Browse entries in the PDBbind-CN Database
HEADER 4A0J_COMPLEX COMPND 4A0J_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 136 THR LEU PRO PRO ALA TRP GLN PRO PHE LEU LYS ASP HIS SEQRES 2 A 136 ARG ILE SER THR PHE LYS ASN TRP PRO PHE LEU GLU GLY SEQRES 3 A 136 CYS ALA CYS THR PRO GLU ARG MET ALA GLU ALA GLY PHE SEQRES 4 A 136 ILE HIS CYS PRO THR GLU ASN GLU PRO ASP LEU ALA GLN SEQRES 5 A 136 CYS PHE PHE CYS PHE LYS GLU LEU GLU GLY TRP GLU PRO SEQRES 6 A 136 ASP ASP ASP PRO ILE GLU GLU HIS LYS LYS HIS SER SER SEQRES 7 A 136 GLY CYS ALA PHE LEU SER VAL LYS LYS GLN PHE GLU GLU SEQRES 8 A 136 LEU THR LEU GLY GLU PHE LEU LYS LEU ASP ARG GLU ARG SEQRES 9 A 136 ALA LYS ASN LYS ILE ALA LYS GLU THR ASN ASN LYS LYS SEQRES 10 A 136 LYS GLU PHE GLU GLU THR ALA LYS LYS VAL ARG ARG ALA SEQRES 11 A 136 ILE GLU GLN LEU ALA ALA HET ZN A 1 1 HET ALA A 143 96 ATOM 1 N THR A 5 20.319 -28.678 9.824 1.00111.39 N ATOM 2 CA THR A 5 19.532 -29.228 10.928 1.00141.82 C ATOM 3 C THR A 5 18.503 -28.226 11.455 1.00130.06 C ATOM 4 O THR A 5 18.437 -27.087 10.999 1.00102.57 O ATOM 5 CB THR A 5 20.435 -29.717 12.084 1.00149.44 C ATOM 6 OG1 THR A 5 21.680 -29.003 12.054 1.00157.18 O ATOM 7 CG2 THR A 5 20.712 -31.212 11.952 1.00124.08 C ATOM 8 HA THR A 5 18.993 -30.085 10.523 1.00 0.00 H ATOM 9 HB THR A 5 19.922 -29.534 13.028 1.00 0.00 H ATOM 10 HG1 THR A 5 22.257 -29.317 12.795 1.00 0.00 H ATOM 11 HG23 THR A 5 19.769 -31.758 11.974 1.00 0.00 H ATOM 12 HG21 THR A 5 21.222 -31.404 11.008 1.00 0.00 H ATOM 13 HG22 THR A 5 21.342 -31.538 12.780 1.00 0.00 H ATOM 14 HN3 THR A 5 20.827 -27.831 10.150 1.00 0.00 H ATOM 15 HN2 THR A 5 19.684 -28.422 9.041 1.00 0.00 H ATOM 16 HN1 THR A 5 21.003 -29.391 9.499 1.00 0.00 H ATOM 17 N LEU A 6 17.701 -28.651 12.422 1.00138.61 N ATOM 18 CA LEU A 6 16.605 -27.817 12.908 1.00146.46 C ATOM 19 C LEU A 6 16.806 -27.371 14.357 1.00138.61 C ATOM 20 O LEU A 6 17.120 -28.188 15.225 1.00120.72 O ATOM 21 CB LEU A 6 15.262 -28.537 12.741 1.00125.90 C ATOM 22 CG LEU A 6 15.323 -30.019 12.351 1.00138.93 C ATOM 23 CD1 LEU A 6 15.885 -30.221 10.940 1.00114.87 C ATOM 24 CD2 LEU A 6 16.114 -30.830 13.381 1.00144.54 C ATOM 25 HA LEU A 6 16.598 -26.914 12.298 1.00 0.00 H ATOM 26 HB2 LEU A 6 14.728 -28.465 13.688 1.00 0.00 H ATOM 27 HB3 LEU A 6 14.700 -28.014 11.968 1.00 0.00 H ATOM 28 HG LEU A 6 14.298 -30.389 12.344 1.00 0.00 H ATOM 29 HD21 LEU A 6 17.131 -30.444 13.442 1.00 0.00 H ATOM 30 HD22 LEU A 6 15.633 -30.746 14.355 1.00 0.00 H ATOM 31 HD23 LEU A 6 16.139 -31.876 13.076 1.00 0.00 H ATOM 32 HD11 LEU A 6 15.249 -29.706 10.220 1.00 0.00 H ATOM 33 HD12 LEU A 6 16.895 -29.815 10.891 1.00 0.00 H ATOM 34 HD13 LEU A 6 15.909 -31.286 10.709 1.00 0.00 H ATOM 35 H LEU A 6 17.855 -29.591 12.840 1.00 0.00 H ATOM 36 N PRO A 7 16.643 -26.059 14.610 1.00125.85 N ATOM 37 CA PRO A 7 16.824 -25.427 15.924 1.00102.72 C ATOM 38 C PRO A 7 16.290 -26.306 17.041 1.00102.13 C ATOM 39 O PRO A 7 15.101 -26.611 17.037 1.00141.04 O ATOM 40 CB PRO A 7 15.980 -24.157 15.812 1.00104.32 C ATOM 41 CG PRO A 7 15.893 -23.864 14.311 1.00 79.01 C ATOM 42 CD PRO A 7 16.413 -25.060 13.550 1.00 86.33 C ATOM 43 HA PRO A 7 17.872 -25.245 16.161 1.00 0.00 H ATOM 44 HD3 PRO A 7 15.676 -25.416 12.830 1.00 0.00 H ATOM 45 HD2 PRO A 7 17.341 -24.820 13.030 1.00 0.00 H ATOM 46 HG3 PRO A 7 16.496 -22.988 14.073 1.00 0.00 H ATOM 47 HG2 PRO A 7 14.856 -23.676 14.034 1.00 0.00 H ATOM 48 HB2 PRO A 7 14.986 -24.320 16.228 1.00 0.00 H ATOM 49 HB3 PRO A 7 16.461 -23.331 16.336 1.00 0.00 H ATOM 50 N PRO A 8 17.158 -26.693 17.989 1.00114.71 N ATOM 51 CA PRO A 8 16.916 -27.720 19.018 1.00117.75 C ATOM 52 C PRO A 8 15.680 -27.481 19.882 1.00102.04 C ATOM 53 O PRO A 8 15.020 -28.439 20.273 1.00105.46 O ATOM 54 CB PRO A 8 18.180 -27.661 19.884 1.00 99.07 C ATOM 55 CG PRO A 8 19.218 -27.073 18.996 1.00108.78 C ATOM 56 CD PRO A 8 18.492 -26.088 18.123 1.00109.87 C ATOM 57 HA PRO A 8 16.722 -28.685 18.550 1.00 0.00 H ATOM 58 HD3 PRO A 8 18.434 -25.109 18.599 1.00 0.00 H ATOM 59 HD2 PRO A 8 18.978 -25.990 17.152 1.00 0.00 H ATOM 60 HG3 PRO A 8 19.684 -27.849 18.389 1.00 0.00 H ATOM 61 HG2 PRO A 8 19.982 -26.568 19.586 1.00 0.00 H ATOM 62 HB2 PRO A 8 18.019 -27.030 20.758 1.00 0.00 H ATOM 63 HB3 PRO A 8 18.472 -28.660 20.208 1.00 0.00 H ATOM 64 N ALA A 9 15.380 -26.225 20.189 1.00123.61 N ATOM 65 CA ALA A 9 14.176 -25.911 20.945 1.00101.95 C ATOM 66 C ALA A 9 12.950 -26.388 20.179 1.00 76.28 C ATOM 67 O ALA A 9 12.002 -26.894 20.764 1.00 88.13 O ATOM 68 CB ALA A 9 14.090 -24.418 21.206 1.00109.38 C ATOM 69 HA ALA A 9 14.216 -26.424 21.906 1.00 0.00 H ATOM 70 HB1 ALA A 9 14.962 -24.099 21.777 1.00 0.00 H ATOM 71 HB2 ALA A 9 14.062 -23.885 20.255 1.00 0.00 H ATOM 72 HB3 ALA A 9 13.184 -24.201 21.772 1.00 0.00 H ATOM 73 H ALA A 9 16.012 -25.457 19.886 1.00 0.00 H ATOM 74 N TRP A 10 12.983 -26.229 18.861 1.00100.35 N ATOM 75 CA TRP A 10 11.857 -26.597 18.011 1.00 90.93 C ATOM 76 C TRP A 10 11.795 -28.104 17.686 1.00 70.56 C ATOM 77 O TRP A 10 10.820 -28.574 17.087 1.00 76.69 O ATOM 78 CB TRP A 10 11.863 -25.751 16.723 1.00 73.11 C ATOM 79 HA TRP A 10 10.953 -26.382 18.580 1.00 0.00 H ATOM 80 HB2 TRP A 10 11.784 -24.695 16.983 1.00 0.00 H ATOM 81 HB3 TRP A 10 12.792 -25.925 16.180 1.00 0.00 H ATOM 82 H TRP A 10 13.837 -25.830 18.422 1.00 0.00 H ATOM 83 N GLN A 11 12.810 -28.860 18.104 1.00 74.08 N ATOM 84 CA GLN A 11 12.912 -30.295 17.770 1.00 81.82 C ATOM 85 C GLN A 11 11.744 -31.244 18.116 1.00 66.58 C ATOM 86 O GLN A 11 11.396 -32.105 17.307 1.00 59.89 O ATOM 87 CB GLN A 11 14.225 -30.883 18.273 1.00 98.47 C ATOM 88 CG GLN A 11 15.361 -30.702 17.290 1.00117.95 C ATOM 89 CD GLN A 11 16.525 -31.605 17.596 1.00131.36 C ATOM 90 OE1 GLN A 11 17.255 -31.389 18.565 1.00105.50 O ATOM 91 NE2 GLN A 11 16.701 -32.638 16.778 1.00145.31 N ATOM 92 HA GLN A 11 12.862 -30.255 16.682 1.00 0.00 H ATOM 93 HB2 GLN A 11 14.492 -30.392 19.209 1.00 0.00 H ATOM 94 HB3 GLN A 11 14.084 -31.949 18.451 1.00 0.00 H ATOM 95 HG2 GLN A 11 14.997 -30.925 16.287 1.00 0.00 H ATOM 96 HG3 GLN A 11 15.699 -29.667 17.330 1.00 0.00 H ATOM 97 HE22 GLN A 11 16.058 -32.779 15.973 1.00 0.00 H ATOM 98 HE21 GLN A 11 17.481 -33.305 16.943 1.00 0.00 H ATOM 99 H GLN A 11 13.555 -28.425 18.685 1.00 0.00 H ATOM 100 N PRO A 12 11.141 -31.102 19.309 1.00 69.60 N ATOM 101 CA PRO A 12 10.015 -32.000 19.611 1.00 64.96 C ATOM 102 C PRO A 12 8.788 -31.858 18.701 1.00 61.99 C ATOM 103 O PRO A 12 7.852 -32.645 18.836 1.00 67.07 O ATOM 104 CB PRO A 12 9.658 -31.657 21.060 1.00 47.91 C ATOM 105 CG PRO A 12 10.923 -31.087 21.630 1.00 73.59 C ATOM 106 CD PRO A 12 11.586 -30.351 20.497 1.00 72.96 C ATOM 107 HA PRO A 12 10.314 -33.035 19.446 1.00 0.00 H ATOM 108 HD3 PRO A 12 11.252 -29.314 20.454 1.00 0.00 H ATOM 109 HD2 PRO A 12 12.671 -30.378 20.594 1.00 0.00 H ATOM 110 HG3 PRO A 12 11.569 -31.885 21.995 1.00 0.00 H ATOM 111 HG2 PRO A 12 10.697 -30.402 22.448 1.00 0.00 H ATOM 112 HB2 PRO A 12 8.853 -30.923 21.096 1.00 0.00 H ATOM 113 HB3 PRO A 12 9.357 -32.551 21.606 1.00 0.00 H ATOM 114 N PHE A 13 8.781 -30.897 17.787 1.00 65.63 N ATOM 115 CA PHE A 13 7.692 -30.812 16.812 1.00 62.92 C ATOM 116 C PHE A 13 7.862 -31.911 15.775 1.00 69.05 C ATOM 117 O PHE A 13 6.939 -32.209 15.014 1.00 60.22 O ATOM 118 CB PHE A 13 7.669 -29.435 16.125 1.00 67.52 C ATOM 119 CG PHE A 13 7.030 -28.353 16.952 1.00 85.85 C ATOM 120 CD1 PHE A 13 5.660 -28.138 16.900 1.00 75.34 C ATOM 121 CD2 PHE A 13 7.796 -27.556 17.790 1.00 85.36 C ATOM 122 CE1 PHE A 13 5.065 -27.146 17.670 1.00 66.12 C ATOM 123 CE2 PHE A 13 7.205 -26.558 18.565 1.00 72.17 C ATOM 124 CZ PHE A 13 5.842 -26.358 18.507 1.00 71.30 C ATOM 125 HA PHE A 13 6.744 -30.940 17.334 1.00 0.00 H ATOM 126 HB2 PHE A 13 8.696 -29.141 15.909 1.00 0.00 H ATOM 127 HB3 PHE A 13 7.115 -29.526 15.191 1.00 0.00 H ATOM 128 HD2 PHE A 13 8.874 -27.712 17.844 1.00 0.00 H ATOM 129 HE2 PHE A 13 7.820 -25.937 19.216 1.00 0.00 H ATOM 130 HZ PHE A 13 5.376 -25.584 19.117 1.00 0.00 H ATOM 131 HE1 PHE A 13 3.988 -26.987 17.616 1.00 0.00 H ATOM 132 HD1 PHE A 13 5.043 -28.755 16.247 1.00 0.00 H ATOM 133 H PHE A 13 9.553 -30.200 17.763 1.00 0.00 H ATOM 134 N LEU A 14 9.064 -32.491 15.751 1.00 69.25 N ATOM 135 CA LEU A 14 9.439 -33.534 14.795 1.00 87.36 C ATOM 136 C LEU A 14 9.094 -34.947 15.275 1.00102.87 C ATOM 137 O LEU A 14 9.657 -35.431 16.264 1.00 77.04 O ATOM 138 CB LEU A 14 10.941 -33.468 14.516 1.00 93.87 C ATOM 139 CG LEU A 14 11.453 -32.288 13.694 1.00115.81 C ATOM 140 CD1 LEU A 14 12.976 -32.237 13.725 1.00106.76 C ATOM 141 CD2 LEU A 14 10.932 -32.380 12.267 1.00111.58 C ATOM 142 HA LEU A 14 8.861 -33.342 13.891 1.00 0.00 H ATOM 143 HB2 LEU A 14 11.452 -33.442 15.479 1.00 0.00 H ATOM 144 HB3 LEU A 14 11.215 -34.380 13.985 1.00 0.00 H ATOM 145 HG LEU A 14 11.081 -31.362 14.132 1.00 0.00 H ATOM 146 HD21 LEU A 14 11.278 -33.309 11.814 1.00 0.00 H ATOM 147 HD22 LEU A 14 9.842 -32.363 12.278 1.00 0.00 H ATOM 148 HD23 LEU A 14 11.304 -31.533 11.690 1.00 0.00 H ATOM 149 HD11 LEU A 14 13.314 -32.125 14.755 1.00 0.00 H ATOM 150 HD12 LEU A 14 13.378 -33.161 13.308 1.00 0.00 H ATOM 151 HD13 LEU A 14 13.322 -31.389 13.134 1.00 0.00 H ATOM 152 H LEU A 14 9.772 -32.185 16.449 1.00 0.00 H ATOM 153 N LYS A 15 8.184 -35.606 14.562 1.00 70.02 N ATOM 154 CA LYS A 15 7.806 -36.973 14.886 1.00 93.46 C ATOM 155 C LYS A 15 9.030 -37.868 15.095 1.00 90.47 C ATOM 156 O LYS A 15 9.060 -38.678 16.019 1.00 81.69 O ATOM 157 CB LYS A 15 6.910 -37.559 13.795 1.00104.11 C ATOM 158 CG LYS A 15 6.464 -38.990 14.063 1.00 78.90 C ATOM 159 CD LYS A 15 6.378 -39.787 12.766 1.00107.33 C ATOM 160 CE LYS A 15 5.635 -41.099 12.961 1.00112.99 C ATOM 161 NZ LYS A 15 4.213 -40.869 13.339 1.00105.77 N ATOM 162 HA LYS A 15 7.251 -36.940 15.824 1.00 0.00 H ATOM 163 HB2 LYS A 15 6.022 -36.933 13.708 1.00 0.00 H ATOM 164 HB3 LYS A 15 7.459 -37.541 12.854 1.00 0.00 H ATOM 165 HG2 LYS A 15 7.182 -39.469 14.729 1.00 0.00 H ATOM 166 HG3 LYS A 15 5.483 -38.975 14.538 1.00 0.00 H ATOM 167 HD2 LYS A 15 5.854 -39.191 12.019 1.00 0.00 H ATOM 168 HD3 LYS A 15 7.387 -40.001 12.415 1.00 0.00 H ATOM 169 HE2 LYS A 15 6.124 -41.670 13.751 1.00 0.00 H ATOM 170 HE3 LYS A 15 5.667 -41.667 12.031 1.00 0.00 H ATOM 171 HZ1 LYS A 15 4.175 -40.332 14.229 1.00 0.00 H ATOM 172 HZ2 LYS A 15 3.739 -40.330 12.587 1.00 0.00 H ATOM 173 HZ3 LYS A 15 3.736 -41.785 13.464 1.00 0.00 H ATOM 174 H LYS A 15 7.732 -35.132 13.754 1.00 0.00 H ATOM 175 N ASP A 16 10.043 -37.716 14.249 1.00 74.22 N ATOM 176 CA ASP A 16 11.210 -38.588 14.342 1.00 82.43 C ATOM 177 C ASP A 16 12.072 -38.295 15.563 1.00 86.11 C ATOM 178 O ASP A 16 12.651 -39.207 16.156 1.00 83.00 O ATOM 179 CB ASP A 16 12.027 -38.567 13.050 1.00 74.98 C ATOM 180 CG ASP A 16 11.277 -39.195 11.883 1.00125.69 C ATOM 181 OD1 ASP A 16 10.199 -39.789 12.117 1.00133.76 O ATOM 182 OD2 ASP A 16 11.764 -39.104 10.736 1.00127.79 O ATOM 183 HA ASP A 16 10.831 -39.601 14.477 1.00 0.00 H ATOM 184 HB2 ASP A 16 12.262 -37.532 12.800 1.00 0.00 H ATOM 185 HB3 ASP A 16 12.952 -39.120 13.211 1.00 0.00 H ATOM 186 H ASP A 16 10.005 -36.975 13.520 1.00 0.00 H ATOM 187 N HIS A 17 12.146 -37.031 15.956 1.00 83.36 N ATOM 188 CA HIS A 17 12.844 -36.703 17.190 1.00 73.80 C ATOM 189 C HIS A 17 12.125 -37.296 18.394 1.00 88.98 C ATOM 190 O HIS A 17 12.760 -37.827 19.315 1.00 55.72 O ATOM 191 CB HIS A 17 12.951 -35.205 17.394 1.00 64.09 C ATOM 192 CG HIS A 17 13.511 -34.836 18.730 1.00 81.31 C ATOM 193 ND1 HIS A 17 12.712 -34.509 19.805 1.00 64.18 N ATOM 194 CD2 HIS A 17 14.790 -34.781 19.176 1.00 61.90 C ATOM 195 CE1 HIS A 17 13.476 -34.247 20.853 1.00 77.34 C ATOM 196 NE2 HIS A 17 14.740 -34.409 20.498 1.00 82.72 N ATOM 197 HA HIS A 17 13.844 -37.127 17.102 1.00 0.00 H ATOM 198 HB2 HIS A 17 13.599 -34.794 16.620 1.00 0.00 H ATOM 199 HB3 HIS A 17 11.956 -34.770 17.302 1.00 0.00 H ATOM 200 HD2 HIS A 17 15.688 -34.992 18.596 1.00 0.00 H ATOM 201 HE1 HIS A 17 13.124 -33.949 21.840 1.00 0.00 H ATOM 202 H HIS A 17 11.708 -36.279 15.386 1.00 0.00 H ATOM 203 N ARG A 18 10.799 -37.181 18.389 1.00 78.15 N ATOM 204 CA ARG A 18 9.985 -37.698 19.482 1.00 63.98 C ATOM 205 C ARG A 18 10.150 -39.210 19.609 1.00 86.51 C ATOM 206 O ARG A 18 10.315 -39.728 20.718 1.00 72.44 O ATOM 207 CB ARG A 18 8.509 -37.304 19.322 1.00 54.06 C ATOM 208 CG ARG A 18 8.232 -35.812 19.566 1.00 66.92 C ATOM 209 CD ARG A 18 6.741 -35.504 19.766 1.00 60.82 C ATOM 210 NE ARG A 18 5.899 -36.021 18.688 1.00 61.74 N ATOM 211 CZ ARG A 18 5.705 -35.410 17.521 1.00 78.54 C ATOM 212 NH1 ARG A 18 6.295 -34.248 17.269 1.00 65.28 N ATOM 213 NH2 ARG A 18 4.925 -35.963 16.599 1.00 68.86 N ATOM 214 HA ARG A 18 10.338 -37.243 20.407 1.00 0.00 H ATOM 215 HB2 ARG A 18 8.196 -37.550 18.307 1.00 0.00 H ATOM 216 HB3 ARG A 18 7.920 -37.883 20.033 1.00 0.00 H ATOM 217 HG2 ARG A 18 8.774 -35.499 20.458 1.00 0.00 H ATOM 218 HG3 ARG A 18 8.592 -35.246 18.706 1.00 0.00 H ATOM 219 HD2 ARG A 18 6.614 -34.423 19.818 1.00 0.00 H ATOM 220 HD3 ARG A 18 6.417 -35.952 20.705 1.00 0.00 H ATOM 221 HE ARG A 18 5.418 -36.930 18.844 1.00 0.00 H ATOM 222 HH12 ARG A 18 6.141 -33.774 16.356 1.00 0.00 H ATOM 223 HH11 ARG A 18 6.911 -33.812 17.984 1.00 0.00 H ATOM 224 HH22 ARG A 18 4.776 -35.483 15.689 1.00 0.00 H ATOM 225 HH21 ARG A 18 4.464 -36.876 16.788 1.00 0.00 H ATOM 226 H ARG A 18 10.333 -36.711 17.587 1.00 0.00 H ATOM 227 N ILE A 19 10.124 -39.913 18.476 1.00 85.45 N ATOM 228 CA ILE A 19 10.378 -41.351 18.478 1.00 70.14 C ATOM 229 C ILE A 19 11.729 -41.635 19.128 1.00 66.06 C ATOM 230 O ILE A 19 11.812 -42.358 20.114 1.00 87.40 O ATOM 231 CB ILE A 19 10.359 -41.957 17.059 1.00 70.98 C ATOM 232 CG1 ILE A 19 8.920 -42.144 16.567 1.00 66.71 C ATOM 233 CG2 ILE A 19 11.053 -43.296 17.063 1.00 54.75 C ATOM 234 CD1 ILE A 19 8.806 -42.553 15.108 1.00 49.17 C ATOM 235 HA ILE A 19 9.574 -41.818 19.047 1.00 0.00 H ATOM 236 HB ILE A 19 10.878 -41.270 16.390 1.00 0.00 H ATOM 237 HG12 ILE A 19 8.448 -42.915 17.176 1.00 0.00 H ATOM 238 HG13 ILE A 19 8.388 -41.202 16.700 1.00 0.00 H ATOM 239 HD11 ILE A 19 9.261 -41.787 14.481 1.00 0.00 H ATOM 240 HD12 ILE A 19 9.321 -43.502 14.957 1.00 0.00 H ATOM 241 HD13 ILE A 19 7.754 -42.663 14.844 1.00 0.00 H ATOM 242 HG21 ILE A 19 12.086 -43.167 17.386 1.00 0.00 H ATOM 243 HG22 ILE A 19 10.538 -43.969 17.749 1.00 0.00 H ATOM 244 HG23 ILE A 19 11.035 -43.716 16.057 1.00 0.00 H ATOM 245 H ILE A 19 9.920 -39.430 17.578 1.00 0.00 H ATOM 246 N SER A 20 12.779 -41.037 18.583 1.00 70.97 N ATOM 247 CA SER A 20 14.129 -41.217 19.105 1.00 81.10 C ATOM 248 C SER A 20 14.218 -41.092 20.630 1.00 65.24 C ATOM 249 O SER A 20 15.179 -41.557 21.236 1.00 79.95 O ATOM 250 CB SER A 20 15.108 -40.239 18.425 1.00 83.74 C ATOM 251 OG SER A 20 15.265 -39.042 19.169 1.00 67.65 O ATOM 252 HA SER A 20 14.413 -42.242 18.866 1.00 0.00 H ATOM 253 HB2 SER A 20 14.727 -39.991 17.434 1.00 0.00 H ATOM 254 HB3 SER A 20 16.080 -40.724 18.328 1.00 0.00 H ATOM 255 HG SER A 20 14.388 -38.592 19.256 1.00 0.00 H ATOM 256 H SER A 20 12.636 -40.420 17.758 1.00 0.00 H ATOM 257 N THR A 21 13.226 -40.467 21.254 1.00 77.48 N ATOM 258 CA THR A 21 13.318 -40.210 22.688 1.00100.73 C ATOM 259 C THR A 21 12.928 -41.433 23.490 1.00 91.25 C ATOM 260 O THR A 21 13.220 -41.519 24.682 1.00 80.75 O ATOM 261 CB THR A 21 12.432 -39.038 23.140 1.00 87.74 C ATOM 262 OG1 THR A 21 11.066 -39.465 23.177 1.00 69.16 O ATOM 263 CG2 THR A 21 12.589 -37.849 22.197 1.00 84.84 C ATOM 264 HA THR A 21 14.361 -39.952 22.872 1.00 0.00 H ATOM 265 HB THR A 21 12.741 -38.722 24.136 1.00 0.00 H ATOM 266 HG1 THR A 21 10.790 -39.761 22.274 1.00 0.00 H ATOM 267 HG23 THR A 21 13.633 -37.536 22.180 1.00 0.00 H ATOM 268 HG21 THR A 21 12.279 -38.140 21.193 1.00 0.00 H ATOM 269 HG22 THR A 21 11.967 -37.025 22.547 1.00 0.00 H ATOM 270 H THR A 21 12.386 -40.162 20.722 1.00 0.00 H ATOM 271 N PHE A 22 12.253 -42.372 22.839 1.00 92.91 N ATOM 272 CA PHE A 22 11.862 -43.607 23.506 1.00 98.77 C ATOM 273 C PHE A 22 13.053 -44.547 23.578 1.00110.88 C ATOM 274 O PHE A 22 13.491 -45.109 22.573 1.00 87.35 O ATOM 275 CB PHE A 22 10.661 -44.256 22.817 1.00 75.97 C ATOM 276 CG PHE A 22 9.394 -43.467 22.964 1.00 99.54 C ATOM 277 CD1 PHE A 22 9.066 -42.470 22.052 1.00103.47 C ATOM 278 CD2 PHE A 22 8.541 -43.700 24.027 1.00 97.93 C ATOM 279 CE1 PHE A 22 7.900 -41.729 22.193 1.00 94.09 C ATOM 280 CE2 PHE A 22 7.372 -42.962 24.175 1.00112.74 C ATOM 281 CZ PHE A 22 7.053 -41.973 23.255 1.00100.99 C ATOM 282 HA PHE A 22 11.546 -43.376 24.523 1.00 0.00 H ATOM 283 HB2 PHE A 22 10.884 -44.357 21.755 1.00 0.00 H ATOM 284 HB3 PHE A 22 10.506 -45.244 23.250 1.00 0.00 H ATOM 285 HD2 PHE A 22 8.788 -44.471 24.757 1.00 0.00 H ATOM 286 HE2 PHE A 22 6.705 -43.160 25.014 1.00 0.00 H ATOM 287 HZ PHE A 22 6.138 -41.392 23.371 1.00 0.00 H ATOM 288 HE1 PHE A 22 7.654 -40.955 21.466 1.00 0.00 H ATOM 289 HD1 PHE A 22 9.734 -42.267 21.215 1.00 0.00 H ATOM 290 H PHE A 22 12.000 -42.225 21.841 1.00 0.00 H ATOM 291 N LYS A 23 13.589 -44.681 24.784 1.00104.67 N ATOM 292 CA LYS A 23 14.800 -45.442 25.014 1.00126.45 C ATOM 293 C LYS A 23 14.498 -46.502 26.049 1.00130.05 C ATOM 294 O LYS A 23 14.332 -46.195 27.230 1.00111.65 O ATOM 295 CB LYS A 23 15.918 -44.519 25.508 1.00146.53 C ATOM 296 CG LYS A 23 16.677 -43.782 24.400 1.00141.08 C ATOM 297 CD LYS A 23 17.235 -42.440 24.882 1.00134.39 C ATOM 298 CE LYS A 23 17.698 -42.485 26.337 1.00134.31 C ATOM 299 NZ LYS A 23 18.905 -43.333 26.561 1.00133.99 N ATOM 300 HA LYS A 23 15.134 -45.908 24.087 1.00 0.00 H ATOM 301 HB2 LYS A 23 15.476 -43.774 26.170 1.00 0.00 H ATOM 302 HB3 LYS A 23 16.634 -45.122 26.067 1.00 0.00 H ATOM 303 HG2 LYS A 23 17.504 -44.407 24.064 1.00 0.00 H ATOM 304 HG3 LYS A 23 15.997 -43.602 23.567 1.00 0.00 H ATOM 305 HD2 LYS A 23 18.083 -42.168 24.254 1.00 0.00 H ATOM 306 HD3 LYS A 23 16.456 -41.683 24.786 1.00 0.00 H ATOM 307 HE2 LYS A 23 16.884 -42.879 26.945 1.00 0.00 H ATOM 308 HE3 LYS A 23 17.928 -41.468 26.656 1.00 0.00 H ATOM 309 HZ1 LYS A 23 18.699 -44.311 26.272 1.00 0.00 H ATOM 310 HZ2 LYS A 23 19.696 -42.963 25.997 1.00 0.00 H ATOM 311 HZ3 LYS A 23 19.158 -43.314 27.570 1.00 0.00 H ATOM 312 H LYS A 23 13.123 -44.223 25.593 1.00 0.00 H ATOM 313 N ASN A 24 14.428 -47.750 25.596 1.00125.42 N ATOM 314 CA ASN A 24 13.995 -48.856 26.441 1.00116.30 C ATOM 315 C ASN A 24 12.518 -48.738 26.785 1.00102.71 C ATOM 316 O ASN A 24 12.103 -49.004 27.911 1.00 94.73 O ATOM 317 CB ASN A 24 14.842 -48.961 27.712 1.00135.64 C ATOM 318 CG ASN A 24 16.099 -49.784 27.507 1.00153.90 C ATOM 319 OD1 ASN A 24 17.212 -49.301 27.713 1.00164.92 O ATOM 320 ND2 ASN A 24 15.927 -51.037 27.099 1.00143.87 N ATOM 321 HA ASN A 24 14.139 -49.774 25.871 1.00 0.00 H ATOM 322 HB2 ASN A 24 15.129 -47.957 28.025 1.00 0.00 H ATOM 323 HB3 ASN A 24 14.243 -49.427 28.494 1.00 0.00 H ATOM 324 HD22 ASN A 24 14.968 -51.404 26.937 1.00 0.00 H ATOM 325 HD21 ASN A 24 16.752 -51.650 26.942 1.00 0.00 H ATOM 326 H ASN A 24 14.690 -47.943 24.608 1.00 0.00 H ATOM 327 N TRP A 25 11.728 -48.317 25.806 1.00107.78 N ATOM 328 CA TRP A 25 10.284 -48.294 25.969 1.00102.73 C ATOM 329 C TRP A 25 9.794 -49.729 25.909 1.00117.14 C ATOM 330 O TRP A 25 10.033 -50.433 24.926 1.00120.73 O ATOM 331 CB TRP A 25 9.636 -47.469 24.869 1.00 68.59 C ATOM 332 CG TRP A 25 8.142 -47.384 24.944 1.00 61.05 C ATOM 333 CD1 TRP A 25 7.247 -47.958 24.089 1.00 65.32 C ATOM 334 CD2 TRP A 25 7.368 -46.654 25.905 1.00 66.21 C ATOM 335 NE1 TRP A 25 5.957 -47.633 24.458 1.00 68.95 N ATOM 336 CE2 TRP A 25 6.004 -46.833 25.569 1.00 76.55 C ATOM 337 CE3 TRP A 25 7.691 -45.866 27.017 1.00 66.05 C ATOM 338 CZ2 TRP A 25 4.965 -46.254 26.307 1.00 73.82 C ATOM 339 CZ3 TRP A 25 6.651 -45.288 27.755 1.00 84.59 C ATOM 340 CH2 TRP A 25 5.307 -45.490 27.396 1.00 63.40 C ATOM 341 HA TRP A 25 10.018 -47.838 26.923 1.00 0.00 H ATOM 342 HB2 TRP A 25 10.037 -46.457 24.923 1.00 0.00 H ATOM 343 HB3 TRP A 25 9.903 -47.913 23.910 1.00 0.00 H ATOM 344 HE1 TRP A 25 5.092 -47.944 23.972 1.00 0.00 H ATOM 345 HD1 TRP A 25 7.512 -48.584 23.237 1.00 0.00 H ATOM 346 HZ2 TRP A 25 3.922 -46.404 26.028 1.00 0.00 H ATOM 347 HH2 TRP A 25 4.520 -45.031 27.994 1.00 0.00 H ATOM 348 HZ3 TRP A 25 6.887 -44.671 28.622 1.00 0.00 H ATOM 349 HE3 TRP A 25 8.731 -45.706 27.302 1.00 0.00 H ATOM 350 H TRP A 25 12.148 -47.999 24.909 1.00 0.00 H ATOM 351 N PRO A 26 9.102 -50.168 26.965 1.00103.07 N ATOM 352 CA PRO A 26 8.744 -51.579 27.126 1.00 97.86 C ATOM 353 C PRO A 26 7.787 -52.097 26.055 1.00101.19 C ATOM 354 O PRO A 26 7.804 -53.288 25.762 1.00103.80 O ATOM 355 CB PRO A 26 8.075 -51.611 28.500 1.00 81.34 C ATOM 356 CG PRO A 26 7.554 -50.220 28.695 1.00119.74 C ATOM 357 CD PRO A 26 8.563 -49.328 28.047 1.00110.97 C ATOM 358 HA PRO A 26 9.619 -52.223 27.033 1.00 0.00 H ATOM 359 HD3 PRO A 26 8.093 -48.429 27.648 1.00 0.00 H ATOM 360 HD2 PRO A 26 9.346 -49.045 28.751 1.00 0.00 H ATOM 361 HG3 PRO A 26 7.466 -49.990 29.757 1.00 0.00 H ATOM 362 HG2 PRO A 26 6.581 -50.106 28.218 1.00 0.00 H ATOM 363 HB2 PRO A 26 7.259 -52.334 28.515 1.00 0.00 H ATOM 364 HB3 PRO A 26 8.798 -51.864 29.275 1.00 0.00 H ATOM 365 N PHE A 27 6.977 -51.224 25.468 1.00100.15 N ATOM 366 CA PHE A 27 5.923 -51.675 24.559 1.00 80.75 C ATOM 367 C PHE A 27 6.300 -51.566 23.091 1.00 98.37 C ATOM 368 O PHE A 27 6.150 -50.508 22.477 1.00123.92 O ATOM 369 CB PHE A 27 4.621 -50.935 24.857 1.00 78.89 C ATOM 370 CG PHE A 27 4.243 -50.969 26.311 1.00119.04 C ATOM 371 CD1 PHE A 27 3.688 -52.111 26.869 1.00124.95 C ATOM 372 CD2 PHE A 27 4.468 -49.874 27.129 1.00102.26 C ATOM 373 CE1 PHE A 27 3.351 -52.153 28.210 1.00106.45 C ATOM 374 CE2 PHE A 27 4.134 -49.909 28.470 1.00121.65 C ATOM 375 CZ PHE A 27 3.573 -51.052 29.012 1.00108.61 C ATOM 376 HA PHE A 27 5.780 -52.740 24.743 1.00 0.00 H ATOM 377 HB2 PHE A 27 4.735 -49.895 24.552 1.00 0.00 H ATOM 378 HB3 PHE A 27 3.820 -51.396 24.279 1.00 0.00 H ATOM 379 HD2 PHE A 27 4.915 -48.972 26.710 1.00 0.00 H ATOM 380 HE2 PHE A 27 4.312 -49.037 29.100 1.00 0.00 H ATOM 381 HZ PHE A 27 3.307 -51.083 30.069 1.00 0.00 H ATOM 382 HE1 PHE A 27 2.910 -53.056 28.633 1.00 0.00 H ATOM 383 HD1 PHE A 27 3.515 -52.986 26.243 1.00 0.00 H ATOM 384 H PHE A 27 7.093 -50.208 25.657 1.00 0.00 H ATOM 385 N LEU A 28 6.780 -52.672 22.532 1.00 71.79 N ATOM 386 CA LEU A 28 7.285 -52.679 21.168 1.00 77.53 C ATOM 387 C LEU A 28 6.376 -53.420 20.197 1.00 70.41 C ATOM 388 O LEU A 28 5.166 -53.248 20.240 1.00 67.73 O ATOM 389 CB LEU A 28 8.701 -53.244 21.135 1.00 77.77 C ATOM 390 CG LEU A 28 9.631 -52.526 22.120 1.00 67.96 C ATOM 391 CD1 LEU A 28 11.066 -52.996 21.926 1.00 87.02 C ATOM 392 CD2 LEU A 28 9.536 -50.999 21.972 1.00 66.72 C ATOM 393 HA LEU A 28 7.304 -51.643 20.830 1.00 0.00 H ATOM 394 HB2 LEU A 28 8.664 -54.302 21.394 1.00 0.00 H ATOM 395 HB3 LEU A 28 9.101 -53.132 20.127 1.00 0.00 H ATOM 396 HG LEU A 28 9.311 -52.779 23.131 1.00 0.00 H ATOM 397 HD21 LEU A 28 9.820 -50.715 20.959 1.00 0.00 H ATOM 398 HD22 LEU A 28 8.512 -50.679 22.167 1.00 0.00 H ATOM 399 HD23 LEU A 28 10.209 -50.524 22.686 1.00 0.00 H ATOM 400 HD11 LEU A 28 11.122 -54.071 22.100 1.00 0.00 H ATOM 401 HD12 LEU A 28 11.385 -52.775 20.907 1.00 0.00 H ATOM 402 HD13 LEU A 28 11.715 -52.478 22.632 1.00 0.00 H ATOM 403 H LEU A 28 6.795 -53.554 23.083 1.00 0.00 H ATOM 404 N GLU A 29 6.975 -54.242 19.336 1.00 73.24 N ATOM 405 CA GLU A 29 6.288 -54.895 18.215 1.00 76.94 C ATOM 406 C GLU A 29 4.773 -55.112 18.362 1.00112.82 C ATOM 407 O GLU A 29 3.982 -54.467 17.677 1.00128.59 O ATOM 408 CB GLU A 29 6.980 -56.214 17.853 1.00111.72 C ATOM 409 CG GLU A 29 8.291 -56.060 17.084 1.00126.63 C ATOM 410 CD GLU A 29 9.432 -55.499 17.928 1.00133.55 C ATOM 411 OE1 GLU A 29 9.613 -55.927 19.090 1.00107.69 O ATOM 412 OE2 GLU A 29 10.160 -54.625 17.416 1.00150.59 O ATOM 413 HA GLU A 29 6.374 -54.171 17.405 1.00 0.00 H ATOM 414 HB2 GLU A 29 7.190 -56.752 18.777 1.00 0.00 H ATOM 415 HB3 GLU A 29 6.294 -56.800 17.241 1.00 0.00 H ATOM 416 HG2 GLU A 29 8.588 -57.040 16.710 1.00 0.00 H ATOM 417 HG3 GLU A 29 8.121 -55.387 16.243 1.00 0.00 H ATOM 418 H GLU A 29 7.989 -54.432 19.466 1.00 0.00 H ATOM 419 N GLY A 30 4.366 -56.018 19.242 1.00 74.37 N ATOM 420 CA GLY A 30 2.972 -56.423 19.290 1.00 95.12 C ATOM 421 C GLY A 30 1.954 -55.446 19.865 1.00 98.90 C ATOM 422 O GLY A 30 0.746 -55.710 19.837 1.00 88.25 O ATOM 423 HA3 GLY A 30 2.921 -57.332 19.889 1.00 0.00 H ATOM 424 HA2 GLY A 30 2.665 -56.645 18.268 1.00 0.00 H ATOM 425 H GLY A 30 5.050 -56.441 19.902 1.00 0.00 H ATOM 426 N CYS A 31 2.426 -54.313 20.379 1.00 98.37 N ATOM 427 CA CYS A 31 1.566 -53.390 21.129 1.00 85.52 C ATOM 428 C CYS A 31 0.910 -52.275 20.308 1.00 89.09 C ATOM 429 O CYS A 31 1.273 -52.021 19.159 1.00103.94 O ATOM 430 CB CYS A 31 2.343 -52.769 22.286 1.00 81.66 C ATOM 431 SG CYS A 31 3.174 -53.960 23.330 1.00100.92 S ATOM 432 HA CYS A 31 0.745 -54.013 21.484 1.00 0.00 H ATOM 433 HB2 CYS A 31 1.645 -52.202 22.902 1.00 0.00 H ATOM 434 HB3 CYS A 31 3.092 -52.094 21.872 1.00 0.00 H ATOM 435 HG CYS A 31 3.843 -53.297 24.339 1.00 0.00 H ATOM 436 H CYS A 31 3.430 -54.076 20.246 1.00 0.00 H ATOM 437 N ALA A 32 -0.060 -51.610 20.927 1.00 76.15 N ATOM 438 CA ALA A 32 -0.797 -50.526 20.291 1.00 82.71 C ATOM 439 C ALA A 32 -0.148 -49.178 20.615 1.00100.57 C ATOM 440 O ALA A 32 -0.209 -48.228 19.824 1.00 73.79 O ATOM 441 CB ALA A 32 -2.252 -50.545 20.739 1.00 55.58 C ATOM 442 HA ALA A 32 -0.767 -50.668 19.211 1.00 0.00 H ATOM 443 HB1 ALA A 32 -2.704 -51.497 20.460 1.00 0.00 H ATOM 444 HB2 ALA A 32 -2.299 -50.422 21.821 1.00 0.00 H ATOM 445 HB3 ALA A 32 -2.790 -49.730 20.256 1.00 0.00 H ATOM 446 H ALA A 32 -0.302 -51.874 21.903 1.00 0.00 H ATOM 447 N CYS A 33 0.473 -49.104 21.788 1.00 83.68 N ATOM 448 CA CYS A 33 1.206 -47.915 22.171 1.00 66.94 C ATOM 449 C CYS A 33 2.693 -48.086 21.870 1.00 81.30 C ATOM 450 O CYS A 33 3.543 -47.967 22.761 1.00 75.37 O ATOM 451 CB CYS A 33 0.957 -47.560 23.644 1.00 70.05 C ATOM 452 SG CYS A 33 1.608 -48.705 24.876 1.00 78.42 S ATOM 453 HA CYS A 33 0.841 -47.077 21.577 1.00 0.00 H ATOM 454 HB2 CYS A 33 -0.121 -47.495 23.790 1.00 0.00 H ATOM 455 HB3 CYS A 33 1.407 -46.585 23.829 1.00 0.00 H ATOM 456 HG CYS A 33 2.978 -48.796 24.739 1.00 0.00 H ATOM 457 H CYS A 33 0.432 -49.912 22.441 1.00 0.00 H ATOM 458 N THR A 34 2.999 -48.369 20.605 1.00 87.82 N ATOM 459 CA THR A 34 4.381 -48.444 20.147 1.00 89.79 C ATOM 460 C THR A 34 4.957 -47.043 20.027 1.00 99.63 C ATOM 461 O THR A 34 4.236 -46.102 19.700 1.00101.82 O ATOM 462 CB THR A 34 4.488 -49.107 18.765 1.00 87.40 C ATOM 463 OG1 THR A 34 3.804 -48.308 17.785 1.00 86.64 O ATOM 464 CG2 THR A 34 3.890 -50.495 18.795 1.00 90.36 C ATOM 465 HA THR A 34 4.930 -49.039 20.877 1.00 0.00 H ATOM 466 HB THR A 34 5.542 -49.184 18.499 1.00 0.00 H ATOM 467 HG1 THR A 34 4.215 -47.408 17.749 1.00 0.00 H ATOM 468 HG23 THR A 34 4.411 -51.098 19.539 1.00 0.00 H ATOM 469 HG21 THR A 34 2.833 -50.429 19.055 1.00 0.00 H ATOM 470 HG22 THR A 34 3.996 -50.956 17.813 1.00 0.00 H ATOM 471 H THR A 34 2.231 -48.541 19.925 1.00 0.00 H ATOM 472 N PRO A 35 6.261 -46.901 20.295 1.00 96.34 N ATOM 473 CA PRO A 35 6.982 -45.636 20.159 1.00 91.23 C ATOM 474 C PRO A 35 6.581 -44.840 18.910 1.00 74.84 C ATOM 475 O PRO A 35 6.422 -43.632 18.980 1.00 65.71 O ATOM 476 CB PRO A 35 8.434 -46.096 20.072 1.00 92.74 C ATOM 477 CG PRO A 35 8.475 -47.261 20.976 1.00 80.76 C ATOM 478 CD PRO A 35 7.138 -47.964 20.815 1.00 97.56 C ATOM 479 HA PRO A 35 6.773 -44.951 20.981 1.00 0.00 H ATOM 480 HD3 PRO A 35 7.213 -48.790 20.108 1.00 0.00 H ATOM 481 HD2 PRO A 35 6.775 -48.338 21.772 1.00 0.00 H ATOM 482 HG3 PRO A 35 8.610 -46.936 22.007 1.00 0.00 H ATOM 483 HG2 PRO A 35 9.290 -47.929 20.697 1.00 0.00 H ATOM 484 HB2 PRO A 35 8.693 -46.383 19.053 1.00 0.00 H ATOM 485 HB3 PRO A 35 9.113 -45.314 20.411 1.00 0.00 H ATOM 486 N GLU A 36 6.412 -45.509 17.780 1.00 73.96 N ATOM 487 CA GLU A 36 5.925 -44.827 16.593 1.00 52.26 C ATOM 488 C GLU A 36 4.530 -44.258 16.869 1.00 73.54 C ATOM 489 O GLU A 36 4.302 -43.055 16.754 1.00 79.82 O ATOM 490 CB GLU A 36 5.913 -45.781 15.391 1.00 65.88 C ATOM 491 CG GLU A 36 5.592 -45.134 14.046 1.00 73.30 C ATOM 492 CD GLU A 36 4.122 -44.765 13.898 1.00113.91 C ATOM 493 OE1 GLU A 36 3.259 -45.482 14.449 1.00113.98 O ATOM 494 OE2 GLU A 36 3.826 -43.750 13.233 1.00128.79 O ATOM 495 HA GLU A 36 6.594 -44.002 16.348 1.00 0.00 H ATOM 496 HB2 GLU A 36 6.898 -46.241 15.317 1.00 0.00 H ATOM 497 HB3 GLU A 36 5.166 -46.552 15.581 1.00 0.00 H ATOM 498 HG2 GLU A 36 6.190 -44.228 13.945 1.00 0.00 H ATOM 499 HG3 GLU A 36 5.856 -45.833 13.252 1.00 0.00 H ATOM 500 H GLU A 36 6.628 -46.526 17.742 1.00 0.00 H ATOM 501 N ARG A 37 3.601 -45.131 17.242 1.00112.51 N ATOM 502 CA ARG A 37 2.232 -44.714 17.509 1.00123.75 C ATOM 503 C ARG A 37 2.193 -43.661 18.649 1.00 85.53 C ATOM 504 O ARG A 37 1.280 -42.825 18.704 1.00 72.01 O ATOM 505 CB ARG A 37 1.321 -45.946 17.755 1.00 37.56 C ATOM 506 HA ARG A 37 1.825 -44.215 16.629 1.00 0.00 H ATOM 507 HB2 ARG A 37 1.329 -46.585 16.872 1.00 0.00 H ATOM 508 HB3 ARG A 37 1.693 -46.506 18.613 1.00 0.00 H ATOM 509 H ARG A 37 3.857 -46.134 17.346 1.00 0.00 H ATOM 510 N MET A 38 3.209 -43.678 19.518 1.00 67.56 N ATOM 511 CA MET A 38 3.303 -42.746 20.657 1.00 58.94 C ATOM 512 C MET A 38 3.773 -41.361 20.258 1.00 70.12 C ATOM 513 O MET A 38 3.210 -40.364 20.692 1.00 84.10 O ATOM 514 CB MET A 38 4.259 -43.269 21.734 1.00 70.85 C ATOM 515 CG MET A 38 3.696 -44.359 22.622 1.00 77.42 C ATOM 516 SD MET A 38 2.535 -43.760 23.860 1.00 79.10 S ATOM 517 CE MET A 38 3.631 -43.055 25.101 1.00 43.58 C ATOM 518 HA MET A 38 2.287 -42.676 21.045 1.00 0.00 H ATOM 519 HB2 MET A 38 5.145 -43.663 21.236 1.00 0.00 H ATOM 520 HB3 MET A 38 4.544 -42.430 22.369 1.00 0.00 H ATOM 521 HG2 MET A 38 4.525 -44.847 23.135 1.00 0.00 H ATOM 522 HG3 MET A 38 3.183 -45.085 21.992 1.00 0.00 H ATOM 523 HE1 MET A 38 4.295 -43.832 25.481 1.00 0.00 H ATOM 524 HE2 MET A 38 4.222 -42.258 24.651 1.00 0.00 H ATOM 525 HE3 MET A 38 3.037 -42.650 25.921 1.00 0.00 H ATOM 526 H MET A 38 3.966 -44.379 19.385 1.00 0.00 H ATOM 527 N ALA A 39 4.832 -41.302 19.459 1.00 83.43 N ATOM 528 CA ALA A 39 5.339 -40.036 18.950 1.00 71.94 C ATOM 529 C ALA A 39 4.296 -39.392 18.059 1.00 72.68 C ATOM 530 O ALA A 39 4.125 -38.176 18.063 1.00 95.56 O ATOM 531 CB ALA A 39 6.618 -40.257 18.176 1.00 85.86 C ATOM 532 HA ALA A 39 5.552 -39.375 19.790 1.00 0.00 H ATOM 533 HB1 ALA A 39 7.366 -40.703 18.832 1.00 0.00 H ATOM 534 HB2 ALA A 39 6.423 -40.926 17.338 1.00 0.00 H ATOM 535 HB3 ALA A 39 6.985 -39.301 17.802 1.00 0.00 H ATOM 536 H ALA A 39 5.312 -42.184 19.190 1.00 0.00 H ATOM 537 N GLU A 40 3.605 -40.213 17.282 1.00 55.34 N ATOM 538 CA GLU A 40 2.520 -39.727 16.443 1.00 73.86 C ATOM 539 C GLU A 40 1.479 -38.986 17.293 1.00 69.54 C ATOM 540 O GLU A 40 0.745 -38.142 16.793 1.00 68.47 O ATOM 541 CB GLU A 40 1.883 -40.891 15.666 1.00 66.27 C ATOM 542 CG GLU A 40 0.651 -40.530 14.818 1.00 61.45 C ATOM 543 CD GLU A 40 1.008 -39.811 13.514 1.00113.75 C ATOM 544 OE1 GLU A 40 2.067 -39.144 13.465 1.00134.25 O ATOM 545 OE2 GLU A 40 0.229 -39.917 12.536 1.00 93.20 O ATOM 546 HA GLU A 40 2.923 -39.021 15.717 1.00 0.00 H ATOM 547 HB2 GLU A 40 2.640 -41.303 14.999 1.00 0.00 H ATOM 548 HB3 GLU A 40 1.583 -41.651 16.387 1.00 0.00 H ATOM 549 HG2 GLU A 40 0.117 -41.448 14.573 1.00 0.00 H ATOM 550 HG3 GLU A 40 0.003 -39.880 15.406 1.00 0.00 H ATOM 551 H GLU A 40 3.843 -41.225 17.272 1.00 0.00 H ATOM 552 N ALA A 41 1.428 -39.301 18.580 1.00 89.07 N ATOM 553 CA ALA A 41 0.446 -38.706 19.481 1.00 66.70 C ATOM 554 C ALA A 41 1.053 -37.524 20.234 1.00 75.16 C ATOM 555 O ALA A 41 0.383 -36.885 21.049 1.00 69.86 O ATOM 556 CB ALA A 41 -0.076 -39.759 20.460 1.00 59.00 C ATOM 557 HA ALA A 41 -0.391 -38.336 18.889 1.00 0.00 H ATOM 558 HB1 ALA A 41 -0.546 -40.570 19.903 1.00 0.00 H ATOM 559 HB2 ALA A 41 0.755 -40.153 21.045 1.00 0.00 H ATOM 560 HB3 ALA A 41 -0.808 -39.302 21.127 1.00 0.00 H ATOM 561 H ALA A 41 2.107 -39.992 18.958 1.00 0.00 H ATOM 562 N GLY A 42 2.329 -37.250 19.966 1.00 64.43 N ATOM 563 CA GLY A 42 3.007 -36.103 20.545 1.00 47.20 C ATOM 564 C GLY A 42 3.755 -36.363 21.842 1.00 69.10 C ATOM 565 O GLY A 42 4.266 -35.432 22.473 1.00 89.41 O ATOM 566 HA3 GLY A 42 2.259 -35.334 20.738 1.00 0.00 H ATOM 567 HA2 GLY A 42 3.725 -35.734 19.813 1.00 0.00 H ATOM 568 H GLY A 42 2.855 -37.876 19.323 1.00 0.00 H ATOM 569 N PHE A 43 3.838 -37.623 22.245 1.00 63.76 N ATOM 570 CA PHE A 43 4.560 -37.952 23.464 1.00 58.82 C ATOM 571 C PHE A 43 6.077 -38.076 23.260 1.00 59.98 C ATOM 572 O PHE A 43 6.568 -38.350 22.160 1.00 43.97 O ATOM 573 CB PHE A 43 3.997 -39.232 24.090 1.00 63.45 C ATOM 574 CG PHE A 43 2.560 -39.116 24.502 1.00 76.09 C ATOM 575 CD1 PHE A 43 2.221 -38.612 25.755 1.00 61.58 C ATOM 576 CD2 PHE A 43 1.544 -39.501 23.635 1.00 69.77 C ATOM 577 CE1 PHE A 43 0.890 -38.491 26.139 1.00 64.80 C ATOM 578 CE2 PHE A 43 0.213 -39.388 24.006 1.00 72.22 C ATOM 579 CZ PHE A 43 -0.118 -38.879 25.261 1.00 70.20 C ATOM 580 HA PHE A 43 4.410 -37.115 24.146 1.00 0.00 H ATOM 581 HB2 PHE A 43 4.083 -40.039 23.362 1.00 0.00 H ATOM 582 HB3 PHE A 43 4.590 -39.475 24.972 1.00 0.00 H ATOM 583 HD2 PHE A 43 1.797 -39.897 22.651 1.00 0.00 H ATOM 584 HE2 PHE A 43 -0.574 -39.697 23.317 1.00 0.00 H ATOM 585 HZ PHE A 43 -1.164 -38.785 25.554 1.00 0.00 H ATOM 586 HE1 PHE A 43 0.637 -38.094 27.122 1.00 0.00 H ATOM 587 HD1 PHE A 43 3.009 -38.308 26.444 1.00 0.00 H ATOM 588 H PHE A 43 3.386 -38.377 21.689 1.00 0.00 H ATOM 589 N ILE A 44 6.813 -37.848 24.336 1.00 49.52 N ATOM 590 CA ILE A 44 8.231 -38.122 24.364 1.00 66.17 C ATOM 591 C ILE A 44 8.468 -38.952 25.618 1.00 95.63 C ATOM 592 O ILE A 44 7.773 -38.790 26.620 1.00 67.55 O ATOM 593 CB ILE A 44 9.067 -36.831 24.418 1.00 70.72 C ATOM 594 CG1 ILE A 44 8.765 -36.059 25.696 1.00 78.04 C ATOM 595 CG2 ILE A 44 8.822 -35.960 23.178 1.00 73.74 C ATOM 596 CD1 ILE A 44 9.423 -34.725 25.744 1.00 95.33 C ATOM 597 HA ILE A 44 8.536 -38.644 23.457 1.00 0.00 H ATOM 598 HB ILE A 44 10.122 -37.106 24.423 1.00 0.00 H ATOM 599 HG12 ILE A 44 7.687 -35.917 25.769 1.00 0.00 H ATOM 600 HG13 ILE A 44 9.111 -36.647 26.546 1.00 0.00 H ATOM 601 HD11 ILE A 44 10.504 -34.852 25.683 1.00 0.00 H ATOM 602 HD12 ILE A 44 9.079 -34.121 24.904 1.00 0.00 H ATOM 603 HD13 ILE A 44 9.167 -34.228 26.680 1.00 0.00 H ATOM 604 HG21 ILE A 44 9.099 -36.518 22.283 1.00 0.00 H ATOM 605 HG22 ILE A 44 7.767 -35.690 23.128 1.00 0.00 H ATOM 606 HG23 ILE A 44 9.427 -35.056 23.246 1.00 0.00 H ATOM 607 H ILE A 44 6.357 -37.460 25.186 1.00 0.00 H ATOM 608 N HIS A 45 9.420 -39.871 25.561 1.00 98.61 N ATOM 609 CA HIS A 45 9.700 -40.690 26.722 1.00 88.48 C ATOM 610 C HIS A 45 10.589 -39.899 27.677 1.00 83.30 C ATOM 611 O HIS A 45 11.691 -39.497 27.315 1.00113.83 O ATOM 612 CB HIS A 45 10.351 -42.010 26.298 1.00 97.78 C ATOM 613 CG HIS A 45 10.504 -42.997 27.414 1.00 90.71 C ATOM 614 ND1 HIS A 45 11.353 -44.080 27.337 1.00 89.79 N ATOM 615 CD2 HIS A 45 9.922 -43.061 28.635 1.00 86.71 C ATOM 616 CE1 HIS A 45 11.286 -44.769 28.462 1.00110.59 C ATOM 617 NE2 HIS A 45 10.427 -44.170 29.267 1.00102.39 N ATOM 618 HA HIS A 45 8.773 -40.943 27.237 1.00 0.00 H ATOM 619 HB2 HIS A 45 9.735 -42.463 25.521 1.00 0.00 H ATOM 620 HB3 HIS A 45 11.340 -41.791 25.895 1.00 0.00 H ATOM 621 HD2 HIS A 45 9.190 -42.363 29.040 1.00 0.00 H ATOM 622 HE1 HIS A 45 11.845 -45.677 28.688 1.00 0.00 H ATOM 623 H HIS A 45 9.965 -40.004 24.685 1.00 0.00 H ATOM 624 N CYS A 46 10.098 -39.667 28.888 1.00 67.16 N ATOM 625 CA CYS A 46 10.863 -38.955 29.908 1.00 90.20 C ATOM 626 C CYS A 46 10.810 -39.699 31.243 1.00108.37 C ATOM 627 O CYS A 46 10.193 -39.239 32.207 1.00 98.39 O ATOM 628 CB CYS A 46 10.365 -37.511 30.052 1.00 82.01 C ATOM 629 SG CYS A 46 8.567 -37.320 30.191 1.00131.42 S ATOM 630 HA CYS A 46 11.905 -38.916 29.591 1.00 0.00 H ATOM 631 HB2 CYS A 46 10.696 -36.952 29.177 1.00 0.00 H ATOM 632 HB3 CYS A 46 10.819 -37.086 30.947 1.00 0.00 H ATOM 633 HG CYS A 46 8.118 -38.002 31.304 1.00 0.00 H ATOM 634 H CYS A 46 9.141 -40.002 29.117 1.00 0.00 H ATOM 635 N PRO A 47 11.482 -40.858 31.297 1.00122.82 N ATOM 636 CA PRO A 47 11.429 -41.813 32.405 1.00117.01 C ATOM 637 C PRO A 47 12.084 -41.289 33.670 1.00107.06 C ATOM 638 O PRO A 47 13.063 -40.556 33.600 1.00103.57 O ATOM 639 CB PRO A 47 12.236 -42.998 31.870 1.00114.18 C ATOM 640 CG PRO A 47 13.204 -42.383 30.923 1.00 78.03 C ATOM 641 CD PRO A 47 12.443 -41.276 30.260 1.00 95.99 C ATOM 642 HA PRO A 47 10.402 -42.044 32.687 1.00 0.00 H ATOM 643 HD3 PRO A 47 13.106 -40.455 29.987 1.00 0.00 H ATOM 644 HD2 PRO A 47 11.926 -41.635 29.370 1.00 0.00 H ATOM 645 HG3 PRO A 47 13.538 -43.114 30.187 1.00 0.00 H ATOM 646 HG2 PRO A 47 14.067 -41.988 31.459 1.00 0.00 H ATOM 647 HB2 PRO A 47 12.758 -43.508 32.680 1.00 0.00 H ATOM 648 HB3 PRO A 47 11.588 -43.706 31.355 1.00 0.00 H ATOM 649 N THR A 48 11.538 -41.673 34.817 1.00123.59 N ATOM 650 CA THR A 48 12.158 -41.371 36.099 1.00128.84 C ATOM 651 C THR A 48 12.465 -42.684 36.809 1.00133.75 C ATOM 652 O THR A 48 12.319 -43.756 36.222 1.00108.99 O ATOM 653 CB THR A 48 11.247 -40.491 36.975 1.00107.70 C ATOM 654 OG1 THR A 48 10.098 -41.242 37.398 1.00121.52 O ATOM 655 CG2 THR A 48 10.809 -39.257 36.190 1.00 88.54 C ATOM 656 HA THR A 48 13.077 -40.811 35.926 1.00 0.00 H ATOM 657 HB THR A 48 11.801 -40.171 37.857 1.00 0.00 H ATOM 658 HG1 THR A 48 9.592 -41.545 36.603 1.00 0.00 H ATOM 659 HG23 THR A 48 11.689 -38.697 35.875 1.00 0.00 H ATOM 660 HG21 THR A 48 10.242 -39.568 35.313 1.00 0.00 H ATOM 661 HG22 THR A 48 10.184 -38.628 36.824 1.00 0.00 H ATOM 662 H THR A 48 10.644 -42.204 34.800 1.00 0.00 H ATOM 663 N GLU A 49 12.901 -42.605 38.061 1.00143.43 N ATOM 664 CA GLU A 49 13.139 -43.817 38.827 1.00140.67 C ATOM 665 C GLU A 49 11.813 -44.496 39.161 1.00145.96 C ATOM 666 O GLU A 49 11.554 -45.614 38.713 1.00140.21 O ATOM 667 CB GLU A 49 13.967 -43.542 40.088 1.00150.62 C ATOM 668 CG GLU A 49 13.395 -42.512 41.047 1.00170.37 C ATOM 669 CD GLU A 49 14.145 -42.477 42.373 1.00168.64 C ATOM 670 OE1 GLU A 49 14.680 -43.530 42.789 1.00151.11 O ATOM 671 OE2 GLU A 49 14.196 -41.398 43.002 1.00155.94 O ATOM 672 HA GLU A 49 13.728 -44.497 38.212 1.00 0.00 H ATOM 673 HB2 GLU A 49 14.072 -44.482 40.630 1.00 0.00 H ATOM 674 HB3 GLU A 49 14.951 -43.195 39.772 1.00 0.00 H ATOM 675 HG2 GLU A 49 13.457 -41.528 40.583 1.00 0.00 H ATOM 676 HG3 GLU A 49 12.350 -42.755 41.241 1.00 0.00 H ATOM 677 H GLU A 49 13.072 -41.675 38.494 1.00 0.00 H ATOM 678 N ASN A 50 10.965 -43.808 39.922 1.00146.93 N ATOM 679 CA ASN A 50 9.669 -44.359 40.317 1.00153.03 C ATOM 680 C ASN A 50 8.693 -44.484 39.148 1.00143.12 C ATOM 681 O ASN A 50 7.652 -45.130 39.260 1.00123.16 O ATOM 682 CB ASN A 50 9.039 -43.523 41.441 1.00148.16 C ATOM 683 CG ASN A 50 7.679 -44.063 41.887 1.00145.98 C ATOM 684 OD1 ASN A 50 7.580 -44.811 42.867 1.00126.55 O ATOM 685 ND2 ASN A 50 6.623 -43.685 41.164 1.00121.46 N ATOM 686 HA ASN A 50 9.865 -45.367 40.682 1.00 0.00 H ATOM 687 HB2 ASN A 50 9.713 -43.525 42.297 1.00 0.00 H ATOM 688 HB3 ASN A 50 8.909 -42.501 41.085 1.00 0.00 H ATOM 689 HD22 ASN A 50 6.751 -43.054 40.347 1.00 0.00 H ATOM 690 HD21 ASN A 50 5.672 -44.021 41.418 1.00 0.00 H ATOM 691 H ASN A 50 11.230 -42.855 40.244 1.00 0.00 H ATOM 692 N GLU A 51 9.035 -43.866 38.025 1.00147.41 N ATOM 693 CA GLU A 51 8.146 -43.850 36.872 1.00128.72 C ATOM 694 C GLU A 51 8.933 -44.009 35.577 1.00124.07 C ATOM 695 O GLU A 51 9.208 -43.033 34.886 1.00130.80 O ATOM 696 CB GLU A 51 7.345 -42.549 36.856 1.00117.64 C ATOM 697 CG GLU A 51 6.566 -42.304 38.139 1.00139.42 C ATOM 698 CD GLU A 51 6.376 -40.832 38.444 1.00150.35 C ATOM 699 OE1 GLU A 51 7.044 -40.001 37.795 1.00156.67 O ATOM 700 OE2 GLU A 51 5.563 -40.506 39.337 1.00146.21 O ATOM 701 HA GLU A 51 7.457 -44.691 36.950 1.00 0.00 H ATOM 702 HB2 GLU A 51 8.036 -41.719 36.707 1.00 0.00 H ATOM 703 HB3 GLU A 51 6.640 -42.587 36.025 1.00 0.00 H ATOM 704 HG2 GLU A 51 5.585 -42.769 38.044 1.00 0.00 H ATOM 705 HG3 GLU A 51 7.106 -42.764 38.967 1.00 0.00 H ATOM 706 H GLU A 51 9.955 -43.384 37.967 1.00 0.00 H ATOM 707 N PRO A 52 9.298 -45.252 35.245 1.00114.97 N ATOM 708 CA PRO A 52 10.118 -45.555 34.070 1.00107.85 C ATOM 709 C PRO A 52 9.321 -45.530 32.769 1.00100.45 C ATOM 710 O PRO A 52 9.919 -45.531 31.695 1.00104.12 O ATOM 711 CB PRO A 52 10.606 -46.974 34.355 1.00116.89 C ATOM 712 CG PRO A 52 9.505 -47.576 35.149 1.00123.19 C ATOM 713 CD PRO A 52 8.959 -46.464 36.008 1.00119.70 C ATOM 714 HA PRO A 52 10.911 -44.821 33.928 1.00 0.00 H ATOM 715 HD3 PRO A 52 7.880 -46.559 36.132 1.00 0.00 H ATOM 716 HD2 PRO A 52 9.437 -46.456 36.988 1.00 0.00 H ATOM 717 HG3 PRO A 52 9.885 -48.385 35.772 1.00 0.00 H ATOM 718 HG2 PRO A 52 8.728 -47.962 34.489 1.00 0.00 H ATOM 719 HB2 PRO A 52 10.762 -47.525 33.427 1.00 0.00 H ATOM 720 HB3 PRO A 52 11.534 -46.958 34.927 1.00 0.00 H ATOM 721 N ASP A 53 7.996 -45.515 32.860 1.00100.09 N ATOM 722 CA ASP A 53 7.162 -45.471 31.663 1.00108.45 C ATOM 723 C ASP A 53 6.454 -44.124 31.521 1.00103.82 C ATOM 724 O ASP A 53 5.466 -44.002 30.798 1.00 84.56 O ATOM 725 CB ASP A 53 6.157 -46.637 31.640 1.00108.02 C ATOM 726 CG ASP A 53 4.950 -46.409 32.553 1.00113.49 C ATOM 727 OD1 ASP A 53 5.086 -45.702 33.581 1.00116.99 O ATOM 728 OD2 ASP A 53 3.863 -46.954 32.234 1.00100.41 O ATOM 729 HA ASP A 53 7.821 -45.584 30.802 1.00 0.00 H ATOM 730 HB2 ASP A 53 5.800 -46.767 30.618 1.00 0.00 H ATOM 731 HB3 ASP A 53 6.670 -47.543 31.962 1.00 0.00 H ATOM 732 H ASP A 53 7.546 -45.535 33.798 1.00 0.00 H ATOM 733 N LEU A 54 6.975 -43.116 32.213 1.00103.07 N ATOM 734 CA LEU A 54 6.438 -41.761 32.142 1.00 88.69 C ATOM 735 C LEU A 54 6.595 -41.164 30.745 1.00 94.66 C ATOM 736 O LEU A 54 7.703 -41.101 30.207 1.00 88.86 O ATOM 737 CB LEU A 54 7.142 -40.865 33.160 1.00 86.85 C ATOM 738 CG LEU A 54 6.544 -39.476 33.389 1.00 92.09 C ATOM 739 CD1 LEU A 54 5.136 -39.589 33.938 1.00101.99 C ATOM 740 CD2 LEU A 54 7.416 -38.673 34.335 1.00104.15 C ATOM 741 HA LEU A 54 5.374 -41.817 32.370 1.00 0.00 H ATOM 742 HB2 LEU A 54 7.139 -41.387 34.117 1.00 0.00 H ATOM 743 HB3 LEU A 54 8.170 -40.730 32.825 1.00 0.00 H ATOM 744 HG LEU A 54 6.502 -38.957 32.431 1.00 0.00 H ATOM 745 HD21 LEU A 54 7.486 -39.192 35.291 1.00 0.00 H ATOM 746 HD22 LEU A 54 8.412 -38.564 33.905 1.00 0.00 H ATOM 747 HD23 LEU A 54 6.975 -37.688 34.486 1.00 0.00 H ATOM 748 HD11 LEU A 54 4.513 -40.131 33.227 1.00 0.00 H ATOM 749 HD12 LEU A 54 5.159 -40.126 34.886 1.00 0.00 H ATOM 750 HD13 LEU A 54 4.727 -38.591 34.094 1.00 0.00 H ATOM 751 H LEU A 54 7.794 -43.299 32.827 1.00 0.00 H ATOM 752 N ALA A 55 5.482 -40.727 30.161 1.00 89.96 N ATOM 753 CA ALA A 55 5.507 -40.072 28.852 1.00 88.73 C ATOM 754 C ALA A 55 4.789 -38.723 28.917 1.00 97.79 C ATOM 755 O ALA A 55 3.879 -38.536 29.721 1.00101.65 O ATOM 756 CB ALA A 55 4.886 -40.969 27.781 1.00 63.19 C ATOM 757 HA ALA A 55 6.547 -39.895 28.577 1.00 0.00 H ATOM 758 HB1 ALA A 55 5.449 -41.900 27.718 1.00 0.00 H ATOM 759 HB2 ALA A 55 3.851 -41.185 28.045 1.00 0.00 H ATOM 760 HB3 ALA A 55 4.917 -40.458 26.818 1.00 0.00 H ATOM 761 H ALA A 55 4.571 -40.854 30.647 1.00 0.00 H ATOM 762 N GLN A 56 5.198 -37.789 28.066 1.00 87.97 N ATOM 763 CA GLN A 56 4.698 -36.418 28.134 1.00 64.45 C ATOM 764 C GLN A 56 4.414 -35.798 26.772 1.00 72.23 C ATOM 765 O GLN A 56 5.207 -35.920 25.836 1.00 57.95 O ATOM 766 CB GLN A 56 5.697 -35.530 28.868 1.00 63.03 C ATOM 767 CG GLN A 56 5.211 -34.094 29.059 1.00 88.24 C ATOM 768 CD GLN A 56 6.144 -33.254 29.925 1.00 94.91 C ATOM 769 OE1 GLN A 56 7.370 -33.352 29.813 1.00 62.93 O ATOM 770 NE2 GLN A 56 5.565 -32.424 30.797 1.00 82.88 N ATOM 771 HA GLN A 56 3.751 -36.477 28.670 1.00 0.00 H ATOM 772 HB2 GLN A 56 5.888 -35.963 29.850 1.00 0.00 H ATOM 773 HB3 GLN A 56 6.624 -35.507 28.296 1.00 0.00 H ATOM 774 HG2 GLN A 56 5.129 -33.623 28.080 1.00 0.00 H ATOM 775 HG3 GLN A 56 4.229 -34.120 29.532 1.00 0.00 H ATOM 776 HE22 GLN A 56 4.528 -32.374 30.857 1.00 0.00 H ATOM 777 HE21 GLN A 56 6.151 -31.828 31.415 1.00 0.00 H ATOM 778 H GLN A 56 5.892 -38.040 27.333 1.00 0.00 H ATOM 779 N CYS A 57 3.281 -35.115 26.661 1.00 68.17 N ATOM 780 CA CYS A 57 3.023 -34.343 25.457 1.00 77.20 C ATOM 781 C CYS A 57 3.989 -33.148 25.365 1.00 86.19 C ATOM 782 O CYS A 57 4.130 -32.368 26.308 1.00 67.38 O ATOM 783 CB CYS A 57 1.580 -33.864 25.411 1.00 63.38 C ATOM 784 SG CYS A 57 1.233 -32.996 23.883 1.00 70.61 S ATOM 785 HA CYS A 57 3.190 -34.994 24.599 1.00 0.00 H ATOM 786 HB2 CYS A 57 1.401 -33.192 26.250 1.00 0.00 H ATOM 787 HB3 CYS A 57 0.917 -34.725 25.489 1.00 0.00 H ATOM 788 HG CYS A 57 -0.083 -32.579 23.881 1.00 0.00 H ATOM 789 H CYS A 57 2.582 -35.132 27.431 1.00 0.00 H ATOM 790 N PHE A 58 4.662 -33.014 24.228 1.00 74.74 N ATOM 791 CA PHE A 58 5.669 -31.974 24.079 1.00 82.93 C ATOM 792 C PHE A 58 4.989 -30.607 23.949 1.00 95.09 C ATOM 793 O PHE A 58 5.650 -29.559 23.991 1.00 76.91 O ATOM 794 CB PHE A 58 6.508 -32.228 22.832 1.00 49.53 C ATOM 795 CG PHE A 58 5.882 -31.696 21.576 1.00 63.03 C ATOM 796 CD1 PHE A 58 4.887 -32.408 20.921 1.00 54.02 C ATOM 797 CD2 PHE A 58 6.277 -30.470 21.058 1.00 73.25 C ATOM 798 CE1 PHE A 58 4.306 -31.915 19.755 1.00 57.87 C ATOM 799 CE2 PHE A 58 5.704 -29.969 19.900 1.00 59.33 C ATOM 800 CZ PHE A 58 4.714 -30.692 19.249 1.00 66.61 C ATOM 801 HA PHE A 58 6.312 -31.986 24.959 1.00 0.00 H ATOM 802 HB2 PHE A 58 7.479 -31.750 22.964 1.00 0.00 H ATOM 803 HB3 PHE A 58 6.646 -33.303 22.721 1.00 0.00 H ATOM 804 HD2 PHE A 58 7.048 -29.894 21.569 1.00 0.00 H ATOM 805 HE2 PHE A 58 6.030 -29.009 19.501 1.00 0.00 H ATOM 806 HZ PHE A 58 4.258 -30.298 18.341 1.00 0.00 H ATOM 807 HE1 PHE A 58 3.534 -32.489 19.243 1.00 0.00 H ATOM 808 HD1 PHE A 58 4.556 -33.365 21.324 1.00 0.00 H ATOM 809 H PHE A 58 4.467 -33.659 23.436 1.00 0.00 H ATOM 810 N PHE A 59 3.668 -30.631 23.791 1.00 65.70 N ATOM 811 CA PHE A 59 2.918 -29.440 23.445 1.00 71.01 C ATOM 812 C PHE A 59 2.043 -28.911 24.580 1.00 83.37 C ATOM 813 O PHE A 59 2.071 -27.725 24.902 1.00 98.86 O ATOM 814 CB PHE A 59 2.058 -29.708 22.217 1.00 64.93 C ATOM 815 CG PHE A 59 1.421 -28.473 21.656 1.00 91.46 C ATOM 816 CD1 PHE A 59 0.213 -28.016 22.154 1.00 90.53 C ATOM 817 CD2 PHE A 59 2.040 -27.758 20.640 1.00 73.64 C ATOM 818 CE1 PHE A 59 -0.370 -26.874 21.646 1.00 93.60 C ATOM 819 CE2 PHE A 59 1.459 -26.616 20.121 1.00 87.03 C ATOM 820 CZ PHE A 59 0.252 -26.173 20.626 1.00 98.03 C ATOM 821 HA PHE A 59 3.656 -28.665 23.236 1.00 0.00 H ATOM 822 HB2 PHE A 59 2.686 -30.154 21.446 1.00 0.00 H ATOM 823 HB3 PHE A 59 1.270 -30.409 22.493 1.00 0.00 H ATOM 824 HD2 PHE A 59 2.997 -28.101 20.246 1.00 0.00 H ATOM 825 HE2 PHE A 59 1.951 -26.068 19.317 1.00 0.00 H ATOM 826 HZ PHE A 59 -0.211 -25.272 20.222 1.00 0.00 H ATOM 827 HE1 PHE A 59 -1.321 -26.523 22.047 1.00 0.00 H ATOM 828 HD1 PHE A 59 -0.282 -28.564 22.955 1.00 0.00 H ATOM 829 H PHE A 59 3.160 -31.529 23.919 1.00 0.00 H ATOM 830 N CYS A 60 1.252 -29.794 25.169 1.00 84.11 N ATOM 831 CA CYS A 60 0.369 -29.428 26.266 1.00 77.17 C ATOM 832 C CYS A 60 1.022 -29.761 27.609 1.00 85.41 C ATOM 833 O CYS A 60 0.598 -29.267 28.652 1.00 77.78 O ATOM 834 CB CYS A 60 -0.959 -30.176 26.140 1.00 53.52 C ATOM 835 SG CYS A 60 -0.823 -31.890 26.657 1.00 77.84 S ATOM 836 HA CYS A 60 0.184 -28.355 26.220 1.00 0.00 H ATOM 837 HB2 CYS A 60 -1.281 -30.147 25.099 1.00 0.00 H ATOM 838 HB3 CYS A 60 -1.703 -29.679 26.763 1.00 0.00 H ATOM 839 HG CYS A 60 0.109 -32.534 25.869 1.00 0.00 H ATOM 840 H CYS A 60 1.262 -30.780 24.837 1.00 0.00 H ATOM 841 N PHE A 61 2.042 -30.615 27.572 1.00 81.72 N ATOM 842 CA PHE A 61 2.840 -30.968 28.754 1.00 69.78 C ATOM 843 C PHE A 61 2.111 -31.818 29.780 1.00 71.46 C ATOM 844 O PHE A 61 2.562 -31.931 30.924 1.00 74.25 O ATOM 845 CB PHE A 61 3.437 -29.728 29.420 1.00 50.47 C ATOM 846 CG PHE A 61 4.254 -28.894 28.488 1.00 79.21 C ATOM 847 CD1 PHE A 61 3.654 -27.899 27.713 1.00 62.83 C ATOM 848 CD2 PHE A 61 5.618 -29.125 28.356 1.00 56.07 C ATOM 849 CE1 PHE A 61 4.403 -27.143 26.828 1.00 65.34 C ATOM 850 CE2 PHE A 61 6.377 -28.377 27.470 1.00 61.41 C ATOM 851 CZ PHE A 61 5.770 -27.381 26.705 1.00 77.08 C ATOM 852 HA PHE A 61 3.644 -31.593 28.364 1.00 0.00 H ATOM 853 HB2 PHE A 61 2.622 -29.117 29.808 1.00 0.00 H ATOM 854 HB3 PHE A 61 4.073 -30.050 30.245 1.00 0.00 H ATOM 855 HD2 PHE A 61 6.095 -29.901 28.954 1.00 0.00 H ATOM 856 HE2 PHE A 61 7.446 -28.567 27.371 1.00 0.00 H ATOM 857 HZ PHE A 61 6.366 -26.789 26.011 1.00 0.00 H ATOM 858 HE1 PHE A 61 3.926 -26.366 26.231 1.00 0.00 H ATOM 859 HD1 PHE A 61 2.584 -27.716 27.806 1.00 0.00 H ATOM 860 H PHE A 61 2.286 -31.054 26.661 1.00 0.00 H ATOM 861 N LYS A 62 0.997 -32.419 29.368 1.00 78.74 N ATOM 862 CA LYS A 62 0.328 -33.428 30.182 1.00 73.45 C ATOM 863 C LYS A 62 1.278 -34.616 30.349 1.00 85.83 C ATOM 864 O LYS A 62 2.030 -34.942 29.427 1.00 70.47 O ATOM 865 CB LYS A 62 -0.982 -33.874 29.521 1.00 62.89 C ATOM 866 CG LYS A 62 -1.849 -34.795 30.388 1.00 90.47 C ATOM 867 CD LYS A 62 -2.754 -33.987 31.297 1.00102.52 C ATOM 868 CE LYS A 62 -2.908 -34.626 32.657 1.00 99.23 C ATOM 869 NZ LYS A 62 -3.455 -33.645 33.627 1.00 87.84 N ATOM 870 HA LYS A 62 0.078 -33.012 31.158 1.00 0.00 H ATOM 871 HB2 LYS A 62 -1.564 -32.984 29.282 1.00 0.00 H ATOM 872 HB3 LYS A 62 -0.736 -34.404 28.601 1.00 0.00 H ATOM 873 HG2 LYS A 62 -2.461 -35.423 29.741 1.00 0.00 H ATOM 874 HG3 LYS A 62 -1.202 -35.426 30.997 1.00 0.00 H ATOM 875 HD2 LYS A 62 -2.329 -32.991 31.422 1.00 0.00 H ATOM 876 HD3 LYS A 62 -3.737 -33.905 30.833 1.00 0.00 H ATOM 877 HE2 LYS A 62 -1.935 -34.972 33.005 1.00 0.00 H ATOM 878 HE3 LYS A 62 -3.588 -35.475 32.581 1.00 0.00 H ATOM 879 HZ1 LYS A 62 -2.806 -32.836 33.703 1.00 0.00 H ATOM 880 HZ2 LYS A 62 -4.385 -33.316 33.298 1.00 0.00 H ATOM 881 HZ3 LYS A 62 -3.555 -34.098 34.558 1.00 0.00 H ATOM 882 H LYS A 62 0.594 -32.163 28.444 1.00 0.00 H ATOM 883 N GLU A 63 1.254 -35.251 31.520 1.00 85.33 N ATOM 884 CA GLU A 63 2.124 -36.395 31.786 1.00 83.99 C ATOM 885 C GLU A 63 1.326 -37.646 32.160 1.00 93.65 C ATOM 886 O GLU A 63 0.398 -37.584 32.965 1.00 96.08 O ATOM 887 CB GLU A 63 3.126 -36.063 32.889 1.00 86.28 C ATOM 888 CG GLU A 63 4.012 -34.870 32.588 1.00 87.50 C ATOM 889 CD GLU A 63 4.879 -34.481 33.774 1.00122.43 C ATOM 890 OE1 GLU A 63 5.979 -35.060 33.925 1.00125.47 O ATOM 891 OE2 GLU A 63 4.460 -33.593 34.552 1.00117.18 O ATOM 892 HA GLU A 63 2.665 -36.609 30.864 1.00 0.00 H ATOM 893 HB2 GLU A 63 2.571 -35.854 33.804 1.00 0.00 H ATOM 894 HB3 GLU A 63 3.765 -36.933 33.044 1.00 0.00 H ATOM 895 HG2 GLU A 63 4.659 -35.117 31.747 1.00 0.00 H ATOM 896 HG3 GLU A 63 3.380 -34.022 32.322 1.00 0.00 H ATOM 897 H GLU A 63 0.602 -34.925 32.262 1.00 0.00 H ATOM 898 N LEU A 64 1.701 -38.781 31.575 1.00 86.21 N ATOM 899 CA LEU A 64 0.973 -40.029 31.779 1.00 70.66 C ATOM 900 C LEU A 64 1.893 -41.208 32.077 1.00 96.80 C ATOM 901 O LEU A 64 2.741 -41.567 31.259 1.00102.92 O ATOM 902 CB LEU A 64 0.104 -40.343 30.556 1.00 70.92 C ATOM 903 CG LEU A 64 -0.872 -39.271 30.051 1.00 73.46 C ATOM 904 CD1 LEU A 64 -1.611 -39.769 28.827 1.00 68.91 C ATOM 905 CD2 LEU A 64 -1.864 -38.845 31.118 1.00 64.03 C ATOM 906 HA LEU A 64 0.341 -39.884 32.655 1.00 0.00 H ATOM 907 HB2 LEU A 64 0.780 -40.575 29.733 1.00 0.00 H ATOM 908 HB3 LEU A 64 -0.487 -41.226 30.800 1.00 0.00 H ATOM 909 HG LEU A 64 -0.279 -38.395 29.789 1.00 0.00 H ATOM 910 HD21 LEU A 64 -2.447 -39.709 31.436 1.00 0.00 H ATOM 911 HD22 LEU A 64 -1.324 -38.435 31.971 1.00 0.00 H ATOM 912 HD23 LEU A 64 -2.531 -38.086 30.710 1.00 0.00 H ATOM 913 HD11 LEU A 64 -0.893 -39.998 28.039 1.00 0.00 H ATOM 914 HD12 LEU A 64 -2.171 -40.669 29.083 1.00 0.00 H ATOM 915 HD13 LEU A 64 -2.299 -38.998 28.481 1.00 0.00 H ATOM 916 H LEU A 64 2.536 -38.778 30.955 1.00 0.00 H ATOM 917 N GLU A 65 1.723 -41.799 33.256 1.00106.41 N ATOM 918 CA GLU A 65 2.392 -43.048 33.599 1.00102.15 C ATOM 919 C GLU A 65 1.390 -44.183 33.486 1.00 99.88 C ATOM 920 O GLU A 65 0.221 -43.954 33.182 1.00 88.20 O ATOM 921 CB GLU A 65 2.972 -42.992 35.018 1.00 95.69 C ATOM 922 CG GLU A 65 1.991 -42.567 36.103 1.00109.23 C ATOM 923 CD GLU A 65 2.657 -42.425 37.466 1.00120.46 C ATOM 924 OE1 GLU A 65 3.764 -42.973 37.641 1.00131.50 O ATOM 925 OE2 GLU A 65 2.081 -41.766 38.360 1.00111.81 O ATOM 926 HA GLU A 65 3.221 -43.211 32.910 1.00 0.00 H ATOM 927 HB2 GLU A 65 3.344 -43.985 35.270 1.00 0.00 H ATOM 928 HB3 GLU A 65 3.801 -42.284 35.016 1.00 0.00 H ATOM 929 HG2 GLU A 65 1.555 -41.608 35.825 1.00 0.00 H ATOM 930 HG3 GLU A 65 1.202 -43.316 36.175 1.00 0.00 H ATOM 931 H GLU A 65 1.093 -41.356 33.955 1.00 0.00 H ATOM 932 N GLY A 66 1.849 -45.406 33.725 1.00 98.19 N ATOM 933 CA GLY A 66 0.961 -46.554 33.801 1.00 94.27 C ATOM 934 C GLY A 66 0.365 -46.969 32.475 1.00 96.01 C ATOM 935 O GLY A 66 -0.837 -47.199 32.366 1.00 96.38 O ATOM 936 HA3 GLY A 66 0.145 -46.310 34.481 1.00 0.00 H ATOM 937 HA2 GLY A 66 1.525 -47.397 34.200 1.00 0.00 H ATOM 938 H GLY A 66 2.870 -45.546 33.861 1.00 0.00 H ATOM 939 N TRP A 67 1.213 -47.072 31.462 1.00106.87 N ATOM 940 CA TRP A 67 0.759 -47.465 30.140 1.00105.22 C ATOM 941 C TRP A 67 0.536 -48.972 30.053 1.00112.89 C ATOM 942 O TRP A 67 1.313 -49.759 30.593 1.00 99.59 O ATOM 943 CB TRP A 67 1.762 -47.009 29.074 1.00100.17 C ATOM 944 CG TRP A 67 1.768 -45.532 28.881 1.00 86.58 C ATOM 945 CD1 TRP A 67 2.487 -44.616 29.593 1.00 78.75 C ATOM 946 CD2 TRP A 67 1.002 -44.790 27.926 1.00 86.51 C ATOM 947 NE1 TRP A 67 2.213 -43.349 29.145 1.00 80.40 N ATOM 948 CE2 TRP A 67 1.306 -43.425 28.120 1.00 86.08 C ATOM 949 CE3 TRP A 67 0.085 -45.143 26.929 1.00 79.62 C ATOM 950 CZ2 TRP A 67 0.732 -42.412 27.349 1.00 77.43 C ATOM 951 CZ3 TRP A 67 -0.486 -44.133 26.163 1.00112.50 C ATOM 952 CH2 TRP A 67 -0.157 -42.784 26.377 1.00101.26 C ATOM 953 HA TRP A 67 -0.198 -46.976 29.956 1.00 0.00 H ATOM 954 HB2 TRP A 67 2.760 -47.325 29.377 1.00 0.00 H ATOM 955 HB3 TRP A 67 1.504 -47.483 28.127 1.00 0.00 H ATOM 956 HE1 TRP A 67 2.626 -42.472 29.522 1.00 0.00 H ATOM 957 HD1 TRP A 67 3.179 -44.857 30.400 1.00 0.00 H ATOM 958 HZ2 TRP A 67 0.983 -41.364 27.515 1.00 0.00 H ATOM 959 HH2 TRP A 67 -0.620 -42.017 25.756 1.00 0.00 H ATOM 960 HZ3 TRP A 67 -1.202 -44.392 25.383 1.00 0.00 H ATOM 961 HE3 TRP A 67 -0.176 -46.187 26.757 1.00 0.00 H ATOM 962 H TRP A 67 2.221 -46.868 31.616 1.00 0.00 H ATOM 963 N GLU A 68 -0.540 -49.358 29.377 1.00103.33 N ATOM 964 CA GLU A 68 -0.822 -50.757 29.089 1.00104.56 C ATOM 965 C GLU A 68 -0.692 -50.974 27.589 1.00 98.86 C ATOM 966 O GLU A 68 -1.045 -50.100 26.807 1.00108.75 O ATOM 967 CB GLU A 68 -2.229 -51.133 29.558 1.00115.35 C ATOM 968 CG GLU A 68 -2.404 -51.152 31.069 1.00110.49 C ATOM 969 CD GLU A 68 -3.863 -51.199 31.478 1.00122.39 C ATOM 970 OE1 GLU A 68 -4.708 -51.559 30.628 1.00119.96 O ATOM 971 OE2 GLU A 68 -4.162 -50.871 32.645 1.00124.87 O ATOM 972 HA GLU A 68 -0.113 -51.391 29.622 1.00 0.00 H ATOM 973 HB2 GLU A 68 -2.932 -50.411 29.142 1.00 0.00 H ATOM 974 HB3 GLU A 68 -2.462 -52.127 29.175 1.00 0.00 H ATOM 975 HG2 GLU A 68 -1.899 -52.031 31.470 1.00 0.00 H ATOM 976 HG3 GLU A 68 -1.951 -50.252 31.486 1.00 0.00 H ATOM 977 H GLU A 68 -1.206 -48.634 29.041 1.00 0.00 H ATOM 978 N PRO A 69 -0.194 -52.148 27.182 1.00100.43 N ATOM 979 CA PRO A 69 0.167 -52.411 25.786 1.00104.83 C ATOM 980 C PRO A 69 -0.988 -52.212 24.822 1.00 93.01 C ATOM 981 O PRO A 69 -0.768 -52.046 23.626 1.00111.22 O ATOM 982 CB PRO A 69 0.586 -53.885 25.803 1.00105.19 C ATOM 983 CG PRO A 69 -0.080 -54.460 26.991 1.00 84.97 C ATOM 984 CD PRO A 69 -0.074 -53.358 28.009 1.00 93.58 C ATOM 985 HA PRO A 69 0.940 -51.725 25.440 1.00 0.00 H ATOM 986 HD3 PRO A 69 -0.917 -53.451 28.693 1.00 0.00 H ATOM 987 HD2 PRO A 69 0.856 -53.354 28.578 1.00 0.00 H ATOM 988 HG3 PRO A 69 0.472 -55.325 27.359 1.00 0.00 H ATOM 989 HG2 PRO A 69 -1.101 -54.756 26.752 1.00 0.00 H ATOM 990 HB2 PRO A 69 0.253 -54.389 24.896 1.00 0.00 H ATOM 991 HB3 PRO A 69 1.669 -53.975 25.890 1.00 0.00 H ATOM 992 N ASP A 70 -2.206 -52.222 25.338 1.00109.17 N ATOM 993 CA ASP A 70 -3.369 -52.114 24.474 1.00119.97 C ATOM 994 C ASP A 70 -3.856 -50.677 24.303 1.00101.66 C ATOM 995 O ASP A 70 -4.729 -50.411 23.475 1.00 75.76 O ATOM 996 CB ASP A 70 -4.493 -53.017 24.974 1.00133.19 C ATOM 997 CG ASP A 70 -4.755 -54.174 24.042 1.00138.35 C ATOM 998 OD1 ASP A 70 -4.583 -53.987 22.817 1.00121.45 O ATOM 999 OD2 ASP A 70 -5.122 -55.265 24.530 1.00130.70 O ATOM 1000 HA ASP A 70 -3.058 -52.450 23.485 1.00 0.00 H ATOM 1001 HB2 ASP A 70 -4.218 -53.410 25.953 1.00 0.00 H ATOM 1002 HB3 ASP A 70 -5.404 -52.426 25.064 1.00 0.00 H ATOM 1003 H ASP A 70 -2.332 -52.308 26.367 1.00 0.00 H ATOM 1004 N ASP A 71 -3.277 -49.763 25.081 1.00 90.77 N ATOM 1005 CA ASP A 71 -3.606 -48.340 25.009 1.00 84.30 C ATOM 1006 C ASP A 71 -3.291 -47.719 23.639 1.00 90.52 C ATOM 1007 O ASP A 71 -2.195 -47.886 23.103 1.00 77.08 O ATOM 1008 CB ASP A 71 -2.866 -47.553 26.099 1.00 79.52 C ATOM 1009 CG ASP A 71 -3.339 -47.888 27.498 1.00 92.56 C ATOM 1010 OD1 ASP A 71 -4.465 -48.404 27.645 1.00109.33 O ATOM 1011 OD2 ASP A 71 -2.582 -47.619 28.458 1.00 80.53 O ATOM 1012 HA ASP A 71 -4.683 -48.274 25.165 1.00 0.00 H ATOM 1013 HB2 ASP A 71 -1.802 -47.779 26.029 1.00 0.00 H ATOM 1014 HB3 ASP A 71 -3.022 -46.488 25.925 1.00 0.00 H ATOM 1015 H ASP A 71 -2.561 -50.075 25.768 1.00 0.00 H ATOM 1016 N ASP A 72 -4.263 -47.006 23.080 1.00 76.77 N ATOM 1017 CA ASP A 72 -4.033 -46.190 21.900 1.00 87.82 C ATOM 1018 C ASP A 72 -3.697 -44.766 22.360 1.00 94.38 C ATOM 1019 O ASP A 72 -4.552 -44.062 22.904 1.00 81.75 O ATOM 1020 CB ASP A 72 -5.262 -46.197 20.992 1.00 79.84 C ATOM 1021 CG ASP A 72 -5.151 -45.198 19.852 1.00108.79 C ATOM 1022 OD1 ASP A 72 -4.021 -44.749 19.555 1.00102.03 O ATOM 1023 OD2 ASP A 72 -6.193 -44.862 19.249 1.00 94.39 O ATOM 1024 HA ASP A 72 -3.202 -46.595 21.322 1.00 0.00 H ATOM 1025 HB2 ASP A 72 -5.380 -47.196 20.571 1.00 0.00 H ATOM 1026 HB3 ASP A 72 -6.139 -45.950 21.589 1.00 0.00 H ATOM 1027 H ASP A 72 -5.215 -47.033 23.499 1.00 0.00 H ATOM 1028 N PRO A 73 -2.438 -44.342 22.151 1.00 89.93 N ATOM 1029 CA PRO A 73 -1.930 -43.089 22.720 1.00 83.25 C ATOM 1030 C PRO A 73 -2.720 -41.857 22.277 1.00 80.63 C ATOM 1031 O PRO A 73 -2.826 -40.918 23.058 1.00 89.91 O ATOM 1032 CB PRO A 73 -0.486 -43.029 22.205 1.00 86.40 C ATOM 1033 CG PRO A 73 -0.125 -44.430 21.878 1.00 54.84 C ATOM 1034 CD PRO A 73 -1.403 -45.044 21.374 1.00 79.52 C ATOM 1035 HA PRO A 73 -2.014 -43.079 23.807 1.00 0.00 H ATOM 1036 HD3 PRO A 73 -1.528 -44.868 20.306 1.00 0.00 H ATOM 1037 HD2 PRO A 73 -1.426 -46.116 21.569 1.00 0.00 H ATOM 1038 HG3 PRO A 73 0.230 -44.953 22.766 1.00 0.00 H ATOM 1039 HG2 PRO A 73 0.646 -44.459 21.108 1.00 0.00 H ATOM 1040 HB2 PRO A 73 -0.424 -42.402 21.316 1.00 0.00 H ATOM 1041 HB3 PRO A 73 0.177 -42.634 22.974 1.00 0.00 H ATOM 1042 N ILE A 74 -3.258 -41.854 21.061 1.00 68.71 N ATOM 1043 CA ILE A 74 -4.169 -40.791 20.644 1.00 79.74 C ATOM 1044 C ILE A 74 -5.418 -40.728 21.530 1.00 90.29 C ATOM 1045 O ILE A 74 -5.706 -39.701 22.142 1.00 81.79 O ATOM 1046 CB ILE A 74 -4.625 -40.966 19.195 1.00 87.25 C ATOM 1047 CG1 ILE A 74 -3.510 -40.570 18.233 1.00 89.92 C ATOM 1048 CG2 ILE A 74 -5.861 -40.123 18.926 1.00 79.96 C ATOM 1049 CD1 ILE A 74 -3.853 -40.837 16.776 1.00 91.86 C ATOM 1050 HA ILE A 74 -3.603 -39.865 20.741 1.00 0.00 H ATOM 1051 HB ILE A 74 -4.870 -42.016 19.037 1.00 0.00 H ATOM 1052 HG12 ILE A 74 -3.311 -39.505 18.353 1.00 0.00 H ATOM 1053 HG13 ILE A 74 -2.615 -41.137 18.488 1.00 0.00 H ATOM 1054 HD11 ILE A 74 -4.045 -41.901 16.638 1.00 0.00 H ATOM 1055 HD12 ILE A 74 -4.742 -40.268 16.503 1.00 0.00 H ATOM 1056 HD13 ILE A 74 -3.017 -40.533 16.146 1.00 0.00 H ATOM 1057 HG21 ILE A 74 -6.665 -40.435 19.593 1.00 0.00 H ATOM 1058 HG22 ILE A 74 -5.628 -39.073 19.102 1.00 0.00 H ATOM 1059 HG23 ILE A 74 -6.173 -40.258 17.891 1.00 0.00 H ATOM 1060 H ILE A 74 -3.027 -42.620 20.397 1.00 0.00 H ATOM 1061 N GLU A 75 -6.160 -41.830 21.587 1.00 92.57 N ATOM 1062 CA GLU A 75 -7.360 -41.900 22.409 1.00 95.67 C ATOM 1063 C GLU A 75 -7.059 -41.541 23.858 1.00 88.41 C ATOM 1064 O GLU A 75 -7.846 -40.864 24.521 1.00 96.48 O ATOM 1065 CB GLU A 75 -8.005 -43.284 22.312 1.00 94.00 C ATOM 1066 CG GLU A 75 -8.721 -43.521 20.990 1.00140.54 C ATOM 1067 CD GLU A 75 -9.502 -42.297 20.514 1.00140.53 C ATOM 1068 OE1 GLU A 75 -10.116 -41.608 21.360 1.00136.28 O ATOM 1069 OE2 GLU A 75 -9.492 -42.020 19.291 1.00108.98 O ATOM 1070 HA GLU A 75 -8.069 -41.166 22.026 1.00 0.00 H ATOM 1071 HB2 GLU A 75 -7.226 -44.038 22.424 1.00 0.00 H ATOM 1072 HB3 GLU A 75 -8.728 -43.387 23.121 1.00 0.00 H ATOM 1073 HG2 GLU A 75 -7.980 -43.778 20.233 1.00 0.00 H ATOM 1074 HG3 GLU A 75 -9.416 -44.352 21.114 1.00 0.00 H ATOM 1075 H GLU A 75 -5.876 -42.662 21.031 1.00 0.00 H ATOM 1076 N GLU A 76 -5.904 -41.985 24.333 1.00 76.12 N ATOM 1077 CA GLU A 76 -5.478 -41.713 25.697 1.00 81.70 C ATOM 1078 C GLU A 76 -5.121 -40.229 25.878 1.00 81.73 C ATOM 1079 O GLU A 76 -5.126 -39.696 26.989 1.00 78.55 O ATOM 1080 CB GLU A 76 -4.289 -42.616 26.051 1.00 80.16 C ATOM 1081 CG GLU A 76 -4.311 -43.150 27.482 1.00121.84 C ATOM 1082 CD GLU A 76 -5.550 -43.980 27.792 1.00127.84 C ATOM 1083 OE1 GLU A 76 -5.879 -44.885 26.994 1.00112.38 O ATOM 1084 OE2 GLU A 76 -6.189 -43.731 28.840 1.00128.84 O ATOM 1085 HA GLU A 76 -6.302 -41.932 26.376 1.00 0.00 H ATOM 1086 HB2 GLU A 76 -4.290 -43.466 25.369 1.00 0.00 H ATOM 1087 HB3 GLU A 76 -3.372 -42.043 25.914 1.00 0.00 H ATOM 1088 HG2 GLU A 76 -3.429 -43.773 27.634 1.00 0.00 H ATOM 1089 HG3 GLU A 76 -4.279 -42.304 28.169 1.00 0.00 H ATOM 1090 H GLU A 76 -5.284 -42.544 23.712 1.00 0.00 H ATOM 1091 N HIS A 77 -4.816 -39.563 24.773 1.00 81.35 N ATOM 1092 CA HIS A 77 -4.441 -38.157 24.813 1.00 81.84 C ATOM 1093 C HIS A 77 -5.694 -37.273 24.824 1.00 91.49 C ATOM 1094 O HIS A 77 -5.791 -36.328 25.603 1.00 83.60 O ATOM 1095 CB HIS A 77 -3.531 -37.823 23.626 1.00 70.17 C ATOM 1096 CG HIS A 77 -2.848 -36.491 23.738 1.00104.18 C ATOM 1097 ND1 HIS A 77 -1.705 -36.179 23.032 1.00 95.22 N ATOM 1098 CD2 HIS A 77 -3.146 -35.392 24.472 1.00103.28 C ATOM 1099 CE1 HIS A 77 -1.324 -34.949 23.330 1.00 78.27 C ATOM 1100 NE2 HIS A 77 -2.185 -34.449 24.200 1.00 92.44 N ATOM 1101 HA HIS A 77 -3.886 -37.959 25.730 1.00 0.00 H ATOM 1102 HB2 HIS A 77 -2.766 -38.596 23.552 1.00 0.00 H ATOM 1103 HB3 HIS A 77 -4.136 -37.824 22.719 1.00 0.00 H ATOM 1104 HD2 HIS A 77 -3.991 -35.277 25.151 1.00 0.00 H ATOM 1105 HE1 HIS A 77 -0.451 -34.435 22.928 1.00 0.00 H ATOM 1106 H HIS A 77 -4.845 -40.056 23.858 1.00 0.00 H ATOM 1107 N LYS A 78 -6.652 -37.593 23.961 1.00 87.87 N ATOM 1108 CA LYS A 78 -7.935 -36.903 23.943 1.00 89.67 C ATOM 1109 C LYS A 78 -8.605 -36.999 25.308 1.00 93.68 C ATOM 1110 O LYS A 78 -9.220 -36.045 25.787 1.00107.48 O ATOM 1111 CB LYS A 78 -8.842 -37.498 22.868 1.00 80.35 C ATOM 1112 CG LYS A 78 -8.335 -37.282 21.446 1.00107.22 C ATOM 1113 CD LYS A 78 -8.690 -38.457 20.529 1.00131.46 C ATOM 1114 CE LYS A 78 -10.177 -38.513 20.182 1.00138.05 C ATOM 1115 NZ LYS A 78 -10.553 -37.561 19.096 1.00132.54 N ATOM 1116 HA LYS A 78 -7.761 -35.852 23.711 1.00 0.00 H ATOM 1117 HB2 LYS A 78 -8.926 -38.570 23.044 1.00 0.00 H ATOM 1118 HB3 LYS A 78 -9.826 -37.038 22.956 1.00 0.00 H ATOM 1119 HG2 LYS A 78 -8.785 -36.373 21.045 1.00 0.00 H ATOM 1120 HG3 LYS A 78 -7.251 -37.169 21.471 1.00 0.00 H ATOM 1121 HD2 LYS A 78 -8.120 -38.361 19.605 1.00 0.00 H ATOM 1122 HD3 LYS A 78 -8.414 -39.385 21.030 1.00 0.00 H ATOM 1123 HE2 LYS A 78 -10.753 -38.269 21.075 1.00 0.00 H ATOM 1124 HE3 LYS A 78 -10.422 -39.525 19.859 1.00 0.00 H ATOM 1125 HZ1 LYS A 78 -10.332 -36.590 19.396 1.00 0.00 H ATOM 1126 HZ2 LYS A 78 -10.016 -37.790 18.235 1.00 0.00 H ATOM 1127 HZ3 LYS A 78 -11.572 -37.642 18.903 1.00 0.00 H ATOM 1128 H LYS A 78 -6.481 -38.359 23.278 1.00 0.00 H ATOM 1129 N LYS A 79 -8.481 -38.164 25.931 1.00 80.38 N ATOM 1130 CA LYS A 79 -9.015 -38.381 27.270 1.00 83.22 C ATOM 1131 C LYS A 79 -8.396 -37.411 28.277 1.00109.39 C ATOM 1132 O LYS A 79 -9.036 -36.443 28.695 1.00117.15 O ATOM 1133 CB LYS A 79 -8.789 -39.838 27.696 1.00 87.34 C ATOM 1134 CG LYS A 79 -9.034 -40.136 29.162 1.00 89.64 C ATOM 1135 CD LYS A 79 -10.216 -41.083 29.372 1.00109.09 C ATOM 1136 CE LYS A 79 -9.915 -42.509 28.929 1.00119.54 C ATOM 1137 NZ LYS A 79 -10.953 -43.470 29.427 1.00110.20 N ATOM 1138 HA LYS A 79 -10.087 -38.187 27.249 1.00 0.00 H ATOM 1139 HB2 LYS A 79 -9.458 -40.467 27.109 1.00 0.00 H ATOM 1140 HB3 LYS A 79 -7.755 -40.098 27.469 1.00 0.00 H ATOM 1141 HG2 LYS A 79 -8.138 -40.594 29.581 1.00 0.00 H ATOM 1142 HG3 LYS A 79 -9.238 -39.200 29.681 1.00 0.00 H ATOM 1143 HD2 LYS A 79 -10.470 -41.093 30.432 1.00 0.00 H ATOM 1144 HD3 LYS A 79 -11.066 -40.712 28.799 1.00 0.00 H ATOM 1145 HE2 LYS A 79 -8.942 -42.804 29.321 1.00 0.00 H ATOM 1146 HE3 LYS A 79 -9.893 -42.545 27.840 1.00 0.00 H ATOM 1147 HZ1 LYS A 79 -10.976 -43.446 30.466 1.00 0.00 H ATOM 1148 HZ2 LYS A 79 -11.884 -43.198 29.052 1.00 0.00 H ATOM 1149 HZ3 LYS A 79 -10.716 -44.431 29.107 1.00 0.00 H ATOM 1150 H LYS A 79 -7.989 -38.944 25.451 1.00 0.00 H ATOM 1151 N HIS A 80 -7.140 -37.654 28.636 1.00 95.11 N ATOM 1152 CA HIS A 80 -6.490 -36.927 29.724 1.00100.28 C ATOM 1153 C HIS A 80 -6.080 -35.473 29.425 1.00102.47 C ATOM 1154 O HIS A 80 -5.570 -34.777 30.303 1.00103.77 O ATOM 1155 CB HIS A 80 -5.286 -37.720 30.218 1.00 82.99 C ATOM 1156 CG HIS A 80 -5.637 -39.078 30.736 1.00100.72 C ATOM 1157 ND1 HIS A 80 -5.828 -39.338 32.075 1.00108.78 N ATOM 1158 CD2 HIS A 80 -5.835 -40.252 30.092 1.00118.17 C ATOM 1159 CE1 HIS A 80 -6.125 -40.615 32.235 1.00132.81 C ATOM 1160 NE2 HIS A 80 -6.137 -41.193 31.047 1.00127.51 N ATOM 1161 HA HIS A 80 -7.256 -36.835 30.494 1.00 0.00 H ATOM 1162 HB2 HIS A 80 -4.586 -37.837 29.390 1.00 0.00 H ATOM 1163 HB3 HIS A 80 -4.808 -37.158 31.020 1.00 0.00 H ATOM 1164 HD2 HIS A 80 -5.768 -40.420 29.017 1.00 0.00 H ATOM 1165 HE1 HIS A 80 -6.326 -41.108 33.186 1.00 0.00 H ATOM 1166 H HIS A 80 -6.603 -38.384 28.127 1.00 0.00 H ATOM 1167 N SER A 81 -6.295 -35.016 28.197 1.00 72.28 N ATOM 1168 CA SER A 81 -5.998 -33.633 27.854 1.00 73.56 C ATOM 1169 C SER A 81 -6.661 -33.210 26.543 1.00 89.58 C ATOM 1170 O SER A 81 -5.992 -32.790 25.605 1.00 86.49 O ATOM 1171 CB SER A 81 -4.485 -33.407 27.792 1.00 83.30 C ATOM 1172 OG SER A 81 -4.176 -32.044 27.536 1.00 87.24 O ATOM 1173 HA SER A 81 -6.415 -33.007 28.643 1.00 0.00 H ATOM 1174 HB2 SER A 81 -4.066 -34.022 26.995 1.00 0.00 H ATOM 1175 HB3 SER A 81 -4.043 -33.699 28.745 1.00 0.00 H ATOM 1176 HG SER A 81 -4.571 -31.775 26.669 1.00 0.00 H ATOM 1177 H SER A 81 -6.680 -35.654 27.472 1.00 0.00 H ATOM 1178 N SER A 82 -7.985 -33.314 26.496 1.00116.67 N ATOM 1179 CA SER A 82 -8.755 -32.996 25.296 1.00106.54 C ATOM 1180 C SER A 82 -8.462 -31.603 24.750 1.00102.74 C ATOM 1181 O SER A 82 -8.543 -31.366 23.543 1.00 95.54 O ATOM 1182 CB SER A 82 -10.245 -33.090 25.605 1.00113.54 C ATOM 1183 OG SER A 82 -10.612 -32.081 26.530 1.00111.54 O ATOM 1184 HA SER A 82 -8.461 -33.720 24.536 1.00 0.00 H ATOM 1185 HB2 SER A 82 -10.465 -34.069 26.032 1.00 0.00 H ATOM 1186 HB3 SER A 82 -10.814 -32.961 24.684 1.00 0.00 H ATOM 1187 HG SER A 82 -11.580 -32.150 26.725 1.00 0.00 H ATOM 1188 H SER A 82 -8.492 -33.634 27.346 1.00 0.00 H ATOM 1189 N GLY A 83 -8.137 -30.675 25.643 1.00 96.03 N ATOM 1190 CA GLY A 83 -7.940 -29.289 25.260 1.00 73.08 C ATOM 1191 C GLY A 83 -6.723 -29.037 24.393 1.00104.61 C ATOM 1192 O GLY A 83 -6.624 -28.000 23.728 1.00 82.23 O ATOM 1193 HA3 GLY A 83 -7.838 -28.697 26.169 1.00 0.00 H ATOM 1194 HA2 GLY A 83 -8.822 -28.960 24.711 1.00 0.00 H ATOM 1195 H GLY A 83 -8.021 -30.948 26.640 1.00 0.00 H ATOM 1196 N CYS A 84 -5.794 -29.988 24.398 1.00114.82 N ATOM 1197 CA CYS A 84 -4.519 -29.827 23.709 1.00 83.08 C ATOM 1198 C CYS A 84 -4.648 -29.548 22.208 1.00 87.27 C ATOM 1199 O CYS A 84 -5.382 -30.231 21.495 1.00 94.29 O ATOM 1200 CB CYS A 84 -3.635 -31.038 23.949 1.00 62.14 C ATOM 1201 SG CYS A 84 -2.238 -31.066 22.845 1.00 77.14 S ATOM 1202 HA CYS A 84 -4.058 -28.937 24.137 1.00 0.00 H ATOM 1203 HB2 CYS A 84 -4.225 -31.942 23.795 1.00 0.00 H ATOM 1204 HB3 CYS A 84 -3.273 -31.013 24.977 1.00 0.00 H ATOM 1205 HG CYS A 84 -1.471 -32.183 23.105 1.00 0.00 H ATOM 1206 H CYS A 84 -5.982 -30.874 24.909 1.00 0.00 H ATOM 1207 N ALA A 85 -3.905 -28.543 21.744 1.00 90.71 N ATOM 1208 CA ALA A 85 -4.015 -28.021 20.381 1.00 74.38 C ATOM 1209 C ALA A 85 -3.346 -28.878 19.312 1.00 91.17 C ATOM 1210 O ALA A 85 -3.767 -28.872 18.151 1.00 83.89 O ATOM 1211 CB ALA A 85 -3.453 -26.620 20.327 1.00 65.58 C ATOM 1212 HA ALA A 85 -5.080 -28.032 20.147 1.00 0.00 H ATOM 1213 HB1 ALA A 85 -4.013 -25.979 21.007 1.00 0.00 H ATOM 1214 HB2 ALA A 85 -2.405 -26.639 20.624 1.00 0.00 H ATOM 1215 HB3 ALA A 85 -3.537 -26.235 19.311 1.00 0.00 H ATOM 1216 H ALA A 85 -3.211 -28.107 22.384 1.00 0.00 H ATOM 1217 N PHE A 86 -2.280 -29.573 19.697 1.00 95.12 N ATOM 1218 CA PHE A 86 -1.577 -30.468 18.786 1.00 78.48 C ATOM 1219 C PHE A 86 -2.523 -31.549 18.274 1.00 65.11 C ATOM 1220 O PHE A 86 -2.459 -31.950 17.106 1.00 69.49 O ATOM 1221 CB PHE A 86 -0.368 -31.089 19.483 1.00 85.71 C ATOM 1222 CG PHE A 86 0.295 -32.169 18.690 1.00 69.69 C ATOM 1223 CD1 PHE A 86 1.060 -31.861 17.583 1.00 70.04 C ATOM 1224 CD2 PHE A 86 0.158 -33.494 19.052 1.00 95.08 C ATOM 1225 CE1 PHE A 86 1.670 -32.858 16.844 1.00 83.61 C ATOM 1226 CE2 PHE A 86 0.770 -34.492 18.317 1.00115.18 C ATOM 1227 CZ PHE A 86 1.528 -34.169 17.209 1.00 86.74 C ATOM 1228 HA PHE A 86 -1.220 -29.893 17.931 1.00 0.00 H ATOM 1229 HB2 PHE A 86 0.363 -30.302 19.671 1.00 0.00 H ATOM 1230 HB3 PHE A 86 -0.697 -31.512 20.432 1.00 0.00 H ATOM 1231 HD2 PHE A 86 -0.439 -33.756 19.926 1.00 0.00 H ATOM 1232 HE2 PHE A 86 0.654 -35.535 18.612 1.00 0.00 H ATOM 1233 HZ PHE A 86 2.011 -34.955 16.628 1.00 0.00 H ATOM 1234 HE1 PHE A 86 2.265 -32.599 15.969 1.00 0.00 H ATOM 1235 HD1 PHE A 86 1.185 -30.819 17.288 1.00 0.00 H ATOM 1236 H PHE A 86 -1.938 -29.476 20.674 1.00 0.00 H ATOM 1237 N LEU A 87 -3.415 -31.996 19.157 1.00 64.83 N ATOM 1238 CA LEU A 87 -4.468 -32.947 18.802 1.00 70.80 C ATOM 1239 C LEU A 87 -5.257 -32.536 17.558 1.00 85.51 C ATOM 1240 O LEU A 87 -5.856 -33.379 16.895 1.00 75.35 O ATOM 1241 CB LEU A 87 -5.437 -33.118 19.969 1.00 67.59 C ATOM 1242 CG LEU A 87 -5.201 -34.299 20.911 1.00 94.52 C ATOM 1243 CD1 LEU A 87 -3.720 -34.486 21.186 1.00 92.11 C ATOM 1244 CD2 LEU A 87 -5.992 -34.139 22.211 1.00 96.25 C ATOM 1245 HA LEU A 87 -3.966 -33.888 18.576 1.00 0.00 H ATOM 1246 HB2 LEU A 87 -5.393 -32.208 20.567 1.00 0.00 H ATOM 1247 HB3 LEU A 87 -6.437 -33.228 19.550 1.00 0.00 H ATOM 1248 HG LEU A 87 -5.565 -35.199 20.416 1.00 0.00 H ATOM 1249 HD21 LEU A 87 -5.679 -33.224 22.715 1.00 0.00 H ATOM 1250 HD22 LEU A 87 -7.056 -34.084 21.983 1.00 0.00 H ATOM 1251 HD23 LEU A 87 -5.802 -34.995 22.858 1.00 0.00 H ATOM 1252 HD11 LEU A 87 -3.199 -34.676 20.248 1.00 0.00 H ATOM 1253 HD12 LEU A 87 -3.321 -33.583 21.648 1.00 0.00 H ATOM 1254 HD13 LEU A 87 -3.581 -35.332 21.859 1.00 0.00 H ATOM 1255 H LEU A 87 -3.360 -31.655 20.138 1.00 0.00 H ATOM 1256 N SER A 88 -5.264 -31.245 17.243 1.00 91.00 N ATOM 1257 CA SER A 88 -6.068 -30.751 16.129 1.00 91.47 C ATOM 1258 C SER A 88 -5.239 -30.519 14.875 1.00 93.54 C ATOM 1259 O SER A 88 -5.784 -30.288 13.794 1.00 99.36 O ATOM 1260 CB SER A 88 -6.789 -29.465 16.518 1.00 74.29 C ATOM 1261 OG SER A 88 -7.306 -29.570 17.830 1.00109.41 O ATOM 1262 HA SER A 88 -6.801 -31.525 15.901 1.00 0.00 H ATOM 1263 HB2 SER A 88 -7.608 -29.287 15.821 1.00 0.00 H ATOM 1264 HB3 SER A 88 -6.088 -28.632 16.473 1.00 0.00 H ATOM 1265 HG SER A 88 -7.771 -28.729 18.069 1.00 0.00 H ATOM 1266 H SER A 88 -4.690 -30.578 17.797 1.00 0.00 H ATOM 1267 N VAL A 89 -3.922 -30.574 15.016 1.00 94.44 N ATOM 1268 CA VAL A 89 -3.057 -30.392 13.864 1.00 97.90 C ATOM 1269 C VAL A 89 -3.263 -31.538 12.888 1.00 92.28 C ATOM 1270 O VAL A 89 -2.691 -32.617 13.049 1.00 97.32 O ATOM 1271 CB VAL A 89 -1.576 -30.329 14.259 1.00 89.71 C ATOM 1272 CG1 VAL A 89 -0.708 -30.269 13.013 1.00 64.45 C ATOM 1273 CG2 VAL A 89 -1.324 -29.137 15.157 1.00 86.56 C ATOM 1274 HA VAL A 89 -3.322 -29.442 13.401 1.00 0.00 H ATOM 1275 HB VAL A 89 -1.315 -31.230 14.814 1.00 0.00 H ATOM 1276 HG11 VAL A 89 -0.881 -31.159 12.408 1.00 0.00 H ATOM 1277 HG12 VAL A 89 -0.964 -29.380 12.436 1.00 0.00 H ATOM 1278 HG13 VAL A 89 0.341 -30.225 13.305 1.00 0.00 H ATOM 1279 HG21 VAL A 89 -1.592 -28.222 14.628 1.00 0.00 H ATOM 1280 HG22 VAL A 89 -1.930 -29.228 16.058 1.00 0.00 H ATOM 1281 HG23 VAL A 89 -0.269 -29.105 15.429 1.00 0.00 H ATOM 1282 H VAL A 89 -3.507 -30.748 15.954 1.00 0.00 H ATOM 1283 N LYS A 90 -4.089 -31.297 11.879 1.00 98.03 N ATOM 1284 CA LYS A 90 -4.346 -32.297 10.851 1.00123.81 C ATOM 1285 C LYS A 90 -3.130 -32.471 9.944 1.00115.83 C ATOM 1286 O LYS A 90 -2.748 -33.594 9.608 1.00 92.56 O ATOM 1287 CB LYS A 90 -5.574 -31.905 10.021 1.00126.84 C ATOM 1288 CG LYS A 90 -6.686 -32.954 10.005 1.00107.16 C ATOM 1289 CD LYS A 90 -7.313 -33.129 11.383 1.00115.79 C ATOM 1290 CE LYS A 90 -8.085 -31.880 11.796 1.00134.17 C ATOM 1291 NZ LYS A 90 -8.799 -32.046 13.095 1.00130.40 N ATOM 1292 HA LYS A 90 -4.543 -33.248 11.345 1.00 0.00 H ATOM 1293 HB2 LYS A 90 -5.982 -30.981 10.431 1.00 0.00 H ATOM 1294 HB3 LYS A 90 -5.251 -31.734 8.994 1.00 0.00 H ATOM 1295 HG2 LYS A 90 -7.458 -32.641 9.302 1.00 0.00 H ATOM 1296 HG3 LYS A 90 -6.268 -33.908 9.683 1.00 0.00 H ATOM 1297 HD2 LYS A 90 -7.996 -33.978 11.359 1.00 0.00 H ATOM 1298 HD3 LYS A 90 -6.525 -33.318 12.112 1.00 0.00 H ATOM 1299 HE2 LYS A 90 -8.818 -31.651 11.022 1.00 0.00 H ATOM 1300 HE3 LYS A 90 -7.384 -31.051 11.887 1.00 0.00 H ATOM 1301 HZ1 LYS A 90 -9.478 -32.830 13.018 1.00 0.00 H ATOM 1302 HZ2 LYS A 90 -8.109 -32.256 13.844 1.00 0.00 H ATOM 1303 HZ3 LYS A 90 -9.306 -31.168 13.325 1.00 0.00 H ATOM 1304 H LYS A 90 -4.564 -30.374 11.820 1.00 0.00 H ATOM 1305 N LYS A 91 -2.524 -31.349 9.565 1.00121.18 N ATOM 1306 CA LYS A 91 -1.428 -31.333 8.599 1.00 94.28 C ATOM 1307 C LYS A 91 -0.166 -32.047 9.064 1.00 96.54 C ATOM 1308 O LYS A 91 0.084 -32.218 10.268 1.00 83.93 O ATOM 1309 CB LYS A 91 -1.069 -29.894 8.225 1.00 91.43 C ATOM 1310 CG LYS A 91 -1.279 -29.575 6.767 1.00 89.28 C ATOM 1311 CD LYS A 91 -2.102 -28.309 6.607 1.00 90.00 C ATOM 1312 CE LYS A 91 -2.414 -28.048 5.144 1.00 99.88 C ATOM 1313 NZ LYS A 91 -3.460 -27.002 4.997 1.00120.21 N ATOM 1314 HA LYS A 91 -1.802 -31.884 7.736 1.00 0.00 H ATOM 1315 HB2 LYS A 91 -1.688 -29.220 8.817 1.00 0.00 H ATOM 1316 HB3 LYS A 91 -0.019 -29.728 8.466 1.00 0.00 H ATOM 1317 HG2 LYS A 91 -0.310 -29.435 6.288 1.00 0.00 H ATOM 1318 HG3 LYS A 91 -1.802 -30.404 6.291 1.00 0.00 H ATOM 1319 HD2 LYS A 91 -3.036 -28.418 7.158 1.00 0.00 H ATOM 1320 HD3 LYS A 91 -1.541 -27.465 7.009 1.00 0.00 H ATOM 1321 HE2 LYS A 91 -2.767 -28.971 4.685 1.00 0.00 H ATOM 1322 HE3 LYS A 91 -1.506 -27.717 4.640 1.00 0.00 H ATOM 1323 HZ1 LYS A 91 -4.331 -27.315 5.472 1.00 0.00 H ATOM 1324 HZ2 LYS A 91 -3.127 -26.117 5.429 1.00 0.00 H ATOM 1325 HZ3 LYS A 91 -3.652 -26.845 3.987 1.00 0.00 H ATOM 1326 H LYS A 91 -2.843 -30.447 9.973 1.00 0.00 H ATOM 1327 N GLN A 92 0.633 -32.465 8.089 1.00 68.85 N ATOM 1328 CA GLN A 92 1.978 -32.914 8.387 1.00100.17 C ATOM 1329 C GLN A 92 2.870 -31.679 8.552 1.00108.33 C ATOM 1330 O GLN A 92 2.695 -30.670 7.867 1.00115.34 O ATOM 1331 CB GLN A 92 2.508 -33.856 7.297 1.00 97.33 C ATOM 1332 CG GLN A 92 3.845 -34.506 7.650 1.00112.59 C ATOM 1333 CD GLN A 92 3.828 -35.170 9.020 1.00131.14 C ATOM 1334 OE1 GLN A 92 4.475 -34.701 9.964 1.00113.17 O ATOM 1335 NE2 GLN A 92 3.082 -36.268 9.136 1.00127.26 N ATOM 1336 HA GLN A 92 1.979 -33.489 9.313 1.00 0.00 H ATOM 1337 HB2 GLN A 92 1.773 -34.644 7.135 1.00 0.00 H ATOM 1338 HB3 GLN A 92 2.634 -33.284 6.378 1.00 0.00 H ATOM 1339 HG2 GLN A 92 4.076 -35.261 6.898 1.00 0.00 H ATOM 1340 HG3 GLN A 92 4.619 -33.739 7.643 1.00 0.00 H ATOM 1341 HE22 GLN A 92 2.554 -36.627 8.315 1.00 0.00 H ATOM 1342 HE21 GLN A 92 3.028 -36.766 10.047 1.00 0.00 H ATOM 1343 H GLN A 92 0.292 -32.470 7.107 1.00 0.00 H ATOM 1344 N PHE A 93 3.805 -31.768 9.487 1.00 79.98 N ATOM 1345 CA PHE A 93 4.720 -30.682 9.826 1.00 89.31 C ATOM 1346 C PHE A 93 5.161 -29.782 8.650 1.00106.84 C ATOM 1347 O PHE A 93 4.845 -28.587 8.595 1.00 73.73 O ATOM 1348 CB PHE A 93 5.949 -31.280 10.510 1.00 75.22 C ATOM 1349 CG PHE A 93 6.883 -30.264 11.066 1.00 85.54 C ATOM 1350 CD1 PHE A 93 6.633 -29.683 12.294 1.00 80.85 C ATOM 1351 CD2 PHE A 93 8.012 -29.880 10.360 1.00110.82 C ATOM 1352 CE1 PHE A 93 7.499 -28.734 12.813 1.00101.29 C ATOM 1353 CE2 PHE A 93 8.883 -28.929 10.871 1.00 92.44 C ATOM 1354 CZ PHE A 93 8.630 -28.357 12.100 1.00 71.93 C ATOM 1355 HA PHE A 93 4.162 -30.016 10.484 1.00 0.00 H ATOM 1356 HB2 PHE A 93 5.611 -31.919 11.326 1.00 0.00 H ATOM 1357 HB3 PHE A 93 6.490 -31.881 9.779 1.00 0.00 H ATOM 1358 HD2 PHE A 93 8.218 -30.332 9.390 1.00 0.00 H ATOM 1359 HE2 PHE A 93 9.765 -28.635 10.303 1.00 0.00 H ATOM 1360 HZ PHE A 93 9.314 -27.613 12.510 1.00 0.00 H ATOM 1361 HE1 PHE A 93 7.292 -28.282 13.783 1.00 0.00 H ATOM 1362 HD1 PHE A 93 5.747 -29.973 12.859 1.00 0.00 H ATOM 1363 H PHE A 93 3.892 -32.663 10.009 1.00 0.00 H ATOM 1364 N GLU A 94 5.912 -30.350 7.719 1.00 93.66 N ATOM 1365 CA GLU A 94 6.454 -29.556 6.631 1.00 85.72 C ATOM 1366 C GLU A 94 5.364 -29.036 5.701 1.00 81.12 C ATOM 1367 O GLU A 94 5.649 -28.296 4.759 1.00 85.83 O ATOM 1368 CB GLU A 94 7.485 -30.364 5.849 1.00 91.67 C ATOM 1369 CG GLU A 94 8.562 -30.979 6.728 1.00109.68 C ATOM 1370 CD GLU A 94 9.746 -31.491 5.927 1.00130.03 C ATOM 1371 OE1 GLU A 94 9.674 -31.480 4.676 1.00124.63 O ATOM 1372 OE2 GLU A 94 10.752 -31.899 6.550 1.00115.35 O ATOM 1373 HA GLU A 94 6.942 -28.687 7.072 1.00 0.00 H ATOM 1374 HB2 GLU A 94 6.968 -31.166 5.322 1.00 0.00 H ATOM 1375 HB3 GLU A 94 7.964 -29.705 5.125 1.00 0.00 H ATOM 1376 HG2 GLU A 94 8.915 -30.223 7.429 1.00 0.00 H ATOM 1377 HG3 GLU A 94 8.128 -31.812 7.282 1.00 0.00 H ATOM 1378 H GLU A 94 6.114 -31.369 7.767 1.00 0.00 H ATOM 1379 N GLU A 95 4.120 -29.431 5.960 1.00 74.73 N ATOM 1380 CA GLU A 95 2.987 -28.960 5.162 1.00 85.06 C ATOM 1381 C GLU A 95 2.430 -27.678 5.756 1.00 83.61 C ATOM 1382 O GLU A 95 1.628 -26.989 5.129 1.00 96.67 O ATOM 1383 CB GLU A 95 1.876 -30.006 5.107 1.00117.47 C ATOM 1384 CG GLU A 95 2.055 -31.096 4.069 1.00134.48 C ATOM 1385 CD GLU A 95 0.878 -32.058 4.051 1.00142.07 C ATOM 1386 OE1 GLU A 95 0.867 -33.004 4.871 1.00125.24 O ATOM 1387 OE2 GLU A 95 -0.041 -31.859 3.225 1.00128.10 O ATOM 1388 HA GLU A 95 3.347 -28.777 4.150 1.00 0.00 H ATOM 1389 HB2 GLU A 95 1.814 -30.481 6.086 1.00 0.00 H ATOM 1390 HB3 GLU A 95 0.939 -29.490 4.894 1.00 0.00 H ATOM 1391 HG2 GLU A 95 2.149 -30.635 3.086 1.00 0.00 H ATOM 1392 HG3 GLU A 95 2.963 -31.654 4.296 1.00 0.00 H ATOM 1393 H GLU A 95 3.949 -30.089 6.747 1.00 0.00 H ATOM 1394 N LEU A 96 2.855 -27.380 6.979 1.00 78.14 N ATOM 1395 CA LEU A 96 2.465 -26.162 7.671 1.00 72.54 C ATOM 1396 C LEU A 96 3.107 -24.938 7.050 1.00 91.66 C ATOM 1397 O LEU A 96 3.973 -25.042 6.191 1.00117.50 O ATOM 1398 CB LEU A 96 2.929 -26.219 9.121 1.00 63.84 C ATOM 1399 CG LEU A 96 2.142 -27.002 10.158 1.00 86.51 C ATOM 1400 CD1 LEU A 96 2.920 -26.923 11.453 1.00 71.01 C ATOM 1401 CD2 LEU A 96 0.737 -26.435 10.322 1.00 73.14 C ATOM 1402 HA LEU A 96 1.380 -26.089 7.599 1.00 0.00 H ATOM 1403 HB2 LEU A 96 3.934 -26.640 9.110 1.00 0.00 H ATOM 1404 HB3 LEU A 96 2.972 -25.189 9.475 1.00 0.00 H ATOM 1405 HG LEU A 96 2.020 -28.040 9.848 1.00 0.00 H ATOM 1406 HD21 LEU A 96 0.801 -25.395 10.644 1.00 0.00 H ATOM 1407 HD22 LEU A 96 0.211 -26.490 9.369 1.00 0.00 H ATOM 1408 HD23 LEU A 96 0.197 -27.015 11.070 1.00 0.00 H ATOM 1409 HD11 LEU A 96 3.909 -27.358 11.308 1.00 0.00 H ATOM 1410 HD12 LEU A 96 3.021 -25.880 11.752 1.00 0.00 H ATOM 1411 HD13 LEU A 96 2.389 -27.474 12.229 1.00 0.00 H ATOM 1412 H LEU A 96 3.493 -28.045 7.461 1.00 0.00 H ATOM 1413 N THR A 97 2.683 -23.772 7.516 1.00 69.44 N ATOM 1414 CA THR A 97 3.348 -22.537 7.179 1.00 83.42 C ATOM 1415 C THR A 97 4.086 -22.072 8.413 1.00 87.98 C ATOM 1416 O THR A 97 3.827 -22.545 9.523 1.00 73.24 O ATOM 1417 CB THR A 97 2.355 -21.444 6.794 1.00 94.78 C ATOM 1418 OG1 THR A 97 1.541 -21.124 7.931 1.00 82.37 O ATOM 1419 CG2 THR A 97 1.485 -21.900 5.636 1.00 65.31 C ATOM 1420 HA THR A 97 4.010 -22.715 6.332 1.00 0.00 H ATOM 1421 HB THR A 97 2.903 -20.556 6.478 1.00 0.00 H ATOM 1422 HG1 THR A 97 2.118 -20.804 8.669 1.00 0.00 H ATOM 1423 HG23 THR A 97 2.117 -22.139 4.781 1.00 0.00 H ATOM 1424 HG21 THR A 97 0.922 -22.785 5.933 1.00 0.00 H ATOM 1425 HG22 THR A 97 0.793 -21.102 5.366 1.00 0.00 H ATOM 1426 H THR A 97 1.851 -23.747 8.140 1.00 0.00 H ATOM 1427 N LEU A 98 4.998 -21.131 8.214 1.00 86.42 N ATOM 1428 CA LEU A 98 5.724 -20.548 9.321 1.00 89.10 C ATOM 1429 C LEU A 98 4.748 -19.806 10.209 1.00 88.72 C ATOM 1430 O LEU A 98 4.831 -19.877 11.435 1.00 95.60 O ATOM 1431 CB LEU A 98 6.832 -19.642 8.797 1.00 76.21 C ATOM 1432 CG LEU A 98 7.832 -20.495 8.010 1.00 90.23 C ATOM 1433 CD1 LEU A 98 8.577 -19.689 6.971 1.00111.25 C ATOM 1434 CD2 LEU A 98 8.798 -21.185 8.954 1.00 63.33 C ATOM 1435 HA LEU A 98 6.203 -21.325 9.917 1.00 0.00 H ATOM 1436 HB2 LEU A 98 6.406 -18.880 8.144 1.00 0.00 H ATOM 1437 HB3 LEU A 98 7.339 -19.160 9.633 1.00 0.00 H ATOM 1438 HG LEU A 98 7.262 -21.254 7.474 1.00 0.00 H ATOM 1439 HD21 LEU A 98 9.344 -20.434 9.526 1.00 0.00 H ATOM 1440 HD22 LEU A 98 8.241 -21.828 9.635 1.00 0.00 H ATOM 1441 HD23 LEU A 98 9.501 -21.786 8.377 1.00 0.00 H ATOM 1442 HD11 LEU A 98 7.865 -19.263 6.264 1.00 0.00 H ATOM 1443 HD12 LEU A 98 9.128 -18.887 7.462 1.00 0.00 H ATOM 1444 HD13 LEU A 98 9.273 -20.338 6.440 1.00 0.00 H ATOM 1445 H LEU A 98 5.195 -20.806 7.246 1.00 0.00 H ATOM 1446 N GLY A 99 3.799 -19.122 9.582 1.00 85.30 N ATOM 1447 CA GLY A 99 2.740 -18.459 10.319 1.00 83.37 C ATOM 1448 C GLY A 99 2.012 -19.420 11.240 1.00 97.65 C ATOM 1449 O GLY A 99 1.874 -19.159 12.440 1.00 95.69 O ATOM 1450 HA3 GLY A 99 2.026 -18.038 9.611 1.00 0.00 H ATOM 1451 HA2 GLY A 99 3.173 -17.657 10.916 1.00 0.00 H ATOM 1452 H GLY A 99 3.815 -19.060 8.544 1.00 0.00 H ATOM 1453 N GLU A 100 1.551 -20.538 10.680 1.00 74.24 N ATOM 1454 CA GLU A 100 0.835 -21.540 11.463 1.00 84.98 C ATOM 1455 C GLU A 100 1.744 -22.106 12.551 1.00 99.09 C ATOM 1456 O GLU A 100 1.308 -22.341 13.681 1.00 92.53 O ATOM 1457 CB GLU A 100 0.334 -22.675 10.570 1.00 87.14 C ATOM 1458 CG GLU A 100 -0.581 -22.243 9.434 1.00 69.92 C ATOM 1459 CD GLU A 100 -0.773 -23.335 8.384 1.00 94.91 C ATOM 1460 OE1 GLU A 100 -0.477 -24.517 8.667 1.00 93.56 O ATOM 1461 OE2 GLU A 100 -1.218 -23.014 7.265 1.00103.77 O ATOM 1462 HA GLU A 100 -0.025 -21.056 11.926 1.00 0.00 H ATOM 1463 HB2 GLU A 100 1.201 -23.172 10.136 1.00 0.00 H ATOM 1464 HB3 GLU A 100 -0.213 -23.381 11.195 1.00 0.00 H ATOM 1465 HG2 GLU A 100 -1.555 -21.983 9.850 1.00 0.00 H ATOM 1466 HG3 GLU A 100 -0.148 -21.367 8.951 1.00 0.00 H ATOM 1467 H GLU A 100 1.705 -20.700 9.664 1.00 0.00 H ATOM 1468 N PHE A 101 3.009 -22.320 12.197 1.00 88.49 N ATOM 1469 CA PHE A 101 3.980 -22.902 13.112 1.00 72.93 C ATOM 1470 C PHE A 101 4.255 -22.006 14.318 1.00 78.09 C ATOM 1471 O PHE A 101 4.347 -22.477 15.456 1.00 67.79 O ATOM 1472 CB PHE A 101 5.281 -23.228 12.379 1.00 84.35 C ATOM 1473 CG PHE A 101 6.387 -23.712 13.286 1.00 89.52 C ATOM 1474 CD1 PHE A 101 6.282 -24.929 13.946 1.00 76.68 C ATOM 1475 CD2 PHE A 101 7.537 -22.953 13.477 1.00 82.60 C ATOM 1476 CE1 PHE A 101 7.304 -25.386 14.792 1.00 61.55 C ATOM 1477 CE2 PHE A 101 8.559 -23.400 14.316 1.00101.63 C ATOM 1478 CZ PHE A 101 8.443 -24.624 14.975 1.00 84.31 C ATOM 1479 HA PHE A 101 3.545 -23.826 13.493 1.00 0.00 H ATOM 1480 HB2 PHE A 101 5.075 -24.005 11.643 1.00 0.00 H ATOM 1481 HB3 PHE A 101 5.624 -22.327 11.869 1.00 0.00 H ATOM 1482 HD2 PHE A 101 7.641 -21.997 12.965 1.00 0.00 H ATOM 1483 HE2 PHE A 101 9.451 -22.790 14.457 1.00 0.00 H ATOM 1484 HZ PHE A 101 9.242 -24.976 15.627 1.00 0.00 H ATOM 1485 HE1 PHE A 101 7.200 -26.342 15.305 1.00 0.00 H ATOM 1486 HD1 PHE A 101 5.390 -25.540 13.805 1.00 0.00 H ATOM 1487 H PHE A 101 3.313 -22.063 11.236 1.00 0.00 H ATOM 1488 N LEU A 102 4.392 -20.713 14.066 1.00 71.39 N ATOM 1489 CA LEU A 102 4.696 -19.776 15.137 1.00 79.08 C ATOM 1490 C LEU A 102 3.496 -19.578 16.060 1.00 95.40 C ATOM 1491 O LEU A 102 3.660 -19.402 17.272 1.00 73.46 O ATOM 1492 CB LEU A 102 5.218 -18.461 14.562 1.00 79.17 C ATOM 1493 CG LEU A 102 6.545 -18.708 13.834 1.00 77.27 C ATOM 1494 CD1 LEU A 102 6.893 -17.624 12.824 1.00 76.52 C ATOM 1495 CD2 LEU A 102 7.666 -18.890 14.846 1.00 88.54 C ATOM 1496 HA LEU A 102 5.489 -20.197 15.754 1.00 0.00 H ATOM 1497 HB2 LEU A 102 4.489 -18.057 13.860 1.00 0.00 H ATOM 1498 HB3 LEU A 102 5.375 -17.748 15.371 1.00 0.00 H ATOM 1499 HG LEU A 102 6.423 -19.624 13.255 1.00 0.00 H ATOM 1500 HD21 LEU A 102 7.752 -17.991 15.456 1.00 0.00 H ATOM 1501 HD22 LEU A 102 7.442 -19.744 15.485 1.00 0.00 H ATOM 1502 HD23 LEU A 102 8.604 -19.065 14.319 1.00 0.00 H ATOM 1503 HD11 LEU A 102 6.110 -17.569 12.068 1.00 0.00 H ATOM 1504 HD12 LEU A 102 6.974 -16.665 13.336 1.00 0.00 H ATOM 1505 HD13 LEU A 102 7.844 -17.864 12.348 1.00 0.00 H ATOM 1506 H LEU A 102 4.281 -20.364 13.093 1.00 0.00 H ATOM 1507 N LYS A 103 2.292 -19.633 15.493 1.00110.51 N ATOM 1508 CA LYS A 103 1.087 -19.645 16.315 1.00102.00 C ATOM 1509 C LYS A 103 1.218 -20.799 17.294 1.00 87.15 C ATOM 1510 O LYS A 103 1.139 -20.623 18.513 1.00 82.54 O ATOM 1511 CB LYS A 103 -0.171 -19.816 15.457 1.00 62.86 C ATOM 1512 HA LYS A 103 0.987 -18.696 16.842 1.00 0.00 H ATOM 1513 HB2 LYS A 103 -0.242 -18.990 14.749 1.00 0.00 H ATOM 1514 HB3 LYS A 103 -0.113 -20.759 14.913 1.00 0.00 H ATOM 1515 H LYS A 103 2.210 -19.668 14.457 1.00 0.00 H ATOM 1516 N LEU A 104 1.454 -21.983 16.741 1.00 75.19 N ATOM 1517 CA LEU A 104 1.569 -23.192 17.535 1.00 64.65 C ATOM 1518 C LEU A 104 2.632 -23.096 18.625 1.00 83.83 C ATOM 1519 O LEU A 104 2.384 -23.448 19.781 1.00 79.30 O ATOM 1520 CB LEU A 104 1.861 -24.370 16.616 1.00 83.30 C ATOM 1521 CG LEU A 104 0.685 -24.769 15.729 1.00 92.53 C ATOM 1522 CD1 LEU A 104 1.183 -25.492 14.485 1.00 91.25 C ATOM 1523 CD2 LEU A 104 -0.307 -25.622 16.532 1.00 73.46 C ATOM 1524 HA LEU A 104 0.618 -23.336 18.048 1.00 0.00 H ATOM 1525 HB2 LEU A 104 2.701 -24.105 15.974 1.00 0.00 H ATOM 1526 HB3 LEU A 104 2.133 -25.227 17.232 1.00 0.00 H ATOM 1527 HG LEU A 104 0.160 -23.874 15.395 1.00 0.00 H ATOM 1528 HD21 LEU A 104 0.195 -26.520 16.891 1.00 0.00 H ATOM 1529 HD22 LEU A 104 -0.675 -25.046 17.381 1.00 0.00 H ATOM 1530 HD23 LEU A 104 -1.144 -25.903 15.892 1.00 0.00 H ATOM 1531 HD11 LEU A 104 1.845 -24.833 13.924 1.00 0.00 H ATOM 1532 HD12 LEU A 104 1.727 -26.389 14.781 1.00 0.00 H ATOM 1533 HD13 LEU A 104 0.332 -25.770 13.863 1.00 0.00 H ATOM 1534 H LEU A 104 1.560 -22.046 15.708 1.00 0.00 H ATOM 1535 N ASP A 105 3.818 -22.625 18.259 1.00 83.68 N ATOM 1536 CA ASP A 105 4.906 -22.552 19.221 1.00 89.72 C ATOM 1537 C ASP A 105 4.573 -21.576 20.352 1.00 79.41 C ATOM 1538 O ASP A 105 4.934 -21.814 21.508 1.00 73.05 O ATOM 1539 CB ASP A 105 6.223 -22.180 18.536 1.00 85.57 C ATOM 1540 CG ASP A 105 7.438 -22.559 19.364 1.00109.21 C ATOM 1541 OD1 ASP A 105 7.266 -22.974 20.532 1.00124.60 O ATOM 1542 OD2 ASP A 105 8.569 -22.441 18.851 1.00107.75 O ATOM 1543 HA ASP A 105 5.031 -23.541 19.662 1.00 0.00 H ATOM 1544 HB2 ASP A 105 6.277 -22.698 17.578 1.00 0.00 H ATOM 1545 HB3 ASP A 105 6.237 -21.103 18.367 1.00 0.00 H ATOM 1546 H ASP A 105 3.970 -22.307 17.280 1.00 0.00 H ATOM 1547 N ARG A 106 3.882 -20.485 20.020 1.00 79.85 N ATOM 1548 CA ARG A 106 3.457 -19.520 21.036 1.00 85.77 C ATOM 1549 C ARG A 106 2.542 -20.193 22.037 1.00 83.20 C ATOM 1550 O ARG A 106 2.693 -20.016 23.245 1.00 98.40 O ATOM 1551 CB ARG A 106 2.749 -18.319 20.410 1.00 78.88 C ATOM 1552 CG ARG A 106 3.689 -17.275 19.839 1.00 99.05 C ATOM 1553 CD ARG A 106 2.941 -16.035 19.354 1.00 97.03 C ATOM 1554 NE ARG A 106 2.257 -16.236 18.076 1.00100.20 N ATOM 1555 CZ ARG A 106 2.812 -16.001 16.888 1.00117.17 C ATOM 1556 NH1 ARG A 106 4.063 -15.563 16.818 1.00125.77 N ATOM 1557 NH2 ARG A 106 2.120 -16.204 15.771 1.00 97.65 N ATOM 1558 HA ARG A 106 4.350 -19.155 21.544 1.00 0.00 H ATOM 1559 HB2 ARG A 106 2.108 -18.680 19.605 1.00 0.00 H ATOM 1560 HB3 ARG A 106 2.136 -17.845 21.176 1.00 0.00 H ATOM 1561 HG2 ARG A 106 4.398 -16.979 20.612 1.00 0.00 H ATOM 1562 HG3 ARG A 106 4.231 -17.710 18.999 1.00 0.00 H ATOM 1563 HD2 ARG A 106 3.657 -15.221 19.240 1.00 0.00 H ATOM 1564 HD3 ARG A 106 2.199 -15.762 20.105 1.00 0.00 H ATOM 1565 HE ARG A 106 1.277 -16.584 18.096 1.00 0.00 H ATOM 1566 HH12 ARG A 106 4.498 -15.379 15.892 1.00 0.00 H ATOM 1567 HH11 ARG A 106 4.608 -15.404 17.689 1.00 0.00 H ATOM 1568 HH22 ARG A 106 2.559 -16.019 14.847 1.00 0.00 H ATOM 1569 HH21 ARG A 106 1.140 -16.548 15.822 1.00 0.00 H ATOM 1570 H ARG A 106 3.641 -20.317 19.022 1.00 0.00 H ATOM 1571 N GLU A 107 1.597 -20.978 21.529 1.00 85.11 N ATOM 1572 CA GLU A 107 0.679 -21.714 22.396 1.00 96.35 C ATOM 1573 C GLU A 107 1.418 -22.704 23.299 1.00 87.97 C ATOM 1574 O GLU A 107 1.050 -22.899 24.457 1.00 80.15 O ATOM 1575 CB GLU A 107 -0.400 -22.429 21.575 1.00 71.65 C ATOM 1576 CG GLU A 107 -1.565 -22.920 22.420 1.00 86.54 C ATOM 1577 CD GLU A 107 -2.787 -23.248 21.587 1.00112.48 C ATOM 1578 OE1 GLU A 107 -2.730 -23.004 20.351 1.00 86.75 O ATOM 1579 OE2 GLU A 107 -3.793 -23.738 22.174 1.00 76.07 O ATOM 1580 HA GLU A 107 0.191 -20.983 23.041 1.00 0.00 H ATOM 1581 HB2 GLU A 107 -0.782 -21.736 20.826 1.00 0.00 H ATOM 1582 HB3 GLU A 107 0.053 -23.286 21.077 1.00 0.00 H ATOM 1583 HG2 GLU A 107 -1.255 -23.817 22.955 1.00 0.00 H ATOM 1584 HG3 GLU A 107 -1.829 -22.143 23.138 1.00 0.00 H ATOM 1585 H GLU A 107 1.509 -21.070 20.497 1.00 0.00 H ATOM 1586 N ARG A 108 2.458 -23.327 22.755 1.00 79.97 N ATOM 1587 CA ARG A 108 3.302 -24.234 23.518 1.00 92.69 C ATOM 1588 C ARG A 108 3.968 -23.485 24.675 1.00 79.66 C ATOM 1589 O ARG A 108 3.892 -23.895 25.838 1.00 64.97 O ATOM 1590 CB ARG A 108 4.348 -24.839 22.585 1.00 92.52 C ATOM 1591 CG ARG A 108 5.214 -25.938 23.174 1.00 77.49 C ATOM 1592 CD ARG A 108 6.211 -26.373 22.116 1.00 82.61 C ATOM 1593 NE ARG A 108 7.438 -26.952 22.657 1.00112.35 N ATOM 1594 CZ ARG A 108 8.659 -26.654 22.214 1.00125.18 C ATOM 1595 NH1 ARG A 108 8.823 -25.770 21.225 1.00 69.76 N ATOM 1596 NH2 ARG A 108 9.718 -27.236 22.762 1.00127.66 N ATOM 1597 HA ARG A 108 2.698 -25.035 23.943 1.00 0.00 H ATOM 1598 HB2 ARG A 108 3.826 -25.253 21.723 1.00 0.00 H ATOM 1599 HB3 ARG A 108 5.007 -24.035 22.258 1.00 0.00 H ATOM 1600 HG2 ARG A 108 5.744 -25.562 24.049 1.00 0.00 H ATOM 1601 HG3 ARG A 108 4.591 -26.784 23.464 1.00 0.00 H ATOM 1602 HD2 ARG A 108 6.478 -25.502 21.517 1.00 0.00 H ATOM 1603 HD3 ARG A 108 5.732 -27.117 21.479 1.00 0.00 H ATOM 1604 HE ARG A 108 7.354 -27.638 23.434 1.00 0.00 H ATOM 1605 HH12 ARG A 108 9.779 -25.542 20.884 1.00 0.00 H ATOM 1606 HH11 ARG A 108 7.995 -25.310 20.796 1.00 0.00 H ATOM 1607 HH22 ARG A 108 10.673 -27.007 22.420 1.00 0.00 H ATOM 1608 HH21 ARG A 108 9.593 -27.922 23.534 1.00 0.00 H ATOM 1609 H ARG A 108 2.676 -23.161 21.752 1.00 0.00 H ATOM 1610 N ALA A 109 4.604 -22.368 24.350 1.00 71.12 N ATOM 1611 CA ALA A 109 5.268 -21.553 25.358 1.00 75.60 C ATOM 1612 C ALA A 109 4.277 -21.102 26.434 1.00 78.08 C ATOM 1613 O ALA A 109 4.615 -21.030 27.621 1.00 82.83 O ATOM 1614 CB ALA A 109 5.959 -20.378 24.707 1.00 58.61 C ATOM 1615 HA ALA A 109 6.029 -22.157 25.853 1.00 0.00 H ATOM 1616 HB1 ALA A 109 6.701 -20.742 23.997 1.00 0.00 H ATOM 1617 HB2 ALA A 109 5.222 -19.769 24.184 1.00 0.00 H ATOM 1618 HB3 ALA A 109 6.451 -19.778 25.472 1.00 0.00 H ATOM 1619 H ALA A 109 4.629 -22.068 23.355 1.00 0.00 H ATOM 1620 N LYS A 110 3.046 -20.823 26.016 1.00 67.97 N ATOM 1621 CA LYS A 110 1.980 -20.499 26.956 1.00 72.02 C ATOM 1622 C LYS A 110 1.584 -21.715 27.801 1.00 80.99 C ATOM 1623 O LYS A 110 1.460 -21.611 29.018 1.00101.07 O ATOM 1624 CB LYS A 110 0.764 -19.939 26.215 1.00 84.27 C ATOM 1625 HA LYS A 110 2.358 -19.735 27.635 1.00 0.00 H ATOM 1626 HB2 LYS A 110 1.052 -19.034 25.679 1.00 0.00 H ATOM 1627 HB3 LYS A 110 0.398 -20.682 25.506 1.00 0.00 H ATOM 1628 H LYS A 110 2.839 -20.836 24.997 1.00 0.00 H ATOM 1629 N ASN A 111 1.394 -22.871 27.170 1.00 63.77 N ATOM 1630 CA ASN A 111 1.053 -24.069 27.927 1.00 68.65 C ATOM 1631 C ASN A 111 2.165 -24.436 28.897 1.00 84.22 C ATOM 1632 O ASN A 111 1.912 -24.991 29.970 1.00 78.21 O ATOM 1633 CB ASN A 111 0.746 -25.255 27.002 1.00 62.65 C ATOM 1634 CG ASN A 111 -0.429 -24.992 26.085 1.00 85.30 C ATOM 1635 OD1 ASN A 111 -1.205 -24.054 26.298 1.00120.64 O ATOM 1636 ND2 ASN A 111 -0.572 -25.817 25.058 1.00 59.77 N ATOM 1637 HA ASN A 111 0.152 -23.843 28.497 1.00 0.00 H ATOM 1638 HB2 ASN A 111 1.626 -25.459 26.392 1.00 0.00 H ATOM 1639 HB3 ASN A 111 0.521 -26.127 27.616 1.00 0.00 H ATOM 1640 HD22 ASN A 111 0.105 -26.594 24.917 1.00 0.00 H ATOM 1641 HD21 ASN A 111 -1.361 -25.688 24.393 1.00 0.00 H ATOM 1642 H ASN A 111 1.489 -22.920 26.135 1.00 0.00 H ATOM 1643 N LYS A 112 3.401 -24.133 28.512 1.00 80.79 N ATOM 1644 CA LYS A 112 4.546 -24.493 29.337 1.00100.69 C ATOM 1645 C LYS A 112 4.473 -23.709 30.629 1.00100.28 C ATOM 1646 O LYS A 112 4.488 -24.272 31.729 1.00 82.29 O ATOM 1647 CB LYS A 112 5.858 -24.190 28.614 1.00 72.14 C ATOM 1648 CG LYS A 112 7.090 -24.385 29.490 1.00 87.58 C ATOM 1649 CD LYS A 112 8.108 -25.339 28.863 1.00 79.88 C ATOM 1650 CE LYS A 112 9.484 -25.220 29.533 1.00108.80 C ATOM 1651 NZ LYS A 112 10.077 -23.832 29.463 1.00105.45 N ATOM 1652 HA LYS A 112 4.519 -25.563 29.543 1.00 0.00 H ATOM 1653 HB2 LYS A 112 5.939 -24.852 27.752 1.00 0.00 H ATOM 1654 HB3 LYS A 112 5.835 -23.154 28.275 1.00 0.00 H ATOM 1655 HG2 LYS A 112 7.566 -23.417 29.645 1.00 0.00 H ATOM 1656 HG3 LYS A 112 6.775 -24.791 30.451 1.00 0.00 H ATOM 1657 HD2 LYS A 112 7.748 -26.362 28.973 1.00 0.00 H ATOM 1658 HD3 LYS A 112 8.209 -25.102 27.804 1.00 0.00 H ATOM 1659 HE2 LYS A 112 10.168 -25.912 29.041 1.00 0.00 H ATOM 1660 HE3 LYS A 112 9.381 -25.498 30.582 1.00 0.00 H ATOM 1661 HZ1 LYS A 112 10.192 -23.555 28.467 1.00 0.00 H ATOM 1662 HZ2 LYS A 112 9.441 -23.160 29.939 1.00 0.00 H ATOM 1663 HZ3 LYS A 112 11.004 -23.828 29.935 1.00 0.00 H ATOM 1664 H LYS A 112 3.552 -23.634 27.612 1.00 0.00 H ATOM 1665 N ILE A 113 4.390 -22.394 30.464 1.00 97.30 N ATOM 1666 CA ILE A 113 4.209 -21.466 31.566 1.00 85.16 C ATOM 1667 C ILE A 113 3.008 -21.892 32.413 1.00 87.74 C ATOM 1668 O ILE A 113 3.125 -22.059 33.630 1.00 78.76 O ATOM 1669 CB ILE A 113 4.077 -20.010 31.025 1.00 91.44 C ATOM 1670 CG1 ILE A 113 5.463 -19.382 30.867 1.00 96.41 C ATOM 1671 CG2 ILE A 113 3.206 -19.128 31.919 1.00 64.43 C ATOM 1672 CD1 ILE A 113 5.432 -17.935 30.431 1.00120.11 C ATOM 1673 HA ILE A 113 5.084 -21.485 32.215 1.00 0.00 H ATOM 1674 HB ILE A 113 3.584 -20.073 30.055 1.00 0.00 H ATOM 1675 HG12 ILE A 113 5.979 -19.441 31.826 1.00 0.00 H ATOM 1676 HG13 ILE A 113 6.017 -19.954 30.122 1.00 0.00 H ATOM 1677 HD11 ILE A 113 4.930 -17.858 29.467 1.00 0.00 H ATOM 1678 HD12 ILE A 113 4.892 -17.345 31.172 1.00 0.00 H ATOM 1679 HD13 ILE A 113 6.452 -17.562 30.342 1.00 0.00 H ATOM 1680 HG21 ILE A 113 2.205 -19.554 31.983 1.00 0.00 H ATOM 1681 HG22 ILE A 113 3.645 -19.077 32.915 1.00 0.00 H ATOM 1682 HG23 ILE A 113 3.149 -18.126 31.494 1.00 0.00 H ATOM 1683 H ILE A 113 4.458 -22.011 29.500 1.00 0.00 H ATOM 1684 N ALA A 114 1.863 -22.085 31.761 1.00 72.34 N ATOM 1685 CA ALA A 114 0.672 -22.591 32.430 1.00 54.88 C ATOM 1686 C ALA A 114 1.003 -23.822 33.275 1.00 63.82 C ATOM 1687 O ALA A 114 0.538 -23.948 34.407 1.00 59.77 O ATOM 1688 CB ALA A 114 -0.402 -22.920 31.408 1.00 78.29 C ATOM 1689 HA ALA A 114 0.296 -21.815 33.097 1.00 0.00 H ATOM 1690 HB1 ALA A 114 -0.660 -22.019 30.851 1.00 0.00 H ATOM 1691 HB2 ALA A 114 -0.028 -23.679 30.721 1.00 0.00 H ATOM 1692 HB3 ALA A 114 -1.287 -23.297 31.921 1.00 0.00 H ATOM 1693 H ALA A 114 1.818 -21.868 30.745 1.00 0.00 H ATOM 1694 N LYS A 115 1.819 -24.724 32.727 1.00 83.06 N ATOM 1695 CA LYS A 115 2.226 -25.928 33.445 1.00100.29 C ATOM 1696 C LYS A 115 3.114 -25.610 34.645 1.00 95.41 C ATOM 1697 O LYS A 115 2.926 -26.181 35.722 1.00 74.69 O ATOM 1698 CB LYS A 115 2.952 -26.896 32.509 1.00111.30 C ATOM 1699 CG LYS A 115 3.716 -28.001 33.233 1.00 84.18 C ATOM 1700 CD LYS A 115 3.095 -29.359 33.001 1.00 64.21 C ATOM 1701 CE LYS A 115 2.045 -29.706 34.043 1.00 79.41 C ATOM 1702 NZ LYS A 115 1.353 -30.985 33.703 1.00 68.05 N ATOM 1703 HA LYS A 115 1.315 -26.397 33.817 1.00 0.00 H ATOM 1704 HB2 LYS A 115 2.214 -27.360 31.855 1.00 0.00 H ATOM 1705 HB3 LYS A 115 3.660 -26.326 31.908 1.00 0.00 H ATOM 1706 HG2 LYS A 115 4.744 -28.016 32.870 1.00 0.00 H ATOM 1707 HG3 LYS A 115 3.713 -27.790 34.302 1.00 0.00 H ATOM 1708 HD2 LYS A 115 2.626 -29.366 32.017 1.00 0.00 H ATOM 1709 HD3 LYS A 115 3.881 -30.113 33.033 1.00 0.00 H ATOM 1710 HE2 LYS A 115 1.309 -28.903 34.088 1.00 0.00 H ATOM 1711 HE3 LYS A 115 2.528 -29.809 35.015 1.00 0.00 H ATOM 1712 HZ1 LYS A 115 0.887 -30.890 32.778 1.00 0.00 H ATOM 1713 HZ2 LYS A 115 2.051 -31.755 33.663 1.00 0.00 H ATOM 1714 HZ3 LYS A 115 0.642 -31.197 34.431 1.00 0.00 H ATOM 1715 H LYS A 115 2.175 -24.565 31.763 1.00 0.00 H ATOM 1716 N GLU A 116 4.081 -24.710 34.453 1.00 70.05 N ATOM 1717 CA GLU A 116 4.964 -24.290 35.541 1.00 71.33 C ATOM 1718 C GLU A 116 4.137 -23.790 36.718 1.00 85.62 C ATOM 1719 O GLU A 116 4.266 -24.282 37.843 1.00 98.60 O ATOM 1720 CB GLU A 116 5.933 -23.203 35.072 1.00 61.25 C ATOM 1721 HA GLU A 116 5.552 -25.151 35.859 1.00 0.00 H ATOM 1722 HB2 GLU A 116 6.543 -23.589 34.255 1.00 0.00 H ATOM 1723 HB3 GLU A 116 5.367 -22.338 34.727 1.00 0.00 H ATOM 1724 H GLU A 116 4.210 -24.297 33.507 1.00 0.00 H ATOM 1725 N THR A 117 3.274 -22.818 36.437 1.00 79.91 N ATOM 1726 CA THR A 117 2.330 -22.300 37.421 1.00 77.83 C ATOM 1727 C THR A 117 1.665 -23.444 38.156 1.00 79.85 C ATOM 1728 O THR A 117 1.730 -23.536 39.386 1.00 82.96 O ATOM 1729 CB THR A 117 1.215 -21.474 36.747 1.00 82.37 C ATOM 1730 OG1 THR A 117 1.773 -20.656 35.709 1.00 87.10 O ATOM 1731 CG2 THR A 117 0.481 -20.603 37.771 1.00 78.55 C ATOM 1732 HA THR A 117 2.895 -21.669 38.107 1.00 0.00 H ATOM 1733 HB THR A 117 0.492 -22.163 36.311 1.00 0.00 H ATOM 1734 HG1 THR A 117 2.207 -21.234 35.032 1.00 0.00 H ATOM 1735 HG23 THR A 117 0.063 -21.237 38.553 1.00 0.00 H ATOM 1736 HG21 THR A 117 1.182 -19.895 38.213 1.00 0.00 H ATOM 1737 HG22 THR A 117 -0.322 -20.059 37.274 1.00 0.00 H ATOM 1738 H THR A 117 3.272 -22.412 35.480 1.00 0.00 H ATOM 1739 N ASN A 118 1.027 -24.315 37.380 1.00 89.47 N ATOM 1740 CA ASN A 118 0.295 -25.454 37.916 1.00 98.95 C ATOM 1741 C ASN A 118 1.104 -26.319 38.889 1.00 85.60 C ATOM 1742 O ASN A 118 0.563 -26.853 39.855 1.00 62.32 O ATOM 1743 CB ASN A 118 -0.242 -26.310 36.768 1.00110.57 C ATOM 1744 CG ASN A 118 -1.008 -27.521 37.256 1.00107.22 C ATOM 1745 OD1 ASN A 118 -2.013 -27.388 37.967 1.00 67.42 O ATOM 1746 ND2 ASN A 118 -0.543 -28.715 36.874 1.00100.82 N ATOM 1747 HA ASN A 118 -0.526 -25.041 38.501 1.00 0.00 H ATOM 1748 HB2 ASN A 118 -0.906 -25.699 36.157 1.00 0.00 H ATOM 1749 HB3 ASN A 118 0.598 -26.649 36.162 1.00 0.00 H ATOM 1750 HD22 ASN A 118 0.306 -28.775 36.276 1.00 0.00 H ATOM 1751 HD21 ASN A 118 -1.030 -29.583 37.175 1.00 0.00 H ATOM 1752 H ASN A 118 1.052 -24.177 36.349 1.00 0.00 H ATOM 1753 N ASN A 119 2.399 -26.462 38.631 1.00 80.39 N ATOM 1754 CA ASN A 119 3.239 -27.268 39.502 1.00 77.70 C ATOM 1755 C ASN A 119 3.600 -26.510 40.758 1.00 84.06 C ATOM 1756 O ASN A 119 3.278 -26.960 41.854 1.00 80.39 O ATOM 1757 CB ASN A 119 4.479 -27.749 38.761 1.00111.76 C ATOM 1758 CG ASN A 119 4.126 -28.562 37.539 1.00118.91 C ATOM 1759 OD1 ASN A 119 3.211 -29.395 37.574 1.00 98.16 O ATOM 1760 ND2 ASN A 119 4.823 -28.304 36.437 1.00113.11 N ATOM 1761 HA ASN A 119 2.673 -28.149 39.805 1.00 0.00 H ATOM 1762 HB2 ASN A 119 5.063 -26.882 38.451 1.00 0.00 H ATOM 1763 HB3 ASN A 119 5.075 -28.365 39.434 1.00 0.00 H ATOM 1764 HD22 ASN A 119 5.583 -27.595 36.457 1.00 0.00 H ATOM 1765 HD21 ASN A 119 4.608 -28.811 35.555 1.00 0.00 H ATOM 1766 H ASN A 119 2.815 -25.994 37.800 1.00 0.00 H ATOM 1767 N LYS A 120 4.252 -25.358 40.594 1.00 70.48 N ATOM 1768 CA LYS A 120 4.397 -24.379 41.687 1.00 96.86 C ATOM 1769 C LYS A 120 3.203 -24.325 42.649 1.00 84.91 C ATOM 1770 O LYS A 120 3.377 -24.135 43.857 1.00 73.21 O ATOM 1771 CB LYS A 120 4.669 -22.975 41.130 1.00 68.65 C ATOM 1772 CG LYS A 120 6.139 -22.740 40.757 1.00 76.28 C ATOM 1773 CD LYS A 120 6.350 -21.468 39.972 1.00 69.04 C ATOM 1774 CE LYS A 120 7.755 -21.452 39.400 1.00 99.25 C ATOM 1775 NZ LYS A 120 8.737 -21.966 40.400 1.00 81.38 N ATOM 1776 HA LYS A 120 5.250 -24.728 42.269 1.00 0.00 H ATOM 1777 HB2 LYS A 120 4.059 -22.833 40.238 1.00 0.00 H ATOM 1778 HB3 LYS A 120 4.383 -22.242 41.885 1.00 0.00 H ATOM 1779 HG2 LYS A 120 6.726 -22.685 41.674 1.00 0.00 H ATOM 1780 HG3 LYS A 120 6.484 -23.581 40.156 1.00 0.00 H ATOM 1781 HD2 LYS A 120 5.626 -21.419 39.159 1.00 0.00 H ATOM 1782 HD3 LYS A 120 6.215 -20.609 40.629 1.00 0.00 H ATOM 1783 HE2 LYS A 120 8.020 -20.430 39.130 1.00 0.00 H ATOM 1784 HE3 LYS A 120 7.787 -22.081 38.511 1.00 0.00 H ATOM 1785 HZ1 LYS A 120 8.712 -21.366 41.249 1.00 0.00 H ATOM 1786 HZ2 LYS A 120 8.489 -22.943 40.657 1.00 0.00 H ATOM 1787 HZ3 LYS A 120 9.692 -21.946 39.988 1.00 0.00 H ATOM 1788 H LYS A 120 4.671 -25.144 39.667 1.00 0.00 H ATOM 1789 N LYS A 121 1.997 -24.490 42.107 1.00 57.72 N ATOM 1790 CA LYS A 121 0.790 -24.522 42.922 1.00 61.81 C ATOM 1791 C LYS A 121 0.713 -25.768 43.803 1.00 70.43 C ATOM 1792 O LYS A 121 0.363 -25.696 44.982 1.00 67.63 O ATOM 1793 CB LYS A 121 -0.455 -24.447 42.038 1.00 50.86 C ATOM 1794 CG LYS A 121 -1.744 -24.359 42.850 1.00 85.08 C ATOM 1795 CD LYS A 121 -3.000 -24.511 41.994 1.00 77.70 C ATOM 1796 CE LYS A 121 -4.244 -24.544 42.883 1.00 98.18 C ATOM 1797 NZ LYS A 121 -5.488 -24.875 42.131 1.00 87.25 N ATOM 1798 HA LYS A 121 0.832 -23.652 43.578 1.00 0.00 H ATOM 1799 HB2 LYS A 121 -0.381 -23.564 41.403 1.00 0.00 H ATOM 1800 HB3 LYS A 121 -0.495 -25.340 41.414 1.00 0.00 H ATOM 1801 HG2 LYS A 121 -1.737 -25.150 43.600 1.00 0.00 H ATOM 1802 HG3 LYS A 121 -1.777 -23.389 43.346 1.00 0.00 H ATOM 1803 HD2 LYS A 121 -3.071 -23.669 41.306 1.00 0.00 H ATOM 1804 HD3 LYS A 121 -2.939 -25.439 41.426 1.00 0.00 H ATOM 1805 HE2 LYS A 121 -4.367 -23.565 43.345 1.00 0.00 H ATOM 1806 HE3 LYS A 121 -4.097 -25.295 43.659 1.00 0.00 H ATOM 1807 HZ1 LYS A 121 -5.646 -24.160 41.392 1.00 0.00 H ATOM 1808 HZ2 LYS A 121 -5.387 -25.813 41.692 1.00 0.00 H ATOM 1809 HZ3 LYS A 121 -6.296 -24.882 42.786 1.00 0.00 H ATOM 1810 H LYS A 121 1.915 -24.599 41.076 1.00 0.00 H ATOM 1811 N LYS A 122 1.015 -26.919 43.217 1.00 91.73 N ATOM 1812 CA LYS A 122 0.972 -28.162 43.964 1.00 85.04 C ATOM 1813 C LYS A 122 2.078 -28.140 45.009 1.00 77.69 C ATOM 1814 O LYS A 122 1.878 -28.561 46.149 1.00 80.62 O ATOM 1815 CB LYS A 122 1.138 -29.372 43.036 1.00 97.60 C ATOM 1816 CG LYS A 122 0.194 -29.399 41.836 1.00 88.95 C ATOM 1817 CD LYS A 122 0.131 -30.791 41.217 1.00 91.42 C ATOM 1818 CE LYS A 122 -0.308 -30.753 39.755 1.00124.16 C ATOM 1819 NZ LYS A 122 0.785 -30.332 38.816 1.00121.74 N ATOM 1820 HA LYS A 122 0.001 -28.255 44.450 1.00 0.00 H ATOM 1821 HB2 LYS A 122 2.162 -29.373 42.661 1.00 0.00 H ATOM 1822 HB3 LYS A 122 0.966 -30.274 43.622 1.00 0.00 H ATOM 1823 HG2 LYS A 122 -0.805 -29.109 42.162 1.00 0.00 H ATOM 1824 HG3 LYS A 122 0.550 -28.692 41.087 1.00 0.00 H ATOM 1825 HD2 LYS A 122 1.120 -31.246 41.275 1.00 0.00 H ATOM 1826 HD3 LYS A 122 -0.580 -31.395 41.782 1.00 0.00 H ATOM 1827 HE2 LYS A 122 -1.135 -30.050 39.660 1.00 0.00 H ATOM 1828 HE3 LYS A 122 -0.645 -31.749 39.469 1.00 0.00 H ATOM 1829 HZ1 LYS A 122 1.110 -29.377 39.070 1.00 0.00 H ATOM 1830 HZ2 LYS A 122 1.578 -31.001 38.888 1.00 0.00 H ATOM 1831 HZ3 LYS A 122 0.421 -30.327 37.842 1.00 0.00 H ATOM 1832 H LYS A 122 1.285 -26.931 42.213 1.00 0.00 H ATOM 1833 N GLU A 123 3.247 -27.643 44.615 1.00 77.92 N ATOM 1834 CA GLU A 123 4.382 -27.567 45.522 1.00 73.71 C ATOM 1835 C GLU A 123 3.954 -26.727 46.707 1.00 93.90 C ATOM 1836 O GLU A 123 4.225 -27.059 47.866 1.00 82.39 O ATOM 1837 CB GLU A 123 5.601 -26.933 44.833 1.00 85.73 C ATOM 1838 CG GLU A 123 5.744 -27.227 43.333 1.00104.69 C ATOM 1839 CD GLU A 123 5.839 -28.726 42.993 1.00145.09 C ATOM 1840 OE1 GLU A 123 5.067 -29.548 43.551 1.00109.30 O ATOM 1841 OE2 GLU A 123 6.691 -29.081 42.145 1.00144.02 O ATOM 1842 HA GLU A 123 4.677 -28.568 45.838 1.00 0.00 H ATOM 1843 HB2 GLU A 123 5.533 -25.852 44.958 1.00 0.00 H ATOM 1844 HB3 GLU A 123 6.497 -27.299 45.334 1.00 0.00 H ATOM 1845 HG2 GLU A 123 4.877 -26.813 42.818 1.00 0.00 H ATOM 1846 HG3 GLU A 123 6.648 -26.736 42.972 1.00 0.00 H ATOM 1847 H GLU A 123 3.352 -27.302 43.638 1.00 0.00 H ATOM 1848 N PHE A 124 3.256 -25.640 46.397 1.00 83.07 N ATOM 1849 CA PHE A 124 2.760 -24.729 47.412 1.00 77.52 C ATOM 1850 C PHE A 124 1.792 -25.412 48.372 1.00 77.32 C ATOM 1851 O PHE A 124 1.964 -25.345 49.589 1.00 93.03 O ATOM 1852 CB PHE A 124 2.076 -23.542 46.749 1.00 95.68 C ATOM 1853 CG PHE A 124 1.608 -22.509 47.715 1.00 85.52 C ATOM 1854 CD1 PHE A 124 2.481 -21.534 48.175 1.00 79.91 C ATOM 1855 CD2 PHE A 124 0.298 -22.514 48.173 1.00 89.25 C ATOM 1856 CE1 PHE A 124 2.055 -20.576 49.076 1.00 79.12 C ATOM 1857 CE2 PHE A 124 -0.140 -21.561 49.070 1.00 91.22 C ATOM 1858 CZ PHE A 124 0.739 -20.587 49.524 1.00 91.36 C ATOM 1859 HA PHE A 124 3.616 -24.388 47.995 1.00 0.00 H ATOM 1860 HB2 PHE A 124 2.782 -23.077 46.061 1.00 0.00 H ATOM 1861 HB3 PHE A 124 1.214 -23.908 46.191 1.00 0.00 H ATOM 1862 HD2 PHE A 124 -0.393 -23.280 47.820 1.00 0.00 H ATOM 1863 HE2 PHE A 124 -1.172 -21.573 49.421 1.00 0.00 H ATOM 1864 HZ PHE A 124 0.397 -19.831 50.231 1.00 0.00 H ATOM 1865 HE1 PHE A 124 2.748 -19.815 49.434 1.00 0.00 H ATOM 1866 HD1 PHE A 124 3.512 -21.523 47.823 1.00 0.00 H ATOM 1867 H PHE A 124 3.059 -25.436 45.396 1.00 0.00 H ATOM 1868 N GLU A 125 0.770 -26.061 47.821 1.00 69.84 N ATOM 1869 CA GLU A 125 -0.213 -26.777 48.638 1.00 88.16 C ATOM 1870 C GLU A 125 0.410 -27.939 49.437 1.00 77.98 C ATOM 1871 O GLU A 125 -0.045 -28.263 50.533 1.00 66.56 O ATOM 1872 CB GLU A 125 -1.388 -27.258 47.779 1.00 82.07 C ATOM 1873 CG GLU A 125 -2.059 -26.142 46.983 1.00 88.47 C ATOM 1874 CD GLU A 125 -3.321 -26.590 46.254 1.00113.20 C ATOM 1875 OE1 GLU A 125 -3.210 -27.346 45.264 1.00102.84 O ATOM 1876 OE2 GLU A 125 -4.428 -26.178 46.670 1.00126.00 O ATOM 1877 HA GLU A 125 -0.591 -26.067 49.374 1.00 0.00 H ATOM 1878 HB2 GLU A 125 -1.019 -28.008 47.079 1.00 0.00 H ATOM 1879 HB3 GLU A 125 -2.132 -27.710 48.435 1.00 0.00 H ATOM 1880 HG2 GLU A 125 -2.324 -25.339 47.670 1.00 0.00 H ATOM 1881 HG3 GLU A 125 -1.348 -25.768 46.246 1.00 0.00 H ATOM 1882 H GLU A 125 0.666 -26.060 46.786 1.00 0.00 H ATOM 1883 N GLU A 126 1.459 -28.553 48.901 1.00 75.04 N ATOM 1884 CA GLU A 126 2.208 -29.546 49.668 1.00 94.87 C ATOM 1885 C GLU A 126 2.802 -28.911 50.934 1.00 76.67 C ATOM 1886 O GLU A 126 2.555 -29.374 52.048 1.00 63.65 O ATOM 1887 CB GLU A 126 3.304 -30.191 48.810 1.00 80.20 C ATOM 1888 HA GLU A 126 1.519 -30.334 49.972 1.00 0.00 H ATOM 1889 HB2 GLU A 126 2.848 -30.683 47.951 1.00 0.00 H ATOM 1890 HB3 GLU A 126 3.994 -29.421 48.466 1.00 0.00 H ATOM 1891 H GLU A 126 1.749 -28.325 47.929 1.00 0.00 H ATOM 1892 N THR A 127 3.564 -27.836 50.753 1.00 74.68 N ATOM 1893 CA THR A 127 4.192 -27.137 51.872 1.00 73.19 C ATOM 1894 C THR A 127 3.163 -26.692 52.914 1.00 89.98 C ATOM 1895 O THR A 127 3.399 -26.766 54.123 1.00 74.86 O ATOM 1896 CB THR A 127 4.974 -25.903 51.388 1.00 88.67 C ATOM 1897 OG1 THR A 127 5.703 -26.224 50.195 1.00 85.75 O ATOM 1898 CG2 THR A 127 5.937 -25.417 52.466 1.00 76.41 C ATOM 1899 HA THR A 127 4.878 -27.847 52.334 1.00 0.00 H ATOM 1900 HB THR A 127 4.262 -25.106 51.174 1.00 0.00 H ATOM 1901 HG1 THR A 127 5.070 -26.508 49.489 1.00 0.00 H ATOM 1902 HG23 THR A 127 5.377 -25.175 53.369 1.00 0.00 H ATOM 1903 HG21 THR A 127 6.661 -26.202 52.685 1.00 0.00 H ATOM 1904 HG22 THR A 127 6.459 -24.528 52.111 1.00 0.00 H ATOM 1905 H THR A 127 3.717 -27.483 49.787 1.00 0.00 H ATOM 1906 N ALA A 128 2.021 -26.217 52.434 1.00 85.35 N ATOM 1907 CA ALA A 128 0.926 -25.827 53.308 1.00 63.24 C ATOM 1908 C ALA A 128 0.521 -26.962 54.257 1.00 94.44 C ATOM 1909 O ALA A 128 0.508 -26.782 55.478 1.00 78.09 O ATOM 1910 CB ALA A 128 -0.251 -25.387 52.475 1.00 57.97 C ATOM 1911 HA ALA A 128 1.264 -24.997 53.928 1.00 0.00 H ATOM 1912 HB1 ALA A 128 0.040 -24.538 51.856 1.00 0.00 H ATOM 1913 HB2 ALA A 128 -0.571 -26.211 51.837 1.00 0.00 H ATOM 1914 HB3 ALA A 128 -1.070 -25.095 53.132 1.00 0.00 H ATOM 1915 H ALA A 128 1.906 -26.121 51.405 1.00 0.00 H ATOM 1916 N LYS A 129 0.191 -28.122 53.683 1.00 90.79 N ATOM 1917 CA LYS A 129 -0.148 -29.328 54.448 1.00 91.98 C ATOM 1918 C LYS A 129 0.846 -29.624 55.571 1.00 85.04 C ATOM 1919 O LYS A 129 0.452 -29.885 56.710 1.00 61.16 O ATOM 1920 CB LYS A 129 -0.224 -30.545 53.521 1.00 95.11 C ATOM 1921 CG LYS A 129 -1.532 -30.685 52.758 1.00117.62 C ATOM 1922 CD LYS A 129 -1.366 -31.553 51.506 1.00125.57 C ATOM 1923 CE LYS A 129 -1.062 -33.014 51.843 1.00135.44 C ATOM 1924 NZ LYS A 129 -2.231 -33.743 52.425 1.00 88.05 N ATOM 1925 HA LYS A 129 -1.118 -29.134 54.905 1.00 0.00 H ATOM 1926 HB2 LYS A 129 0.586 -30.470 52.795 1.00 0.00 H ATOM 1927 HB3 LYS A 129 -0.086 -31.441 54.126 1.00 0.00 H ATOM 1928 HG2 LYS A 129 -2.275 -31.144 53.411 1.00 0.00 H ATOM 1929 HG3 LYS A 129 -1.875 -29.695 52.459 1.00 0.00 H ATOM 1930 HD2 LYS A 129 -2.289 -31.512 50.927 1.00 0.00 H ATOM 1931 HD3 LYS A 129 -0.546 -31.153 50.909 1.00 0.00 H ATOM 1932 HE2 LYS A 129 -0.244 -33.040 52.563 1.00 0.00 H ATOM 1933 HE3 LYS A 129 -0.756 -33.524 50.929 1.00 0.00 H ATOM 1934 HZ1 LYS A 129 -2.528 -33.274 53.304 1.00 0.00 H ATOM 1935 HZ2 LYS A 129 -3.017 -33.735 51.744 1.00 0.00 H ATOM 1936 HZ3 LYS A 129 -1.958 -34.725 52.630 1.00 0.00 H ATOM 1937 H LYS A 129 0.173 -28.173 52.644 1.00 0.00 H ATOM 1938 N LYS A 130 2.134 -29.604 55.244 1.00 59.49 N ATOM 1939 CA LYS A 130 3.157 -29.833 56.248 1.00 68.76 C ATOM 1940 C LYS A 130 3.027 -28.804 57.370 1.00 76.02 C ATOM 1941 O LYS A 130 3.039 -29.146 58.553 1.00 83.39 O ATOM 1942 CB LYS A 130 4.548 -29.784 55.612 1.00 92.17 C ATOM 1943 CG LYS A 130 4.775 -30.844 54.533 1.00 96.32 C ATOM 1944 CD LYS A 130 6.021 -30.540 53.688 1.00120.81 C ATOM 1945 CE LYS A 130 7.321 -30.604 54.495 1.00128.12 C ATOM 1946 NZ LYS A 130 7.866 -31.988 54.627 1.00119.24 N ATOM 1947 HA LYS A 130 3.020 -30.826 56.677 1.00 0.00 H ATOM 1948 HB2 LYS A 130 4.685 -28.801 55.162 1.00 0.00 H ATOM 1949 HB3 LYS A 130 5.290 -29.929 56.397 1.00 0.00 H ATOM 1950 HG2 LYS A 130 4.902 -31.815 55.013 1.00 0.00 H ATOM 1951 HG3 LYS A 130 3.904 -30.874 53.879 1.00 0.00 H ATOM 1952 HD2 LYS A 130 6.078 -31.268 52.878 1.00 0.00 H ATOM 1953 HD3 LYS A 130 5.921 -29.539 53.269 1.00 0.00 H ATOM 1954 HE2 LYS A 130 7.129 -30.211 55.493 1.00 0.00 H ATOM 1955 HE3 LYS A 130 8.067 -29.984 53.999 1.00 0.00 H ATOM 1956 HZ1 LYS A 130 7.168 -32.590 55.108 1.00 0.00 H ATOM 1957 HZ2 LYS A 130 8.064 -32.373 53.681 1.00 0.00 H ATOM 1958 HZ3 LYS A 130 8.745 -31.962 55.183 1.00 0.00 H ATOM 1959 H LYS A 130 2.412 -29.422 54.258 1.00 0.00 H ATOM 1960 N VAL A 131 2.881 -27.541 56.993 1.00 82.57 N ATOM 1961 CA VAL A 131 2.751 -26.478 57.978 1.00 63.56 C ATOM 1962 C VAL A 131 1.503 -26.682 58.846 1.00 60.37 C ATOM 1963 O VAL A 131 1.587 -26.685 60.076 1.00 70.44 O ATOM 1964 CB VAL A 131 2.755 -25.089 57.305 1.00 77.33 C ATOM 1965 CG1 VAL A 131 2.693 -23.989 58.340 1.00 52.64 C ATOM 1966 CG2 VAL A 131 4.004 -24.924 56.462 1.00 59.60 C ATOM 1967 HA VAL A 131 3.619 -26.522 58.636 1.00 0.00 H ATOM 1968 HB VAL A 131 1.874 -25.017 56.667 1.00 0.00 H ATOM 1969 HG11 VAL A 131 1.779 -24.093 58.925 1.00 0.00 H ATOM 1970 HG12 VAL A 131 3.558 -24.063 58.999 1.00 0.00 H ATOM 1971 HG13 VAL A 131 2.697 -23.021 57.840 1.00 0.00 H ATOM 1972 HG21 VAL A 131 4.885 -25.017 57.097 1.00 0.00 H ATOM 1973 HG22 VAL A 131 4.026 -25.696 55.693 1.00 0.00 H ATOM 1974 HG23 VAL A 131 3.996 -23.941 55.992 1.00 0.00 H ATOM 1975 H VAL A 131 2.859 -27.307 55.980 1.00 0.00 H ATOM 1976 N ARG A 132 0.351 -26.866 58.208 1.00 60.59 N ATOM 1977 CA ARG A 132 -0.884 -27.192 58.935 1.00 63.17 C ATOM 1978 C ARG A 132 -0.649 -28.288 59.969 1.00 72.95 C ATOM 1979 O ARG A 132 -0.757 -28.038 61.169 1.00 65.22 O ATOM 1980 CB ARG A 132 -1.983 -27.622 57.960 1.00 78.29 C ATOM 1981 CG ARG A 132 -3.258 -28.157 58.608 1.00106.86 C ATOM 1982 CD ARG A 132 -4.375 -28.283 57.574 1.00117.04 C ATOM 1983 NE ARG A 132 -4.335 -27.152 56.648 1.00159.89 N ATOM 1984 CZ ARG A 132 -3.989 -27.237 55.365 1.00153.34 C ATOM 1985 NH1 ARG A 132 -3.677 -28.411 54.833 1.00164.98 N ATOM 1986 NH2 ARG A 132 -3.968 -26.146 54.610 1.00 95.35 N ATOM 1987 HA ARG A 132 -1.204 -26.292 59.460 1.00 0.00 H ATOM 1988 HB2 ARG A 132 -2.251 -26.758 57.352 1.00 0.00 H ATOM 1989 HB3 ARG A 132 -1.577 -28.404 57.319 1.00 0.00 H ATOM 1990 HG2 ARG A 132 -3.057 -29.138 59.039 1.00 0.00 H ATOM 1991 HG3 ARG A 132 -3.574 -27.473 59.396 1.00 0.00 H ATOM 1992 HD2 ARG A 132 -5.338 -28.298 58.084 1.00 0.00 H ATOM 1993 HD3 ARG A 132 -4.247 -29.210 57.016 1.00 0.00 H ATOM 1994 HE ARG A 132 -4.595 -26.215 57.017 1.00 0.00 H ATOM 1995 HH12 ARG A 132 -3.407 -28.472 53.830 1.00 0.00 H ATOM 1996 HH11 ARG A 132 -3.702 -29.270 55.418 1.00 0.00 H ATOM 1997 HH22 ARG A 132 -3.698 -26.212 53.608 1.00 0.00 H ATOM 1998 HH21 ARG A 132 -4.222 -25.225 55.020 1.00 0.00 H ATOM 1999 H ARG A 132 0.323 -26.777 57.172 1.00 0.00 H ATOM 2000 N ARG A 133 -0.312 -29.491 59.490 1.00 82.19 N ATOM 2001 CA ARG A 133 -0.026 -30.647 60.348 1.00 70.97 C ATOM 2002 C ARG A 133 0.873 -30.304 61.530 1.00 63.36 C ATOM 2003 O ARG A 133 0.556 -30.620 62.682 1.00 58.60 O ATOM 2004 CB ARG A 133 0.595 -31.788 59.541 1.00 70.20 C ATOM 2005 CG ARG A 133 -0.385 -32.517 58.629 1.00122.51 C ATOM 2006 CD ARG A 133 0.188 -33.848 58.125 1.00135.96 C ATOM 2007 NE ARG A 133 1.385 -33.673 57.303 1.00138.51 N ATOM 2008 CZ ARG A 133 1.392 -33.687 55.971 1.00142.94 C ATOM 2009 NH1 ARG A 133 0.263 -33.874 55.301 1.00135.24 N ATOM 2010 NH2 ARG A 133 2.529 -33.516 55.307 1.00139.25 N ATOM 2011 HA ARG A 133 -0.987 -30.967 60.752 1.00 0.00 H ATOM 2012 HB2 ARG A 133 1.393 -31.375 58.924 1.00 0.00 H ATOM 2013 HB3 ARG A 133 1.015 -32.512 60.240 1.00 0.00 H ATOM 2014 HG2 ARG A 133 -1.303 -32.715 59.183 1.00 0.00 H ATOM 2015 HG3 ARG A 133 -0.609 -31.882 57.772 1.00 0.00 H ATOM 2016 HD2 ARG A 133 -0.573 -34.352 57.530 1.00 0.00 H ATOM 2017 HD3 ARG A 133 0.443 -34.466 58.986 1.00 0.00 H ATOM 2018 HE ARG A 133 2.292 -33.528 57.791 1.00 0.00 H ATOM 2019 HH12 ARG A 133 0.271 -33.885 54.261 1.00 0.00 H ATOM 2020 HH11 ARG A 133 -0.631 -34.010 55.815 1.00 0.00 H ATOM 2021 HH22 ARG A 133 2.531 -33.528 54.267 1.00 0.00 H ATOM 2022 HH21 ARG A 133 3.418 -33.371 55.827 1.00 0.00 H ATOM 2023 H ARG A 133 -0.250 -29.613 58.459 1.00 0.00 H ATOM 2024 N ALA A 134 1.997 -29.660 61.238 1.00 50.63 N ATOM 2025 CA ALA A 134 2.903 -29.211 62.286 1.00 61.03 C ATOM 2026 C ALA A 134 2.175 -28.396 63.357 1.00 72.92 C ATOM 2027 O ALA A 134 2.239 -28.713 64.546 1.00 90.27 O ATOM 2028 CB ALA A 134 4.036 -28.409 61.691 1.00 62.42 C ATOM 2029 HA ALA A 134 3.311 -30.097 62.771 1.00 0.00 H ATOM 2030 HB1 ALA A 134 4.587 -29.030 60.985 1.00 0.00 H ATOM 2031 HB2 ALA A 134 3.631 -27.540 61.173 1.00 0.00 H ATOM 2032 HB3 ALA A 134 4.704 -28.081 62.487 1.00 0.00 H ATOM 2033 H ALA A 134 2.235 -29.473 60.243 1.00 0.00 H ATOM 2034 N ILE A 135 1.483 -27.346 62.930 1.00 69.18 N ATOM 2035 CA ILE A 135 0.821 -26.449 63.870 1.00 89.20 C ATOM 2036 C ILE A 135 -0.193 -27.208 64.730 1.00 83.66 C ATOM 2037 O ILE A 135 -0.275 -27.010 65.946 1.00 72.52 O ATOM 2038 CB ILE A 135 0.145 -25.264 63.145 1.00 76.35 C ATOM 2039 CG1 ILE A 135 1.194 -24.406 62.433 1.00 77.00 C ATOM 2040 CG2 ILE A 135 -0.619 -24.406 64.129 1.00 66.29 C ATOM 2041 CD1 ILE A 135 0.614 -23.359 61.494 1.00 80.60 C ATOM 2042 HA ILE A 135 1.589 -26.040 64.527 1.00 0.00 H ATOM 2043 HB ILE A 135 -0.549 -25.669 62.409 1.00 0.00 H ATOM 2044 HG12 ILE A 135 1.788 -23.894 63.190 1.00 0.00 H ATOM 2045 HG13 ILE A 135 1.838 -25.066 61.852 1.00 0.00 H ATOM 2046 HD11 ILE A 135 0.026 -23.853 60.720 1.00 0.00 H ATOM 2047 HD12 ILE A 135 -0.024 -22.680 62.059 1.00 0.00 H ATOM 2048 HD13 ILE A 135 1.426 -22.797 61.032 1.00 0.00 H ATOM 2049 HG21 ILE A 135 -1.386 -25.008 64.615 1.00 0.00 H ATOM 2050 HG22 ILE A 135 0.069 -24.016 64.880 1.00 0.00 H ATOM 2051 HG23 ILE A 135 -1.088 -23.577 63.599 1.00 0.00 H ATOM 2052 H ILE A 135 1.412 -27.161 61.909 1.00 0.00 H ATOM 2053 N GLU A 136 -0.961 -28.083 64.095 1.00 80.59 N ATOM 2054 CA GLU A 136 -1.903 -28.917 64.823 1.00 84.72 C ATOM 2055 C GLU A 136 -1.190 -29.737 65.910 1.00 86.11 C ATOM 2056 O GLU A 136 -1.511 -29.623 67.095 1.00 89.08 O ATOM 2057 CB GLU A 136 -2.708 -29.792 63.852 1.00 58.36 C ATOM 2058 CG GLU A 136 -4.044 -29.165 63.459 1.00 96.06 C ATOM 2059 CD GLU A 136 -4.590 -29.664 62.132 1.00108.65 C ATOM 2060 OE1 GLU A 136 -3.926 -30.501 61.487 1.00 93.67 O ATOM 2061 OE2 GLU A 136 -5.687 -29.208 61.734 1.00135.96 O ATOM 2062 HA GLU A 136 -2.616 -28.274 65.340 1.00 0.00 H ATOM 2063 HB2 GLU A 136 -2.116 -29.946 62.950 1.00 0.00 H ATOM 2064 HB3 GLU A 136 -2.901 -30.754 64.327 1.00 0.00 H ATOM 2065 HG2 GLU A 136 -4.772 -29.392 64.238 1.00 0.00 H ATOM 2066 HG3 GLU A 136 -3.910 -28.085 63.392 1.00 0.00 H ATOM 2067 H GLU A 136 -0.888 -28.174 63.062 1.00 0.00 H ATOM 2068 N GLN A 137 -0.207 -30.539 65.511 1.00 78.01 N ATOM 2069 CA GLN A 137 0.573 -31.312 66.469 1.00 74.23 C ATOM 2070 C GLN A 137 1.121 -30.436 67.596 1.00 82.66 C ATOM 2071 O GLN A 137 1.202 -30.855 68.748 1.00 96.99 O ATOM 2072 CB GLN A 137 1.725 -32.021 65.764 1.00 92.49 C ATOM 2073 CG GLN A 137 1.306 -33.218 64.931 1.00 96.75 C ATOM 2074 CD GLN A 137 2.488 -33.892 64.260 1.00126.47 C ATOM 2075 OE1 GLN A 137 3.542 -33.281 64.070 1.00133.23 O ATOM 2076 NE2 GLN A 137 2.321 -35.158 63.903 1.00121.60 N ATOM 2077 HA GLN A 137 -0.096 -32.050 66.911 1.00 0.00 H ATOM 2078 HB2 GLN A 137 2.217 -31.303 65.107 1.00 0.00 H ATOM 2079 HB3 GLN A 137 2.431 -32.362 66.521 1.00 0.00 H ATOM 2080 HG2 GLN A 137 0.811 -33.941 65.579 1.00 0.00 H ATOM 2081 HG3 GLN A 137 0.609 -32.884 64.162 1.00 0.00 H ATOM 2082 HE22 GLN A 137 1.414 -35.634 64.083 1.00 0.00 H ATOM 2083 HE21 GLN A 137 3.097 -35.675 63.443 1.00 0.00 H ATOM 2084 H GLN A 137 0.009 -30.616 64.497 1.00 0.00 H ATOM 2085 N LEU A 138 1.493 -29.212 67.257 1.00 88.19 N ATOM 2086 CA LEU A 138 2.108 -28.316 68.223 1.00103.58 C ATOM 2087 C LEU A 138 1.080 -27.734 69.201 1.00116.76 C ATOM 2088 O LEU A 138 1.427 -27.320 70.309 1.00116.46 O ATOM 2089 CB LEU A 138 2.854 -27.205 67.484 1.00 93.24 C ATOM 2090 CG LEU A 138 4.320 -26.932 67.833 1.00 93.91 C ATOM 2091 CD1 LEU A 138 5.131 -28.200 68.101 1.00 65.96 C ATOM 2092 CD2 LEU A 138 4.955 -26.125 66.720 1.00 96.59 C ATOM 2093 HA LEU A 138 2.817 -28.890 68.820 1.00 0.00 H ATOM 2094 HB2 LEU A 138 2.819 -27.448 66.422 1.00 0.00 H ATOM 2095 HB3 LEU A 138 2.306 -26.280 67.662 1.00 0.00 H ATOM 2096 HG LEU A 138 4.329 -26.369 68.766 1.00 0.00 H ATOM 2097 HD21 LEU A 138 4.899 -26.687 65.788 1.00 0.00 H ATOM 2098 HD22 LEU A 138 4.423 -25.180 66.609 1.00 0.00 H ATOM 2099 HD23 LEU A 138 5.999 -25.929 66.965 1.00 0.00 H ATOM 2100 HD11 LEU A 138 4.691 -28.741 68.939 1.00 0.00 H ATOM 2101 HD12 LEU A 138 5.119 -28.832 67.213 1.00 0.00 H ATOM 2102 HD13 LEU A 138 6.159 -27.928 68.341 1.00 0.00 H ATOM 2103 H LEU A 138 1.343 -28.885 66.281 1.00 0.00 H ATOM 2104 N ALA A 139 -0.183 -27.708 68.786 1.00102.33 N ATOM 2105 CA ALA A 139 -1.263 -27.242 69.651 1.00103.61 C ATOM 2106 C ALA A 139 -1.801 -28.387 70.502 1.00109.72 C ATOM 2107 O ALA A 139 -1.979 -28.235 71.707 1.00 98.22 O ATOM 2108 CB ALA A 139 -2.387 -26.612 68.828 1.00 70.87 C ATOM 2109 HA ALA A 139 -0.859 -26.478 70.315 1.00 0.00 H ATOM 2110 HB1 ALA A 139 -1.994 -25.763 68.268 1.00 0.00 H ATOM 2111 HB2 ALA A 139 -2.787 -27.352 68.135 1.00 0.00 H ATOM 2112 HB3 ALA A 139 -3.179 -26.273 69.496 1.00 0.00 H ATOM 2113 H ALA A 139 -0.407 -28.027 67.822 1.00 0.00 H ATOM 2114 N ALA A 140 -2.056 -29.526 69.858 1.00121.97 N ATOM 2115 CA ALA A 140 -2.559 -30.734 70.521 1.00120.04 C ATOM 2116 C ALA A 140 -2.572 -30.649 72.049 1.00123.50 C ATOM 2117 O ALA A 140 -1.650 -31.119 72.720 1.00131.88 O ATOM 2118 CB ALA A 140 -1.767 -31.966 70.058 1.00101.06 C ATOM 2119 HA ALA A 140 -3.602 -30.828 70.220 1.00 0.00 H ATOM 2120 HB1 ALA A 140 -1.874 -32.081 68.979 1.00 0.00 H ATOM 2121 HB2 ALA A 140 -0.714 -31.835 70.308 1.00 0.00 H ATOM 2122 HB3 ALA A 140 -2.153 -32.854 70.559 1.00 0.00 H ATOM 2123 H ALA A 140 -1.890 -29.560 68.832 1.00 0.00 H TER 2124 ALA A 140 HETATM 2125 ZN ZN A 1 -1.038 -32.485 24.304 1.00 72.95 ZN HETATM 2126 O HOH 2 6.595 -34.628 12.056 1.00 60.25 O HETATM 2127 O HOH 3 9.699 -36.473 11.118 1.00 87.21 O HETATM 2128 O HOH 4 -7.458 -29.804 28.045 1.00 78.22 O HETATM 2129 O HOH 5 -0.181 -25.512 5.830 1.00 85.51 O HETATM 2130 O HOH 6 6.076 -35.390 65.315 1.00 74.12 O HETATM 2131 N ALA A 7 -3.591 -44.781 30.114 1.00 0.24 N HETATM 2132 CA ALA A 7 -2.721 -44.646 31.280 1.00 0.06 C HETATM 2133 C ALA A 7 -3.282 -43.665 32.313 1.00 0.23 C HETATM 2134 O ALA A 7 -4.373 -43.128 32.136 1.00 -0.39 O HETATM 2135 N ALA A 7 -2.533 -43.438 33.389 1.00 -0.26 N HETATM 2136 CA ALA A 7 -2.952 -42.507 34.437 1.00 0.13 C HETATM 2137 C ALA A 7 -2.279 -41.151 34.282 1.00 0.20 C HETATM 2138 O ALA A 7 -1.206 -41.050 33.692 1.00 -0.39 O HETATM 2139 N ALA A 7 -2.905 -40.117 34.836 1.00 -0.26 N HETATM 2140 CA ALA A 7 -2.230 -38.841 35.041 1.00 0.16 C HETATM 2141 CB ALA A 7 -3.243 -37.739 35.397 1.00 0.13 C HETATM 2142 CG2 ALA A 7 -2.527 -36.491 35.928 1.00 -0.03 C HETATM 2143 H ALA A 7 -1.961 -36.751 36.823 1.00 0.03 H HETATM 2144 H ALA A 7 -1.848 -36.111 35.165 1.00 0.03 H HETATM 2145 H ALA A 7 -3.265 -35.727 36.172 1.00 0.03 H HETATM 2146 OG1 ALA A 7 -4.031 -37.386 34.254 1.00 -0.27 O HETATM 2147 P ALA A 7 -5.484 -36.947 34.793 1.00 0.20 P HETATM 2148 O1P ALA A 7 -6.542 -37.452 33.888 1.00 -0.55 O HETATM 2149 O2P ALA A 7 -5.674 -37.546 36.276 1.00 -0.55 O HETATM 2150 O3P ALA A 7 -5.597 -35.342 34.853 1.00 -0.55 O HETATM 2151 H ALA A 7 -3.898 -38.131 36.175 1.00 0.07 H HETATM 2152 C ALA A 7 -1.217 -39.032 36.169 1.00 0.21 C HETATM 2153 O ALA A 7 -1.533 -39.626 37.201 1.00 -0.39 O HETATM 2154 N ALA A 7 0.002 -38.544 35.967 1.00 -0.26 N HETATM 2155 CA ALA A 7 1.070 -38.711 36.952 1.00 0.13 C HETATM 2156 C ALA A 7 0.662 -38.236 38.348 1.00 0.20 C HETATM 2157 O ALA A 7 -0.127 -37.297 38.494 1.00 -0.39 O HETATM 2158 N ALA A 7 1.206 -38.892 39.368 1.00 -0.26 N HETATM 2159 CA ALA A 7 0.937 -38.517 40.750 1.00 0.13 C HETATM 2160 C ALA A 7 2.240 -38.175 41.476 1.00 0.20 C HETATM 2161 O ALA A 7 3.266 -38.823 41.265 1.00 -0.39 O HETATM 2162 N ALA A 7 2.193 -37.147 42.321 1.00 -0.27 N HETATM 2163 CA ALA A 7 3.359 -36.703 43.091 1.00 0.09 C HETATM 2164 C ALA A 7 4.463 -36.098 42.216 1.00 0.06 C HETATM 2165 O ALA A 7 5.015 -35.036 42.531 1.00 -0.57 O HETATM 2166 O1 ALA A 7 4.814 -36.691 41.161 1.00 -0.57 O HETATM 2167 CB ALA A 7 3.947 -37.843 43.959 1.00 -0.03 C HETATM 2168 H ALA A 7 3.188 -38.193 44.659 1.00 0.03 H HETATM 2169 H ALA A 7 4.256 -38.666 43.315 1.00 0.03 H HETATM 2170 H ALA A 7 4.809 -37.469 44.512 1.00 0.03 H HETATM 2171 H ALA A 7 2.987 -35.915 43.746 1.00 0.07 H HETATM 2172 H ALA A 7 1.311 -36.649 42.437 1.00 0.19 H HETATM 2173 CB ALA A 7 0.195 -39.647 41.466 1.00 -0.02 C HETATM 2174 H ALA A 7 -0.749 -39.840 40.957 1.00 0.03 H HETATM 2175 H ALA A 7 0.808 -40.548 41.452 1.00 0.03 H HETATM 2176 H ALA A 7 -0.000 -39.355 42.498 1.00 0.03 H HETATM 2177 H ALA A 7 0.304 -37.630 40.757 1.00 0.08 H HETATM 2178 H ALA A 7 1.828 -39.678 39.178 1.00 0.19 H HETATM 2179 CB ALA A 7 2.344 -37.984 36.502 1.00 -0.01 C HETATM 2180 CG ALA A 7 3.486 -38.070 37.506 1.00 -0.04 C HETATM 2181 CD ALA A 7 4.565 -37.015 37.266 1.00 -0.01 C HETATM 2182 CE ALA A 7 5.574 -37.036 38.412 1.00 -0.04 C HETATM 2183 NZ ALA A 7 6.538 -35.906 38.363 1.00 0.22 N HETATM 2184 H ALA A 7 7.182 -35.976 39.151 1.00 0.20 H HETATM 2185 H ALA A 7 7.062 -35.946 37.489 1.00 0.20 H HETATM 2186 H ALA A 7 6.029 -35.024 38.416 1.00 0.20 H HETATM 2187 H ALA A 7 6.145 -37.961 38.333 1.00 0.08 H HETATM 2188 H ALA A 7 5.016 -36.955 39.345 1.00 0.08 H HETATM 2189 H ALA A 7 4.101 -36.030 37.213 1.00 0.03 H HETATM 2190 H ALA A 7 5.079 -37.232 36.330 1.00 0.03 H HETATM 2191 H ALA A 7 3.949 -39.051 37.402 1.00 0.03 H HETATM 2192 H ALA A 7 3.071 -37.903 38.500 1.00 0.03 H HETATM 2193 H ALA A 7 2.093 -36.930 36.384 1.00 0.03 H HETATM 2194 H ALA A 7 2.683 -38.460 35.582 1.00 0.03 H HETATM 2195 H ALA A 7 1.268 -39.781 37.017 1.00 0.08 H HETATM 2196 H ALA A 7 0.198 -38.040 35.102 1.00 0.19 H HETATM 2197 H ALA A 7 -1.725 -38.528 34.127 1.00 0.08 H HETATM 2198 H ALA A 7 -3.878 -40.219 35.124 1.00 0.19 H HETATM 2199 CB ALA A 7 -2.589 -43.040 35.827 1.00 -0.01 C HETATM 2200 CG ALA A 7 -3.201 -44.366 36.207 1.00 -0.02 C HETATM 2201 CD ALA A 7 -2.832 -44.712 37.641 1.00 0.06 C HETATM 2202 NE ALA A 7 -1.434 -44.394 37.934 1.00 -0.27 N HETATM 2203 CZ ALA A 7 -0.414 -45.224 37.728 1.00 0.29 C HETATM 2204 NH1 ALA A 7 -0.625 -46.431 37.222 1.00 -0.28 N HETATM 2205 H ALA A 7 -1.573 -46.728 36.989 1.00 0.26 H HETATM 2206 H ALA A 7 0.160 -47.063 37.066 1.00 0.26 H HETATM 2207 NH2 ALA A 7 0.821 -44.849 38.028 1.00 -0.28 N HETATM 2208 H ALA A 7 0.992 -43.922 38.418 1.00 0.26 H HETATM 2209 H ALA A 7 1.601 -45.487 37.869 1.00 0.26 H HETATM 2210 H ALA A 7 -1.227 -43.474 38.322 1.00 0.26 H HETATM 2211 H ALA A 7 -2.977 -45.783 37.783 1.00 0.07 H HETATM 2212 H ALA A 7 -3.464 -44.126 38.308 1.00 0.07 H HETATM 2213 H ALA A 7 -2.823 -45.141 35.541 1.00 0.03 H HETATM 2214 H ALA A 7 -4.285 -44.300 36.120 1.00 0.03 H HETATM 2215 H ALA A 7 -2.968 -42.311 36.543 1.00 0.03 H HETATM 2216 H ALA A 7 -1.509 -43.190 35.825 1.00 0.03 H HETATM 2217 H ALA A 7 -4.032 -42.403 34.337 1.00 0.08 H HETATM 2218 H ALA A 7 -1.643 -43.926 33.486 1.00 0.19 H HETATM 2219 CB ALA A 7 -1.341 -44.226 30.848 1.00 -0.00 C HETATM 2220 H ALA A 7 -1.388 -43.232 30.404 1.00 0.03 H HETATM 2221 H ALA A 7 -0.680 -44.208 31.715 1.00 0.03 H HETATM 2222 H ALA A 7 -0.960 -44.936 30.114 1.00 0.03 H HETATM 2223 H ALA A 7 -2.667 -45.621 31.764 1.00 0.11 H HETATM 2224 H ALA A 7 -4.522 -45.066 30.417 1.00 0.20 H HETATM 2225 H ALA A 7 -3.649 -43.886 29.629 1.00 0.20 H HETATM 2226 H ALA A 7 -3.207 -45.486 29.485 1.00 0.20 H CONECT 1 2 14 15 16 CONECT 14 1 CONECT 15 1 CONECT 16 1 CONECT 784 783 788 2125 CONECT 835 834 839 2125 CONECT 1100 1098 1099 2125 CONECT 1201 1200 1205 2125 CONECT 2125 784 835 1100 1201 CONECT 2131 2132 2224 2225 2226 CONECT 2132 2131 2133 2219 2223 CONECT 2133 2132 2134 2135 CONECT 2134 2133 CONECT 2135 2133 2136 2218 CONECT 2136 2135 2137 2199 2217 CONECT 2137 2136 2138 2139 CONECT 2138 2137 CONECT 2139 2137 2140 2198 CONECT 2140 2139 2141 2152 2197 CONECT 2141 2140 2142 2146 2151 CONECT 2142 2141 2143 2144 2145 CONECT 2143 2142 CONECT 2144 2142 CONECT 2145 2142 CONECT 2146 2141 2147 CONECT 2147 2146 2148 2149 2150 CONECT 2148 2147 CONECT 2149 2147 CONECT 2150 2147 CONECT 2151 2141 CONECT 2152 2140 2153 2154 CONECT 2153 2152 CONECT 2154 2152 2155 2196 CONECT 2155 2154 2156 2179 2195 CONECT 2156 2155 2157 2158 CONECT 2157 2156 CONECT 2158 2156 2159 2178 CONECT 2159 2158 2160 2173 2177 CONECT 2160 2159 2161 2162 CONECT 2161 2160 CONECT 2162 2160 2163 2172 CONECT 2163 2162 2164 2167 2171 CONECT 2164 2163 2165 2166 CONECT 2165 2164 CONECT 2166 2164 CONECT 2167 2163 2168 2169 2170 CONECT 2168 2167 CONECT 2169 2167 CONECT 2170 2167 CONECT 2171 2163 CONECT 2172 2162 CONECT 2173 2159 2174 2175 2176 CONECT 2174 2173 CONECT 2175 2173 CONECT 2176 2173 CONECT 2177 2159 CONECT 2178 2158 CONECT 2179 2155 2180 2193 2194 CONECT 2180 2179 2181 2191 2192 CONECT 2181 2180 2182 2189 2190 CONECT 2182 2181 2183 2187 2188 CONECT 2183 2182 2184 2185 2186 CONECT 2184 2183 CONECT 2185 2183 CONECT 2186 2183 CONECT 2187 2182 CONECT 2188 2182 CONECT 2189 2181 CONECT 2190 2181 CONECT 2191 2180 CONECT 2192 2180 CONECT 2193 2179 CONECT 2194 2179 CONECT 2195 2155 CONECT 2196 2154 CONECT 2197 2140 CONECT 2198 2139 CONECT 2199 2136 2200 2215 2216 CONECT 2200 2199 2201 2213 2214 CONECT 2201 2200 2202 2211 2212 CONECT 2202 2201 2203 2210 CONECT 2203 2202 2204 2207 CONECT 2204 2203 2205 2206 CONECT 2205 2204 CONECT 2206 2204 CONECT 2207 2203 2208 2209 CONECT 2208 2207 CONECT 2209 2207 CONECT 2210 2202 CONECT 2211 2201 CONECT 2212 2201 CONECT 2213 2200 CONECT 2214 2200 CONECT 2215 2199 CONECT 2216 2199 CONECT 2217 2136 CONECT 2218 2135 CONECT 2219 2132 2220 2221 2222 CONECT 2220 2219 CONECT 2221 2219 CONECT 2222 2219 CONECT 2223 2132 CONECT 2224 2131 CONECT 2225 2131 CONECT 2226 2131 MASTER 0 0 0 0 0 0 0 0 2225 1 105 11 END
Display Options:
Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
Goto PDB code:
3D presentation of molecule is powered by
3Dmol
, which supports all modern browsers and mobile devices via WebGL.
Hold mouse button:
left to rotate,middle to shift,right to zoom
Related entries of code: 4a0j
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
3uec
RCSB PDB
PDBbind
146aa, >3UEC_1|Chain... *
3uii
RCSB PDB
PDBbind
143aa, >3UII_1|Chains... at 99%
3uik
RCSB PDB
PDBbind
143aa, >3UIK_1|Chains... at 97%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1a7c
RCSB PDB
PDBbind
6-mer
1elr
RCSB PDB
PDBbind
6-mer
1gui
RCSB PDB
PDBbind
6-mer
1gvx
RCSB PDB
PDBbind
6-mer
1gwm
RCSB PDB
PDBbind
6-mer
1k9r
RCSB PDB
PDBbind
6-mer
1lyb
RCSB PDB
PDBbind
6-mer
1njt
RCSB PDB
PDBbind
6-mer
1okv
RCSB PDB
PDBbind
6-mer
1ol1
RCSB PDB
PDBbind
6-mer
1ol2
RCSB PDB
PDBbind
6-mer
1q4k
RCSB PDB
PDBbind
6-mer
1rhk
RCSB PDB
PDBbind
6-mer
1sld
RCSB PDB
PDBbind
6-mer
1sme
RCSB PDB
PDBbind
6-mer
1str
RCSB PDB
PDBbind
6-mer
1urc
RCSB PDB
PDBbind
6-mer
1xt3
RCSB PDB
PDBbind
6-mer
1ym2
RCSB PDB
PDBbind
6-mer
1zfp
RCSB PDB
PDBbind
6-mer
2h65
RCSB PDB
PDBbind
6-mer
2h6t
RCSB PDB
PDBbind
6-mer
2hob
RCSB PDB
PDBbind
6-mer
2itk
RCSB PDB
PDBbind
6-mer
2l65
RCSB PDB
PDBbind
6-mer
2oqs
RCSB PDB
PDBbind
6-mer
2q6f
RCSB PDB
PDBbind
6-mer
2qzx
RCSB PDB
PDBbind
6-mer
2r0z
RCSB PDB
PDBbind
6-mer
2w76
RCSB PDB
PDBbind
6-mer
2x6x
RCSB PDB
PDBbind
6-mer
3avz
RCSB PDB
PDBbind
6-mer
3aw0
RCSB PDB
PDBbind
6-mer
3bv9
RCSB PDB
PDBbind
6-mer
3dri
RCSB PDB
PDBbind
6-mer
3eys
RCSB PDB
PDBbind
6-mer
3fv3
RCSB PDB
PDBbind
6-mer
3fwv
RCSB PDB
PDBbind
6-mer
3h6z
RCSB PDB
PDBbind
6-mer
3hik
RCSB PDB
PDBbind
6-mer
3iqu
RCSB PDB
PDBbind
6-mer
3iqv
RCSB PDB
PDBbind
6-mer
3kd7
RCSB PDB
PDBbind
6-mer
3luo
RCSB PDB
PDBbind
6-mer
3nth
RCSB PDB
PDBbind
6-mer
3old
RCSB PDB
PDBbind
6-mer
3psl
RCSB PDB
PDBbind
6-mer
3q4j
RCSB PDB
PDBbind
6-mer
3q4k
RCSB PDB
PDBbind
6-mer
3q4l
RCSB PDB
PDBbind
6-mer
3r5j
RCSB PDB
PDBbind
6-mer
3r6g
RCSB PDB
PDBbind
6-mer
3rjm
RCSB PDB
PDBbind
6-mer
3sm1
RCSB PDB
PDBbind
6-mer
3sna
RCSB PDB
PDBbind
6-mer
3snb
RCSB PDB
PDBbind
6-mer
3snc
RCSB PDB
PDBbind
6-mer
3snd
RCSB PDB
PDBbind
6-mer
3u51
RCSB PDB
PDBbind
6-mer
3ux0
RCSB PDB
PDBbind
6-mer
3wqw
RCSB PDB
PDBbind
6-mer
3zmt
RCSB PDB
PDBbind
6-mer
3zmu
RCSB PDB
PDBbind
6-mer
3zmv
RCSB PDB
PDBbind
6-mer
3zmz
RCSB PDB
PDBbind
6-mer
3zn0
RCSB PDB
PDBbind
6-mer
3zn1
RCSB PDB
PDBbind
6-mer
4apo
RCSB PDB
PDBbind
6-mer
4b3b
RCSB PDB
PDBbind
6-mer
4b4q
RCSB PDB
PDBbind
6-mer
4b8y
RCSB PDB
PDBbind
6-mer
4c4n
RCSB PDB
PDBbind
6-mer
4dgb
RCSB PDB
PDBbind
6-mer
4er2
RCSB PDB
PDBbind
6-mer
4exh
RCSB PDB
PDBbind
6-mer
4fr3
RCSB PDB
PDBbind
6-mer
4fys
RCSB PDB
PDBbind
6-mer
4fz3
RCSB PDB
PDBbind
6-mer
4gye
RCSB PDB
PDBbind
6-mer
4gzf
RCSB PDB
PDBbind
6-mer
4ifi
RCSB PDB
PDBbind
6-mer
4ikn
RCSB PDB
PDBbind
6-mer
4j09
RCSB PDB
PDBbind
6-mer
4j77
RCSB PDB
PDBbind
6-mer
4j79
RCSB PDB
PDBbind
6-mer
4j86
RCSB PDB
PDBbind
6-mer
4j8b
RCSB PDB
PDBbind
6-mer
4jj7
RCSB PDB
PDBbind
6-mer
4jj8
RCSB PDB
PDBbind
6-mer
4jje
RCSB PDB
PDBbind
6-mer
4jr0
RCSB PDB
PDBbind
6-mer
4k3o
RCSB PDB
PDBbind
6-mer
4k3p
RCSB PDB
PDBbind
6-mer
4k3q
RCSB PDB
PDBbind
6-mer
4k3r
RCSB PDB
PDBbind
6-mer
4ny3
RCSB PDB
PDBbind
6-mer
4o9w
RCSB PDB
PDBbind
6-mer
4ou3
RCSB PDB
PDBbind
6-mer
4tsz
RCSB PDB
PDBbind
6-mer
4tt2
RCSB PDB
PDBbind
6-mer
4wk2
RCSB PDB
PDBbind
6-mer
4wvt
RCSB PDB
PDBbind
6-mer
4x9r
RCSB PDB
PDBbind
6-mer
4x9v
RCSB PDB
PDBbind
6-mer
4ynl
RCSB PDB
PDBbind
6-mer
5a2i
RCSB PDB
PDBbind
6-mer
5a2j
RCSB PDB
PDBbind
6-mer
5a2k
RCSB PDB
PDBbind
6-mer
5e1b
RCSB PDB
PDBbind
6-mer
5e1d
RCSB PDB
PDBbind
6-mer
5e1m
RCSB PDB
PDBbind
6-mer
5e1o
RCSB PDB
PDBbind
6-mer
5epk
RCSB PDB
PDBbind
6-mer
5epl
RCSB PDB
PDBbind
6-mer
5eq0
RCSB PDB
PDBbind
6-mer
5fot
RCSB PDB
PDBbind
6-mer
5fou
RCSB PDB
PDBbind
6-mer
5fov
RCSB PDB
PDBbind
6-mer
5fow
RCSB PDB
PDBbind
6-mer
5fox
RCSB PDB
PDBbind
6-mer
5fpk
RCSB PDB
PDBbind
6-mer
5gwz
RCSB PDB
PDBbind
6-mer
5hvp
RCSB PDB
PDBbind
6-mer
5izf
RCSB PDB
PDBbind
6-mer
5l7k
RCSB PDB
PDBbind
6-mer
5lrg
RCSB PDB
PDBbind
6-mer
5lrj
RCSB PDB
PDBbind
6-mer
5lrk
RCSB PDB
PDBbind
6-mer
5lso
RCSB PDB
PDBbind
6-mer
5tpc
RCSB PDB
PDBbind
6-mer
5w94
RCSB PDB
PDBbind
6-mer
5y24
RCSB PDB
PDBbind
6-mer
6apr
RCSB PDB
PDBbind
6-mer
6asz
RCSB PDB
PDBbind
6-mer
6at0
RCSB PDB
PDBbind
6-mer
6cdg
RCSB PDB
PDBbind
6-mer
6cgt
RCSB PDB
PDBbind
6-mer
6do4
RCSB PDB
PDBbind
6-mer
6do5
RCSB PDB
PDBbind
6-mer
6dub
RCSB PDB
PDBbind
6-mer
6eqx
RCSB PDB
PDBbind
6-mer
7hvp
RCSB PDB
PDBbind
6-mer
6rhe
RCSB PDB
PDBbind
6-mer
6nsx
RCSB PDB
PDBbind
6-mer
6nsv
RCSB PDB
PDBbind
6-mer
6jij
RCSB PDB
PDBbind
6-mer
6im4
RCSB PDB
PDBbind
6-mer
6hzd
RCSB PDB
PDBbind
6-mer
6hzc
RCSB PDB
PDBbind
6-mer
6hp5
RCSB PDB
PDBbind
6-mer
6hmy
RCSB PDB
PDBbind
6-mer
6hle
RCSB PDB
PDBbind
6-mer
6fvo
RCSB PDB
PDBbind
6-mer
6fvn
RCSB PDB
PDBbind
6-mer
6fvm
RCSB PDB
PDBbind
6-mer
6fvl
RCSB PDB
PDBbind
6-mer
6efk
RCSB PDB
PDBbind
6-mer
6a30
RCSB PDB
PDBbind
6-mer
5zw6
RCSB PDB
PDBbind
6-mer
5zvw
RCSB PDB
PDBbind
6-mer
Entry Information
PDB ID
4a0j
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
BACULOVIRAL IAP REPEAT-CONTAINING PROTEIN 5, SURVIVIN
Ligand Name
6-mer
EC.Number
E.C.-.-.-.-
Resolution
2.8(Å)
Affinity (Kd/Ki/IC50)
Kd=1.0uM
Release Year
2011
Protein/NA Sequence
Check fasta file
Primary Reference
(2011) Structure Vol. 19: pp. 1625
Ligand Properties
Formula
C
2
5
H
5
3
N
1
0
O
1
1
P
Molecular Weight
700.722
Exact Mass
700.363
No. of atoms
100
No. of bonds
99
Polar Surface Area
387.6
LOGP Value
-6.87 (
Computed with XLOGP3
)
-4.87 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 7
No. of Hydrogen Bond Acceptors: 10
No. of Rotatable Bonds: 25
No. of Nitrogen and Oxygen Atoms: 21
No. of Rings: 0
Canonical SMILES
[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)C)C)NC(=O)[C@H]([C@H](OP(O)(O)O)C)NC(=O)[C@@H](NC(=O)[C@@H]([NH3+])C)CCC[NH+]=C(N)N
InChI String
InChI=1S/C25H51N10O11P/c1-12(27)19(36)33-17(9-7-11-30-25(28)29)22(39)35-18(15(4)46-47(43,44)45)23(40)34-16(8-5-6-10-26)21(38)31-13(2)20(37)32-14(3)24(41)42/h12-18,43-45,47H,5-11,26-27H2,1-4H3,(H,31,38)(H,32,37)(H,33,36)(H,34,40)(H,35,39)(H,41,42)(H4,28,29,30)/p+3/t12-,13-,14-,15+,16-,17-,18-/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):
O15392
P68431
Entrez Gene ID
NCBI Entrez Gene ID:
332
8350
8351
8352
8353
8354
8355
8356
8357
8358
8968
ASD
Information of known allosteric effects of PDB entries
This site has been visited
times since Nov 2007.
Copyright ©2007-2024 涓婃捣鐩堣禌鎬濅俊鎭鎶鏈夐檺鍏徃 缃戠珯澶囨鍙凤細
娌狪CP澶2021015625鍙-3
娌叕缃戝畨澶囷細
姝e湪鐢宠涓
Technical Support锛堟妧鏈敮鎸侊級:
yingsaisi@foxmail.com