 13.449 127.032 1.00 33.44 N ATOM 1605 CA GLN A 180 -40.931 13.115 126.844 1.00 33.21 C ATOM 1606 C GLN A 180 -41.356 12.086 127.834 1.00 35.07 C ATOM 1607 O GLN A 180 -42.463 12.139 128.323 1.00 37.60 O ATOM 1608 CB GLN A 180 -41.190 12.661 125.422 1.00 31.07 C ATOM 1609 CG GLN A 180 -40.986 13.810 124.429 1.00 34.39 C ATOM 1610 CD GLN A 180 -41.989 14.940 124.646 1.00 34.70 C ATOM 1611 OE1 GLN A 180 -43.128 14.700 125.041 1.00 38.77 O ATOM 1612 NE2 GLN A 180 -41.584 16.148 124.385 1.00 35.77 N ATOM 1613 HE22 GLN A 180 -40.612 16.310 124.053 1.00 0.00 H ATOM 1614 HE21 GLN A 180 -42.232 16.952 124.509 1.00 0.00 H ATOM 1615 H GLN A 180 -38.834 13.128 126.338 1.00 0.00 H ATOM 1616 N GLU A 181 -40.478 11.156 128.139 1.00 37.09 N ATOM 1617 CA GLU A 181 -40.765 10.196 129.196 1.00 40.35 C ATOM 1618 C GLU A 181 -41.017 10.901 130.517 1.00 36.67 C ATOM 1619 O GLU A 181 -42.016 10.608 131.195 1.00 36.88 O ATOM 1620 CB GLU A 181 -39.628 9.179 129.371 1.00 44.61 C ATOM 1621 CG GLU A 181 -39.883 7.832 128.745 1.00 52.77 C ATOM 1622 CD GLU A 181 -41.163 7.213 129.275 1.00 57.05 C ATOM 1623 OE1 GLU A 181 -41.426 7.300 130.510 1.00 58.64 O ATOM 1624 OE2 GLU A 181 -41.921 6.679 128.439 1.00 63.73 O ATOM 1625 H GLU A 181 -39.576 11.106 127.624 1.00 0.00 H ATOM 1626 N MET A 182 -40.116 11.819 130.864 1.00 37.63 N ATOM 1627 CA MET A 182 -40.253 12.643 132.075 1.00 37.28 C ATOM 1628 C MET A 182 -41.559 13.347 132.029 1.00 40.68 C ATOM 1629 O MET A 182 -42.310 13.305 133.012 1.00 40.69 O ATOM 1630 CB MET A 182 -39.122 13.642 132.224 1.00 38.09 C ATOM 1631 CG MET A 182 -37.795 12.976 132.585 1.00 41.96 C ATOM 1632 SD MET A 182 -36.583 14.208 133.059 1.00 44.04 S ATOM 1633 CE MET A 182 -35.058 13.313 133.270 1.00 45.24 C ATOM 1634 H MET A 182 -39.284 11.958 130.256 1.00 0.00 H ATOM 1635 N ALA A 183 -41.883 13.934 130.872 1.00 38.65 N ATOM 1636 CA ALA A 183 -43.174 14.614 130.742 1.00 40.86 C ATOM 1637 C ALA A 183 -44.400 13.641 130.868 1.00 42.39 C ATOM 1638 O ALA A 183 -45.416 14.006 131.461 1.00 44.60 O ATOM 1639 CB ALA A 183 -43.229 15.448 129.459 1.00 37.69 C ATOM 1640 H ALA A 183 -41.222 13.908 130.069 1.00 0.00 H ATOM 1641 N SER A 184 -44.310 12.421 130.344 1.00 42.54 N ATOM 1642 CA SER A 184 -45.362 11.423 130.564 1.00 44.33 C ATOM 1643 C SER A 184 -45.611 11.213 132.048 1.00 46.92 C ATOM 1644 O SER A 184 -46.752 10.983 132.462 1.00 47.73 O ATOM 1645 CB SER A 184 -44.979 10.070 129.996 1.00 46.18 C ATOM 1646 OG SER A 184 -44.834 10.116 128.595 1.00 55.97 O ATOM 1647 HG SER A 184 -44.126 10.766 128.359 1.00 0.00 H ATOM 1648 H SER A 184 -43.480 12.171 129.769 1.00 0.00 H ATOM 1649 N ARG A 185 -44.536 11.272 132.842 1.00 46.84 N ATOM 1650 CA ARG A 185 -44.610 11.065 134.288 1.00 46.15 C ATOM 1651 C ARG A 185 -44.682 12.370 135.110 1.00 44.15 C ATOM 1652 O ARG A 185 -44.374 12.368 136.288 1.00 46.20 O ATOM 1653 CB ARG A 185 -43.399 10.237 134.718 1.00 46.27 C ATOM 1654 CG ARG A 185 -43.321 8.865 134.054 1.00 44.43 C ATOM 1655 CD ARG A 185 -41.953 8.278 134.315 1.00 49.42 C ATOM 1656 NE ARG A 185 -41.640 7.104 133.485 1.00 58.81 N ATOM 1657 CZ ARG A 185 -41.252 5.901 133.932 1.00 64.76 C ATOM 1658 NH1 ARG A 185 -41.105 5.640 135.229 1.00 74.92 N ATOM 1659 NH2 ARG A 185 -40.984 4.935 133.067 1.00 64.81 N ATOM 1660 HE ARG A 185 -41.728 7.218 132.455 1.00 0.00 H ATOM 1661 HH12 ARG A 185 -40.802 4.694 135.538 1.00 0.00 H ATOM 1662 HH11 ARG A 185 -41.293 6.382 135.933 1.00 0.00 H ATOM 1663 HH22 ARG A 185 -40.683 4.000 133.409 1.00 0.00 H ATOM 1664 HH21 ARG A 185 -41.075 5.111 132.046 1.00 0.00 H ATOM 1665 H ARG A 185 -43.610 11.473 132.414 1.00 0.00 H ATOM 1666 N SER A 186 -45.056 13.483 134.481 1.00 45.00 N ATOM 1667 CA SER A 186 -45.087 14.807 135.126 1.00 42.04 C ATOM 1668 C SER A 186 -43.850 15.114 135.925 1.00 42.53 C ATOM 1669 O SER A 186 -43.946 15.651 137.009 1.00 49.50 O ATOM 1670 CB SER A 186 -46.322 14.900 136.016 1.00 48.05 C ATOM 1671 OG SER A 186 -47.475 15.146 135.222 1.00 53.90 O ATOM 1672 HG SER A 186 -48.271 15.205 135.808 1.00 0.00 H ATOM 1673 H SER A 186 -45.341 13.414 133.483 1.00 0.00 H ATOM 1674 N LEU A 187 -42.674 14.752 135.412 1.00 43.66 N ATOM 1675 CA LEU A 187 -41.393 15.115 136.047 1.00 40.76 C ATOM 1676 C LEU A 187 -40.602 16.170 135.325 1.00 37.68 C ATOM 1677 O LEU A 187 -39.580 16.634 135.836 1.00 38.33 O ATOM 1678 CB LEU A 187 -40.519 13.897 136.157 1.00 43.93 C ATOM 1679 CG LEU A 187 -41.142 12.643 136.732 1.00 47.77 C ATOM 1680 CD1 LEU A 187 -40.116 11.526 136.600 1.00 49.95 C ATOM 1681 CD2 LEU A 187 -41.526 12.855 138.181 1.00 48.19 C ATOM 1682 H LEU A 187 -42.659 14.195 134.534 1.00 0.00 H ATOM 1683 N TRP A 188 -41.063 16.539 134.123 1.00 40.59 N ATOM 1684 CA TRP A 188 -40.271 17.363 133.225 1.00 40.05 C ATOM 1685 C TRP A 188 -40.160 18.815 133.708 1.00 37.43 C ATOM 1686 O TRP A 188 -39.085 19.420 133.594 1.00 38.45 O ATOM 1687 CB TRP A 188 -40.790 17.289 131.762 1.00 40.36 C ATOM 1688 CG TRP A 188 -40.083 18.271 130.913 1.00 37.34 C ATOM 1689 CD1 TRP A 188 -40.597 19.454 130.440 1.00 38.04 C ATOM 1690 CD2 TRP A 188 -38.679 18.277 130.576 1.00 37.17 C ATOM 1691 NE1 TRP A 188 -39.604 20.166 129.772 1.00 40.66 N ATOM 1692 CE2 TRP A 188 -38.431 19.454 129.828 1.00 39.39 C ATOM 1693 CE3 TRP A 188 -37.626 17.385 130.783 1.00 38.38 C ATOM 1694 CZ2 TRP A 188 -37.190 19.748 129.297 1.00 36.58 C ATOM 1695 CZ3 TRP A 188 -36.408 17.661 130.223 1.00 36.64 C ATOM 1696 CH2 TRP A 188 -36.192 18.849 129.500 1.00 39.15 C ATOM 1697 HE1 TRP A 188 -39.730 21.087 129.306 1.00 0.00 H ATOM 1698 H TRP A 188 -42.010 16.229 133.825 1.00 0.00 H ATOM 1699 N ASP A 189 -41.258 19.356 134.225 1.00 41.20 N ATOM 1700 CA ASP A 189 -41.326 20.759 134.706 1.00 45.37 C ATOM 1701 C ASP A 189 -40.354 21.017 135.842 1.00 43.99 C ATOM 1702 O ASP A 189 -39.570 21.961 135.789 1.00 47.18 O ATOM 1703 CB ASP A 189 -42.764 21.128 135.119 1.00 49.30 C ATOM 1704 CG ASP A 189 -43.672 21.375 133.923 1.00 52.97 C ATOM 1705 OD1 ASP A 189 -43.179 21.570 132.788 1.00 58.77 O ATOM 1706 OD2 ASP A 189 -44.901 21.377 134.112 1.00 70.81 O ATOM 1707 H ASP A 189 -42.112 18.767 134.296 1.00 0.00 H ATOM 1708 N SER A 190 -40.390 20.120 136.822 1.00 41.20 N ATOM 1709 CA SER A 190 -39.394 20.035 137.866 1.00 39.38 C ATOM 1710 C SER A 190 -38.015 19.864 137.281 1.00 37.62 C ATOM 1711 O SER A 190 -37.117 20.598 137.602 1.00 34.55 O ATOM 1712 CB SER A 190 -39.712 18.834 138.798 1.00 43.41 C ATOM 1713 OG SER A 190 -38.703 18.626 139.783 1.00 42.37 O ATOM 1714 HG SER A 190 -38.951 17.853 140.350 1.00 0.00 H ATOM 1715 H SER A 190 -41.178 19.442 136.839 1.00 0.00 H ATOM 1716 N PHE A 191 -37.832 18.874 136.414 1.00 39.14 N ATOM 1717 CA PHE A 191 -36.478 18.622 135.914 1.00 37.26 C ATOM 1718 C PHE A 191 -35.899 19.846 135.161 1.00 35.40 C ATOM 1719 O PHE A 191 -34.749 20.226 135.344 1.00 39.04 O ATOM 1720 CB PHE A 191 -36.462 17.360 135.051 1.00 35.17 C ATOM 1721 CG PHE A 191 -35.086 16.988 134.575 1.00 35.50 C ATOM 1722 CD1 PHE A 191 -34.100 16.594 135.481 1.00 33.19 C ATOM 1723 CD2 PHE A 191 -34.757 17.076 133.248 1.00 36.72 C ATOM 1724 CE1 PHE A 191 -32.843 16.248 135.066 1.00 33.91 C ATOM 1725 CE2 PHE A 191 -33.472 16.756 132.822 1.00 37.36 C ATOM 1726 CZ PHE A 191 -32.514 16.345 133.731 1.00 37.35 C ATOM 1727 H PHE A 191 -38.632 18.291 136.097 1.00 0.00 H ATOM 1728 N ARG A 192 -36.730 20.484 134.373 1.00 35.54 N ATOM 1729 CA ARG A 192 -36.352 21.639 133.569 1.00 41.52 C ATOM 1730 C ARG A 192 -35.908 22.820 134.420 1.00 39.91 C ATOM 1731 O ARG A 192 -34.969 23.510 134.099 1.00 42.93 O ATOM 1732 CB ARG A 192 -37.572 22.071 132.719 1.00 46.28 C ATOM 1733 CG ARG A 192 -37.212 22.827 131.459 1.00 56.06 C ATOM 1734 CD ARG A 192 -37.896 24.186 131.366 1.00 62.15 C ATOM 1735 NE ARG A 192 -39.235 24.203 131.992 1.00 66.62 N ATOM 1736 CZ ARG A 192 -39.806 25.282 132.549 1.00 59.33 C ATOM 1737 NH1 ARG A 192 -41.017 25.180 133.098 1.00 54.48 N ATOM 1738 NH2 ARG A 192 -39.172 26.459 132.576 1.00 64.59 N ATOM 1739 HE ARG A 192 -39.774 23.314 132.001 1.00 0.00 H ATOM 1740 HH12 ARG A 192 -41.464 26.014 133.531 1.00 0.00 H ATOM 1741 HH11 ARG A 192 -41.515 24.267 133.093 1.00 0.00 H ATOM 1742 HH22 ARG A 192 -39.629 27.286 133.012 1.00 0.00 H ATOM 1743 HH21 ARG A 192 -38.222 26.548 132.161 1.00 0.00 H ATOM 1744 H ARG A 192 -37.713 20.147 134.319 1.00 0.00 H ATOM 1745 N GLN A 193 -36.594 23.074 135.520 1.00 40.38 N ATOM 1746 CA GLN A 193 -36.258 24.264 136.314 1.00 37.30 C ATOM 1747 C GLN A 193 -35.119 24.035 137.310 1.00 42.21 C ATOM 1748 O GLN A 193 -34.729 24.966 137.991 1.00 44.69 O ATOM 1749 CB GLN A 193 -37.493 24.757 137.025 1.00 36.08 C ATOM 1750 CG GLN A 193 -38.583 25.173 136.063 1.00 38.75 C ATOM 1751 CD GLN A 193 -39.826 25.580 136.794 1.00 41.89 C ATOM 1752 OE1 GLN A 193 -39.847 26.588 137.464 1.00 41.36 O ATOM 1753 NE2 GLN A 193 -40.863 24.786 136.675 1.00 44.06 N ATOM 1754 HE22 GLN A 193 -40.798 23.930 136.088 1.00 0.00 H ATOM 1755 HE21 GLN A 193 -41.750 25.012 137.168 1.00 0.00 H ATOM 1756 H GLN A 193 -37.362 22.440 135.820 1.00 0.00 H ATOM 1757 N SER A 194 -34.570 22.821 137.411 1.00 39.56 N ATOM 1758 CA SER A 194 -33.491 22.589 138.376 1.00 43.23 C ATOM 1759 C SER A 194 -32.062 22.607 137.815 1.00 42.00 C ATOM 1760 O SER A 194 -31.167 22.147 138.485 1.00 49.09 O ATOM 1761 CB SER A 194 -33.774 21.270 139.109 1.00 43.09 C ATOM 1762 OG SER A 194 -33.728 20.252 138.177 1.00 47.26 O ATOM 1763 HG SER A 194 -34.413 20.413 137.480 1.00 0.00 H ATOM 1764 H SER A 194 -34.907 22.044 136.807 1.00 0.00 H ATOM 1765 N GLU A 195 -31.820 23.162 136.626 1.00 44.49 N ATOM 1766 CA GLU A 195 -30.461 23.129 136.046 1.00 49.01 C ATOM 1767 C GLU A 195 -29.534 24.131 136.783 1.00 58.40 C ATOM 1768 O GLU A 195 -29.843 25.338 136.885 1.00 58.44 O ATOM 1769 CB GLU A 195 -30.465 23.370 134.508 1.00 45.53 C ATOM 1770 CG GLU A 195 -29.052 23.460 133.907 1.00 48.79 C ATOM 1771 CD GLU A 195 -28.947 23.149 132.408 1.00 50.87 C ATOM 1772 OE1 GLU A 195 -29.430 22.079 131.970 1.00 53.88 O ATOM 1773 OE2 GLU A 195 -28.357 23.963 131.664 1.00 42.50 O ATOM 1774 H GLU A 195 -32.593 23.621 136.104 1.00 0.00 H TER 1775 GLU A 195 HETATM 1776 MN MN A 1 -17.334 15.391 132.757 1.00 41.14 MN HETATM 1777 MN MN A 2 -19.690 17.188 130.496 1.00 35.22 MN HETATM 1778 O HOH 3 -28.185 19.902 136.088 1.00 53.69 O HETATM 1779 O HOH 4 -15.898 17.072 132.118 1.00 28.72 O HETATM 1780 O HOH 5 -23.441 18.841 131.021 1.00 33.28 O HETATM 1781 O HOH 6 -15.349 14.043 133.184 1.00 37.57 O HETATM 1782 O HOH 7 -17.420 19.832 133.405 1.00 61.18 O HETATM 1783 O HOH 8 -21.101 16.197 138.242 1.00 53.99 O HETATM 1784 O HOH 9 -22.166 22.213 134.644 1.00 55.18 O HETATM 1785 O HOH 10 -30.913 18.437 137.600 1.00 59.36 O HETATM 1786 O HOH 11 -22.588 12.416 134.347 1.00 44.11 O HETATM 1787 O HOH 12 -29.252 18.514 131.805 1.00 53.04 O HETATM 1788 O HOH 13 -20.798 13.734 135.940 1.00 66.16 O HETATM 1789 O HOH 14 -16.807 12.904 137.692 1.00 60.73 O HETATM 1790 O HOH 15 -20.823 10.598 136.027 1.00 66.27 O HETATM 1791 O HOH 16 -26.547 20.452 133.304 1.00 57.66 O HETATM 1792 O HOH 17 -15.246 13.382 135.628 1.00 36.42 O HETATM 1793 O HOH 18 -19.997 20.657 135.481 1.00 49.86 O HETATM 1794 OAV HWJ A 19 -17.351 16.053 134.611 1.00 -0.55 O HETATM 1795 CAU HWJ A 19 -18.407 16.350 135.241 1.00 0.12 C HETATM 1796 OAW HWJ A 19 -18.394 16.399 136.460 1.00 -0.55 O HETATM 1797 CAR HWJ A 19 -19.564 16.847 134.679 1.00 0.13 C HETATM 1798 NAQ HWJ A 19 -20.571 17.069 135.616 1.00 -0.26 N HETATM 1799 CAM HWJ A 19 -21.772 17.608 135.197 1.00 0.05 C HETATM 1800 CAN HWJ A 19 -21.953 17.959 133.860 1.00 0.01 C HETATM 1801 CAO HWJ A 19 -20.963 17.745 132.902 1.00 0.15 C HETATM 1802 CAS HWJ A 19 -19.772 17.178 133.340 1.00 0.20 C HETATM 1803 OAT HWJ A 19 -18.815 16.966 132.439 1.00 -0.35 O HETATM 1804 H2 HWJ A 19 -19.119 17.245 131.584 1.00 0.22 H HETATM 1805 H1 HWJ A 19 -20.179 16.172 133.160 1.00 0.11 H HETATM 1806 OAP HWJ A 19 -21.184 18.054 131.714 1.00 -0.40 O HETATM 1807 H3 HWJ A 19 -22.895 18.413 133.555 1.00 0.06 H HETATM 1808 CAL HWJ A 19 -22.826 17.856 136.069 1.00 0.01 C HETATM 1809 CAH HWJ A 19 -24.078 17.201 135.901 1.00 -0.03 C HETATM 1810 CAI HWJ A 19 -24.358 16.243 134.889 1.00 -0.03 C HETATM 1811 H4 HWJ A 19 -25.398 15.898 134.988 1.00 0.04 H HETATM 1812 H5 HWJ A 19 -23.676 15.387 134.996 1.00 0.04 H HETATM 1813 H6 HWJ A 19 -24.217 16.703 133.900 1.00 0.04 H HETATM 1814 CAG HWJ A 19 -25.119 17.516 136.749 1.00 -0.04 C HETATM 1815 CAF HWJ A 19 -24.933 18.442 137.772 1.00 0.04 C HETATM 1816 CAJ HWJ A 19 -23.693 19.096 137.940 1.00 -0.05 C HETATM 1817 CAK HWJ A 19 -22.636 18.802 137.080 1.00 -0.05 C HETATM 1818 H8 HWJ A 19 -21.680 19.300 137.194 1.00 0.06 H HETATM 1819 H9 HWJ A 19 -23.564 19.823 138.734 1.00 0.06 H HETATM 1820 CAE HWJ A 19 -25.976 18.713 138.535 1.00 0.19 C HETATM 1821 NAD HWJ A 19 -27.244 18.465 138.158 1.00 -0.21 N HETATM 1822 NAA HWJ A 19 -27.952 18.877 139.045 1.00 -0.14 N HETATM 1823 NAB HWJ A 19 -27.171 19.403 140.019 1.00 -0.06 N HETATM 1824 NAC HWJ A 19 -25.949 19.321 139.720 1.00 -0.15 N HETATM 1825 H10 HWJ A 19 -25.132 19.644 140.258 1.00 0.27 H HETATM 1826 H7 HWJ A 19 -26.085 17.041 136.619 1.00 0.06 H CONECT 1 2 9 10 11 CONECT 9 1 CONECT 10 1 CONECT 11 1 CONECT 412 410 411 1777 CONECT 518 519 528 529 530 CONECT 528 518 CONECT 529 518 CONECT 530 518 CONECT 596 594 1776 CONECT 865 864 1776 CONECT 866 864 1777 CONECT 994 992 1777 CONECT 999 998 1777 CONECT 1199 1200 1208 1209 1210 CONECT 1208 1199 CONECT 1209 1199 CONECT 1210 1199 CONECT 1776 596 865 CONECT 1777 412 866 994 999 CONECT 1794 1795 CONECT 1795 1794 1796 1797 CONECT 1796 1795 CONECT 1797 1795 1798 1802 CONECT 1798 1797 1799 CONECT 1799 1798 1800 1808 CONECT 1800 1799 1801 1807 CONECT 1801 1800 1802 1806 CONECT 1802 1797 1801 1803 1805 CONECT 1803 1802 1804 CONECT 1804 1803 CONECT 1805 1802 CONECT 1806 1801 CONECT 1807 1800 CONECT 1808 1799 1809 1817 CONECT 1809 1808 1810 1814 CONECT 1810 1809 1811 1812 1813 CONECT 1811 1810 CONECT 1812 1810 CONECT 1813 1810 CONECT 1814 1809 1815 1826 CONECT 1815 1814 1816 1820 CONECT 1816 1815 1817 1819 CONECT 1817 1808 1816 1818 CONECT 1818 1817 CONECT 1819 1816 CONECT 1820 1815 1821 1824 CONECT 1821 1820 1822 CONECT 1822 1821 1823 CONECT 1823 1822 1824 CONECT 1824 1820 1823 1825 CONECT 1825 1824 CONECT 1826 1814 MASTER 0 0 0 0 0 0 0 0 1823 3 53 15 END
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Structure:
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Protein
Pocket-Ligand
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Related entries of code: 6e6w
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
4avg
RCSB PDB
PDBbind
204aa, >4AVG_1|Chains... at 97%
4awf
RCSB PDB
PDBbind
204aa, >4AWF_1|Chains... at 97%
4awg
RCSB PDB
PDBbind
204aa, >4AWG_1|Chains... at 97%
4awm
RCSB PDB
PDBbind
192aa, >4AWM_1|Chain... at 96%
4e5f
RCSB PDB
PDBbind
187aa, >4E5F_1|Chains... at 91%
4e5g
RCSB PDB
PDBbind
187aa, >4E5G_1|Chains... at 91%
4e5h
RCSB PDB
PDBbind
187aa, >4E5H_1|Chains... at 91%
4e5i
RCSB PDB
PDBbind
187aa, >4E5I_1|Chains... at 91%
4e5j
RCSB PDB
PDBbind
187aa, >4E5J_1|Chains... at 91%
4kil
RCSB PDB
PDBbind
213aa, >4KIL_1|Chain... at 98%
4ln7
RCSB PDB
PDBbind
209aa, >4LN7_1|Chain... at 100%
4m4q
RCSB PDB
PDBbind
241aa, >4M4Q_1|Chain... *
4m5o
RCSB PDB
PDBbind
241aa, >4M5O_1|Chain... at 100%
4m5r
RCSB PDB
PDBbind
241aa, >4M5R_1|Chain... at 100%
4m5u
RCSB PDB
PDBbind
241aa, >4M5U_1|Chain... at 100%
4mk1
RCSB PDB
PDBbind
241aa, >4MK1_1|Chain... at 100%
4mk2
RCSB PDB
PDBbind
241aa, >4MK2_1|Chain... at 100%
4mk5
RCSB PDB
PDBbind
241aa, >4MK5_1|Chain... at 100%
4w9s
RCSB PDB
PDBbind
241aa, >4W9S_1|Chain... at 100%
5cgv
RCSB PDB
PDBbind
187aa, >5CGV_1|Chain... at 94%
5ega
RCSB PDB
PDBbind
187aa, >5EGA_1|Chain... at 94%
5w44
RCSB PDB
PDBbind
178aa, >5W44_1|Chain... at 98%
5w73
RCSB PDB
PDBbind
197aa, >5W73_1|Chain... at 93%
5w7u
RCSB PDB
PDBbind
197aa, >5W7U_1|Chain... at 93%
5w92
RCSB PDB
PDBbind
197aa, >5W92_1|Chain... at 93%
5w9g
RCSB PDB
PDBbind
197aa, >5W9G_1|Chain... at 93%
5wa7
RCSB PDB
PDBbind
197aa, >5WA7_1|Chain... at 93%
5wap
RCSB PDB
PDBbind
197aa, >5WAP_1|Chain... at 93%
5wb3
RCSB PDB
PDBbind
197aa, >5WB3_1|Chain... at 93%
5wdc
RCSB PDB
PDBbind
197aa, >5WDC_1|Chain... at 93%
5wdw
RCSB PDB
PDBbind
197aa, >5WDW_1|Chain... at 93%
5we9
RCSB PDB
PDBbind
187aa, >5WE9_1|Chain... at 94%
5web
RCSB PDB
PDBbind
197aa, >5WEB_1|Chain... at 93%
5wef
RCSB PDB
PDBbind
187aa, >5WEF_1|Chain... at 93%
5wei
RCSB PDB
PDBbind
197aa, >5WEI_1|Chain... at 92%
5wf3
RCSB PDB
PDBbind
197aa, >5WF3_1|Chain... at 92%
5wfm
RCSB PDB
PDBbind
197aa, >5WFM_1|Chain... at 92%
5wfw
RCSB PDB
PDBbind
197aa, >5WFW_1|Chain... at 92%
5wfz
RCSB PDB
PDBbind
197aa, >5WFZ_1|Chain... at 92%
5wg9
RCSB PDB
PDBbind
197aa, >5WG9_1|Chain... at 92%
6dcy
RCSB PDB
PDBbind
192aa, >6DCY_1|Chain... at 96%
6dcz
RCSB PDB
PDBbind
192aa, >6DCZ_1|Chain... at 96%
6dzq
RCSB PDB
PDBbind
192aa, >6DZQ_1|Chain... at 96%
6e0q
RCSB PDB
PDBbind
192aa, >6E0Q_1|Chain... at 96%
6nem
RCSB PDB
PDBbind
241aa, >6NEM_1|Chain... at 100%
6nel
RCSB PDB
PDBbind
241aa, >6NEL_1|Chain... at 100%
6e6v
RCSB PDB
PDBbind
192aa, >6E6V_1|Chain... at 96%
6e4c
RCSB PDB
PDBbind
192aa, >6E4C_1|Chain... at 96%
6e3p
RCSB PDB
PDBbind
192aa, >6E3P_1|Chain... at 96%
6e3n
RCSB PDB
PDBbind
192aa, >6E3N_1|Chain... at 96%
6e3o
RCSB PDB
PDBbind
192aa, >6E3O_1|Chain... at 96%
6e3m
RCSB PDB
PDBbind
192aa, >6E3M_1|Chain... at 96%
5wa6
RCSB PDB
PDBbind
197aa, >5WA6_1|Chain... at 93%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
6e6w
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Polymerase acidic protein
Ligand Name
HWJ
EC.Number
E.C.-.-.-.-
Resolution
2.35(Å)
Affinity (Kd/Ki/IC50)
IC50=110pM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) J.Med.Chem. Vol. 62: pp. 9438-9449
Ligand Properties
Formula
C
1
4
H
1
1
N
5
O
4
Molecular Weight
313.268
Exact Mass
313.081
No. of atoms
34
No. of bonds
36
Polar Surface Area
141.42
LOGP Value
1.83 (
Computed with XLOGP3
)
-0.58 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 7
No. of Rotatable Bonds: 3
No. of Nitrogen and Oxygen Atoms: 9
No. of Rings: 3
Canonical SMILES
O=C1C=C(N=C([C@@H]1O)C(=O)O)c1ccc(cc1C)c1nnn[nH]1
InChI String
InChI=1S/C14H11N5O4/c1-6-4-7(13-16-18-19-17-13)2-3-8(6)9-5-10(20)12(21)11(15-9)14(22)23/h2-5,12,21H,1H3,(H,22,23)(H,16,17,18,19)/t12-/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
C3W5S0
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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