Browse entries in the PDBbind-CN Database
HEADER 6E3P_COMPLEX COMPND 6E3P_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 53 ALA MET GLU ASP PHE VAL ARG GLN CYS PHE ASN PRO MET SEQRES 2 A 53 ILE VAL GLU LEU ALA GLU LYS ALA MET LYS GLU TYR GLY SEQRES 3 A 53 GLU ASP PRO LYS ILE GLU THR ASN LYS PHE ALA ALA ILE SEQRES 4 A 53 CYS THR HIS LEU GLU VAL CYS PHE MET TYR SER ASP PHE SEQRES 5 A 53 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 56 GLU LYS THR HIS ILE HIS ILE PHE SER PHE THR GLY GLU SEQRES 2 A 56 GLU MET ALA THR LYS ALA ASP TYR THR LEU ASP GLU GLU SEQRES 3 A 56 SER ARG ALA ARG ILE LYS THR ARG LEU PHE THR ILE ARG SEQRES 4 A 56 GLN GLU MET ALA SER ARG SER LEU TRP ASP SER PHE ARG SEQRES 5 A 56 GLN SER GLU ARG HET MN A 1 1 HET MN A 2 1 HET HO A 1 30 ATOM 1 N ALA A 0 -40.819 8.795 143.116 1.00 43.01 N ATOM 2 CA ALA A 0 -41.327 8.867 141.700 1.00 42.99 C ATOM 3 C ALA A 0 -40.151 9.188 140.777 1.00 44.14 C ATOM 4 O ALA A 0 -39.933 8.495 139.779 1.00 46.80 O ATOM 5 CB ALA A 0 -42.427 9.896 141.548 1.00 40.51 C ATOM 6 HN3 ALA A 0 -40.400 9.710 143.380 1.00 0.00 H ATOM 7 HN2 ALA A 0 -40.098 8.049 143.187 1.00 0.00 H ATOM 8 HN1 ALA A 0 -41.609 8.577 143.756 1.00 0.00 H ATOM 9 N MET A 1 -39.406 10.245 141.121 1.00 40.95 N ATOM 10 CA MET A 1 -38.214 10.590 140.381 1.00 40.03 C ATOM 11 C MET A 1 -37.180 9.459 140.527 1.00 40.14 C ATOM 12 O MET A 1 -36.570 9.058 139.548 1.00 42.16 O ATOM 13 CB MET A 1 -37.629 11.928 140.837 1.00 38.63 C ATOM 14 CG MET A 1 -36.369 12.340 140.068 1.00 39.18 C ATOM 15 SD MET A 1 -36.485 12.108 138.258 1.00 36.27 S ATOM 16 CE MET A 1 -37.470 13.531 137.800 1.00 36.10 C ATOM 17 H MET A 1 -39.690 10.828 141.934 1.00 0.00 H ATOM 18 N GLU A 2 -37.028 8.920 141.738 1.00 40.16 N ATOM 19 CA GLU A 2 -36.139 7.787 141.989 1.00 41.17 C ATOM 20 C GLU A 2 -36.634 6.536 141.242 1.00 41.34 C ATOM 21 O GLU A 2 -35.854 5.847 140.562 1.00 35.84 O ATOM 22 CB GLU A 2 -36.063 7.499 143.487 1.00 43.21 C ATOM 23 CG GLU A 2 -35.042 6.430 143.821 1.00 48.61 C ATOM 24 CD GLU A 2 -35.068 5.912 145.248 1.00 51.54 C ATOM 25 OE1 GLU A 2 -35.905 6.403 146.037 1.00 50.98 O ATOM 26 OE2 GLU A 2 -34.246 5.020 145.562 1.00 53.76 O ATOM 27 H GLU A 2 -37.563 9.322 142.534 1.00 0.00 H ATOM 28 N ASP A 3 -37.930 6.225 141.393 1.00 42.88 N ATOM 29 CA ASP A 3 -38.524 5.067 140.725 1.00 40.44 C ATOM 30 C ASP A 3 -38.161 5.162 139.245 1.00 38.11 C ATOM 31 O ASP A 3 -37.579 4.246 138.711 1.00 39.98 O ATOM 32 CB ASP A 3 -40.037 4.985 140.936 1.00 41.44 C ATOM 33 CG ASP A 3 -40.471 4.652 142.358 1.00 44.09 C ATOM 34 OD1 ASP A 3 -39.676 4.026 143.102 1.00 43.11 O ATOM 35 OD2 ASP A 3 -41.622 5.002 142.707 1.00 44.52 O ATOM 36 H ASP A 3 -38.527 6.822 142.000 1.00 0.00 H ATOM 37 N PHE A 4 -38.446 6.325 138.644 1.00 36.96 N ATOM 38 CA PHE A 4 -38.182 6.622 137.238 1.00 35.04 C ATOM 39 C PHE A 4 -36.710 6.355 136.877 1.00 33.97 C ATOM 40 O PHE A 4 -36.448 5.703 135.860 1.00 33.54 O ATOM 41 CB PHE A 4 -38.569 8.065 136.898 1.00 34.95 C ATOM 42 CG PHE A 4 -37.985 8.542 135.594 1.00 35.40 C ATOM 43 CD1 PHE A 4 -38.459 8.054 134.388 1.00 36.11 C ATOM 44 CD2 PHE A 4 -36.916 9.421 135.567 1.00 35.49 C ATOM 45 CE1 PHE A 4 -37.896 8.447 133.182 1.00 34.40 C ATOM 46 CE2 PHE A 4 -36.364 9.822 134.362 1.00 35.45 C ATOM 47 CZ PHE A 4 -36.857 9.337 133.171 1.00 34.81 C ATOM 48 H PHE A 4 -38.887 7.070 139.220 1.00 0.00 H ATOM 49 N VAL A 5 -35.766 6.852 137.691 1.00 30.78 N ATOM 50 CA VAL A 5 -34.342 6.665 137.446 1.00 30.52 C ATOM 51 C VAL A 5 -34.034 5.164 137.417 1.00 34.47 C ATOM 52 O VAL A 5 -33.421 4.652 136.473 1.00 35.65 O ATOM 53 CB VAL A 5 -33.463 7.379 138.488 1.00 30.73 C ATOM 54 CG1 VAL A 5 -32.012 6.976 138.346 1.00 32.38 C ATOM 55 CG2 VAL A 5 -33.573 8.894 138.418 1.00 31.30 C ATOM 56 H VAL A 5 -36.062 7.392 138.529 1.00 0.00 H ATOM 57 N ARG A 6 -34.457 4.441 138.454 1.00 39.64 N ATOM 58 CA ARG A 6 -34.076 3.030 138.570 1.00 43.40 C ATOM 59 C ARG A 6 -34.712 2.257 137.407 1.00 44.02 C ATOM 60 O ARG A 6 -34.056 1.452 136.759 1.00 48.01 O ATOM 61 CB ARG A 6 -34.452 2.461 139.943 1.00 46.80 C ATOM 62 CG ARG A 6 -34.242 3.435 141.096 1.00 50.20 C ATOM 63 CD ARG A 6 -33.953 2.759 142.421 1.00 51.99 C ATOM 64 NE ARG A 6 -32.522 2.544 142.592 1.00 52.19 N ATOM 65 CZ ARG A 6 -31.746 3.273 143.387 1.00 50.16 C ATOM 66 NH1 ARG A 6 -32.285 4.182 144.186 1.00 43.61 N ATOM 67 NH2 ARG A 6 -30.436 3.088 143.372 1.00 45.82 N ATOM 68 HE ARG A 6 -32.079 1.770 142.057 1.00 0.00 H ATOM 69 HH12 ARG A 6 -31.678 4.753 144.808 1.00 0.00 H ATOM 70 HH11 ARG A 6 -33.315 4.325 144.191 1.00 0.00 H ATOM 71 HH22 ARG A 6 -29.824 3.656 143.992 1.00 0.00 H ATOM 72 HH21 ARG A 6 -30.019 2.375 142.740 1.00 0.00 H ATOM 73 H ARG A 6 -35.058 4.878 139.182 1.00 0.00 H ATOM 74 N GLN A 7 -35.977 2.564 137.117 1.00 44.38 N ATOM 75 CA GLN A 7 -36.754 1.869 136.098 1.00 46.20 C ATOM 76 C GLN A 7 -36.223 2.171 134.687 1.00 48.11 C ATOM 77 O GLN A 7 -36.235 1.286 133.841 1.00 58.90 O ATOM 78 CB GLN A 7 -38.241 2.206 136.262 1.00 46.82 C ATOM 79 CG GLN A 7 -38.842 1.610 137.536 1.00 48.15 C ATOM 80 CD GLN A 7 -40.250 2.051 137.871 1.00 51.56 C ATOM 81 OE1 GLN A 7 -40.702 1.906 139.010 1.00 50.70 O ATOM 82 NE2 GLN A 7 -40.960 2.591 136.887 1.00 51.04 N ATOM 83 HE22 GLN A 7 -40.542 2.695 135.941 1.00 0.00 H ATOM 84 HE21 GLN A 7 -41.934 2.909 137.063 1.00 0.00 H ATOM 85 H GLN A 7 -36.431 3.337 137.644 1.00 0.00 H ATOM 86 N CYS A 8 -35.733 3.389 134.431 1.00 45.76 N ATOM 87 CA CYS A 8 -35.556 3.853 133.043 1.00 46.02 C ATOM 88 C CYS A 8 -34.081 4.064 132.648 1.00 44.99 C ATOM 89 O CYS A 8 -33.828 4.617 131.577 1.00 43.30 O ATOM 90 CB CYS A 8 -36.352 5.137 132.816 1.00 48.17 C ATOM 91 SG CYS A 8 -36.813 5.417 131.087 1.00 44.49 S ATOM 92 H CYS A 8 -35.474 4.015 135.220 1.00 0.00 H ATOM 93 N PHE A 9 -33.123 3.622 133.478 1.00 42.30 N ATOM 94 CA PHE A 9 -31.676 3.712 133.156 1.00 40.53 C ATOM 95 C PHE A 9 -30.972 2.371 133.439 1.00 39.94 C ATOM 96 O PHE A 9 -31.261 1.673 134.402 1.00 43.88 O ATOM 97 CB PHE A 9 -30.997 4.834 133.950 1.00 39.32 C ATOM 98 CG PHE A 9 -31.120 6.231 133.393 1.00 36.34 C ATOM 99 CD1 PHE A 9 -32.143 7.075 133.791 1.00 36.06 C ATOM 100 CD2 PHE A 9 -30.184 6.719 132.502 1.00 35.70 C ATOM 101 CE1 PHE A 9 -32.240 8.364 133.286 1.00 36.54 C ATOM 102 CE2 PHE A 9 -30.288 8.002 131.991 1.00 35.33 C ATOM 103 CZ PHE A 9 -31.311 8.826 132.388 1.00 34.97 C ATOM 104 H PHE A 9 -33.406 3.199 134.385 1.00 0.00 H ATOM 105 N ASN A 10 -30.018 2.025 132.583 1.00 40.36 N ATOM 106 CA ASN A 10 -29.186 0.852 132.738 1.00 44.73 C ATOM 107 C ASN A 10 -28.722 0.732 134.185 1.00 48.16 C ATOM 108 O ASN A 10 -28.268 1.711 134.762 1.00 56.22 O ATOM 109 CB ASN A 10 -27.946 0.930 131.845 1.00 48.25 C ATOM 110 CG ASN A 10 -27.454 -0.430 131.412 1.00 52.23 C ATOM 111 OD1 ASN A 10 -26.799 -1.134 132.178 1.00 56.66 O ATOM 112 ND2 ASN A 10 -27.773 -0.803 130.184 1.00 53.86 N ATOM 113 HD22 ASN A 10 -28.330 -0.169 129.576 1.00 0.00 H ATOM 114 HD21 ASN A 10 -27.467 -1.730 129.826 1.00 0.00 H ATOM 115 H ASN A 10 -29.860 2.632 131.754 1.00 0.00 H ATOM 116 N PRO A 11 -28.805 -0.458 134.823 1.00 49.87 N ATOM 117 CA PRO A 11 -28.210 -0.663 136.147 1.00 46.93 C ATOM 118 C PRO A 11 -26.772 -0.140 136.309 1.00 48.59 C ATOM 119 O PRO A 11 -26.467 0.534 137.296 1.00 52.20 O ATOM 120 CB PRO A 11 -28.251 -2.188 136.289 1.00 45.16 C ATOM 121 CG PRO A 11 -29.502 -2.576 135.538 1.00 45.89 C ATOM 122 CD PRO A 11 -29.525 -1.648 134.341 1.00 46.96 C ATOM 123 N MET A 12 -25.898 -0.445 135.347 1.00 49.31 N ATOM 124 CA MET A 12 -24.502 -0.010 135.403 1.00 51.37 C ATOM 125 C MET A 12 -24.436 1.508 135.641 1.00 46.54 C ATOM 126 O MET A 12 -23.578 1.975 136.374 1.00 46.23 O ATOM 127 CB MET A 12 -23.774 -0.369 134.103 1.00 59.60 C ATOM 128 CG MET A 12 -22.367 0.212 133.991 1.00 67.12 C ATOM 129 SD MET A 12 -21.600 -0.064 132.354 1.00 82.39 S ATOM 130 CE MET A 12 -22.822 0.656 131.253 1.00 81.00 C ATOM 131 H MET A 12 -26.219 -1.008 134.534 1.00 0.00 H ATOM 132 N ILE A 13 -25.346 2.264 135.007 1.00 40.46 N ATOM 133 CA ILE A 13 -25.358 3.724 135.063 1.00 36.57 C ATOM 134 C ILE A 13 -25.900 4.179 136.428 1.00 33.37 C ATOM 135 O ILE A 13 -25.384 5.112 137.052 1.00 30.25 O ATOM 136 CB ILE A 13 -26.156 4.292 133.871 1.00 37.91 C ATOM 137 CG1 ILE A 13 -25.303 4.303 132.598 1.00 39.99 C ATOM 138 CG2 ILE A 13 -26.721 5.676 134.170 1.00 39.48 C ATOM 139 CD1 ILE A 13 -26.103 4.425 131.318 1.00 40.31 C ATOM 140 H ILE A 13 -26.080 1.786 134.447 1.00 0.00 H ATOM 141 N VAL A 14 -26.951 3.512 136.893 1.00 31.57 N ATOM 142 CA VAL A 14 -27.556 3.842 138.168 1.00 32.11 C ATOM 143 C VAL A 14 -26.530 3.594 139.277 1.00 31.83 C ATOM 144 O VAL A 14 -26.339 4.425 140.125 1.00 31.02 O ATOM 145 CB VAL A 14 -28.862 3.056 138.384 1.00 30.62 C ATOM 146 CG1 VAL A 14 -29.419 3.286 139.780 1.00 30.56 C ATOM 147 CG2 VAL A 14 -29.902 3.398 137.320 1.00 28.90 C ATOM 148 H VAL A 14 -27.349 2.734 136.328 1.00 0.00 H ATOM 149 N GLU A 15 -25.853 2.447 139.211 1.00 38.41 N ATOM 150 CA GLU A 15 -24.768 2.069 140.121 1.00 41.34 C ATOM 151 C GLU A 15 -23.656 3.139 140.092 1.00 40.31 C ATOM 152 O GLU A 15 -23.160 3.565 141.145 1.00 40.08 O ATOM 153 CB GLU A 15 -24.274 0.676 139.727 1.00 46.47 C ATOM 154 CG GLU A 15 -23.543 -0.064 140.830 1.00 55.48 C ATOM 155 CD GLU A 15 -22.784 -1.296 140.354 1.00 64.96 C ATOM 156 OE1 GLU A 15 -22.388 -2.120 141.211 1.00 67.43 O ATOM 157 OE2 GLU A 15 -22.577 -1.428 139.123 1.00 69.59 O ATOM 158 H GLU A 15 -26.113 1.774 138.462 1.00 0.00 H ATOM 159 N LEU A 16 -23.282 3.600 138.890 1.00 38.80 N ATOM 160 CA LEU A 16 -22.242 4.635 138.733 1.00 38.34 C ATOM 161 C LEU A 16 -22.714 5.981 139.305 1.00 39.34 C ATOM 162 O LEU A 16 -21.955 6.631 140.026 1.00 40.96 O ATOM 163 CB LEU A 16 -21.857 4.773 137.256 1.00 36.62 C ATOM 164 CG LEU A 16 -20.987 3.646 136.690 1.00 36.91 C ATOM 165 CD1 LEU A 16 -20.754 3.851 135.203 1.00 37.28 C ATOM 166 CD2 LEU A 16 -19.653 3.531 137.418 1.00 34.97 C ATOM 167 H LEU A 16 -23.740 3.215 138.039 1.00 0.00 H ATOM 168 N ALA A 17 -23.950 6.394 138.986 1.00 39.09 N ATOM 169 CA ALA A 17 -24.498 7.682 139.428 1.00 37.62 C ATOM 170 C ALA A 17 -24.511 7.750 140.949 1.00 40.84 C ATOM 171 O ALA A 17 -24.177 8.796 141.514 1.00 41.43 O ATOM 172 CB ALA A 17 -25.891 7.879 138.906 1.00 39.82 C ATOM 173 H ALA A 17 -24.546 5.775 138.400 1.00 0.00 H ATOM 174 N GLU A 18 -24.884 6.623 141.582 1.00 45.34 N ATOM 175 CA GLU A 18 -25.057 6.526 143.035 1.00 44.98 C ATOM 176 C GLU A 18 -23.734 6.668 143.787 1.00 45.27 C ATOM 177 O GLU A 18 -23.737 7.198 144.874 1.00 47.39 O ATOM 178 CB GLU A 18 -25.727 5.218 143.426 1.00 46.53 C ATOM 179 CG GLU A 18 -27.232 5.351 143.473 1.00 53.05 C ATOM 180 CD GLU A 18 -27.928 4.250 144.248 1.00 57.62 C ATOM 181 OE1 GLU A 18 -27.975 3.109 143.714 1.00 54.37 O ATOM 182 OE2 GLU A 18 -28.419 4.537 145.378 1.00 57.35 O ATOM 183 H GLU A 18 -25.059 5.773 141.009 1.00 0.00 H ATOM 184 N LYS A 19 -22.634 6.181 143.208 1.00 50.56 N ATOM 185 CA LYS A 19 -21.293 6.319 143.787 1.00 52.13 C ATOM 186 C LYS A 19 -20.805 7.771 143.640 1.00 52.00 C ATOM 187 O LYS A 19 -20.330 8.385 144.606 1.00 50.18 O ATOM 188 CB LYS A 19 -20.332 5.327 143.122 1.00 56.81 C ATOM 189 CG LYS A 19 -20.406 3.899 143.649 1.00 59.76 C ATOM 190 CD LYS A 19 -19.223 3.047 143.224 1.00 63.44 C ATOM 191 CE LYS A 19 -19.180 1.685 143.890 1.00 64.94 C ATOM 192 NZ LYS A 19 -18.969 0.600 142.897 1.00 64.39 N ATOM 193 HZ1 LYS A 19 -19.748 0.606 142.208 1.00 0.00 H ATOM 194 HZ2 LYS A 19 -18.067 0.754 142.403 1.00 0.00 H ATOM 195 HZ3 LYS A 19 -18.945 -0.317 143.387 1.00 0.00 H ATOM 196 H LYS A 19 -22.732 5.679 142.302 1.00 0.00 H ATOM 197 N ALA A 20 -20.946 8.337 142.435 1.00 52.46 N ATOM 198 CA ALA A 20 -20.571 9.745 142.176 1.00 55.18 C ATOM 199 C ALA A 20 -21.230 10.688 143.204 1.00 57.21 C ATOM 200 O ALA A 20 -20.781 11.826 143.382 1.00 58.17 O ATOM 201 CB ALA A 20 -20.934 10.126 140.758 1.00 51.58 C ATOM 202 H ALA A 20 -21.332 7.768 141.655 1.00 0.00 H ATOM 203 N MET A 21 -22.314 10.217 143.840 1.00 55.34 N ATOM 204 CA MET A 21 -23.058 10.933 144.881 1.00 51.97 C ATOM 205 C MET A 21 -22.589 10.471 146.271 1.00 52.51 C ATOM 206 O MET A 21 -22.163 11.296 147.081 1.00 49.73 O ATOM 207 CB MET A 21 -24.574 10.704 144.739 1.00 46.91 C ATOM 208 CG MET A 21 -25.210 11.422 143.546 1.00 45.61 C ATOM 209 SD MET A 21 -27.030 11.247 143.438 1.00 45.60 S ATOM 210 CE MET A 21 -27.586 12.818 144.099 1.00 41.02 C ATOM 211 H MET A 21 -22.653 9.270 143.574 1.00 0.00 H ATOM 212 N LYS A 22 -22.663 9.154 146.521 1.00 56.61 N ATOM 213 CA LYS A 22 -22.659 8.558 147.881 1.00 60.96 C ATOM 214 C LYS A 22 -21.280 8.654 148.540 1.00 60.22 C ATOM 215 O LYS A 22 -21.194 8.570 149.749 1.00 57.21 O ATOM 216 CB LYS A 22 -23.042 7.072 147.874 1.00 64.80 C ATOM 217 CG LYS A 22 -24.530 6.758 147.943 1.00 66.10 C ATOM 218 CD LYS A 22 -24.802 5.272 148.099 1.00 65.40 C ATOM 219 CE LYS A 22 -26.275 4.935 148.010 1.00 67.29 C ATOM 220 NZ LYS A 22 -26.494 3.480 147.860 1.00 69.07 N ATOM 221 HZ1 LYS A 22 -26.028 3.148 146.991 1.00 0.00 H ATOM 222 HZ2 LYS A 22 -26.093 2.984 148.681 1.00 0.00 H ATOM 223 HZ3 LYS A 22 -27.515 3.288 147.802 1.00 0.00 H ATOM 224 H LYS A 22 -22.727 8.508 145.708 1.00 0.00 H ATOM 225 N GLU A 23 -20.211 8.754 147.746 1.00 62.43 N ATOM 226 CA GLU A 23 -18.893 9.023 148.305 1.00 64.20 C ATOM 227 C GLU A 23 -18.868 10.456 148.842 1.00 63.64 C ATOM 228 O GLU A 23 -18.326 10.708 149.911 1.00 71.94 O ATOM 229 CB GLU A 23 -17.771 8.826 147.281 1.00 66.64 C ATOM 230 CG GLU A 23 -16.891 7.622 147.560 1.00 69.17 C ATOM 231 CD GLU A 23 -17.209 6.411 146.704 1.00 71.06 C ATOM 232 OE1 GLU A 23 -17.759 5.422 147.238 1.00 67.37 O ATOM 233 OE2 GLU A 23 -16.895 6.464 145.503 1.00 75.52 O ATOM 234 H GLU A 23 -20.321 8.639 146.718 1.00 0.00 H ATOM 235 N TYR A 24 -19.469 11.382 148.094 1.00 59.54 N ATOM 236 CA TYR A 24 -19.323 12.795 148.364 1.00 63.72 C ATOM 237 C TYR A 24 -20.492 13.286 149.238 1.00 67.70 C ATOM 238 O TYR A 24 -20.608 14.489 149.513 1.00 61.84 O ATOM 239 CB TYR A 24 -19.110 13.514 147.029 1.00 65.11 C ATOM 240 CG TYR A 24 -17.905 13.018 146.258 1.00 68.33 C ATOM 241 CD1 TYR A 24 -16.623 13.169 146.761 1.00 64.80 C ATOM 242 CD2 TYR A 24 -18.032 12.382 145.029 1.00 69.89 C ATOM 243 CE1 TYR A 24 -15.511 12.724 146.063 1.00 62.81 C ATOM 244 CE2 TYR A 24 -16.929 11.924 144.321 1.00 64.24 C ATOM 245 CZ TYR A 24 -15.658 12.101 144.838 1.00 60.98 C ATOM 246 OH TYR A 24 -14.553 11.666 144.163 1.00 58.93 O ATOM 247 HH TYR A 24 -13.741 11.881 144.688 1.00 0.00 H ATOM 248 H TYR A 24 -20.060 11.079 147.293 1.00 0.00 H ATOM 249 N GLY A 25 -21.344 12.349 149.685 1.00 71.70 N ATOM 250 CA GLY A 25 -22.268 12.553 150.821 1.00 69.58 C ATOM 251 C GLY A 25 -23.704 12.875 150.418 1.00 71.58 C ATOM 252 O GLY A 25 -24.576 12.932 151.278 1.00 70.06 O ATOM 253 H GLY A 25 -21.354 11.427 149.204 1.00 0.00 H ATOM 254 N GLU A 26 -23.958 13.105 149.121 1.00 72.86 N ATOM 255 CA GLU A 26 -25.304 13.412 148.613 1.00 66.53 C ATOM 256 C GLU A 26 -26.141 12.120 148.606 1.00 60.01 C ATOM 257 O GLU A 26 -25.666 11.082 148.160 1.00 60.45 O ATOM 258 CB GLU A 26 -25.208 14.034 147.214 1.00 69.85 C ATOM 259 CG GLU A 26 -24.599 15.437 147.170 1.00 74.53 C ATOM 260 CD GLU A 26 -25.558 16.596 146.895 1.00 79.24 C ATOM 261 OE1 GLU A 26 -25.519 17.148 145.772 1.00 74.14 O ATOM 262 OE2 GLU A 26 -26.331 16.972 147.807 1.00 81.73 O ATOM 263 H GLU A 26 -23.169 13.064 148.445 1.00 0.00 H ATOM 264 N ASP A 27 -27.382 12.192 149.109 1.00 53.16 N ATOM 265 CA ASP A 27 -28.320 11.055 149.107 1.00 50.24 C ATOM 266 C ASP A 27 -29.176 11.072 147.836 1.00 47.84 C ATOM 267 O ASP A 27 -29.904 12.030 147.584 1.00 44.21 O ATOM 268 CB ASP A 27 -29.211 11.077 150.353 1.00 50.47 C ATOM 269 CG ASP A 27 -30.102 9.853 150.516 1.00 50.74 C ATOM 270 OD1 ASP A 27 -29.748 8.790 149.975 1.00 51.88 O ATOM 271 OD2 ASP A 27 -31.152 9.972 151.179 1.00 52.20 O ATOM 272 H ASP A 27 -27.698 13.093 149.520 1.00 0.00 H ATOM 273 N PRO A 28 -29.155 10.006 147.000 1.00 48.07 N ATOM 274 CA PRO A 28 -29.978 9.956 145.790 1.00 45.73 C ATOM 275 C PRO A 28 -31.490 9.825 146.029 1.00 46.78 C ATOM 276 O PRO A 28 -32.281 9.992 145.082 1.00 46.20 O ATOM 277 CB PRO A 28 -29.492 8.703 145.045 1.00 44.60 C ATOM 278 CG PRO A 28 -28.171 8.358 145.681 1.00 46.12 C ATOM 279 CD PRO A 28 -28.292 8.821 147.119 1.00 48.03 C ATOM 280 N LYS A 29 -31.881 9.511 147.274 1.00 48.25 N ATOM 281 CA LYS A 29 -33.298 9.403 147.643 1.00 46.18 C ATOM 282 C LYS A 29 -33.868 10.788 147.939 1.00 40.73 C ATOM 283 O LYS A 29 -35.058 10.933 147.952 1.00 46.28 O ATOM 284 CB LYS A 29 -33.485 8.458 148.831 1.00 52.19 C ATOM 285 CG LYS A 29 -32.828 7.092 148.657 1.00 57.91 C ATOM 286 CD LYS A 29 -33.515 5.952 149.388 1.00 63.22 C ATOM 287 CE LYS A 29 -33.004 4.591 148.954 1.00 68.27 C ATOM 288 NZ LYS A 29 -33.396 3.519 149.900 1.00 70.89 N ATOM 289 HZ1 LYS A 29 -33.004 3.728 150.840 1.00 0.00 H ATOM 290 HZ2 LYS A 29 -34.433 3.472 149.958 1.00 0.00 H ATOM 291 HZ3 LYS A 29 -33.025 2.608 149.563 1.00 0.00 H ATOM 292 H LYS A 29 -31.157 9.339 148.001 1.00 0.00 H ATOM 293 N ILE A 30 -32.999 11.786 148.122 1.00 38.36 N ATOM 294 CA ILE A 30 -33.374 13.141 148.518 1.00 36.87 C ATOM 295 C ILE A 30 -33.081 14.123 147.374 1.00 36.27 C ATOM 296 O ILE A 30 -33.922 14.976 147.069 1.00 36.73 O ATOM 297 CB ILE A 30 -32.647 13.536 149.821 1.00 37.00 C ATOM 298 CG1 ILE A 30 -33.198 12.774 151.029 1.00 38.00 C ATOM 299 CG2 ILE A 30 -32.681 15.043 150.044 1.00 36.32 C ATOM 300 CD1 ILE A 30 -32.396 12.992 152.314 1.00 40.77 C ATOM 301 H ILE A 30 -31.990 11.585 147.973 1.00 0.00 H ATOM 302 N GLU A 31 -31.876 14.047 146.790 1.00 35.40 N ATOM 303 CA GLU A 31 -31.526 14.839 145.599 1.00 36.40 C ATOM 304 C GLU A 31 -31.815 13.988 144.352 1.00 32.73 C ATOM 305 O GLU A 31 -30.926 13.561 143.627 1.00 27.73 O ATOM 306 CB GLU A 31 -30.072 15.318 145.638 1.00 42.39 C ATOM 307 CG GLU A 31 -29.678 16.078 146.901 1.00 46.80 C ATOM 308 CD GLU A 31 -30.588 17.217 147.355 1.00 48.52 C ATOM 309 OE1 GLU A 31 -30.838 17.304 148.587 1.00 48.74 O ATOM 310 OE2 GLU A 31 -31.030 18.021 146.496 1.00 47.67 O ATOM 311 H GLU A 31 -31.163 13.406 147.193 1.00 0.00 H ATOM 312 N THR A 32 -33.109 13.775 144.118 1.00 32.00 N ATOM 313 CA THR A 32 -33.600 12.895 143.099 1.00 31.91 C ATOM 314 C THR A 32 -33.311 13.497 141.717 1.00 31.76 C ATOM 315 O THR A 32 -32.972 12.769 140.807 1.00 33.26 O ATOM 316 CB THR A 32 -35.090 12.629 143.331 1.00 31.84 C ATOM 317 OG1 THR A 32 -35.789 13.866 143.204 1.00 32.48 O ATOM 318 CG2 THR A 32 -35.378 12.030 144.688 1.00 32.18 C ATOM 319 HG1 THR A 32 -35.646 14.233 142.296 1.00 0.00 H ATOM 320 H THR A 32 -33.803 14.276 144.709 1.00 0.00 H ATOM 321 N ASN A 33 -33.425 14.828 141.598 1.00 30.00 N ATOM 322 CA ASN A 33 -33.225 15.551 140.356 1.00 29.91 C ATOM 323 C ASN A 33 -31.734 15.527 139.984 1.00 29.22 C ATOM 324 O ASN A 33 -31.396 15.256 138.862 1.00 28.23 O ATOM 325 CB ASN A 33 -33.837 16.955 140.423 1.00 31.73 C ATOM 326 CG ASN A 33 -35.354 16.969 140.331 1.00 34.39 C ATOM 327 OD1 ASN A 33 -35.998 15.929 140.478 1.00 42.97 O ATOM 328 ND2 ASN A 33 -35.950 18.132 140.105 1.00 30.86 N ATOM 329 HD22 ASN A 33 -35.380 18.994 139.985 1.00 0.00 H ATOM 330 HD21 ASN A 33 -36.987 18.182 140.048 1.00 0.00 H ATOM 331 H ASN A 33 -33.672 15.375 142.447 1.00 0.00 H ATOM 332 N LYS A 34 -30.838 15.759 140.943 1.00 33.02 N ATOM 333 CA LYS A 34 -29.378 15.631 140.707 1.00 35.03 C ATOM 334 C LYS A 34 -29.035 14.200 140.251 1.00 33.77 C ATOM 335 O LYS A 34 -28.236 14.004 139.360 1.00 32.92 O ATOM 336 CB LYS A 34 -28.569 16.010 141.958 1.00 38.12 C ATOM 337 CG LYS A 34 -27.112 16.376 141.678 1.00 42.71 C ATOM 338 CD LYS A 34 -26.281 16.755 142.894 1.00 46.89 C ATOM 339 CE LYS A 34 -25.527 18.075 142.786 1.00 52.82 C ATOM 340 NZ LYS A 34 -24.954 18.367 141.438 1.00 54.85 N ATOM 341 HZ1 LYS A 34 -24.281 17.617 141.179 1.00 0.00 H ATOM 342 HZ2 LYS A 34 -25.721 18.404 140.737 1.00 0.00 H ATOM 343 HZ3 LYS A 34 -24.462 19.283 141.463 1.00 0.00 H ATOM 344 H LYS A 34 -31.172 16.039 141.887 1.00 0.00 H ATOM 345 N PHE A 35 -29.654 13.205 140.896 1.00 36.09 N ATOM 346 CA PHE A 35 -29.510 11.768 140.586 1.00 33.24 C ATOM 347 C PHE A 35 -29.867 11.524 139.117 1.00 29.95 C ATOM 348 O PHE A 35 -29.076 10.945 138.359 1.00 28.15 O ATOM 349 CB PHE A 35 -30.406 10.953 141.529 1.00 32.42 C ATOM 350 CG PHE A 35 -30.255 9.452 141.484 1.00 31.69 C ATOM 351 CD1 PHE A 35 -29.033 8.855 141.218 1.00 33.15 C ATOM 352 CD2 PHE A 35 -31.342 8.635 141.769 1.00 32.52 C ATOM 353 CE1 PHE A 35 -28.909 7.472 141.201 1.00 36.04 C ATOM 354 CE2 PHE A 35 -31.221 7.254 141.762 1.00 34.24 C ATOM 355 CZ PHE A 35 -30.001 6.674 141.481 1.00 36.19 C ATOM 356 H PHE A 35 -30.288 13.464 141.679 1.00 0.00 H ATOM 357 N ALA A 36 -31.067 11.989 138.751 1.00 27.50 N ATOM 358 CA ALA A 36 -31.608 11.911 137.410 1.00 27.51 C ATOM 359 C ALA A 36 -30.652 12.571 136.410 1.00 27.02 C ATOM 360 O ALA A 36 -30.409 12.004 135.348 1.00 27.25 O ATOM 361 CB ALA A 36 -32.960 12.574 137.374 1.00 28.19 C ATOM 362 H ALA A 36 -31.654 12.439 139.482 1.00 0.00 H ATOM 363 N ALA A 37 -30.144 13.764 136.762 1.00 25.55 N ATOM 364 CA ALA A 37 -29.228 14.521 135.917 1.00 24.55 C ATOM 365 C ALA A 37 -27.944 13.740 135.705 1.00 24.61 C ATOM 366 O ALA A 37 -27.475 13.665 134.600 1.00 26.85 O ATOM 367 CB ALA A 37 -28.894 15.857 136.501 1.00 23.57 C ATOM 368 H ALA A 37 -30.417 14.167 137.681 1.00 0.00 H ATOM 369 N ILE A 38 -27.384 13.190 136.777 1.00 25.56 N ATOM 370 CA ILE A 38 -26.062 12.570 136.696 1.00 27.83 C ATOM 371 C ILE A 38 -26.125 11.368 135.748 1.00 27.86 C ATOM 372 O ILE A 38 -25.195 11.127 134.977 1.00 24.76 O ATOM 373 CB ILE A 38 -25.532 12.180 138.091 1.00 28.69 C ATOM 374 CG1 ILE A 38 -25.148 13.415 138.906 1.00 29.81 C ATOM 375 CG2 ILE A 38 -24.356 11.221 137.977 1.00 29.29 C ATOM 376 CD1 ILE A 38 -24.950 13.123 140.376 1.00 31.99 C ATOM 377 H ILE A 38 -27.892 13.201 137.685 1.00 0.00 H ATOM 378 N CYS A 39 -27.226 10.620 135.863 1.00 31.45 N ATOM 379 CA CYS A 39 -27.533 9.453 135.053 1.00 31.65 C ATOM 380 C CYS A 39 -27.562 9.858 133.578 1.00 32.11 C ATOM 381 O CYS A 39 -26.845 9.266 132.749 1.00 34.89 O ATOM 382 CB CYS A 39 -28.867 8.845 135.478 1.00 32.77 C ATOM 383 SG CYS A 39 -28.732 7.723 136.896 1.00 34.26 S ATOM 384 H CYS A 39 -27.918 10.894 136.589 1.00 0.00 H ATOM 385 N THR A 40 -28.362 10.889 133.273 1.00 30.65 N ATOM 386 CA THR A 40 -28.517 11.385 131.912 1.00 29.53 C ATOM 387 C THR A 40 -27.153 11.758 131.335 1.00 27.96 C ATOM 388 O THR A 40 -26.867 11.414 130.195 1.00 30.21 O ATOM 389 CB THR A 40 -29.461 12.590 131.817 1.00 29.66 C ATOM 390 OG1 THR A 40 -30.665 12.272 132.518 1.00 31.23 O ATOM 391 CG2 THR A 40 -29.774 12.962 130.382 1.00 28.87 C ATOM 392 HG1 THR A 40 -30.453 12.080 133.466 1.00 0.00 H ATOM 393 H THR A 40 -28.893 11.353 134.038 1.00 0.00 H ATOM 394 N HIS A 41 -26.342 12.471 132.122 1.00 26.27 N ATOM 395 CA HIS A 41 -25.027 12.935 131.673 1.00 26.47 C ATOM 396 C HIS A 41 -24.118 11.729 131.434 1.00 26.28 C ATOM 397 O HIS A 41 -23.402 11.679 130.434 1.00 24.65 O ATOM 398 CB HIS A 41 -24.419 13.956 132.647 1.00 26.07 C ATOM 399 CG HIS A 41 -23.042 14.399 132.272 1.00 26.75 C ATOM 400 ND1 HIS A 41 -21.897 13.763 132.751 1.00 29.13 N ATOM 401 CD2 HIS A 41 -22.611 15.397 131.471 1.00 26.46 C ATOM 402 CE1 HIS A 41 -20.830 14.361 132.259 1.00 27.82 C ATOM 403 NE2 HIS A 41 -21.244 15.371 131.475 1.00 27.29 N ATOM 404 H HIS A 41 -26.655 12.704 133.086 1.00 0.00 H ATOM 405 N LEU A 42 -24.188 10.739 132.324 1.00 28.63 N ATOM 406 CA LEU A 42 -23.433 9.509 132.112 1.00 31.70 C ATOM 407 C LEU A 42 -23.859 8.838 130.808 1.00 32.02 C ATOM 408 O LEU A 42 -22.997 8.461 130.022 1.00 31.56 O ATOM 409 CB LEU A 42 -23.586 8.555 133.295 1.00 32.88 C ATOM 410 CG LEU A 42 -22.338 8.485 134.168 1.00 36.71 C ATOM 411 CD1 LEU A 42 -22.683 8.063 135.588 1.00 41.26 C ATOM 412 CD2 LEU A 42 -21.318 7.544 133.545 1.00 38.81 C ATOM 413 H LEU A 42 -24.782 10.844 133.171 1.00 0.00 H ATOM 414 N GLU A 43 -25.171 8.710 130.588 1.00 31.62 N ATOM 415 CA GLU A 43 -25.662 7.994 129.416 1.00 33.06 C ATOM 416 C GLU A 43 -25.156 8.680 128.140 1.00 28.85 C ATOM 417 O GLU A 43 -24.687 8.026 127.240 1.00 28.71 O ATOM 418 CB GLU A 43 -27.189 7.882 129.431 1.00 37.29 C ATOM 419 CG GLU A 43 -27.708 6.725 128.588 1.00 40.33 C ATOM 420 CD GLU A 43 -29.144 6.339 128.890 1.00 45.00 C ATOM 421 OE1 GLU A 43 -29.999 7.229 128.817 1.00 48.25 O ATOM 422 OE2 GLU A 43 -29.402 5.160 129.227 1.00 52.93 O ATOM 423 H GLU A 43 -25.849 9.125 131.259 1.00 0.00 H ATOM 424 N VAL A 44 -25.255 10.008 128.088 1.00 26.91 N ATOM 425 CA VAL A 44 -24.770 10.780 126.968 1.00 25.20 C ATOM 426 C VAL A 44 -23.294 10.445 126.745 1.00 25.00 C ATOM 427 O VAL A 44 -22.919 10.107 125.656 1.00 23.38 O ATOM 428 CB VAL A 44 -24.989 12.289 127.169 1.00 23.95 C ATOM 429 CG1 VAL A 44 -24.139 13.116 126.222 1.00 23.64 C ATOM 430 CG2 VAL A 44 -26.445 12.655 127.009 1.00 24.67 C ATOM 431 H VAL A 44 -25.699 10.508 128.885 1.00 0.00 H ATOM 432 N CYS A 45 -22.486 10.537 127.805 1.00 28.18 N ATOM 433 CA CYS A 45 -21.022 10.315 127.734 1.00 29.13 C ATOM 434 C CYS A 45 -20.701 8.935 127.139 1.00 28.92 C ATOM 435 O CYS A 45 -19.808 8.816 126.332 1.00 29.46 O ATOM 436 CB CYS A 45 -20.360 10.447 129.104 1.00 29.09 C ATOM 437 SG CYS A 45 -20.148 12.169 129.621 1.00 28.07 S ATOM 438 H CYS A 45 -22.905 10.776 128.726 1.00 0.00 H ATOM 439 N PHE A 46 -21.443 7.910 127.557 1.00 29.85 N ATOM 440 CA PHE A 46 -21.246 6.538 127.114 1.00 31.34 C ATOM 441 C PHE A 46 -21.674 6.405 125.645 1.00 31.37 C ATOM 442 O PHE A 46 -20.928 5.882 124.812 1.00 30.90 O ATOM 443 CB PHE A 46 -22.021 5.588 128.034 1.00 32.84 C ATOM 444 CG PHE A 46 -21.391 5.325 129.379 1.00 34.99 C ATOM 445 CD1 PHE A 46 -20.296 6.047 129.822 1.00 37.64 C ATOM 446 CD2 PHE A 46 -21.914 4.359 130.220 1.00 39.49 C ATOM 447 CE1 PHE A 46 -19.726 5.793 131.061 1.00 40.75 C ATOM 448 CE2 PHE A 46 -21.339 4.097 131.454 1.00 41.24 C ATOM 449 CZ PHE A 46 -20.253 4.823 131.878 1.00 41.76 C ATOM 450 H PHE A 46 -22.205 8.101 128.238 1.00 0.00 H ATOM 451 N MET A 47 -22.886 6.870 125.339 1.00 31.21 N ATOM 452 CA MET A 47 -23.387 6.867 123.991 1.00 31.88 C ATOM 453 C MET A 47 -22.332 7.487 123.064 1.00 34.26 C ATOM 454 O MET A 47 -21.869 6.831 122.146 1.00 39.97 O ATOM 455 CB MET A 47 -24.699 7.647 123.891 1.00 31.81 C ATOM 456 CG MET A 47 -25.892 6.904 124.470 1.00 32.24 C ATOM 457 SD MET A 47 -27.444 7.812 124.175 1.00 33.53 S ATOM 458 CE MET A 47 -27.694 7.370 122.457 1.00 34.84 C ATOM 459 H MET A 47 -23.488 7.247 126.099 1.00 0.00 H ATOM 460 N TYR A 48 -21.936 8.733 123.341 1.00 34.50 N ATOM 461 CA TYR A 48 -20.904 9.475 122.585 1.00 34.21 C ATOM 462 C TYR A 48 -19.639 8.617 122.387 1.00 40.17 C ATOM 463 O TYR A 48 -19.111 8.469 121.261 1.00 40.22 O ATOM 464 CB TYR A 48 -20.557 10.743 123.361 1.00 31.18 C ATOM 465 CG TYR A 48 -20.019 11.907 122.571 1.00 30.34 C ATOM 466 CD1 TYR A 48 -18.778 11.851 121.950 1.00 29.94 C ATOM 467 CD2 TYR A 48 -20.714 13.104 122.529 1.00 28.57 C ATOM 468 CE1 TYR A 48 -18.261 12.942 121.272 1.00 29.53 C ATOM 469 CE2 TYR A 48 -20.212 14.201 121.852 1.00 29.13 C ATOM 470 CZ TYR A 48 -18.984 14.121 121.219 1.00 28.70 C ATOM 471 OH TYR A 48 -18.493 15.207 120.555 1.00 28.30 O ATOM 472 HH TYR A 48 -19.121 15.463 119.834 1.00 0.00 H ATOM 473 H TYR A 48 -22.386 9.215 124.145 1.00 0.00 H ATOM 474 N SER A 49 -19.179 8.051 123.507 1.00 43.69 N ATOM 475 CA SER A 49 -17.968 7.250 123.646 1.00 44.39 C ATOM 476 C SER A 49 -18.028 5.999 122.768 1.00 45.80 C ATOM 477 O SER A 49 -17.000 5.541 122.286 1.00 48.16 O ATOM 478 CB SER A 49 -17.784 6.866 125.096 1.00 47.87 C ATOM 479 OG SER A 49 -16.440 6.533 125.370 1.00 54.54 O ATOM 480 HG SER A 49 -16.350 6.286 126.325 1.00 0.00 H ATOM 481 H SER A 49 -19.743 8.197 124.369 1.00 0.00 H ATOM 482 N ASP A 50 -19.231 5.442 122.591 1.00 49.17 N ATOM 483 CA ASP A 50 -19.421 4.171 121.895 1.00 53.71 C ATOM 484 C ASP A 50 -19.305 4.365 120.383 1.00 57.42 C ATOM 485 O ASP A 50 -18.688 3.540 119.713 1.00 62.87 O ATOM 486 CB ASP A 50 -20.775 3.533 122.224 1.00 55.79 C ATOM 487 CG ASP A 50 -20.809 2.730 123.517 1.00 56.07 C ATOM 488 OD1 ASP A 50 -19.727 2.530 124.134 1.00 60.17 O ATOM 489 OD2 ASP A 50 -21.919 2.298 123.896 1.00 50.60 O ATOM 490 H ASP A 50 -20.067 5.935 122.965 1.00 0.00 H ATOM 491 N PHE A 51 -19.911 5.442 119.868 1.00 65.48 N ATOM 492 CA PHE A 51 -20.039 5.682 118.418 1.00 71.99 C ATOM 493 C PHE A 51 -18.688 6.146 117.850 1.00 70.19 C ATOM 494 O PHE A 51 -18.502 7.317 117.577 1.00 66.26 O ATOM 495 CB PHE A 51 -21.168 6.679 118.121 1.00 74.37 C ATOM 496 CG PHE A 51 -22.497 6.399 118.791 1.00 84.04 C ATOM 497 CD1 PHE A 51 -22.833 5.124 119.248 1.00 88.51 C ATOM 498 CD2 PHE A 51 -23.430 7.416 118.956 1.00 81.41 C ATOM 499 CE1 PHE A 51 -24.057 4.880 119.864 1.00 83.76 C ATOM 500 CE2 PHE A 51 -24.654 7.169 119.567 1.00 83.05 C ATOM 501 CZ PHE A 51 -24.966 5.902 120.021 1.00 84.24 C ATOM 502 H PHE A 51 -20.311 6.144 120.522 1.00 0.00 H ATOM 503 N GLY A 52 -17.763 5.194 117.660 1.00 76.19 N ATOM 504 CA GLY A 52 -16.418 5.449 117.133 1.00 80.05 C ATOM 505 C GLY A 52 -16.429 5.826 115.656 1.00 82.21 C ATOM 506 O GLY A 52 -16.985 5.112 114.816 1.00 80.41 O ATOM 507 H GLY A 52 -18.015 4.214 117.901 1.00 0.00 H TER 508 GLY A 52 ATOM 509 N HIS A 74 -11.899 2.365 118.124 1.00 51.92 N ATOM 510 CA HIS A 74 -11.736 3.004 119.434 1.00 52.59 C ATOM 511 C HIS A 74 -11.241 4.446 119.251 1.00 48.25 C ATOM 512 O HIS A 74 -10.041 4.733 119.382 1.00 51.22 O ATOM 513 CB HIS A 74 -10.812 2.157 120.325 1.00 59.74 C ATOM 514 CG HIS A 74 -10.669 2.630 121.740 1.00 66.39 C ATOM 515 ND1 HIS A 74 -11.706 2.569 122.660 1.00 72.04 N ATOM 516 CD2 HIS A 74 -9.602 3.123 122.412 1.00 68.01 C ATOM 517 CE1 HIS A 74 -11.290 3.029 123.823 1.00 71.21 C ATOM 518 NE2 HIS A 74 -10.000 3.371 123.697 1.00 71.06 N ATOM 519 HN3 HIS A 74 -10.985 2.355 117.628 1.00 0.00 H ATOM 520 HN2 HIS A 74 -12.593 2.899 117.563 1.00 0.00 H ATOM 521 HN1 HIS A 74 -12.234 1.389 118.255 1.00 0.00 H ATOM 522 N ARG A 75 -12.185 5.346 118.943 1.00 43.08 N ATOM 523 CA ARG A 75 -11.915 6.782 118.741 1.00 40.31 C ATOM 524 C ARG A 75 -11.813 7.503 120.092 1.00 39.68 C ATOM 525 O ARG A 75 -10.901 8.303 120.286 1.00 38.15 O ATOM 526 CB ARG A 75 -13.009 7.441 117.889 1.00 38.26 C ATOM 527 CG ARG A 75 -12.882 8.954 117.790 1.00 36.67 C ATOM 528 CD ARG A 75 -13.628 9.574 116.628 1.00 35.18 C ATOM 529 NE ARG A 75 -13.510 11.029 116.670 1.00 34.39 N ATOM 530 CZ ARG A 75 -14.036 11.857 115.771 1.00 34.91 C ATOM 531 NH1 ARG A 75 -14.787 11.373 114.796 1.00 33.58 N ATOM 532 NH2 ARG A 75 -13.804 13.160 115.838 1.00 33.63 N ATOM 533 HE ARG A 75 -12.977 11.448 117.459 1.00 0.00 H ATOM 534 HH12 ARG A 75 -15.201 12.015 114.090 1.00 0.00 H ATOM 535 HH11 ARG A 75 -14.964 10.350 114.735 1.00 0.00 H ATOM 536 HH22 ARG A 75 -14.220 13.799 115.131 1.00 0.00 H ATOM 537 HH21 ARG A 75 -13.206 13.543 116.598 1.00 0.00 H ATOM 538 H ARG A 75 -13.165 5.013 118.840 1.00 0.00 H ATOM 539 N PHE A 76 -12.750 7.199 121.008 1.00 37.51 N ATOM 540 CA PHE A 76 -12.944 7.957 122.226 1.00 34.50 C ATOM 541 C PHE A 76 -12.515 7.171 123.465 1.00 34.30 C ATOM 542 O PHE A 76 -12.801 6.009 123.604 1.00 32.97 O ATOM 543 CB PHE A 76 -14.408 8.365 122.339 1.00 32.23 C ATOM 544 CG PHE A 76 -14.827 9.325 121.261 1.00 28.91 C ATOM 545 CD1 PHE A 76 -14.369 10.630 121.268 1.00 29.51 C ATOM 546 CD2 PHE A 76 -15.682 8.927 120.253 1.00 27.66 C ATOM 547 CE1 PHE A 76 -14.762 11.524 120.280 1.00 32.12 C ATOM 548 CE2 PHE A 76 -16.064 9.814 119.258 1.00 29.20 C ATOM 549 CZ PHE A 76 -15.605 11.112 119.268 1.00 30.73 C ATOM 550 H PHE A 76 -13.365 6.379 120.833 1.00 0.00 H ATOM 551 N GLU A 77 -11.828 7.870 124.365 1.00 40.29 N ATOM 552 CA GLU A 77 -11.566 7.421 125.736 1.00 44.89 C ATOM 553 C GLU A 77 -12.666 7.977 126.655 1.00 45.80 C ATOM 554 O GLU A 77 -12.957 9.164 126.627 1.00 48.06 O ATOM 555 CB GLU A 77 -10.186 7.913 126.193 1.00 48.04 C ATOM 556 CG GLU A 77 -9.634 7.161 127.390 1.00 47.51 C ATOM 557 CD GLU A 77 -9.534 5.676 127.135 1.00 46.67 C ATOM 558 OE1 GLU A 77 -8.912 5.310 126.118 1.00 45.90 O ATOM 559 OE2 GLU A 77 -10.118 4.908 127.923 1.00 47.47 O ATOM 560 H GLU A 77 -11.452 8.796 124.077 1.00 0.00 H ATOM 561 N ILE A 78 -13.290 7.103 127.447 1.00 44.91 N ATOM 562 CA ILE A 78 -14.296 7.517 128.397 1.00 43.27 C ATOM 563 C ILE A 78 -13.569 7.790 129.713 1.00 44.04 C ATOM 564 O ILE A 78 -12.931 6.903 130.261 1.00 46.18 O ATOM 565 CB ILE A 78 -15.417 6.469 128.538 1.00 47.25 C ATOM 566 CG1 ILE A 78 -16.371 6.808 129.686 1.00 49.63 C ATOM 567 CG2 ILE A 78 -14.865 5.058 128.680 1.00 52.03 C ATOM 568 CD1 ILE A 78 -17.223 8.036 129.432 1.00 50.72 C ATOM 569 H ILE A 78 -13.045 6.095 127.378 1.00 0.00 H ATOM 570 N ILE A 79 -13.639 9.045 130.170 1.00 44.25 N ATOM 571 CA ILE A 79 -12.988 9.498 131.397 1.00 40.76 C ATOM 572 C ILE A 79 -14.028 9.674 132.509 1.00 38.15 C ATOM 573 O ILE A 79 -13.708 9.565 133.690 1.00 38.05 O ATOM 574 CB ILE A 79 -12.183 10.780 131.117 1.00 40.01 C ATOM 575 CG1 ILE A 79 -10.943 10.432 130.292 1.00 40.73 C ATOM 576 CG2 ILE A 79 -11.822 11.521 132.402 1.00 38.79 C ATOM 577 CD1 ILE A 79 -10.127 11.626 129.899 1.00 43.52 C ATOM 578 H ILE A 79 -14.188 9.737 129.621 1.00 0.00 H ATOM 579 N GLU A 80 -15.269 9.975 132.134 1.00 36.27 N ATOM 580 CA GLU A 80 -16.322 10.099 133.112 1.00 38.98 C ATOM 581 C GLU A 80 -16.701 8.700 133.615 1.00 38.70 C ATOM 582 O GLU A 80 -16.526 7.710 132.917 1.00 39.91 O ATOM 583 CB GLU A 80 -17.514 10.836 132.506 1.00 40.56 C ATOM 584 CG GLU A 80 -18.595 11.153 133.518 1.00 40.49 C ATOM 585 CD GLU A 80 -18.230 12.270 134.472 1.00 39.98 C ATOM 586 OE1 GLU A 80 -18.076 11.981 135.668 1.00 42.10 O ATOM 587 OE2 GLU A 80 -18.114 13.426 134.014 1.00 41.04 O ATOM 588 H GLU A 80 -15.481 10.122 131.127 1.00 0.00 H ATOM 589 N GLY A 81 -17.186 8.637 134.855 1.00 38.04 N ATOM 590 CA GLY A 81 -17.750 7.422 135.422 1.00 39.00 C ATOM 591 C GLY A 81 -16.702 6.524 136.046 1.00 38.34 C ATOM 592 O GLY A 81 -17.030 5.440 136.495 1.00 40.21 O ATOM 593 H GLY A 81 -17.160 9.494 135.443 1.00 0.00 H ATOM 594 N ARG A 82 -15.447 6.978 136.054 1.00 38.40 N ATOM 595 CA ARG A 82 -14.391 6.352 136.799 1.00 41.55 C ATOM 596 C ARG A 82 -14.204 7.097 138.121 1.00 45.18 C ATOM 597 O ARG A 82 -14.611 8.242 138.239 1.00 45.20 O ATOM 598 CB ARG A 82 -13.083 6.422 136.018 1.00 44.45 C ATOM 599 CG ARG A 82 -13.174 5.865 134.608 1.00 49.17 C ATOM 600 CD ARG A 82 -11.996 6.369 133.806 1.00 52.45 C ATOM 601 NE ARG A 82 -11.916 5.747 132.497 1.00 56.59 N ATOM 602 CZ ARG A 82 -11.429 4.539 132.273 1.00 53.99 C ATOM 603 NH1 ARG A 82 -11.165 3.732 133.290 1.00 52.30 N ATOM 604 NH2 ARG A 82 -11.197 4.166 131.028 1.00 53.03 N ATOM 605 HE ARG A 82 -12.265 6.288 131.681 1.00 0.00 H ATOM 606 HH12 ARG A 82 -10.782 2.781 133.114 1.00 0.00 H ATOM 607 HH11 ARG A 82 -11.341 4.049 134.265 1.00 0.00 H ATOM 608 HH22 ARG A 82 -10.814 3.219 130.832 1.00 0.00 H ATOM 609 HH21 ARG A 82 -11.397 4.819 130.244 1.00 0.00 H ATOM 610 H ARG A 82 -15.223 7.825 135.494 1.00 0.00 H ATOM 611 N ASP A 83 -13.560 6.436 139.093 1.00 50.15 N ATOM 612 CA ASP A 83 -13.071 7.099 140.303 1.00 49.85 C ATOM 613 C ASP A 83 -11.934 8.045 139.896 1.00 47.22 C ATOM 614 O ASP A 83 -11.394 7.971 138.778 1.00 40.70 O ATOM 615 CB ASP A 83 -12.667 6.094 141.395 1.00 55.07 C ATOM 616 CG ASP A 83 -11.435 5.232 141.118 1.00 62.63 C ATOM 617 OD1 ASP A 83 -10.506 5.696 140.411 1.00 66.96 O ATOM 618 OD2 ASP A 83 -11.399 4.095 141.633 1.00 66.91 O ATOM 619 H ASP A 83 -13.402 5.414 138.983 1.00 0.00 H ATOM 620 N ARG A 84 -11.566 8.921 140.831 1.00 48.09 N ATOM 621 CA ARG A 84 -10.608 9.978 140.567 1.00 49.14 C ATOM 622 C ARG A 84 -9.236 9.388 140.227 1.00 46.01 C ATOM 623 O ARG A 84 -8.588 9.875 139.305 1.00 49.14 O ATOM 624 CB ARG A 84 -10.500 10.923 141.762 1.00 51.64 C ATOM 625 CG ARG A 84 -11.796 11.647 142.087 1.00 50.52 C ATOM 626 CD ARG A 84 -12.018 12.849 141.207 1.00 49.75 C ATOM 627 NE ARG A 84 -13.119 13.606 141.775 1.00 53.52 N ATOM 628 CZ ARG A 84 -13.242 14.922 141.729 1.00 52.25 C ATOM 629 NH1 ARG A 84 -14.231 15.502 142.391 1.00 51.91 N ATOM 630 NH2 ARG A 84 -12.366 15.640 141.047 1.00 50.86 N ATOM 631 HE ARG A 84 -13.870 13.071 142.256 1.00 0.00 H ATOM 632 HH12 ARG A 84 -14.339 16.536 142.363 1.00 0.00 H ATOM 633 HH11 ARG A 84 -14.900 14.924 142.939 1.00 0.00 H ATOM 634 HH22 ARG A 84 -12.459 16.675 141.009 1.00 0.00 H ATOM 635 HH21 ARG A 84 -11.583 15.170 140.549 1.00 0.00 H ATOM 636 H ARG A 84 -11.980 8.844 141.782 1.00 0.00 H ATOM 637 N ILE A 85 -8.809 8.349 140.950 1.00 41.20 N ATOM 638 CA ILE A 85 -7.470 7.782 140.720 1.00 42.60 C ATOM 639 C ILE A 85 -7.366 7.309 139.259 1.00 41.64 C ATOM 640 O ILE A 85 -6.374 7.594 138.597 1.00 38.49 O ATOM 641 CB ILE A 85 -7.116 6.657 141.723 1.00 42.01 C ATOM 642 CG1 ILE A 85 -7.277 7.098 143.181 1.00 44.59 C ATOM 643 CG2 ILE A 85 -5.707 6.132 141.483 1.00 39.47 C ATOM 644 CD1 ILE A 85 -6.946 6.017 144.189 1.00 45.11 C ATOM 645 H ILE A 85 -9.426 7.938 141.680 1.00 0.00 H ATOM 646 N MET A 86 -8.391 6.599 138.767 1.00 44.58 N ATOM 647 CA MET A 86 -8.363 6.025 137.407 1.00 48.53 C ATOM 648 C MET A 86 -8.378 7.144 136.354 1.00 44.47 C ATOM 649 O MET A 86 -7.604 7.110 135.410 1.00 42.51 O ATOM 650 CB MET A 86 -9.531 5.062 137.139 1.00 51.30 C ATOM 651 CG MET A 86 -9.211 3.589 137.396 1.00 53.95 C ATOM 652 SD MET A 86 -7.482 3.075 137.045 1.00 59.47 S ATOM 653 CE MET A 86 -7.313 3.493 135.310 1.00 57.10 C ATOM 654 H MET A 86 -9.231 6.448 139.361 1.00 0.00 H ATOM 655 N ALA A 87 -9.261 8.127 136.538 1.00 44.20 N ATOM 656 CA ALA A 87 -9.461 9.231 135.591 1.00 41.13 C ATOM 657 C ALA A 87 -8.151 10.003 135.349 1.00 36.95 C ATOM 658 O ALA A 87 -7.765 10.249 134.206 1.00 35.40 O ATOM 659 CB ALA A 87 -10.554 10.127 136.119 1.00 41.43 C ATOM 660 H ALA A 87 -9.841 8.110 137.401 1.00 0.00 H ATOM 661 N TRP A 88 -7.470 10.383 136.432 1.00 35.49 N ATOM 662 CA TRP A 88 -6.216 11.118 136.337 1.00 35.57 C ATOM 663 C TRP A 88 -5.123 10.211 135.772 1.00 36.06 C ATOM 664 O TRP A 88 -4.358 10.663 134.928 1.00 40.66 O ATOM 665 CB TRP A 88 -5.828 11.764 137.673 1.00 33.73 C ATOM 666 CG TRP A 88 -6.682 12.954 137.994 1.00 33.15 C ATOM 667 CD1 TRP A 88 -7.653 13.043 138.951 1.00 33.63 C ATOM 668 CD2 TRP A 88 -6.694 14.216 137.299 1.00 32.83 C ATOM 669 NE1 TRP A 88 -8.241 14.280 138.923 1.00 34.29 N ATOM 670 CE2 TRP A 88 -7.680 15.019 137.915 1.00 32.57 C ATOM 671 CE3 TRP A 88 -5.972 14.745 136.222 1.00 32.23 C ATOM 672 CZ2 TRP A 88 -7.942 16.326 137.502 1.00 30.78 C ATOM 673 CZ3 TRP A 88 -6.243 16.032 135.809 1.00 30.88 C ATOM 674 CH2 TRP A 88 -7.206 16.813 136.448 1.00 29.53 C ATOM 675 HE1 TRP A 88 -8.992 14.606 139.564 1.00 0.00 H ATOM 676 H TRP A 88 -7.846 10.147 137.372 1.00 0.00 H ATOM 677 N THR A 89 -5.093 8.936 136.179 1.00 35.70 N ATOM 678 CA THR A 89 -4.199 7.946 135.530 1.00 38.09 C ATOM 679 C THR A 89 -4.417 7.960 134.004 1.00 38.15 C ATOM 680 O THR A 89 -3.451 8.050 133.247 1.00 37.34 O ATOM 681 CB THR A 89 -4.373 6.533 136.113 1.00 38.81 C ATOM 682 OG1 THR A 89 -4.173 6.581 137.526 1.00 38.42 O ATOM 683 CG2 THR A 89 -3.423 5.520 135.506 1.00 37.01 C ATOM 684 HG1 THR A 89 -4.837 7.193 137.932 1.00 0.00 H ATOM 685 H THR A 89 -5.706 8.635 136.963 1.00 0.00 H ATOM 686 N VAL A 90 -5.687 7.876 133.573 1.00 39.32 N ATOM 687 CA VAL A 90 -6.076 7.847 132.149 1.00 37.88 C ATOM 688 C VAL A 90 -5.672 9.170 131.485 1.00 38.11 C ATOM 689 O VAL A 90 -5.111 9.158 130.391 1.00 37.19 O ATOM 690 CB VAL A 90 -7.578 7.555 131.946 1.00 36.06 C ATOM 691 CG1 VAL A 90 -7.986 7.716 130.488 1.00 35.90 C ATOM 692 CG2 VAL A 90 -7.971 6.169 132.442 1.00 35.13 C ATOM 693 H VAL A 90 -6.442 7.828 134.286 1.00 0.00 H ATOM 694 N VAL A 91 -5.947 10.296 132.153 1.00 38.67 N ATOM 695 CA VAL A 91 -5.555 11.617 131.638 1.00 39.96 C ATOM 696 C VAL A 91 -4.024 11.691 131.483 1.00 39.40 C ATOM 697 O VAL A 91 -3.552 12.045 130.419 1.00 41.10 O ATOM 698 CB VAL A 91 -6.112 12.762 132.509 1.00 40.49 C ATOM 699 CG1 VAL A 91 -5.531 14.111 132.104 1.00 39.97 C ATOM 700 CG2 VAL A 91 -7.636 12.816 132.472 1.00 39.44 C ATOM 701 H VAL A 91 -6.451 10.236 133.061 1.00 0.00 H ATOM 702 N ASN A 92 -3.255 11.340 132.524 1.00 41.07 N ATOM 703 CA ASN A 92 -1.770 11.394 132.473 1.00 45.44 C ATOM 704 C ASN A 92 -1.225 10.503 131.343 1.00 42.37 C ATOM 705 O ASN A 92 -0.298 10.866 130.633 1.00 40.37 O ATOM 706 CB ASN A 92 -1.109 10.973 133.788 1.00 48.84 C ATOM 707 CG ASN A 92 -1.246 12.008 134.884 1.00 60.03 C ATOM 708 OD1 ASN A 92 -1.937 13.015 134.723 1.00 67.20 O ATOM 709 ND2 ASN A 92 -0.599 11.765 136.014 1.00 66.45 N ATOM 710 HD22 ASN A 92 -0.026 10.903 136.110 1.00 0.00 H ATOM 711 HD21 ASN A 92 -0.664 12.437 136.805 1.00 0.00 H ATOM 712 H ASN A 92 -3.714 11.018 133.400 1.00 0.00 H ATOM 713 N SER A 93 -1.788 9.310 131.201 1.00 39.84 N ATOM 714 CA SER A 93 -1.322 8.401 130.217 1.00 40.15 C ATOM 715 C SER A 93 -1.585 8.990 128.811 1.00 41.57 C ATOM 716 O SER A 93 -0.747 8.878 127.918 1.00 42.62 O ATOM 717 CB SER A 93 -1.928 7.040 130.455 1.00 40.25 C ATOM 718 OG SER A 93 -1.980 6.294 129.253 1.00 45.51 O ATOM 719 HG SER A 93 -2.380 5.407 129.434 1.00 0.00 H ATOM 720 H SER A 93 -2.580 9.038 131.818 1.00 0.00 H ATOM 721 N ILE A 94 -2.712 9.689 128.623 1.00 39.07 N ATOM 722 CA ILE A 94 -3.020 10.330 127.334 1.00 39.32 C ATOM 723 C ILE A 94 -2.049 11.496 127.068 1.00 43.58 C ATOM 724 O ILE A 94 -1.680 11.763 125.910 1.00 43.78 O ATOM 725 CB ILE A 94 -4.498 10.775 127.281 1.00 37.65 C ATOM 726 CG1 ILE A 94 -5.427 9.583 127.039 1.00 35.48 C ATOM 727 CG2 ILE A 94 -4.734 11.868 126.248 1.00 36.73 C ATOM 728 CD1 ILE A 94 -6.856 9.844 127.454 1.00 34.10 C ATOM 729 H ILE A 94 -3.387 9.781 129.408 1.00 0.00 H ATOM 730 N CYS A 95 -1.652 12.207 128.126 1.00 46.07 N ATOM 731 CA CYS A 95 -0.785 13.395 128.008 1.00 49.74 C ATOM 732 C CYS A 95 0.681 13.016 127.711 1.00 52.79 C ATOM 733 O CYS A 95 1.379 13.737 126.985 1.00 52.36 O ATOM 734 CB CYS A 95 -0.892 14.245 129.268 1.00 49.35 C ATOM 735 SG CYS A 95 -2.536 14.985 129.453 1.00 49.12 S ATOM 736 H CYS A 95 -1.967 11.911 129.072 1.00 0.00 H ATOM 737 N ASN A 96 1.145 11.888 128.260 1.00 52.00 N ATOM 738 CA ASN A 96 2.509 11.419 128.050 1.00 51.67 C ATOM 739 C ASN A 96 2.702 10.964 126.596 1.00 52.54 C ATOM 740 O ASN A 96 3.792 11.136 126.035 1.00 55.65 O ATOM 741 CB ASN A 96 2.872 10.288 129.015 1.00 51.00 C ATOM 742 CG ASN A 96 2.855 10.750 130.454 1.00 51.01 C ATOM 743 OD1 ASN A 96 3.117 11.917 130.729 1.00 51.50 O ATOM 744 ND2 ASN A 96 2.524 9.856 131.371 1.00 51.61 N ATOM 745 HD22 ASN A 96 2.310 8.878 131.090 1.00 0.00 H ATOM 746 HD21 ASN A 96 2.478 10.131 132.373 1.00 0.00 H ATOM 747 H ASN A 96 0.509 11.324 128.859 1.00 0.00 H ATOM 748 N THR A 97 1.661 10.391 125.986 1.00 46.48 N ATOM 749 CA THR A 97 1.830 9.732 124.696 1.00 47.79 C ATOM 750 C THR A 97 1.357 10.614 123.525 1.00 47.77 C ATOM 751 O THR A 97 1.408 10.158 122.385 1.00 51.82 O ATOM 752 CB THR A 97 1.131 8.363 124.675 1.00 47.14 C ATOM 753 OG1 THR A 97 -0.283 8.549 124.584 1.00 45.92 O ATOM 754 CG2 THR A 97 1.481 7.514 125.879 1.00 46.55 C ATOM 755 HG1 THR A 97 -0.597 9.068 125.366 1.00 0.00 H ATOM 756 H THR A 97 0.723 10.415 126.434 1.00 0.00 H ATOM 757 N THR A 98 0.902 11.850 123.786 1.00 46.59 N ATOM 758 CA THR A 98 0.322 12.729 122.724 1.00 46.01 C ATOM 759 C THR A 98 0.899 14.149 122.790 1.00 49.47 C ATOM 760 O THR A 98 0.994 14.824 121.759 1.00 52.35 O ATOM 761 CB THR A 98 -1.209 12.802 122.798 1.00 42.46 C ATOM 762 OG1 THR A 98 -1.574 13.469 124.009 1.00 39.16 O ATOM 763 CG2 THR A 98 -1.855 11.436 122.735 1.00 42.96 C ATOM 764 HG1 THR A 98 -1.222 12.962 124.783 1.00 0.00 H ATOM 765 H THR A 98 0.955 12.209 124.761 1.00 0.00 H ATOM 766 N GLY A 99 1.244 14.605 124.001 1.00 50.41 N ATOM 767 CA GLY A 99 1.915 15.871 124.215 1.00 48.93 C ATOM 768 C GLY A 99 0.932 16.981 124.522 1.00 52.27 C ATOM 769 O GLY A 99 1.351 18.130 124.737 1.00 54.79 O ATOM 770 H GLY A 99 1.019 14.020 124.831 1.00 0.00 H ATOM 771 N VAL A 100 -0.366 16.637 124.571 1.00 52.62 N ATOM 772 CA VAL A 100 -1.440 17.628 124.744 1.00 51.71 C ATOM 773 C VAL A 100 -1.446 18.099 126.208 1.00 48.48 C ATOM 774 O VAL A 100 -1.294 17.300 127.130 1.00 41.42 O ATOM 775 CB VAL A 100 -2.813 17.088 124.285 1.00 50.06 C ATOM 776 CG1 VAL A 100 -2.749 16.503 122.884 1.00 49.38 C ATOM 777 CG2 VAL A 100 -3.400 16.072 125.247 1.00 51.21 C ATOM 778 H VAL A 100 -0.621 15.633 124.483 1.00 0.00 H ATOM 779 N GLU A 101 -1.584 19.418 126.395 1.00 51.97 N ATOM 780 CA GLU A 101 -1.587 20.070 127.720 1.00 57.24 C ATOM 781 C GLU A 101 -2.580 19.320 128.625 1.00 52.36 C ATOM 782 O GLU A 101 -3.601 18.833 128.160 1.00 47.59 O ATOM 783 CB GLU A 101 -1.886 21.568 127.535 1.00 61.33 C ATOM 784 CG GLU A 101 -2.040 22.382 128.823 1.00 65.09 C ATOM 785 CD GLU A 101 -2.643 23.776 128.635 1.00 68.03 C ATOM 786 OE1 GLU A 101 -2.083 24.571 127.837 1.00 71.02 O ATOM 787 OE2 GLU A 101 -3.685 24.071 129.272 1.00 60.36 O ATOM 788 H GLU A 101 -1.696 20.021 125.555 1.00 0.00 H ATOM 789 N LYS A 102 -2.238 19.205 129.912 1.00 54.47 N ATOM 790 CA LYS A 102 -3.064 18.528 130.921 1.00 55.62 C ATOM 791 C LYS A 102 -4.089 19.522 131.468 1.00 57.08 C ATOM 792 O LYS A 102 -3.712 20.576 131.976 1.00 65.70 O ATOM 793 CB LYS A 102 -2.175 17.987 132.045 1.00 55.36 C ATOM 794 CG LYS A 102 -2.647 16.691 132.687 1.00 60.43 C ATOM 795 CD LYS A 102 -1.518 15.859 133.276 1.00 66.19 C ATOM 796 CE LYS A 102 -1.206 16.216 134.719 1.00 71.90 C ATOM 797 NZ LYS A 102 0.011 15.535 135.228 1.00 71.79 N ATOM 798 HZ1 LYS A 102 -0.122 14.505 135.176 1.00 0.00 H ATOM 799 HZ2 LYS A 102 0.829 15.810 134.647 1.00 0.00 H ATOM 800 HZ3 LYS A 102 0.176 15.815 136.216 1.00 0.00 H ATOM 801 H LYS A 102 -1.334 19.619 130.217 1.00 0.00 H ATOM 802 N PRO A 103 -5.412 19.247 131.390 1.00 51.82 N ATOM 803 CA PRO A 103 -6.410 20.198 131.875 1.00 50.73 C ATOM 804 C PRO A 103 -6.423 20.208 133.412 1.00 49.25 C ATOM 805 O PRO A 103 -5.932 19.255 134.021 1.00 42.87 O ATOM 806 CB PRO A 103 -7.717 19.667 131.276 1.00 52.44 C ATOM 807 CG PRO A 103 -7.491 18.169 131.201 1.00 54.68 C ATOM 808 CD PRO A 103 -6.019 18.012 130.871 1.00 53.47 C ATOM 809 N LYS A 104 -6.960 21.291 134.000 1.00 49.78 N ATOM 810 CA LYS A 104 -7.002 21.511 135.460 1.00 48.94 C ATOM 811 C LYS A 104 -8.110 20.664 136.086 1.00 46.21 C ATOM 812 O LYS A 104 -7.960 20.227 137.206 1.00 52.98 O ATOM 813 CB LYS A 104 -7.267 22.978 135.821 1.00 52.81 C ATOM 814 CG LYS A 104 -6.053 23.825 136.186 1.00 58.39 C ATOM 815 CD LYS A 104 -6.426 25.230 136.682 1.00 64.23 C ATOM 816 CE LYS A 104 -5.274 25.988 137.320 1.00 68.88 C ATOM 817 NZ LYS A 104 -4.242 26.391 136.329 1.00 69.49 N ATOM 818 HZ1 LYS A 104 -3.854 25.542 135.870 1.00 0.00 H ATOM 819 HZ2 LYS A 104 -4.674 27.007 135.611 1.00 0.00 H ATOM 820 HZ3 LYS A 104 -3.479 26.904 136.814 1.00 0.00 H ATOM 821 H LYS A 104 -7.373 22.022 133.387 1.00 0.00 H ATOM 822 N PHE A 105 -9.221 20.488 135.361 1.00 45.84 N ATOM 823 CA PHE A 105 -10.385 19.700 135.804 1.00 46.56 C ATOM 824 C PHE A 105 -10.508 18.451 134.922 1.00 39.34 C ATOM 825 O PHE A 105 -10.009 18.451 133.815 1.00 42.57 O ATOM 826 CB PHE A 105 -11.640 20.580 135.785 1.00 52.98 C ATOM 827 CG PHE A 105 -11.477 21.880 136.538 1.00 60.64 C ATOM 828 CD1 PHE A 105 -11.348 21.889 137.923 1.00 60.94 C ATOM 829 CD2 PHE A 105 -11.404 23.094 135.861 1.00 66.46 C ATOM 830 CE1 PHE A 105 -11.167 23.081 138.612 1.00 65.56 C ATOM 831 CE2 PHE A 105 -11.218 24.286 136.553 1.00 68.79 C ATOM 832 CZ PHE A 105 -11.104 24.278 137.927 1.00 67.75 C ATOM 833 H PHE A 105 -9.266 20.937 134.424 1.00 0.00 H ATOM 834 N LEU A 106 -11.112 17.380 135.449 1.00 34.66 N ATOM 835 CA LEU A 106 -11.383 16.165 134.679 1.00 32.80 C ATOM 836 C LEU A 106 -12.457 16.464 133.643 1.00 34.42 C ATOM 837 O LEU A 106 -13.584 16.798 134.007 1.00 40.98 O ATOM 838 CB LEU A 106 -11.893 15.040 135.582 1.00 32.85 C ATOM 839 CG LEU A 106 -10.873 14.316 136.464 1.00 34.78 C ATOM 840 CD1 LEU A 106 -11.566 13.182 137.216 1.00 33.81 C ATOM 841 CD2 LEU A 106 -9.681 13.782 135.670 1.00 33.32 C ATOM 842 H LEU A 106 -11.401 17.412 136.448 1.00 0.00 H ATOM 843 N PRO A 107 -12.183 16.295 132.332 1.00 32.66 N ATOM 844 CA PRO A 107 -13.221 16.372 131.317 1.00 32.88 C ATOM 845 C PRO A 107 -13.857 14.976 131.186 1.00 30.92 C ATOM 846 O PRO A 107 -13.690 14.152 132.077 1.00 29.24 O ATOM 847 CB PRO A 107 -12.404 16.875 130.113 1.00 33.42 C ATOM 848 CG PRO A 107 -11.070 16.183 130.252 1.00 32.73 C ATOM 849 CD PRO A 107 -10.877 15.974 131.741 1.00 34.27 C ATOM 850 N ASP A 108 -14.577 14.727 130.087 1.00 30.86 N ATOM 851 CA ASP A 108 -15.496 13.582 129.992 1.00 32.76 C ATOM 852 C ASP A 108 -14.970 12.505 129.030 1.00 33.13 C ATOM 853 O ASP A 108 -15.199 11.313 129.246 1.00 31.99 O ATOM 854 CB ASP A 108 -16.885 14.038 129.538 1.00 31.71 C ATOM 855 CG ASP A 108 -17.595 14.954 130.516 1.00 29.13 C ATOM 856 OD1 ASP A 108 -17.570 14.662 131.709 1.00 30.17 O ATOM 857 OD2 ASP A 108 -18.185 15.940 130.064 1.00 28.79 O ATOM 858 H ASP A 108 -14.484 15.365 129.271 1.00 0.00 H ATOM 859 N LEU A 109 -14.343 12.941 127.933 1.00 34.36 N ATOM 860 CA LEU A 109 -13.847 12.050 126.880 1.00 33.05 C ATOM 861 C LEU A 109 -12.495 12.584 126.443 1.00 32.61 C ATOM 862 O LEU A 109 -12.165 13.723 126.744 1.00 35.11 O ATOM 863 CB LEU A 109 -14.799 12.015 125.674 1.00 32.13 C ATOM 864 CG LEU A 109 -16.265 11.662 125.951 1.00 32.61 C ATOM 865 CD1 LEU A 109 -17.197 12.533 125.136 1.00 33.70 C ATOM 866 CD2 LEU A 109 -16.564 10.209 125.662 1.00 32.79 C ATOM 867 H LEU A 109 -14.200 13.965 127.821 1.00 0.00 H ATOM 868 N TYR A 110 -11.738 11.740 125.742 1.00 33.92 N ATOM 869 CA TYR A 110 -10.669 12.199 124.870 1.00 32.82 C ATOM 870 C TYR A 110 -10.916 11.586 123.489 1.00 31.04 C ATOM 871 O TYR A 110 -11.298 10.413 123.385 1.00 24.04 O ATOM 872 CB TYR A 110 -9.283 11.863 125.433 1.00 32.77 C ATOM 873 CG TYR A 110 -8.148 12.196 124.499 1.00 33.80 C ATOM 874 CD1 TYR A 110 -7.646 13.480 124.408 1.00 37.38 C ATOM 875 CD2 TYR A 110 -7.590 11.234 123.676 1.00 34.97 C ATOM 876 CE1 TYR A 110 -6.603 13.799 123.549 1.00 37.88 C ATOM 877 CE2 TYR A 110 -6.552 11.535 122.808 1.00 37.68 C ATOM 878 CZ TYR A 110 -6.053 12.824 122.739 1.00 38.04 C ATOM 879 OH TYR A 110 -5.021 13.127 121.890 1.00 39.33 O ATOM 880 HH TYR A 110 -5.293 12.930 120.959 1.00 0.00 H ATOM 881 H TYR A 110 -11.918 10.719 125.821 1.00 0.00 H ATOM 882 N ASP A 111 -10.700 12.424 122.464 1.00 32.86 N ATOM 883 CA ASP A 111 -10.824 12.094 121.060 1.00 33.34 C ATOM 884 C ASP A 111 -9.425 11.855 120.487 1.00 35.45 C ATOM 885 O ASP A 111 -8.693 12.842 120.248 1.00 38.94 O ATOM 886 CB ASP A 111 -11.521 13.221 120.300 1.00 33.95 C ATOM 887 CG ASP A 111 -11.774 12.864 118.847 1.00 36.83 C ATOM 888 OD1 ASP A 111 -11.096 11.938 118.368 1.00 36.09 O ATOM 889 OD2 ASP A 111 -12.654 13.501 118.207 1.00 38.18 O ATOM 890 H ASP A 111 -10.418 13.397 122.699 1.00 0.00 H ATOM 891 N TYR A 112 -9.078 10.570 120.279 1.00 34.22 N ATOM 892 CA TYR A 112 -7.781 10.119 119.697 1.00 34.55 C ATOM 893 C TYR A 112 -7.641 10.513 118.211 1.00 38.70 C ATOM 894 O TYR A 112 -6.521 10.609 117.700 1.00 41.07 O ATOM 895 CB TYR A 112 -7.618 8.601 119.814 1.00 32.54 C ATOM 896 CG TYR A 112 -7.333 8.066 121.197 1.00 31.61 C ATOM 897 CD1 TYR A 112 -6.068 8.167 121.756 1.00 29.59 C ATOM 898 CD2 TYR A 112 -8.313 7.414 121.936 1.00 31.47 C ATOM 899 CE1 TYR A 112 -5.793 7.670 123.018 1.00 28.32 C ATOM 900 CE2 TYR A 112 -8.048 6.901 123.200 1.00 29.66 C ATOM 901 CZ TYR A 112 -6.780 7.024 123.736 1.00 27.98 C ATOM 902 OH TYR A 112 -6.496 6.527 124.969 1.00 28.09 O ATOM 903 HH TYR A 112 -7.077 6.964 125.641 1.00 0.00 H ATOM 904 H TYR A 112 -9.767 9.837 120.544 1.00 0.00 H ATOM 905 N LYS A 113 -8.760 10.760 117.518 1.00 40.63 N ATOM 906 CA LYS A 113 -8.741 11.166 116.106 1.00 43.60 C ATOM 907 C LYS A 113 -8.461 12.673 115.940 1.00 44.32 C ATOM 908 O LYS A 113 -7.882 13.069 114.952 1.00 45.77 O ATOM 909 CB LYS A 113 -10.061 10.797 115.419 1.00 44.71 C ATOM 910 CG LYS A 113 -10.126 11.185 113.948 1.00 46.82 C ATOM 911 CD LYS A 113 -11.474 11.004 113.308 1.00 48.06 C ATOM 912 CE LYS A 113 -11.578 11.715 111.980 1.00 48.78 C ATOM 913 NZ LYS A 113 -12.843 12.481 111.885 1.00 52.14 N ATOM 914 HZ1 LYS A 113 -13.649 11.830 111.979 1.00 0.00 H ATOM 915 HZ2 LYS A 113 -12.876 13.189 112.646 1.00 0.00 H ATOM 916 HZ3 LYS A 113 -12.889 12.960 110.963 1.00 0.00 H ATOM 917 H LYS A 113 -9.677 10.661 117.998 1.00 0.00 H ATOM 918 N GLU A 114 -8.925 13.522 116.861 1.00 46.86 N ATOM 919 CA GLU A 114 -8.748 14.986 116.735 1.00 48.32 C ATOM 920 C GLU A 114 -7.679 15.464 117.727 1.00 48.62 C ATOM 921 O GLU A 114 -7.126 16.564 117.570 1.00 47.04 O ATOM 922 CB GLU A 114 -10.061 15.737 116.978 1.00 49.75 C ATOM 923 CG GLU A 114 -11.156 15.395 115.987 1.00 50.88 C ATOM 924 CD GLU A 114 -10.917 15.901 114.576 1.00 53.85 C ATOM 925 OE1 GLU A 114 -10.523 17.072 114.434 1.00 51.62 O ATOM 926 OE2 GLU A 114 -11.124 15.116 113.620 1.00 61.80 O ATOM 927 H GLU A 114 -9.425 13.143 117.691 1.00 0.00 H ATOM 928 N ASN A 115 -7.432 14.644 118.760 1.00 46.44 N ATOM 929 CA ASN A 115 -6.353 14.832 119.734 1.00 45.20 C ATOM 930 C ASN A 115 -6.651 16.080 120.577 1.00 44.68 C ATOM 931 O ASN A 115 -5.850 17.034 120.654 1.00 47.40 O ATOM 932 CB ASN A 115 -4.983 14.775 119.047 1.00 42.45 C ATOM 933 CG ASN A 115 -4.683 13.373 118.551 1.00 42.92 C ATOM 934 OD1 ASN A 115 -4.346 12.482 119.344 1.00 38.30 O ATOM 935 ND2 ASN A 115 -4.858 13.156 117.253 1.00 40.20 N ATOM 936 HD22 ASN A 115 -5.141 13.938 116.629 1.00 0.00 H ATOM 937 HD21 ASN A 115 -4.712 12.204 116.861 1.00 0.00 H ATOM 938 H ASN A 115 -8.050 13.816 118.878 1.00 0.00 H ATOM 939 N ARG A 116 -7.832 16.034 121.207 1.00 41.41 N ATOM 940 CA ARG A 116 -8.341 17.041 122.136 1.00 38.25 C ATOM 941 C ARG A 116 -9.272 16.341 123.131 1.00 35.82 C ATOM 942 O ARG A 116 -9.904 15.357 122.793 1.00 36.63 O ATOM 943 CB ARG A 116 -9.072 18.160 121.384 1.00 35.10 C ATOM 944 CG ARG A 116 -10.359 17.723 120.709 1.00 34.53 C ATOM 945 CD ARG A 116 -10.715 18.597 119.517 1.00 35.08 C ATOM 946 NE ARG A 116 -12.017 18.260 118.957 1.00 35.69 N ATOM 947 CZ ARG A 116 -12.484 18.726 117.804 1.00 37.29 C ATOM 948 NH1 ARG A 116 -11.726 19.518 117.070 1.00 37.34 N ATOM 949 NH2 ARG A 116 -13.702 18.409 117.385 1.00 37.38 N ATOM 950 HE ARG A 116 -12.623 17.610 119.497 1.00 0.00 H ATOM 951 HH12 ARG A 116 -12.083 19.888 116.166 1.00 0.00 H ATOM 952 HH11 ARG A 116 -10.772 19.773 117.396 1.00 0.00 H ATOM 953 HH22 ARG A 116 -14.054 18.782 116.480 1.00 0.00 H ATOM 954 HH21 ARG A 116 -14.305 17.788 117.961 1.00 0.00 H ATOM 955 H ARG A 116 -8.439 15.211 121.019 1.00 0.00 H ATOM 956 N PHE A 117 -9.317 16.848 124.364 1.00 36.48 N ATOM 957 CA PHE A 117 -10.298 16.419 125.368 1.00 35.08 C ATOM 958 C PHE A 117 -11.659 17.024 125.018 1.00 34.22 C ATOM 959 O PHE A 117 -11.736 18.034 124.310 1.00 33.73 O ATOM 960 CB PHE A 117 -9.832 16.816 126.769 1.00 34.98 C ATOM 961 CG PHE A 117 -8.598 16.072 127.211 1.00 36.10 C ATOM 962 CD1 PHE A 117 -8.688 14.767 127.663 1.00 36.77 C ATOM 963 CD2 PHE A 117 -7.348 16.664 127.141 1.00 35.77 C ATOM 964 CE1 PHE A 117 -7.554 14.075 128.051 1.00 38.86 C ATOM 965 CE2 PHE A 117 -6.215 15.978 127.535 1.00 37.43 C ATOM 966 CZ PHE A 117 -6.318 14.680 127.977 1.00 41.14 C ATOM 967 H PHE A 117 -8.626 17.580 124.626 1.00 0.00 H ATOM 968 N ILE A 118 -12.732 16.388 125.495 1.00 32.08 N ATOM 969 CA ILE A 118 -14.066 16.892 125.231 1.00 32.13 C ATOM 970 C ILE A 118 -14.796 17.031 126.561 1.00 30.73 C ATOM 971 O ILE A 118 -14.749 16.116 127.411 1.00 28.78 O ATOM 972 CB ILE A 118 -14.863 15.995 124.256 1.00 33.79 C ATOM 973 CG1 ILE A 118 -14.041 15.606 123.026 1.00 33.80 C ATOM 974 CG2 ILE A 118 -16.179 16.665 123.870 1.00 32.53 C ATOM 975 CD1 ILE A 118 -14.715 14.596 122.136 1.00 35.70 C ATOM 976 H ILE A 118 -12.610 15.524 126.061 1.00 0.00 H ATOM 977 N GLU A 119 -15.508 18.158 126.689 1.00 28.71 N ATOM 978 CA GLU A 119 -16.406 18.375 127.800 1.00 28.22 C ATOM 979 C GLU A 119 -17.835 18.357 127.253 1.00 27.08 C ATOM 980 O GLU A 119 -18.170 19.104 126.334 1.00 25.81 O ATOM 981 CB GLU A 119 -16.015 19.654 128.544 1.00 28.36 C ATOM 982 CG GLU A 119 -16.910 20.001 129.717 1.00 26.58 C ATOM 983 CD GLU A 119 -17.115 18.914 130.742 1.00 25.84 C ATOM 984 OE1 GLU A 119 -16.126 18.235 131.122 1.00 26.25 O ATOM 985 OE2 GLU A 119 -18.267 18.763 131.166 1.00 25.49 O ATOM 986 H GLU A 119 -15.412 18.900 125.967 1.00 0.00 H ATOM 987 N ILE A 120 -18.635 17.448 127.824 1.00 26.38 N ATOM 988 CA ILE A 120 -20.007 17.165 127.440 1.00 25.63 C ATOM 989 C ILE A 120 -20.937 17.888 128.424 1.00 24.62 C ATOM 990 O ILE A 120 -20.881 17.606 129.633 1.00 24.97 O ATOM 991 CB ILE A 120 -20.270 15.646 127.476 1.00 25.87 C ATOM 992 CG1 ILE A 120 -19.303 14.842 126.611 1.00 25.51 C ATOM 993 CG2 ILE A 120 -21.708 15.340 127.106 1.00 27.26 C ATOM 994 CD1 ILE A 120 -19.550 15.003 125.147 1.00 26.32 C ATOM 995 H ILE A 120 -18.239 16.896 128.612 1.00 0.00 H ATOM 996 N GLY A 121 -21.791 18.780 127.900 1.00 21.99 N ATOM 997 CA GLY A 121 -22.834 19.437 128.653 1.00 21.44 C ATOM 998 C GLY A 121 -24.213 18.956 128.242 1.00 22.66 C ATOM 999 O GLY A 121 -24.532 18.855 127.062 1.00 21.19 O ATOM 1000 H GLY A 121 -21.696 19.013 126.891 1.00 0.00 H ATOM 1001 N VAL A 122 -25.039 18.642 129.248 1.00 25.95 N ATOM 1002 CA VAL A 122 -26.491 18.436 129.070 1.00 25.67 C ATOM 1003 C VAL A 122 -27.229 19.491 129.891 1.00 24.77 C ATOM 1004 O VAL A 122 -26.961 19.643 131.067 1.00 24.26 O ATOM 1005 CB VAL A 122 -26.940 17.022 129.468 1.00 26.71 C ATOM 1006 CG1 VAL A 122 -28.354 16.762 128.967 1.00 26.16 C ATOM 1007 CG2 VAL A 122 -25.970 15.951 128.970 1.00 27.17 C ATOM 1008 H VAL A 122 -24.638 18.538 130.202 1.00 0.00 H ATOM 1009 N THR A 123 -28.131 20.224 129.241 1.00 26.23 N ATOM 1010 CA THR A 123 -28.789 21.371 129.845 1.00 27.99 C ATOM 1011 C THR A 123 -30.298 21.293 129.624 1.00 27.56 C ATOM 1012 O THR A 123 -30.757 20.900 128.533 1.00 28.00 O ATOM 1013 CB THR A 123 -28.259 22.715 129.313 1.00 30.14 C ATOM 1014 OG1 THR A 123 -28.929 23.734 130.065 1.00 31.94 O ATOM 1015 CG2 THR A 123 -28.494 22.958 127.832 1.00 30.82 C ATOM 1016 HG1 THR A 123 -28.721 23.624 131.027 1.00 0.00 H ATOM 1017 H THR A 123 -28.374 19.966 128.263 1.00 0.00 H ATOM 1018 N ARG A 124 -31.032 21.726 130.660 1.00 28.21 N ATOM 1019 CA ARG A 124 -32.486 21.950 130.639 1.00 29.19 C ATOM 1020 C ARG A 124 -32.788 23.371 130.155 1.00 31.17 C ATOM 1021 O ARG A 124 -33.945 23.716 129.901 1.00 33.44 O ATOM 1022 CB ARG A 124 -33.106 21.765 132.030 1.00 27.77 C ATOM 1023 CG ARG A 124 -33.276 20.318 132.459 1.00 26.98 C ATOM 1024 CD ARG A 124 -32.090 19.828 133.266 1.00 28.18 C ATOM 1025 NE ARG A 124 -32.236 19.924 134.711 1.00 27.89 N ATOM 1026 CZ ARG A 124 -31.300 19.569 135.589 1.00 28.33 C ATOM 1027 NH1 ARG A 124 -30.022 19.591 135.261 1.00 27.12 N ATOM 1028 NH2 ARG A 124 -31.647 19.185 136.802 1.00 30.82 N ATOM 1029 HE ARG A 124 -33.133 20.295 135.083 1.00 0.00 H ATOM 1030 HH12 ARG A 124 -29.302 19.311 135.957 1.00 0.00 H ATOM 1031 HH11 ARG A 124 -29.735 19.888 134.307 1.00 0.00 H ATOM 1032 HH22 ARG A 124 -30.917 18.908 137.488 1.00 0.00 H ATOM 1033 HH21 ARG A 124 -32.651 19.160 137.072 1.00 0.00 H ATOM 1034 H ARG A 124 -30.532 21.919 131.551 1.00 0.00 H ATOM 1035 N ARG A 125 -31.744 24.201 130.075 1.00 35.99 N ATOM 1036 CA ARG A 125 -31.866 25.616 129.742 1.00 38.13 C ATOM 1037 C ARG A 125 -31.555 25.757 128.254 1.00 39.99 C ATOM 1038 O ARG A 125 -31.673 24.783 127.500 1.00 40.02 O ATOM 1039 CB ARG A 125 -30.947 26.444 130.649 1.00 39.80 C ATOM 1040 CG ARG A 125 -31.526 26.712 132.033 1.00 41.06 C ATOM 1041 CD ARG A 125 -30.544 27.469 132.909 1.00 42.81 C ATOM 1042 NE ARG A 125 -29.367 26.672 133.223 1.00 42.02 N ATOM 1043 CZ ARG A 125 -28.159 27.166 133.472 1.00 44.16 C ATOM 1044 NH1 ARG A 125 -27.959 28.474 133.501 1.00 45.10 N ATOM 1045 NH2 ARG A 125 -27.143 26.343 133.669 1.00 46.19 N ATOM 1046 HE ARG A 125 -29.480 25.639 133.255 1.00 0.00 H ATOM 1047 HH12 ARG A 125 -27.010 28.851 133.697 1.00 0.00 H ATOM 1048 HH11 ARG A 125 -28.751 29.125 133.328 1.00 0.00 H ATOM 1049 HH22 ARG A 125 -26.195 26.724 133.864 1.00 0.00 H ATOM 1050 HH21 ARG A 125 -27.292 25.314 133.629 1.00 0.00 H ATOM 1051 H ARG A 125 -30.795 23.818 130.260 1.00 0.00 H ATOM 1052 N GLU A 126 -31.185 26.966 127.835 1.00 43.92 N ATOM 1053 CA GLU A 126 -30.792 27.185 126.473 1.00 47.77 C ATOM 1054 C GLU A 126 -29.293 26.873 126.352 1.00 44.75 C ATOM 1055 O GLU A 126 -28.526 27.062 127.303 1.00 42.61 O ATOM 1056 CB GLU A 126 -31.274 28.572 126.046 1.00 55.18 C ATOM 1057 CG GLU A 126 -32.763 28.576 125.713 1.00 61.41 C ATOM 1058 CD GLU A 126 -33.535 29.857 125.992 1.00 70.42 C ATOM 1059 OE1 GLU A 126 -33.343 30.451 127.085 1.00 74.04 O ATOM 1060 OE2 GLU A 126 -34.351 30.247 125.123 1.00 73.63 O ATOM 1061 H GLU A 126 -31.181 27.762 128.504 1.00 0.00 H ATOM 1062 N VAL A 127 -28.913 26.356 125.175 1.00 41.63 N ATOM 1063 CA VAL A 127 -27.611 25.766 124.933 1.00 39.60 C ATOM 1064 C VAL A 127 -26.500 26.815 125.046 1.00 38.52 C ATOM 1065 O VAL A 127 -25.482 26.508 125.632 1.00 40.02 O ATOM 1066 CB VAL A 127 -27.551 25.024 123.585 1.00 39.92 C ATOM 1067 CG1 VAL A 127 -28.486 23.836 123.571 1.00 40.00 C ATOM 1068 CG2 VAL A 127 -27.834 25.926 122.400 1.00 44.30 C ATOM 1069 H VAL A 127 -29.593 26.380 124.388 1.00 0.00 H ATOM 1070 N HIS A 128 -26.702 28.027 124.506 1.00 42.10 N ATOM 1071 CA HIS A 128 -25.678 29.106 124.548 1.00 44.94 C ATOM 1072 C HIS A 128 -25.366 29.533 125.982 1.00 42.32 C ATOM 1073 O HIS A 128 -24.250 29.942 126.269 1.00 41.40 O ATOM 1074 CB HIS A 128 -26.057 30.325 123.684 1.00 49.69 C ATOM 1075 CG HIS A 128 -27.188 31.146 124.197 1.00 54.51 C ATOM 1076 ND1 HIS A 128 -28.515 30.805 123.970 1.00 60.02 N ATOM 1077 CD2 HIS A 128 -27.203 32.302 124.890 1.00 58.03 C ATOM 1078 CE1 HIS A 128 -29.297 31.709 124.517 1.00 61.61 C ATOM 1079 NE2 HIS A 128 -28.517 32.633 125.096 1.00 62.23 N ATOM 1080 H HIS A 128 -27.611 28.220 124.039 1.00 0.00 H ATOM 1081 N ILE A 129 -26.349 29.412 126.871 1.00 44.00 N ATOM 1082 CA ILE A 129 -26.186 29.801 128.264 1.00 45.79 C ATOM 1083 C ILE A 129 -25.294 28.775 128.970 1.00 45.03 C ATOM 1084 O ILE A 129 -24.388 29.153 129.719 1.00 49.28 O ATOM 1085 CB ILE A 129 -27.564 29.977 128.931 1.00 46.73 C ATOM 1086 CG1 ILE A 129 -28.229 31.276 128.469 1.00 47.73 C ATOM 1087 CG2 ILE A 129 -27.471 29.903 130.442 1.00 47.09 C ATOM 1088 CD1 ILE A 129 -29.740 31.201 128.437 1.00 51.34 C ATOM 1089 H ILE A 129 -27.264 29.027 126.560 1.00 0.00 H ATOM 1090 N TYR A 130 -25.541 27.486 128.714 1.00 42.67 N ATOM 1091 CA TYR A 130 -24.752 26.424 129.322 1.00 42.27 C ATOM 1092 C TYR A 130 -23.362 26.380 128.668 1.00 39.77 C ATOM 1093 O TYR A 130 -22.374 26.051 129.333 1.00 35.92 O ATOM 1094 CB TYR A 130 -25.501 25.088 129.254 1.00 43.67 C ATOM 1095 CG TYR A 130 -25.072 24.079 130.292 1.00 45.85 C ATOM 1096 CD1 TYR A 130 -25.468 24.191 131.617 1.00 48.15 C ATOM 1097 CD2 TYR A 130 -24.262 23.009 129.958 1.00 48.37 C ATOM 1098 CE1 TYR A 130 -25.081 23.263 132.574 1.00 48.58 C ATOM 1099 CE2 TYR A 130 -23.860 22.075 130.904 1.00 50.39 C ATOM 1100 CZ TYR A 130 -24.268 22.199 132.220 1.00 47.78 C ATOM 1101 OH TYR A 130 -23.872 21.269 133.141 1.00 41.58 O ATOM 1102 HH TYR A 130 -24.247 21.503 134.027 1.00 0.00 H ATOM 1103 H TYR A 130 -26.315 27.236 128.065 1.00 0.00 H ATOM 1104 N TYR A 131 -23.289 26.708 127.369 1.00 38.11 N ATOM 1105 CA TYR A 131 -22.013 26.762 126.666 1.00 39.48 C ATOM 1106 C TYR A 131 -21.092 27.771 127.361 1.00 40.09 C ATOM 1107 O TYR A 131 -19.952 27.442 127.687 1.00 39.32 O ATOM 1108 CB TYR A 131 -22.156 27.122 125.181 1.00 41.83 C ATOM 1109 CG TYR A 131 -20.827 27.137 124.462 1.00 43.11 C ATOM 1110 CD1 TYR A 131 -20.026 28.277 124.468 1.00 41.81 C ATOM 1111 CD2 TYR A 131 -20.317 25.989 123.874 1.00 41.62 C ATOM 1112 CE1 TYR A 131 -18.780 28.298 123.865 1.00 39.09 C ATOM 1113 CE2 TYR A 131 -19.063 25.991 123.274 1.00 44.85 C ATOM 1114 CZ TYR A 131 -18.296 27.149 123.260 1.00 42.93 C ATOM 1115 OH TYR A 131 -17.063 27.159 122.666 1.00 39.33 O ATOM 1116 HH TYR A 131 -16.664 28.061 122.751 1.00 0.00 H ATOM 1117 H TYR A 131 -24.164 26.929 126.851 1.00 0.00 H ATOM 1118 N LEU A 132 -21.606 28.987 127.582 1.00 41.11 N ATOM 1119 CA LEU A 132 -20.843 30.090 128.200 1.00 39.91 C ATOM 1120 C LEU A 132 -20.391 29.725 129.615 1.00 36.47 C ATOM 1121 O LEU A 132 -19.276 30.052 129.966 1.00 35.58 O ATOM 1122 CB LEU A 132 -21.686 31.370 128.210 1.00 40.44 C ATOM 1123 CG LEU A 132 -21.905 32.018 126.841 1.00 40.64 C ATOM 1124 CD1 LEU A 132 -22.983 33.089 126.913 1.00 39.71 C ATOM 1125 CD2 LEU A 132 -20.606 32.591 126.291 1.00 39.70 C ATOM 1126 H LEU A 132 -22.593 29.164 127.304 1.00 0.00 H ATOM 1127 N GLU A 133 -21.264 29.080 130.400 1.00 36.38 N ATOM 1128 CA GLU A 133 -20.955 28.662 131.794 1.00 39.81 C ATOM 1129 C GLU A 133 -19.697 27.776 131.837 1.00 37.79 C ATOM 1130 O GLU A 133 -18.777 27.999 132.631 1.00 33.12 O ATOM 1131 CB GLU A 133 -22.128 27.889 132.402 1.00 44.09 C ATOM 1132 CG GLU A 133 -22.874 28.650 133.476 1.00 51.31 C ATOM 1133 CD GLU A 133 -24.029 27.877 134.102 1.00 62.89 C ATOM 1134 OE1 GLU A 133 -23.829 26.682 134.460 1.00 63.40 O ATOM 1135 OE2 GLU A 133 -25.139 28.470 134.228 1.00 67.55 O ATOM 1136 H GLU A 133 -22.205 28.860 130.016 1.00 0.00 H ATOM 1137 N LYS A 134 -19.703 26.755 130.974 1.00 39.04 N ATOM 1138 CA LYS A 134 -18.613 25.816 130.769 1.00 41.78 C ATOM 1139 C LYS A 134 -17.355 26.507 130.217 1.00 42.95 C ATOM 1140 O LYS A 134 -16.270 26.295 130.732 1.00 44.52 O ATOM 1141 CB LYS A 134 -19.047 24.750 129.762 1.00 43.57 C ATOM 1142 CG LYS A 134 -20.034 23.729 130.292 1.00 44.74 C ATOM 1143 CD LYS A 134 -19.369 22.687 131.129 1.00 45.50 C ATOM 1144 CE LYS A 134 -20.350 21.667 131.650 1.00 47.54 C ATOM 1145 NZ LYS A 134 -19.666 20.759 132.595 1.00 51.40 N ATOM 1146 HZ1 LYS A 134 -18.888 20.273 132.105 1.00 0.00 H ATOM 1147 HZ2 LYS A 134 -19.285 21.311 133.390 1.00 0.00 H ATOM 1148 HZ3 LYS A 134 -20.345 20.057 132.952 1.00 0.00 H ATOM 1149 H LYS A 134 -20.560 26.621 130.401 1.00 0.00 H ATOM 1150 N ALA A 135 -17.504 27.281 129.134 1.00 43.13 N ATOM 1151 CA ALA A 135 -16.386 27.972 128.490 1.00 42.82 C ATOM 1152 C ALA A 135 -15.679 28.874 129.503 1.00 48.02 C ATOM 1153 O ALA A 135 -14.445 28.923 129.509 1.00 50.27 O ATOM 1154 CB ALA A 135 -16.866 28.762 127.306 1.00 41.36 C ATOM 1155 H ALA A 135 -18.457 27.396 128.733 1.00 0.00 H ATOM 1156 N ASN A 136 -16.476 29.552 130.352 1.00 51.97 N ATOM 1157 CA ASN A 136 -16.000 30.466 131.419 1.00 51.93 C ATOM 1158 C ASN A 136 -15.301 29.665 132.524 1.00 49.73 C ATOM 1159 O ASN A 136 -14.284 30.099 133.038 1.00 46.32 O ATOM 1160 CB ASN A 136 -17.133 31.327 131.998 1.00 54.54 C ATOM 1161 CG ASN A 136 -16.680 32.331 133.046 1.00 56.08 C ATOM 1162 OD1 ASN A 136 -15.497 32.640 133.168 1.00 54.91 O ATOM 1163 ND2 ASN A 136 -17.620 32.862 133.812 1.00 53.64 N ATOM 1164 HD22 ASN A 136 -18.613 32.581 133.686 1.00 0.00 H ATOM 1165 HD21 ASN A 136 -17.365 33.560 134.540 1.00 0.00 H ATOM 1166 H ASN A 136 -17.503 29.425 130.252 1.00 0.00 H ATOM 1167 N LYS A 137 -15.848 28.493 132.865 1.00 54.41 N ATOM 1168 CA LYS A 137 -15.299 27.643 133.935 1.00 55.82 C ATOM 1169 C LYS A 137 -13.915 27.089 133.553 1.00 53.68 C ATOM 1170 O LYS A 137 -13.191 26.615 134.418 1.00 47.42 O ATOM 1171 CB LYS A 137 -16.259 26.499 134.271 1.00 57.90 C ATOM 1172 CG LYS A 137 -15.686 25.499 135.261 1.00 64.19 C ATOM 1173 CD LYS A 137 -16.701 24.672 136.001 1.00 73.09 C ATOM 1174 CE LYS A 137 -16.078 23.984 137.200 1.00 80.67 C ATOM 1175 NZ LYS A 137 -16.908 22.853 137.682 1.00 84.73 N ATOM 1176 HZ1 LYS A 137 -17.846 23.206 137.960 1.00 0.00 H ATOM 1177 HZ2 LYS A 137 -17.012 22.152 136.921 1.00 0.00 H ATOM 1178 HZ3 LYS A 137 -16.446 22.411 138.502 1.00 0.00 H ATOM 1179 H LYS A 137 -16.694 28.169 132.354 1.00 0.00 H ATOM 1180 N ILE A 138 -13.571 27.125 132.256 1.00 57.88 N ATOM 1181 CA ILE A 138 -12.236 26.769 131.752 1.00 59.27 C ATOM 1182 C ILE A 138 -11.775 27.850 130.756 1.00 57.30 C ATOM 1183 O ILE A 138 -10.771 27.708 130.052 1.00 46.15 O ATOM 1184 CB ILE A 138 -12.244 25.367 131.111 1.00 62.78 C ATOM 1185 CG1 ILE A 138 -13.326 24.440 131.684 1.00 61.02 C ATOM 1186 CG2 ILE A 138 -10.857 24.748 131.208 1.00 67.67 C ATOM 1187 CD1 ILE A 138 -13.948 23.525 130.646 1.00 61.13 C ATOM 1188 H ILE A 138 -14.291 27.422 131.567 1.00 0.00 H TER 1189 ILE A 138 ATOM 1190 N GLU A 141 -9.464 25.085 128.191 1.00 76.98 N ATOM 1191 CA GLU A 141 -9.001 26.192 127.356 1.00 79.20 C ATOM 1192 C GLU A 141 -8.786 25.698 125.917 1.00 78.62 C ATOM 1193 O GLU A 141 -9.173 26.383 124.957 1.00 80.97 O ATOM 1194 CB GLU A 141 -7.721 26.779 127.952 1.00 81.85 C ATOM 1195 CG GLU A 141 -7.869 27.175 129.412 1.00 77.77 C ATOM 1196 CD GLU A 141 -6.562 27.332 130.163 1.00 77.35 C ATOM 1197 OE1 GLU A 141 -6.570 28.027 131.207 1.00 76.88 O ATOM 1198 OE2 GLU A 141 -5.544 26.755 129.708 1.00 70.77 O ATOM 1199 HN3 GLU A 141 -8.751 24.328 128.188 1.00 0.00 H ATOM 1200 HN2 GLU A 141 -10.361 24.719 127.813 1.00 0.00 H ATOM 1201 HN1 GLU A 141 -9.608 25.423 129.164 1.00 0.00 H ATOM 1202 N LYS A 142 -8.162 24.515 125.790 1.00 71.76 N ATOM 1203 CA LYS A 142 -8.045 23.766 124.525 1.00 61.26 C ATOM 1204 C LYS A 142 -8.973 22.544 124.554 1.00 53.71 C ATOM 1205 O LYS A 142 -8.820 21.630 123.746 1.00 53.35 O ATOM 1206 CB LYS A 142 -6.594 23.330 124.301 1.00 63.24 C ATOM 1207 CG LYS A 142 -5.682 24.438 123.799 1.00 70.85 C ATOM 1208 CD LYS A 142 -4.232 24.036 123.650 1.00 74.11 C ATOM 1209 CE LYS A 142 -3.454 25.005 122.783 1.00 76.35 C ATOM 1210 NZ LYS A 142 -2.027 24.621 122.689 1.00 77.86 N ATOM 1211 HZ1 LYS A 142 -1.607 24.618 123.640 1.00 0.00 H ATOM 1212 HZ2 LYS A 142 -1.952 23.671 122.272 1.00 0.00 H ATOM 1213 HZ3 LYS A 142 -1.524 25.305 122.089 1.00 0.00 H ATOM 1214 H LYS A 142 -7.733 24.099 126.641 1.00 0.00 H ATOM 1215 N THR A 143 -9.916 22.522 125.506 1.00 45.56 N ATOM 1216 CA THR A 143 -10.891 21.446 125.630 1.00 41.04 C ATOM 1217 C THR A 143 -12.099 21.754 124.741 1.00 34.45 C ATOM 1218 O THR A 143 -12.714 22.800 124.854 1.00 28.98 O ATOM 1219 CB THR A 143 -11.345 21.232 127.081 1.00 42.60 C ATOM 1220 OG1 THR A 143 -10.202 20.992 127.901 1.00 43.48 O ATOM 1221 CG2 THR A 143 -12.318 20.080 127.237 1.00 41.66 C ATOM 1222 HG1 THR A 143 -10.492 20.854 128.837 1.00 0.00 H ATOM 1223 H THR A 143 -9.954 23.308 126.186 1.00 0.00 H ATOM 1224 N HIS A 144 -12.434 20.800 123.874 1.00 31.96 N ATOM 1225 CA HIS A 144 -13.554 20.934 122.998 1.00 31.38 C ATOM 1226 C HIS A 144 -14.835 20.807 123.825 1.00 32.38 C ATOM 1227 O HIS A 144 -14.931 19.904 124.662 1.00 35.44 O ATOM 1228 CB HIS A 144 -13.463 19.903 121.881 1.00 30.73 C ATOM 1229 CG HIS A 144 -14.191 20.331 120.662 1.00 31.85 C ATOM 1230 ND1 HIS A 144 -13.568 21.035 119.656 1.00 32.88 N ATOM 1231 CD2 HIS A 144 -15.488 20.191 120.301 1.00 33.36 C ATOM 1232 CE1 HIS A 144 -14.451 21.312 118.712 1.00 34.44 C ATOM 1233 NE2 HIS A 144 -15.645 20.809 119.091 1.00 34.17 N ATOM 1234 H HIS A 144 -11.863 19.932 123.834 1.00 0.00 H ATOM 1235 N ILE A 145 -15.792 21.725 123.611 1.00 30.96 N ATOM 1236 CA ILE A 145 -17.055 21.718 124.357 1.00 29.39 C ATOM 1237 C ILE A 145 -18.170 21.288 123.401 1.00 28.34 C ATOM 1238 O ILE A 145 -18.222 21.724 122.265 1.00 29.04 O ATOM 1239 CB ILE A 145 -17.345 23.072 125.038 1.00 30.99 C ATOM 1240 CG1 ILE A 145 -16.168 23.521 125.915 1.00 32.29 C ATOM 1241 CG2 ILE A 145 -18.637 23.005 125.845 1.00 31.39 C ATOM 1242 CD1 ILE A 145 -16.445 24.723 126.787 1.00 31.03 C ATOM 1243 H ILE A 145 -15.633 22.463 122.895 1.00 0.00 H ATOM 1244 N HIS A 146 -19.031 20.387 123.875 1.00 26.85 N ATOM 1245 CA HIS A 146 -20.215 19.975 123.160 1.00 26.72 C ATOM 1246 C HIS A 146 -21.357 19.997 124.171 1.00 25.80 C ATOM 1247 O HIS A 146 -21.193 19.487 125.247 1.00 26.82 O ATOM 1248 CB HIS A 146 -20.007 18.589 122.524 1.00 27.41 C ATOM 1249 CG HIS A 146 -20.936 18.269 121.398 1.00 26.71 C ATOM 1250 ND1 HIS A 146 -20.549 17.493 120.323 1.00 28.39 N ATOM 1251 CD2 HIS A 146 -22.213 18.628 121.156 1.00 25.46 C ATOM 1252 CE1 HIS A 146 -21.560 17.361 119.490 1.00 25.94 C ATOM 1253 NE2 HIS A 146 -22.583 18.052 119.974 1.00 24.97 N ATOM 1254 H HIS A 146 -18.840 19.961 124.804 1.00 0.00 H ATOM 1255 N ILE A 147 -22.479 20.612 123.810 1.00 25.56 N ATOM 1256 CA ILE A 147 -23.611 20.782 124.705 1.00 25.66 C ATOM 1257 C ILE A 147 -24.861 20.215 124.025 1.00 27.31 C ATOM 1258 O ILE A 147 -25.157 20.550 122.877 1.00 26.69 O ATOM 1259 CB ILE A 147 -23.796 22.271 125.028 1.00 25.09 C ATOM 1260 CG1 ILE A 147 -22.484 22.907 125.494 1.00 25.26 C ATOM 1261 CG2 ILE A 147 -24.935 22.484 126.004 1.00 24.85 C ATOM 1262 CD1 ILE A 147 -21.973 22.413 126.803 1.00 24.44 C ATOM 1263 H ILE A 147 -22.550 20.989 122.843 1.00 0.00 H ATOM 1264 N PHE A 148 -25.583 19.342 124.731 1.00 29.13 N ATOM 1265 CA PHE A 148 -26.841 18.791 124.230 1.00 28.76 C ATOM 1266 C PHE A 148 -27.930 19.332 125.132 1.00 29.18 C ATOM 1267 O PHE A 148 -27.682 19.538 126.300 1.00 30.47 O ATOM 1268 CB PHE A 148 -26.831 17.261 124.211 1.00 28.93 C ATOM 1269 CG PHE A 148 -25.812 16.658 123.272 1.00 30.10 C ATOM 1270 CD1 PHE A 148 -24.530 16.365 123.704 1.00 29.13 C ATOM 1271 CD2 PHE A 148 -26.132 16.399 121.944 1.00 33.60 C ATOM 1272 CE1 PHE A 148 -23.604 15.803 122.837 1.00 32.53 C ATOM 1273 CE2 PHE A 148 -25.201 15.847 121.072 1.00 33.64 C ATOM 1274 CZ PHE A 148 -23.936 15.548 121.521 1.00 32.94 C ATOM 1275 H PHE A 148 -25.240 19.045 125.667 1.00 0.00 H ATOM 1276 N SER A 149 -29.082 19.651 124.549 1.00 30.45 N ATOM 1277 CA SER A 149 -30.262 19.965 125.331 1.00 30.67 C ATOM 1278 C SER A 149 -31.291 18.830 125.188 1.00 30.18 C ATOM 1279 O SER A 149 -31.078 17.874 124.458 1.00 32.71 O ATOM 1280 CB SER A 149 -30.814 21.278 124.905 1.00 28.74 C ATOM 1281 OG SER A 149 -31.481 21.126 123.680 1.00 26.68 O ATOM 1282 HG SER A 149 -31.849 22.000 123.395 1.00 0.00 H ATOM 1283 H SER A 149 -29.138 19.676 123.511 1.00 0.00 H ATOM 1284 N PHE A 150 -32.417 18.959 125.886 1.00 30.36 N ATOM 1285 CA PHE A 150 -33.513 18.000 125.805 1.00 30.10 C ATOM 1286 C PHE A 150 -34.455 18.427 124.674 1.00 30.58 C ATOM 1287 O PHE A 150 -35.550 17.920 124.566 1.00 30.70 O ATOM 1288 CB PHE A 150 -34.225 17.886 127.165 1.00 29.14 C ATOM 1289 CG PHE A 150 -33.401 17.263 128.268 1.00 27.38 C ATOM 1290 CD1 PHE A 150 -32.453 18.010 128.954 1.00 27.16 C ATOM 1291 CD2 PHE A 150 -33.545 15.921 128.593 1.00 25.31 C ATOM 1292 CE1 PHE A 150 -31.676 17.430 129.944 1.00 27.04 C ATOM 1293 CE2 PHE A 150 -32.782 15.346 129.594 1.00 24.57 C ATOM 1294 CZ PHE A 150 -31.851 16.100 130.265 1.00 26.60 C ATOM 1295 H PHE A 150 -32.520 19.779 126.517 1.00 0.00 H ATOM 1296 N THR A 151 -34.014 19.371 123.840 1.00 32.86 N ATOM 1297 CA THR A 151 -34.858 19.943 122.782 1.00 36.43 C ATOM 1298 C THR A 151 -34.271 19.615 121.402 1.00 37.34 C ATOM 1299 O THR A 151 -34.783 20.072 120.383 1.00 40.67 O ATOM 1300 CB THR A 151 -35.045 21.457 122.994 1.00 37.24 C ATOM 1301 OG1 THR A 151 -33.855 22.162 122.613 1.00 34.74 O ATOM 1302 CG2 THR A 151 -35.418 21.798 124.426 1.00 35.96 C ATOM 1303 HG1 THR A 151 -33.096 21.848 123.166 1.00 0.00 H ATOM 1304 H THR A 151 -33.038 19.714 123.943 1.00 0.00 H ATOM 1305 N GLY A 152 -33.199 18.816 121.379 1.00 38.79 N ATOM 1306 CA GLY A 152 -32.496 18.472 120.157 1.00 38.56 C ATOM 1307 C GLY A 152 -31.657 19.625 119.633 1.00 37.90 C ATOM 1308 O GLY A 152 -31.424 19.733 118.433 1.00 44.96 O ATOM 1309 H GLY A 152 -32.853 18.423 122.278 1.00 0.00 H ATOM 1310 N GLU A 153 -31.213 20.492 120.536 1.00 35.53 N ATOM 1311 CA GLU A 153 -30.383 21.616 120.201 1.00 38.62 C ATOM 1312 C GLU A 153 -28.980 21.306 120.721 1.00 35.63 C ATOM 1313 O GLU A 153 -28.833 20.713 121.782 1.00 36.64 O ATOM 1314 CB GLU A 153 -30.935 22.915 120.800 1.00 42.75 C ATOM 1315 CG GLU A 153 -32.008 23.607 119.972 1.00 48.00 C ATOM 1316 CD GLU A 153 -31.961 25.134 120.037 1.00 59.93 C ATOM 1317 OE1 GLU A 153 -31.600 25.685 121.118 1.00 65.05 O ATOM 1318 OE2 GLU A 153 -32.260 25.787 119.001 1.00 65.66 O ATOM 1319 H GLU A 153 -31.478 20.351 121.532 1.00 0.00 H ATOM 1320 N GLU A 154 -27.958 21.701 119.964 1.00 35.09 N ATOM 1321 CA GLU A 154 -26.602 21.423 120.355 1.00 36.19 C ATOM 1322 C GLU A 154 -25.722 22.637 120.047 1.00 34.35 C ATOM 1323 O GLU A 154 -26.032 23.420 119.194 1.00 34.90 O ATOM 1324 CB GLU A 154 -26.126 20.098 119.738 1.00 39.07 C ATOM 1325 CG GLU A 154 -26.151 20.005 118.215 1.00 39.19 C ATOM 1326 CD GLU A 154 -25.486 18.747 117.651 1.00 40.18 C ATOM 1327 OE1 GLU A 154 -24.611 18.168 118.323 1.00 38.67 O ATOM 1328 OE2 GLU A 154 -25.858 18.322 116.547 1.00 39.84 O ATOM 1329 H GLU A 154 -28.142 22.216 119.080 1.00 0.00 H ATOM 1330 N MET A 155 -24.654 22.800 120.832 1.00 37.42 N ATOM 1331 CA MET A 155 -23.627 23.811 120.611 1.00 36.94 C ATOM 1332 C MET A 155 -22.246 23.237 120.963 1.00 38.56 C ATOM 1333 O MET A 155 -22.101 22.432 121.914 1.00 35.08 O ATOM 1334 CB MET A 155 -23.885 25.060 121.446 1.00 36.66 C ATOM 1335 CG MET A 155 -23.554 26.308 120.674 1.00 40.50 C ATOM 1336 SD MET A 155 -22.826 27.606 121.689 1.00 44.62 S ATOM 1337 CE MET A 155 -24.287 28.618 121.892 1.00 44.43 C ATOM 1338 H MET A 155 -24.548 22.167 121.651 1.00 0.00 H ATOM 1339 N ALA A 156 -21.239 23.654 120.179 1.00 39.35 N ATOM 1340 CA ALA A 156 -19.901 23.067 120.202 1.00 38.80 C ATOM 1341 C ALA A 156 -18.874 24.107 119.749 1.00 39.39 C ATOM 1342 O ALA A 156 -19.125 24.808 118.773 1.00 40.24 O ATOM 1343 CB ALA A 156 -19.881 21.855 119.300 1.00 38.29 C ATOM 1344 H ALA A 156 -21.421 24.437 119.520 1.00 0.00 H ATOM 1345 N THR A 157 -17.716 24.163 120.423 1.00 40.72 N ATOM 1346 CA THR A 157 -16.638 25.111 120.067 1.00 44.67 C ATOM 1347 C THR A 157 -16.399 25.066 118.546 1.00 49.67 C ATOM 1348 O THR A 157 -16.440 23.967 117.923 1.00 49.34 O ATOM 1349 CB THR A 157 -15.319 24.842 120.814 1.00 42.40 C ATOM 1350 OG1 THR A 157 -14.873 23.540 120.466 1.00 43.24 O ATOM 1351 CG2 THR A 157 -15.411 24.907 122.320 1.00 42.82 C ATOM 1352 HG1 THR A 157 -14.728 23.493 119.488 1.00 0.00 H ATOM 1353 H THR A 157 -17.571 23.517 121.225 1.00 0.00 H ATOM 1354 N LYS A 158 -16.170 26.255 117.957 1.00 48.75 N ATOM 1355 CA LYS A 158 -15.895 26.443 116.513 1.00 49.32 C ATOM 1356 C LYS A 158 -16.975 25.758 115.657 1.00 50.39 C ATOM 1357 O LYS A 158 -16.759 25.514 114.457 1.00 51.97 O ATOM 1358 CB LYS A 158 -14.499 25.919 116.166 1.00 50.88 C ATOM 1359 CG LYS A 158 -13.376 26.501 117.016 1.00 56.47 C ATOM 1360 CD LYS A 158 -11.981 26.079 116.580 1.00 63.56 C ATOM 1361 CE LYS A 158 -10.867 26.894 117.213 1.00 66.82 C ATOM 1362 NZ LYS A 158 -9.608 26.810 116.428 1.00 67.45 N ATOM 1363 HZ1 LYS A 158 -9.299 25.818 116.376 1.00 0.00 H ATOM 1364 HZ2 LYS A 158 -9.775 27.174 115.468 1.00 0.00 H ATOM 1365 HZ3 LYS A 158 -8.872 27.380 116.893 1.00 0.00 H ATOM 1366 H LYS A 158 -16.187 27.103 118.559 1.00 0.00 H ATOM 1367 N ALA A 159 -18.144 25.494 116.270 1.00 46.13 N ATOM 1368 CA ALA A 159 -19.265 24.750 115.680 1.00 40.70 C ATOM 1369 C ALA A 159 -18.765 23.464 115.016 1.00 39.35 C ATOM 1370 O ALA A 159 -19.190 23.137 113.944 1.00 40.01 O ATOM 1371 CB ALA A 159 -20.003 25.629 114.706 1.00 38.29 C ATOM 1372 H ALA A 159 -18.263 25.846 117.241 1.00 0.00 H ATOM 1373 N ASP A 160 -17.845 22.762 115.686 1.00 41.86 N ATOM 1374 CA ASP A 160 -17.264 21.510 115.210 1.00 41.15 C ATOM 1375 C ASP A 160 -17.853 20.390 116.082 1.00 40.23 C ATOM 1376 O ASP A 160 -17.462 20.179 117.232 1.00 42.31 O ATOM 1377 CB ASP A 160 -15.738 21.624 115.200 1.00 42.45 C ATOM 1378 CG ASP A 160 -14.972 20.344 114.896 1.00 46.49 C ATOM 1379 OD1 ASP A 160 -15.552 19.440 114.250 1.00 49.67 O ATOM 1380 OD2 ASP A 160 -13.783 20.264 115.312 1.00 46.47 O ATOM 1381 H ASP A 160 -17.523 23.131 116.604 1.00 0.00 H ATOM 1382 N TYR A 161 -18.838 19.694 115.520 1.00 38.56 N ATOM 1383 CA TYR A 161 -19.727 18.821 116.271 1.00 38.78 C ATOM 1384 C TYR A 161 -19.168 17.388 116.346 1.00 36.55 C ATOM 1385 O TYR A 161 -19.888 16.461 116.747 1.00 34.39 O ATOM 1386 CB TYR A 161 -21.124 18.860 115.644 1.00 38.88 C ATOM 1387 CG TYR A 161 -21.827 20.192 115.738 1.00 39.58 C ATOM 1388 CD1 TYR A 161 -22.339 20.636 116.949 1.00 41.35 C ATOM 1389 CD2 TYR A 161 -22.015 20.994 114.623 1.00 37.61 C ATOM 1390 CE1 TYR A 161 -23.017 21.838 117.052 1.00 38.82 C ATOM 1391 CE2 TYR A 161 -22.673 22.209 114.713 1.00 36.82 C ATOM 1392 CZ TYR A 161 -23.181 22.624 115.930 1.00 37.20 C ATOM 1393 OH TYR A 161 -23.841 23.802 116.053 1.00 40.34 O ATOM 1394 HH TYR A 161 -24.126 23.922 116.993 1.00 0.00 H ATOM 1395 H TYR A 161 -18.979 19.778 114.493 1.00 0.00 H ATOM 1396 N THR A 162 -17.904 17.207 115.943 1.00 36.08 N ATOM 1397 CA THR A 162 -17.091 16.012 116.260 1.00 39.01 C ATOM 1398 C THR A 162 -17.680 14.747 115.599 1.00 37.04 C ATOM 1399 O THR A 162 -16.977 14.028 114.913 1.00 35.36 O ATOM 1400 CB THR A 162 -16.900 15.857 117.779 1.00 43.05 C ATOM 1401 OG1 THR A 162 -16.620 17.111 118.420 1.00 47.71 O ATOM 1402 CG2 THR A 162 -15.796 14.881 118.124 1.00 43.84 C ATOM 1403 HG1 THR A 162 -16.505 16.965 119.392 1.00 0.00 H ATOM 1404 H THR A 162 -17.465 17.955 115.370 1.00 0.00 H ATOM 1405 N LEU A 163 -18.967 14.464 115.825 1.00 37.88 N ATOM 1406 CA LEU A 163 -19.608 13.224 115.377 1.00 37.20 C ATOM 1407 C LEU A 163 -20.379 13.443 114.071 1.00 35.84 C ATOM 1408 O LEU A 163 -20.655 14.568 113.673 1.00 35.09 O ATOM 1409 CB LEU A 163 -20.564 12.749 116.473 1.00 37.32 C ATOM 1410 CG LEU A 163 -19.907 12.279 117.766 1.00 39.18 C ATOM 1411 CD1 LEU A 163 -20.975 11.909 118.794 1.00 40.44 C ATOM 1412 CD2 LEU A 163 -18.962 11.107 117.512 1.00 38.08 C ATOM 1413 H LEU A 163 -19.542 15.158 116.344 1.00 0.00 H ATOM 1414 N ASP A 164 -20.757 12.333 113.437 1.00 36.71 N ATOM 1415 CA ASP A 164 -21.657 12.361 112.288 1.00 41.66 C ATOM 1416 C ASP A 164 -23.101 12.557 112.786 1.00 41.63 C ATOM 1417 O ASP A 164 -23.400 12.383 113.954 1.00 40.66 O ATOM 1418 CB ASP A 164 -21.476 11.128 111.395 1.00 40.96 C ATOM 1419 CG ASP A 164 -21.774 9.812 112.087 1.00 45.39 C ATOM 1420 OD1 ASP A 164 -21.626 9.749 113.333 1.00 49.91 O ATOM 1421 OD2 ASP A 164 -22.134 8.856 111.376 1.00 49.38 O ATOM 1422 H ASP A 164 -20.399 11.416 113.772 1.00 0.00 H ATOM 1423 N GLU A 165 -23.993 12.906 111.857 1.00 42.56 N ATOM 1424 CA GLU A 165 -25.314 13.373 112.173 1.00 45.05 C ATOM 1425 C GLU A 165 -26.106 12.240 112.831 1.00 42.57 C ATOM 1426 O GLU A 165 -26.782 12.481 113.836 1.00 47.72 O ATOM 1427 CB GLU A 165 -25.993 13.920 110.915 1.00 48.91 C ATOM 1428 CG GLU A 165 -25.262 15.098 110.283 1.00 51.74 C ATOM 1429 CD GLU A 165 -25.892 16.469 110.496 1.00 57.82 C ATOM 1430 OE1 GLU A 165 -27.137 16.580 110.369 1.00 64.03 O ATOM 1431 OE2 GLU A 165 -25.136 17.435 110.755 1.00 59.42 O ATOM 1432 H GLU A 165 -23.719 12.837 110.856 1.00 0.00 H ATOM 1433 N GLU A 166 -25.987 11.024 112.288 1.00 39.82 N ATOM 1434 CA GLU A 166 -26.683 9.832 112.808 1.00 41.53 C ATOM 1435 C GLU A 166 -26.335 9.622 114.285 1.00 38.69 C ATOM 1436 O GLU A 166 -27.208 9.314 115.087 1.00 37.94 O ATOM 1437 CB GLU A 166 -26.337 8.553 112.040 1.00 43.17 C ATOM 1438 CG GLU A 166 -26.885 7.304 112.713 1.00 49.56 C ATOM 1439 CD GLU A 166 -26.743 5.982 111.970 1.00 59.25 C ATOM 1440 OE1 GLU A 166 -27.248 4.958 112.499 1.00 61.91 O ATOM 1441 OE2 GLU A 166 -26.123 5.963 110.879 1.00 65.47 O ATOM 1442 H GLU A 166 -25.372 10.913 111.457 1.00 0.00 H ATOM 1443 N SER A 167 -25.056 9.786 114.626 1.00 36.04 N ATOM 1444 CA SER A 167 -24.602 9.624 115.990 1.00 36.68 C ATOM 1445 C SER A 167 -25.194 10.711 116.895 1.00 35.07 C ATOM 1446 O SER A 167 -25.607 10.435 118.015 1.00 36.43 O ATOM 1447 CB SER A 167 -23.108 9.600 116.047 1.00 37.34 C ATOM 1448 OG SER A 167 -22.641 8.402 115.453 1.00 38.81 O ATOM 1449 HG SER A 167 -22.940 8.364 114.510 1.00 0.00 H ATOM 1450 H SER A 167 -24.365 10.038 113.890 1.00 0.00 H ATOM 1451 N ARG A 168 -25.265 11.938 116.384 1.00 33.17 N ATOM 1452 CA ARG A 168 -25.803 13.058 117.131 1.00 32.60 C ATOM 1453 C ARG A 168 -27.340 12.990 117.221 1.00 31.12 C ATOM 1454 O ARG A 168 -27.925 13.670 118.037 1.00 30.54 O ATOM 1455 CB ARG A 168 -25.298 14.364 116.507 1.00 33.98 C ATOM 1456 CG ARG A 168 -23.782 14.507 116.570 1.00 33.76 C ATOM 1457 CD ARG A 168 -23.299 15.927 116.361 1.00 34.75 C ATOM 1458 NE ARG A 168 -23.041 16.225 114.956 1.00 36.70 N ATOM 1459 CZ ARG A 168 -23.789 17.020 114.197 1.00 35.22 C ATOM 1460 NH1 ARG A 168 -24.707 17.792 114.742 1.00 36.37 N ATOM 1461 NH2 ARG A 168 -23.636 17.026 112.889 1.00 34.93 N ATOM 1462 HE ARG A 168 -22.210 15.782 114.515 1.00 0.00 H ATOM 1463 HH12 ARG A 168 -25.289 18.411 114.142 1.00 0.00 H ATOM 1464 HH11 ARG A 168 -24.850 17.782 115.772 1.00 0.00 H ATOM 1465 HH22 ARG A 168 -24.224 17.650 112.300 1.00 0.00 H ATOM 1466 HH21 ARG A 168 -22.928 16.407 112.445 1.00 0.00 H ATOM 1467 H ARG A 168 -24.923 12.099 115.415 1.00 0.00 H ATOM 1468 N ALA A 169 -27.996 12.160 116.407 1.00 29.34 N ATOM 1469 CA ALA A 169 -29.447 12.069 116.413 1.00 29.36 C ATOM 1470 C ALA A 169 -29.941 11.048 117.462 1.00 31.09 C ATOM 1471 O ALA A 169 -30.969 11.247 118.134 1.00 29.50 O ATOM 1472 CB ALA A 169 -29.901 11.728 115.019 1.00 29.89 C ATOM 1473 H ALA A 169 -27.454 11.562 115.751 1.00 0.00 H ATOM 1474 N ARG A 170 -29.224 9.930 117.592 1.00 33.29 N ATOM 1475 CA ARG A 170 -29.484 8.949 118.630 1.00 36.20 C ATOM 1476 C ARG A 170 -29.414 9.620 120.017 1.00 34.27 C ATOM 1477 O ARG A 170 -30.198 9.323 120.917 1.00 33.06 O ATOM 1478 CB ARG A 170 -28.453 7.816 118.564 1.00 42.73 C ATOM 1479 CG ARG A 170 -28.590 6.869 117.381 1.00 47.96 C ATOM 1480 CD ARG A 170 -27.704 5.650 117.596 1.00 56.63 C ATOM 1481 NE ARG A 170 -27.147 5.065 116.373 1.00 65.08 N ATOM 1482 CZ ARG A 170 -25.899 5.243 115.921 1.00 70.73 C ATOM 1483 NH1 ARG A 170 -25.073 6.087 116.522 1.00 70.11 N ATOM 1484 NH2 ARG A 170 -25.484 4.579 114.852 1.00 71.58 N ATOM 1485 HE ARG A 170 -27.775 4.459 115.807 1.00 0.00 H ATOM 1486 HH12 ARG A 170 -24.106 6.215 116.160 1.00 0.00 H ATOM 1487 HH11 ARG A 170 -25.391 6.621 117.356 1.00 0.00 H ATOM 1488 HH22 ARG A 170 -24.515 4.715 114.499 1.00 0.00 H ATOM 1489 HH21 ARG A 170 -26.127 3.922 114.366 1.00 0.00 H ATOM 1490 H ARG A 170 -28.448 9.754 116.923 1.00 0.00 H ATOM 1491 N ILE A 171 -28.430 10.502 120.204 1.00 31.56 N ATOM 1492 CA ILE A 171 -28.240 11.178 121.462 1.00 29.20 C ATOM 1493 C ILE A 171 -29.447 12.079 121.739 1.00 27.25 C ATOM 1494 O ILE A 171 -29.983 12.076 122.838 1.00 27.72 O ATOM 1495 CB ILE A 171 -26.908 11.950 121.461 1.00 29.67 C ATOM 1496 CG1 ILE A 171 -25.734 10.968 121.453 1.00 30.14 C ATOM 1497 CG2 ILE A 171 -26.833 12.923 122.634 1.00 29.83 C ATOM 1498 CD1 ILE A 171 -24.380 11.619 121.414 1.00 30.45 C ATOM 1499 H ILE A 171 -27.781 10.708 119.418 1.00 0.00 H ATOM 1500 N LYS A 172 -29.853 12.840 120.724 1.00 24.92 N ATOM 1501 CA LYS A 172 -30.846 13.857 120.855 1.00 24.01 C ATOM 1502 C LYS A 172 -32.195 13.202 121.142 1.00 25.93 C ATOM 1503 O LYS A 172 -32.950 13.645 122.011 1.00 25.82 O ATOM 1504 CB LYS A 172 -30.892 14.683 119.568 1.00 24.09 C ATOM 1505 CG LYS A 172 -29.771 15.707 119.410 1.00 23.77 C ATOM 1506 CD LYS A 172 -29.754 16.371 118.068 1.00 23.80 C ATOM 1507 CE LYS A 172 -28.575 17.293 117.891 1.00 24.89 C ATOM 1508 NZ LYS A 172 -28.404 17.670 116.468 1.00 25.39 N ATOM 1509 HZ1 LYS A 172 -28.246 16.813 115.900 1.00 0.00 H ATOM 1510 HZ2 LYS A 172 -29.261 18.156 116.134 1.00 0.00 H ATOM 1511 HZ3 LYS A 172 -27.586 18.305 116.375 1.00 0.00 H ATOM 1512 H LYS A 172 -29.425 12.685 119.789 1.00 0.00 H ATOM 1513 N THR A 173 -32.484 12.138 120.385 1.00 27.12 N ATOM 1514 CA THR A 173 -33.694 11.331 120.559 1.00 26.89 C ATOM 1515 C THR A 173 -33.796 10.817 122.002 1.00 26.88 C ATOM 1516 O THR A 173 -34.876 10.782 122.601 1.00 28.88 O ATOM 1517 CB THR A 173 -33.679 10.135 119.606 1.00 25.32 C ATOM 1518 OG1 THR A 173 -33.439 10.670 118.304 1.00 26.04 O ATOM 1519 CG2 THR A 173 -34.959 9.332 119.655 1.00 25.39 C ATOM 1520 HG1 THR A 173 -32.569 11.143 118.298 1.00 0.00 H ATOM 1521 H THR A 173 -31.816 11.870 119.635 1.00 0.00 H ATOM 1522 N ARG A 174 -32.657 10.370 122.527 1.00 25.12 N ATOM 1523 CA ARG A 174 -32.614 9.677 123.750 1.00 24.96 C ATOM 1524 C ARG A 174 -32.900 10.690 124.858 1.00 26.74 C ATOM 1525 O ARG A 174 -33.748 10.429 125.716 1.00 31.24 O ATOM 1526 CB ARG A 174 -31.276 8.949 123.877 1.00 24.33 C ATOM 1527 CG ARG A 174 -31.018 8.373 125.256 1.00 23.93 C ATOM 1528 CD ARG A 174 -32.114 7.453 125.704 1.00 23.75 C ATOM 1529 NE ARG A 174 -31.774 6.893 127.004 1.00 24.95 N ATOM 1530 CZ ARG A 174 -32.655 6.543 127.944 1.00 24.82 C ATOM 1531 NH1 ARG A 174 -33.956 6.520 127.690 1.00 24.28 N ATOM 1532 NH2 ARG A 174 -32.221 6.247 129.155 1.00 25.27 N ATOM 1533 HE ARG A 174 -30.766 6.755 127.217 1.00 0.00 H ATOM 1534 HH12 ARG A 174 -34.627 6.245 128.436 1.00 0.00 H ATOM 1535 HH11 ARG A 174 -34.306 6.777 126.745 1.00 0.00 H ATOM 1536 HH22 ARG A 174 -32.896 5.973 129.897 1.00 0.00 H ATOM 1537 HH21 ARG A 174 -31.204 6.288 129.367 1.00 0.00 H ATOM 1538 H ARG A 174 -31.768 10.539 122.015 1.00 0.00 H ATOM 1539 N LEU A 175 -32.231 11.848 124.799 1.00 24.48 N ATOM 1540 CA LEU A 175 -32.465 12.940 125.733 1.00 23.53 C ATOM 1541 C LEU A 175 -33.946 13.331 125.696 1.00 23.84 C ATOM 1542 O LEU A 175 -34.599 13.384 126.731 1.00 26.72 O ATOM 1543 CB LEU A 175 -31.567 14.130 125.369 1.00 23.46 C ATOM 1544 CG LEU A 175 -30.096 13.964 125.737 1.00 23.96 C ATOM 1545 CD1 LEU A 175 -29.234 15.047 125.127 1.00 23.04 C ATOM 1546 CD2 LEU A 175 -29.925 13.929 127.248 1.00 25.17 C ATOM 1547 H LEU A 175 -31.515 11.973 124.055 1.00 0.00 H ATOM 1548 N PHE A 176 -34.466 13.594 124.496 1.00 23.38 N ATOM 1549 CA PHE A 176 -35.870 13.987 124.295 1.00 22.98 C ATOM 1550 C PHE A 176 -36.792 12.903 124.857 1.00 21.46 C ATOM 1551 O PHE A 176 -37.830 13.210 125.411 1.00 21.62 O ATOM 1552 CB PHE A 176 -36.154 14.254 122.810 1.00 23.70 C ATOM 1553 CG PHE A 176 -37.499 14.860 122.508 1.00 23.67 C ATOM 1554 CD1 PHE A 176 -38.619 14.064 122.364 1.00 25.90 C ATOM 1555 CD2 PHE A 176 -37.649 16.221 122.366 1.00 24.84 C ATOM 1556 CE1 PHE A 176 -39.859 14.615 122.088 1.00 25.98 C ATOM 1557 CE2 PHE A 176 -38.890 16.778 122.106 1.00 25.53 C ATOM 1558 CZ PHE A 176 -39.991 15.973 121.957 1.00 25.82 C ATOM 1559 H PHE A 176 -33.849 13.518 123.662 1.00 0.00 H ATOM 1560 N THR A 177 -36.402 11.638 124.709 1.00 21.45 N ATOM 1561 CA THR A 177 -37.229 10.549 125.180 1.00 22.91 C ATOM 1562 C THR A 177 -37.322 10.625 126.707 1.00 23.08 C ATOM 1563 O THR A 177 -38.426 10.504 127.271 1.00 23.53 O ATOM 1564 CB THR A 177 -36.741 9.176 124.693 1.00 23.18 C ATOM 1565 OG1 THR A 177 -37.003 9.026 123.292 1.00 22.95 O ATOM 1566 CG2 THR A 177 -37.428 8.048 125.436 1.00 22.74 C ATOM 1567 HG1 THR A 177 -36.528 9.736 122.791 1.00 0.00 H ATOM 1568 H THR A 177 -35.492 11.431 124.249 1.00 0.00 H ATOM 1569 N ILE A 178 -36.162 10.813 127.351 1.00 22.64 N ATOM 1570 CA ILE A 178 -36.064 10.997 128.800 1.00 22.54 C ATOM 1571 C ILE A 178 -36.960 12.174 129.219 1.00 22.23 C ATOM 1572 O ILE A 178 -37.775 12.051 130.109 1.00 23.06 O ATOM 1573 CB ILE A 178 -34.599 11.194 129.237 1.00 22.47 C ATOM 1574 CG1 ILE A 178 -33.806 9.890 129.124 1.00 22.56 C ATOM 1575 CG2 ILE A 178 -34.528 11.769 130.646 1.00 23.25 C ATOM 1576 CD1 ILE A 178 -32.310 10.048 129.332 1.00 22.23 C ATOM 1577 H ILE A 178 -35.285 10.829 126.792 1.00 0.00 H ATOM 1578 N ARG A 179 -36.811 13.322 128.570 1.00 22.41 N ATOM 1579 CA ARG A 179 -37.687 14.432 128.854 1.00 24.12 C ATOM 1580 C ARG A 179 -39.150 13.971 128.797 1.00 24.68 C ATOM 1581 O ARG A 179 -39.926 14.279 129.700 1.00 25.22 O ATOM 1582 CB ARG A 179 -37.457 15.584 127.879 1.00 24.89 C ATOM 1583 CG ARG A 179 -38.484 16.697 127.994 1.00 25.90 C ATOM 1584 CD ARG A 179 -38.103 17.840 127.076 1.00 28.62 C ATOM 1585 NE ARG A 179 -39.210 18.730 126.736 1.00 30.86 N ATOM 1586 CZ ARG A 179 -39.153 19.677 125.808 1.00 30.38 C ATOM 1587 NH1 ARG A 179 -38.021 19.882 125.148 1.00 32.03 N ATOM 1588 NH2 ARG A 179 -40.227 20.396 125.533 1.00 27.27 N ATOM 1589 HE ARG A 179 -40.103 18.614 127.256 1.00 0.00 H ATOM 1590 HH12 ARG A 179 -37.970 20.623 124.420 1.00 0.00 H ATOM 1591 HH11 ARG A 179 -37.184 19.302 125.359 1.00 0.00 H ATOM 1592 HH22 ARG A 179 -40.184 21.138 124.806 1.00 0.00 H ATOM 1593 HH21 ARG A 179 -41.116 20.219 126.044 1.00 0.00 H ATOM 1594 H ARG A 179 -36.062 13.421 127.856 1.00 0.00 H ATOM 1595 N GLN A 180 -39.522 13.244 127.740 1.00 24.86 N ATOM 1596 CA GLN A 180 -40.947 12.935 127.496 1.00 26.45 C ATOM 1597 C GLN A 180 -41.451 11.902 128.519 1.00 27.28 C ATOM 1598 O GLN A 180 -42.629 11.923 128.891 1.00 25.34 O ATOM 1599 CB GLN A 180 -41.179 12.447 126.057 1.00 25.76 C ATOM 1600 CG GLN A 180 -41.121 13.544 125.001 1.00 24.35 C ATOM 1601 CD GLN A 180 -42.041 14.690 125.324 1.00 23.42 C ATOM 1602 OE1 GLN A 180 -43.158 14.505 125.809 1.00 22.87 O ATOM 1603 NE2 GLN A 180 -41.557 15.895 125.081 1.00 22.47 N ATOM 1604 HE22 GLN A 180 -40.607 16.001 124.670 1.00 0.00 H ATOM 1605 HE21 GLN A 180 -42.126 16.738 125.300 1.00 0.00 H ATOM 1606 H GLN A 180 -38.800 12.891 127.080 1.00 0.00 H ATOM 1607 N GLU A 181 -40.569 10.986 128.935 1.00 29.23 N ATOM 1608 CA GLU A 181 -40.900 10.010 129.955 1.00 33.84 C ATOM 1609 C GLU A 181 -41.124 10.751 131.281 1.00 34.22 C ATOM 1610 O GLU A 181 -42.107 10.486 131.988 1.00 34.13 O ATOM 1611 CB GLU A 181 -39.816 8.931 130.081 1.00 39.71 C ATOM 1612 CG GLU A 181 -40.148 7.618 129.373 1.00 45.97 C ATOM 1613 CD GLU A 181 -41.457 6.941 129.794 1.00 53.42 C ATOM 1614 OE1 GLU A 181 -41.842 7.059 130.997 1.00 59.26 O ATOM 1615 OE2 GLU A 181 -42.111 6.302 128.919 1.00 53.80 O ATOM 1616 H GLU A 181 -39.618 10.974 128.514 1.00 0.00 H ATOM 1617 N MET A 182 -40.236 11.709 131.583 1.00 33.80 N ATOM 1618 CA MET A 182 -40.339 12.512 132.808 1.00 32.96 C ATOM 1619 C MET A 182 -41.701 13.221 132.852 1.00 32.79 C ATOM 1620 O MET A 182 -42.366 13.205 133.877 1.00 32.93 O ATOM 1621 CB MET A 182 -39.202 13.535 132.920 1.00 31.15 C ATOM 1622 CG MET A 182 -37.968 12.994 133.627 1.00 30.63 C ATOM 1623 SD MET A 182 -36.652 14.228 133.732 1.00 30.73 S ATOM 1624 CE MET A 182 -35.283 13.248 134.348 1.00 29.64 C ATOM 1625 H MET A 182 -39.448 11.889 130.928 1.00 0.00 H ATOM 1626 N ALA A 183 -42.116 13.802 131.724 1.00 32.09 N ATOM 1627 CA ALA A 183 -43.363 14.545 131.631 1.00 32.26 C ATOM 1628 C ALA A 183 -44.596 13.615 131.733 1.00 35.86 C ATOM 1629 O ALA A 183 -45.636 14.021 132.284 1.00 33.92 O ATOM 1630 CB ALA A 183 -43.356 15.342 130.358 1.00 30.43 C ATOM 1631 H ALA A 183 -41.522 13.720 130.875 1.00 0.00 H ATOM 1632 N SER A 184 -44.495 12.375 131.228 1.00 37.43 N ATOM 1633 CA SER A 184 -45.541 11.355 131.432 1.00 37.09 C ATOM 1634 C SER A 184 -45.853 11.214 132.916 1.00 35.37 C ATOM 1635 O SER A 184 -47.005 11.161 133.280 1.00 35.87 O ATOM 1636 CB SER A 184 -45.154 10.026 130.878 1.00 38.86 C ATOM 1637 OG SER A 184 -44.875 10.152 129.498 1.00 45.79 O ATOM 1638 HG SER A 184 -44.131 10.792 129.370 1.00 0.00 H ATOM 1639 H SER A 184 -43.651 12.125 130.674 1.00 0.00 H ATOM 1640 N ARG A 185 -44.801 11.175 133.743 1.00 35.80 N ATOM 1641 CA ARG A 185 -44.894 10.976 135.200 1.00 35.91 C ATOM 1642 C ARG A 185 -45.024 12.317 135.955 1.00 35.38 C ATOM 1643 O ARG A 185 -44.978 12.331 137.170 1.00 36.04 O ATOM 1644 CB ARG A 185 -43.674 10.175 135.677 1.00 37.64 C ATOM 1645 CG ARG A 185 -43.617 8.739 135.164 1.00 40.24 C ATOM 1646 CD ARG A 185 -42.204 8.171 135.101 1.00 44.87 C ATOM 1647 NE ARG A 185 -42.099 6.853 134.462 1.00 50.48 N ATOM 1648 CZ ARG A 185 -41.723 5.726 135.085 1.00 52.80 C ATOM 1649 NH1 ARG A 185 -41.515 5.720 136.393 1.00 50.77 N ATOM 1650 NH2 ARG A 185 -41.542 4.610 134.396 1.00 48.81 N ATOM 1651 HE ARG A 185 -42.334 6.788 133.451 1.00 0.00 H ATOM 1652 HH12 ARG A 185 -41.224 4.843 136.869 1.00 0.00 H ATOM 1653 HH11 ARG A 185 -41.643 6.593 136.944 1.00 0.00 H ATOM 1654 HH22 ARG A 185 -41.250 3.739 134.884 1.00 0.00 H ATOM 1655 HH21 ARG A 185 -41.691 4.604 133.367 1.00 0.00 H ATOM 1656 H ARG A 185 -43.854 11.293 133.329 1.00 0.00 H ATOM 1657 N SER A 186 -45.209 13.432 135.236 1.00 34.51 N ATOM 1658 CA SER A 186 -45.343 14.782 135.802 1.00 33.85 C ATOM 1659 C SER A 186 -44.116 15.155 136.627 1.00 33.94 C ATOM 1660 O SER A 186 -44.261 15.780 137.659 1.00 34.39 O ATOM 1661 CB SER A 186 -46.589 14.934 136.620 1.00 34.40 C ATOM 1662 OG SER A 186 -47.728 14.978 135.772 1.00 37.17 O ATOM 1663 HG SER A 186 -48.544 15.078 136.323 1.00 0.00 H ATOM 1664 H SER A 186 -45.262 13.335 134.202 1.00 0.00 H ATOM 1665 N LEU A 187 -42.928 14.807 136.111 1.00 34.62 N ATOM 1666 CA LEU A 187 -41.636 15.027 136.769 1.00 32.25 C ATOM 1667 C LEU A 187 -40.767 16.057 136.038 1.00 30.28 C ATOM 1668 O LEU A 187 -39.768 16.520 136.602 1.00 28.42 O ATOM 1669 CB LEU A 187 -40.907 13.686 136.824 1.00 33.58 C ATOM 1670 CG LEU A 187 -41.483 12.695 137.822 1.00 32.89 C ATOM 1671 CD1 LEU A 187 -40.763 11.360 137.711 1.00 32.94 C ATOM 1672 CD2 LEU A 187 -41.385 13.268 139.230 1.00 33.64 C ATOM 1673 H LEU A 187 -42.923 14.348 135.178 1.00 0.00 H ATOM 1674 N TRP A 188 -41.144 16.426 134.809 1.00 29.61 N ATOM 1675 CA TRP A 188 -40.299 17.284 133.982 1.00 29.95 C ATOM 1676 C TRP A 188 -40.190 18.685 134.593 1.00 30.25 C ATOM 1677 O TRP A 188 -39.101 19.220 134.726 1.00 30.83 O ATOM 1678 CB TRP A 188 -40.812 17.331 132.540 1.00 28.74 C ATOM 1679 CG TRP A 188 -40.098 18.323 131.680 1.00 27.20 C ATOM 1680 CD1 TRP A 188 -40.634 19.437 131.113 1.00 27.17 C ATOM 1681 CD2 TRP A 188 -38.706 18.326 131.330 1.00 28.23 C ATOM 1682 NE1 TRP A 188 -39.678 20.124 130.416 1.00 28.72 N ATOM 1683 CE2 TRP A 188 -38.486 19.464 130.523 1.00 28.41 C ATOM 1684 CE3 TRP A 188 -37.633 17.467 131.585 1.00 28.72 C ATOM 1685 CZ2 TRP A 188 -37.247 19.760 129.959 1.00 28.33 C ATOM 1686 CZ3 TRP A 188 -36.407 17.758 131.023 1.00 29.44 C ATOM 1687 CH2 TRP A 188 -36.217 18.888 130.223 1.00 28.85 C ATOM 1688 HE1 TRP A 188 -39.833 21.007 129.889 1.00 0.00 H ATOM 1689 H TRP A 188 -42.056 16.096 134.435 1.00 0.00 H ATOM 1690 N ASP A 189 -41.326 19.265 134.976 1.00 32.35 N ATOM 1691 CA ASP A 189 -41.364 20.655 135.463 1.00 36.04 C ATOM 1692 C ASP A 189 -40.404 20.856 136.656 1.00 32.19 C ATOM 1693 O ASP A 189 -39.684 21.835 136.719 1.00 27.67 O ATOM 1694 CB ASP A 189 -42.797 21.061 135.819 1.00 40.65 C ATOM 1695 CG ASP A 189 -43.171 22.432 135.294 1.00 48.82 C ATOM 1696 OD1 ASP A 189 -42.301 23.345 135.338 1.00 56.31 O ATOM 1697 OD2 ASP A 189 -44.324 22.571 134.828 1.00 56.55 O ATOM 1698 H ASP A 189 -42.211 18.721 134.930 1.00 0.00 H ATOM 1699 N SER A 190 -40.436 19.930 137.618 1.00 30.94 N ATOM 1700 CA SER A 190 -39.538 19.954 138.752 1.00 31.17 C ATOM 1701 C SER A 190 -38.098 19.999 138.226 1.00 31.01 C ATOM 1702 O SER A 190 -37.331 20.923 138.556 1.00 29.95 O ATOM 1703 CB SER A 190 -39.807 18.761 139.672 1.00 31.69 C ATOM 1704 OG SER A 190 -38.863 18.657 140.734 1.00 29.89 O ATOM 1705 HG SER A 190 -39.084 17.872 141.295 1.00 0.00 H ATOM 1706 H SER A 190 -41.134 19.162 137.549 1.00 0.00 H ATOM 1707 N PHE A 191 -37.797 19.028 137.350 1.00 30.91 N ATOM 1708 CA PHE A 191 -36.464 18.735 136.814 1.00 30.81 C ATOM 1709 C PHE A 191 -35.911 19.937 136.030 1.00 30.40 C ATOM 1710 O PHE A 191 -34.778 20.358 136.230 1.00 29.70 O ATOM 1711 CB PHE A 191 -36.515 17.465 135.957 1.00 28.84 C ATOM 1712 CG PHE A 191 -35.167 17.001 135.472 1.00 28.56 C ATOM 1713 CD1 PHE A 191 -34.203 16.555 136.369 1.00 31.29 C ATOM 1714 CD2 PHE A 191 -34.842 17.041 134.132 1.00 27.38 C ATOM 1715 CE1 PHE A 191 -32.946 16.146 135.934 1.00 30.47 C ATOM 1716 CE2 PHE A 191 -33.589 16.635 133.698 1.00 29.44 C ATOM 1717 CZ PHE A 191 -32.639 16.192 134.598 1.00 29.59 C ATOM 1718 H PHE A 191 -38.581 18.429 137.021 1.00 0.00 H ATOM 1719 N ARG A 192 -36.740 20.475 135.142 1.00 32.52 N ATOM 1720 CA ARG A 192 -36.407 21.609 134.303 1.00 34.64 C ATOM 1721 C ARG A 192 -35.840 22.747 135.156 1.00 32.50 C ATOM 1722 O ARG A 192 -34.821 23.329 134.808 1.00 30.34 O ATOM 1723 CB ARG A 192 -37.654 22.064 133.535 1.00 38.95 C ATOM 1724 CG ARG A 192 -37.354 22.897 132.295 1.00 43.67 C ATOM 1725 CD ARG A 192 -37.601 24.374 132.521 1.00 45.19 C ATOM 1726 NE ARG A 192 -38.993 24.571 132.888 1.00 47.80 N ATOM 1727 CZ ARG A 192 -39.474 25.675 133.439 1.00 52.29 C ATOM 1728 NH1 ARG A 192 -38.663 26.703 133.649 1.00 48.06 N ATOM 1729 NH2 ARG A 192 -40.758 25.740 133.769 1.00 52.14 N ATOM 1730 HE ARG A 192 -39.657 23.792 132.705 1.00 0.00 H ATOM 1731 HH12 ARG A 192 -39.030 27.575 134.081 1.00 0.00 H ATOM 1732 HH11 ARG A 192 -37.660 26.637 133.382 1.00 0.00 H ATOM 1733 HH22 ARG A 192 -41.140 26.605 134.202 1.00 0.00 H ATOM 1734 HH21 ARG A 192 -41.382 24.926 133.595 1.00 0.00 H ATOM 1735 H ARG A 192 -37.687 20.056 135.043 1.00 0.00 H ATOM 1736 N GLN A 193 -36.503 23.022 136.288 1.00 33.14 N ATOM 1737 CA GLN A 193 -36.302 24.241 137.075 1.00 31.36 C ATOM 1738 C GLN A 193 -35.164 24.089 138.091 1.00 31.74 C ATOM 1739 O GLN A 193 -34.801 25.061 138.702 1.00 31.22 O ATOM 1740 CB GLN A 193 -37.588 24.606 137.807 1.00 29.91 C ATOM 1741 CG GLN A 193 -38.728 24.952 136.869 1.00 31.06 C ATOM 1742 CD GLN A 193 -39.917 25.519 137.605 1.00 31.97 C ATOM 1743 OE1 GLN A 193 -39.909 26.668 138.041 1.00 32.93 O ATOM 1744 NE2 GLN A 193 -40.952 24.710 137.744 1.00 32.83 N ATOM 1745 HE22 GLN A 193 -40.913 23.745 137.358 1.00 0.00 H ATOM 1746 HE21 GLN A 193 -41.806 25.038 138.239 1.00 0.00 H ATOM 1747 H GLN A 193 -37.201 22.330 136.627 1.00 0.00 H ATOM 1748 N SER A 194 -34.600 22.887 138.253 1.00 33.83 N ATOM 1749 CA SER A 194 -33.589 22.647 139.284 1.00 36.64 C ATOM 1750 C SER A 194 -32.175 22.668 138.681 1.00 37.85 C ATOM 1751 O SER A 194 -31.218 22.219 139.299 1.00 36.09 O ATOM 1752 CB SER A 194 -33.881 21.371 140.075 1.00 36.09 C ATOM 1753 OG SER A 194 -33.621 20.216 139.307 1.00 38.08 O ATOM 1754 HG SER A 194 -34.193 20.223 138.499 1.00 0.00 H ATOM 1755 H SER A 194 -34.887 22.104 137.631 1.00 0.00 H ATOM 1756 N GLU A 195 -32.044 23.220 137.473 1.00 44.64 N ATOM 1757 CA GLU A 195 -30.732 23.585 136.942 1.00 49.71 C ATOM 1758 C GLU A 195 -30.358 24.982 137.462 1.00 52.76 C ATOM 1759 O GLU A 195 -31.217 25.860 137.590 1.00 50.48 O ATOM 1760 CB GLU A 195 -30.700 23.511 135.408 1.00 48.48 C ATOM 1761 CG GLU A 195 -29.292 23.299 134.866 1.00 50.18 C ATOM 1762 CD GLU A 195 -29.141 22.981 133.385 1.00 50.53 C ATOM 1763 OE1 GLU A 195 -29.667 21.939 132.947 1.00 48.94 O ATOM 1764 OE2 GLU A 195 -28.464 23.759 132.675 1.00 50.19 O ATOM 1765 H GLU A 195 -32.893 23.394 136.898 1.00 0.00 H ATOM 1766 N ARG A 196 -29.069 25.151 137.789 1.00 60.28 N ATOM 1767 CA ARG A 196 -28.416 26.457 137.963 1.00 63.56 C ATOM 1768 C ARG A 196 -29.048 27.493 137.020 1.00 69.40 C ATOM 1769 O ARG A 196 -29.731 28.440 137.445 1.00 72.85 O ATOM 1770 CB ARG A 196 -26.919 26.349 137.649 1.00 65.97 C ATOM 1771 CG ARG A 196 -26.122 25.461 138.597 1.00 68.34 C ATOM 1772 CD ARG A 196 -24.642 25.813 138.604 1.00 69.51 C ATOM 1773 NE ARG A 196 -23.997 25.610 137.309 1.00 74.17 N ATOM 1774 CZ ARG A 196 -22.964 24.794 137.098 1.00 79.38 C ATOM 1775 NH1 ARG A 196 -22.484 24.619 135.878 1.00 72.55 N ATOM 1776 NH2 ARG A 196 -22.408 24.153 138.110 1.00 88.20 N ATOM 1777 HE ARG A 196 -24.370 26.139 136.495 1.00 0.00 H ATOM 1778 HH12 ARG A 196 -21.678 23.980 135.723 1.00 0.00 H ATOM 1779 HH11 ARG A 196 -22.913 25.120 135.074 1.00 0.00 H ATOM 1780 HH22 ARG A 196 -21.602 23.517 137.943 1.00 0.00 H ATOM 1781 HH21 ARG A 196 -22.776 24.284 139.074 1.00 0.00 H ATOM 1782 H ARG A 196 -28.490 24.299 137.930 1.00 0.00 H TER 1783 ARG A 196 HETATM 1784 MN MN A 1 -19.678 16.924 131.374 1.00 22.89 MN HETATM 1785 MN MN A 2 -17.217 15.140 133.720 1.00 46.84 MN HETATM 1786 O HOH 3 -17.157 11.291 139.405 1.00 22.76 O HETATM 1787 O HOH 4 -17.078 13.954 139.310 1.00 24.55 O HETATM 1788 O HOH 5 -17.221 20.576 133.916 1.00 19.65 O HETATM 1789 O HOH 6 -23.666 18.472 132.058 1.00 26.92 O HETATM 1790 O HOH 7 -17.988 8.618 138.987 1.00 29.48 O HETATM 1791 OAA HO A 1 -17.974 16.030 137.428 1.00 -0.55 O HETATM 1792 CAO HO A 1 -18.125 16.241 136.199 1.00 0.12 C HETATM 1793 OAC HO A 1 -17.402 15.615 135.389 1.00 -0.55 O HETATM 1794 CAU HO A 1 -19.156 17.069 135.727 1.00 0.14 C HETATM 1795 NAN HO A 1 -19.880 17.822 136.672 1.00 -0.26 N HETATM 1796 CAR HO A 1 -20.947 18.648 136.274 1.00 0.05 C HETATM 1797 CAI HO A 1 -21.276 18.688 134.910 1.00 0.01 C HETATM 1798 CAV HO A 1 -20.592 17.957 133.947 1.00 0.16 C HETATM 1799 CAS HO A 1 -19.519 17.150 134.354 1.00 0.20 C HETATM 1800 OAD HO A 1 -18.839 16.418 133.393 1.00 -0.35 O HETATM 1801 H2 HO A 1 -18.916 15.492 133.589 1.00 0.22 H HETATM 1802 H1 HO A 1 -18.823 17.991 134.219 1.00 0.11 H HETATM 1803 OAB HO A 1 -20.962 18.061 132.771 1.00 -0.40 O HETATM 1804 H3 HO A 1 -22.104 19.320 134.593 1.00 0.06 H HETATM 1805 CAP HO A 1 -21.683 19.419 137.201 1.00 0.01 C HETATM 1806 CAH HO A 1 -22.853 20.075 136.780 1.00 -0.03 C HETATM 1807 CAQ HO A 1 -23.658 20.869 137.615 1.00 0.04 C HETATM 1808 CAG HO A 1 -23.262 21.007 138.951 1.00 -0.04 C HETATM 1809 CAE HO A 1 -22.099 20.367 139.398 1.00 -0.05 C HETATM 1810 CAF HO A 1 -21.310 19.580 138.545 1.00 -0.04 C HETATM 1811 H5 HO A 1 -20.416 19.098 138.923 1.00 0.07 H HETATM 1812 H6 HO A 1 -21.800 20.483 140.433 1.00 0.06 H HETATM 1813 H7 HO A 1 -23.852 21.606 139.635 1.00 0.07 H HETATM 1814 CAT HO A 1 -24.781 21.448 137.088 1.00 0.19 C HETATM 1815 NAM HO A 1 -25.193 21.358 135.807 1.00 -0.21 N HETATM 1816 NAK HO A 1 -26.262 22.002 135.662 1.00 -0.14 N HETATM 1817 NAJ HO A 1 -26.589 22.516 136.773 1.00 -0.06 N HETATM 1818 NAL HO A 1 -25.691 22.191 137.713 1.00 -0.15 N HETATM 1819 H8 HO A 1 -25.703 22.459 138.707 1.00 0.27 H HETATM 1820 H4 HO A 1 -23.154 19.961 135.745 1.00 0.07 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 403 401 402 1784 CONECT 509 510 519 520 521 CONECT 519 509 CONECT 520 509 CONECT 521 509 CONECT 587 585 1785 CONECT 856 855 1785 CONECT 857 855 1784 CONECT 985 983 1784 CONECT 990 989 1784 CONECT 1190 1191 1199 1200 1201 CONECT 1199 1190 CONECT 1200 1190 CONECT 1201 1190 CONECT 1784 403 857 985 990 CONECT 1785 587 856 CONECT 1791 1792 CONECT 1792 1791 1793 1794 CONECT 1793 1792 CONECT 1794 1792 1795 1799 CONECT 1795 1794 1796 CONECT 1796 1795 1797 1805 CONECT 1797 1796 1798 1804 CONECT 1798 1797 1799 1803 CONECT 1799 1794 1798 1800 1802 CONECT 1800 1799 1801 CONECT 1801 1800 CONECT 1802 1799 CONECT 1803 1798 CONECT 1804 1797 CONECT 1805 1796 1806 1810 CONECT 1806 1805 1807 1820 CONECT 1807 1806 1808 1814 CONECT 1808 1807 1809 1813 CONECT 1809 1808 1810 1812 CONECT 1810 1805 1809 1811 CONECT 1811 1810 CONECT 1812 1809 CONECT 1813 1808 CONECT 1814 1807 1815 1818 CONECT 1815 1814 1816 CONECT 1816 1815 1817 CONECT 1817 1816 1818 CONECT 1818 1814 1817 1819 CONECT 1819 1818 CONECT 1820 1806 MASTER 0 0 0 0 0 0 0 0 1817 3 50 15 END
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Structure:
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Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 6e3p
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%
6e6w
RCSB PDB
PDBbind
192aa, >6E6W_1|Chain... at 96%
6e6v
RCSB PDB
PDBbind
192aa, >6E6V_1|Chain... at 96%
6e4c
RCSB PDB
PDBbind
192aa, >6E4C_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
6e3p
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Polymerase acidic protein
Ligand Name
HO1
EC.Number
E.C.-.-.-.-
Resolution
2.8(Å)
Affinity (Kd/Ki/IC50)
IC50=2nM
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
3
H
9
N
5
O
4
Molecular Weight
299.242
Exact Mass
299.065
No. of atoms
31
No. of bonds
33
Polar Surface Area
141.42
LOGP Value
1.47 (
Computed with XLOGP3
)
-0.89 (
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)c1cccc(c1)c1nnn[nH]1
InChI String
InChI=1S/C13H9N5O4/c19-9-5-8(14-10(11(9)20)13(21)22)6-2-1-3-7(4-6)12-15-17-18-16-12/h1-5,11,20H,(H,21,22)(H,15,16,17,18)/t11-/m0/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
C3W5S0
Entrez Gene ID
No matched NCBI Entrez Gene ID found!
ASD
Information of known allosteric effects of PDB entries
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