Browse entries in the PDBbind-CN Database
HEADER 3MXC_COMPLEX COMPND 3MXC_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 98 MET LYS PRO HIS PRO TRP PHE PHE GLY LYS ILE PRO ARG SEQRES 2 A 98 ALA LYS ALA GLU GLU MET LEU SER LYS GLN ARG HIS ASP SEQRES 3 A 98 GLY ALA PHE LEU ILE ARG GLU SER GLU SER ALA PRO GLY SEQRES 4 A 98 ASP PHE SER LEU SER VAL LYS PHE GLY ASN ASP VAL GLN SEQRES 5 A 98 HIS PHE LYS VAL LEU ARG ASP GLY ALA GLY LYS TYR PHE SEQRES 6 A 98 LEU TRP VAL VAL LYS PHE ASN SER LEU ASN GLU LEU VAL SEQRES 7 A 98 ASP TYR HIS ARG SER THR SER VAL SER ARG ASN GLN GLN SEQRES 8 A 98 ILE PHE LEU ARG ASP ILE GLU HET GLY A 221 104 ATOM 1 N MET A 55 -11.422 58.925 24.057 1.00 71.21 N ATOM 2 CA MET A 55 -10.738 58.729 25.364 1.00 73.13 C ATOM 3 C MET A 55 -9.359 59.378 25.335 1.00 67.96 C ATOM 4 O MET A 55 -8.976 60.007 24.351 1.00 65.88 O ATOM 5 CB MET A 55 -10.579 57.233 25.658 1.00 80.77 C ATOM 6 CG MET A 55 -11.834 56.400 25.424 1.00 91.75 C ATOM 7 SD MET A 55 -13.221 56.869 26.472 1.00 97.73 S ATOM 8 CE MET A 55 -12.892 55.873 27.927 1.00 99.21 C ATOM 9 HA MET A 55 -11.344 59.191 26.143 1.00 0.00 H ATOM 10 HB2 MET A 55 -9.788 56.843 25.017 1.00 0.00 H ATOM 11 HB3 MET A 55 -10.287 57.121 26.702 1.00 0.00 H ATOM 12 HG2 MET A 55 -11.594 55.354 25.618 1.00 0.00 H ATOM 13 HG3 MET A 55 -12.135 56.516 24.383 1.00 0.00 H ATOM 14 HE1 MET A 55 -12.889 54.819 27.651 1.00 0.00 H ATOM 15 HE2 MET A 55 -11.920 56.145 28.340 1.00 0.00 H ATOM 16 HE3 MET A 55 -13.667 56.053 28.672 1.00 0.00 H ATOM 17 HN3 MET A 55 -10.855 58.490 23.302 1.00 0.00 H ATOM 18 HN2 MET A 55 -11.527 59.943 23.871 1.00 0.00 H ATOM 19 HN1 MET A 55 -12.361 58.479 24.088 1.00 0.00 H ATOM 20 N LYS A 56 -8.618 59.211 26.424 1.00 63.14 N ATOM 21 CA LYS A 56 -7.272 59.750 26.545 1.00 58.72 C ATOM 22 C LYS A 56 -6.419 58.634 27.133 1.00 52.38 C ATOM 23 O LYS A 56 -6.935 57.743 27.812 1.00 51.48 O ATOM 24 CB LYS A 56 -7.260 60.965 27.477 1.00 63.97 C ATOM 25 CG LYS A 56 -8.084 62.157 26.998 1.00 70.82 C ATOM 26 CD LYS A 56 -8.190 63.206 28.099 1.00 74.49 C ATOM 27 CE LYS A 56 -9.355 64.173 27.881 1.00 76.58 C ATOM 28 NZ LYS A 56 -9.058 65.286 26.929 1.00 77.68 N ATOM 29 HA LYS A 56 -6.893 60.079 25.577 1.00 0.00 H ATOM 30 HB2 LYS A 56 -7.650 60.652 28.445 1.00 0.00 H ATOM 31 HB3 LYS A 56 -6.227 61.293 27.592 1.00 0.00 H ATOM 32 HG2 LYS A 56 -7.603 62.599 26.125 1.00 0.00 H ATOM 33 HG3 LYS A 56 -9.084 61.817 26.727 1.00 0.00 H ATOM 34 HD2 LYS A 56 -8.332 62.698 29.053 1.00 0.00 H ATOM 35 HD3 LYS A 56 -7.262 63.778 28.127 1.00 0.00 H ATOM 36 HE2 LYS A 56 -9.623 64.609 28.844 1.00 0.00 H ATOM 37 HE3 LYS A 56 -10.201 63.607 27.492 1.00 0.00 H ATOM 38 HZ1 LYS A 56 -8.260 65.846 27.290 1.00 0.00 H ATOM 39 HZ2 LYS A 56 -8.812 64.889 26.000 1.00 0.00 H ATOM 40 HZ3 LYS A 56 -9.896 65.895 26.837 1.00 0.00 H ATOM 41 H LYS A 56 -9.015 58.674 27.221 1.00 0.00 H ATOM 42 N PRO A 57 -5.103 58.659 26.874 1.00 45.04 N ATOM 43 CA PRO A 57 -4.236 57.610 27.414 1.00 39.95 C ATOM 44 C PRO A 57 -4.148 57.629 28.942 1.00 36.60 C ATOM 45 O PRO A 57 -4.488 58.628 29.583 1.00 34.14 O ATOM 46 CB PRO A 57 -2.896 57.902 26.748 1.00 40.60 C ATOM 47 CG PRO A 57 -2.914 59.394 26.610 1.00 41.76 C ATOM 48 CD PRO A 57 -4.322 59.654 26.116 1.00 42.47 C ATOM 49 HA PRO A 57 -4.611 56.608 27.204 1.00 0.00 H ATOM 50 HD3 PRO A 57 -4.642 60.670 26.349 1.00 0.00 H ATOM 51 HD2 PRO A 57 -4.402 59.486 25.042 1.00 0.00 H ATOM 52 HG3 PRO A 57 -2.172 59.733 25.887 1.00 0.00 H ATOM 53 HG2 PRO A 57 -2.735 59.882 27.568 1.00 0.00 H ATOM 54 HB2 PRO A 57 -2.066 57.575 27.374 1.00 0.00 H ATOM 55 HB3 PRO A 57 -2.827 57.418 25.774 1.00 0.00 H ATOM 56 N HIS A 58 -3.692 56.520 29.522 1.00 32.60 N ATOM 57 CA HIS A 58 -3.556 56.431 30.974 1.00 30.95 C ATOM 58 C HIS A 58 -2.195 56.953 31.401 1.00 32.28 C ATOM 59 O HIS A 58 -1.174 56.624 30.800 1.00 33.27 O ATOM 60 CB HIS A 58 -3.729 54.989 31.451 1.00 29.04 C ATOM 61 CG HIS A 58 -5.136 54.490 31.347 1.00 27.89 C ATOM 62 ND1 HIS A 58 -6.186 55.089 32.009 1.00 26.49 N ATOM 63 CD2 HIS A 58 -5.667 53.460 30.650 1.00 26.29 C ATOM 64 CE1 HIS A 58 -7.306 54.449 31.723 1.00 25.78 C ATOM 65 NE2 HIS A 58 -7.019 53.456 30.900 1.00 28.56 N ATOM 66 HA HIS A 58 -4.337 57.041 31.428 1.00 0.00 H ATOM 67 HB2 HIS A 58 -3.089 54.346 30.846 1.00 0.00 H ATOM 68 HB3 HIS A 58 -3.418 54.931 32.494 1.00 0.00 H ATOM 69 HD2 HIS A 58 -5.125 52.764 30.010 1.00 0.00 H ATOM 70 HE1 HIS A 58 -8.297 54.698 32.101 1.00 0.00 H ATOM 71 H HIS A 58 -3.429 55.705 28.932 1.00 0.00 H ATOM 72 N PRO A 59 -2.165 57.771 32.460 1.00 34.13 N ATOM 73 CA PRO A 59 -0.930 58.356 32.985 1.00 33.48 C ATOM 74 C PRO A 59 -0.109 57.392 33.842 1.00 31.30 C ATOM 75 O PRO A 59 0.962 57.751 34.332 1.00 31.32 O ATOM 76 CB PRO A 59 -1.449 59.533 33.796 1.00 34.88 C ATOM 77 CG PRO A 59 -2.667 58.934 34.432 1.00 37.23 C ATOM 78 CD PRO A 59 -3.327 58.219 33.251 1.00 34.96 C ATOM 79 HA PRO A 59 -0.233 58.632 32.194 1.00 0.00 H ATOM 80 HD3 PRO A 59 -3.925 57.372 33.587 1.00 0.00 H ATOM 81 HD2 PRO A 59 -3.955 58.901 32.678 1.00 0.00 H ATOM 82 HG3 PRO A 59 -3.319 59.705 34.843 1.00 0.00 H ATOM 83 HG2 PRO A 59 -2.397 58.231 35.220 1.00 0.00 H ATOM 84 HB2 PRO A 59 -0.724 59.854 34.544 1.00 0.00 H ATOM 85 HB3 PRO A 59 -1.706 60.377 33.156 1.00 0.00 H ATOM 86 N TRP A 60 -0.597 56.169 34.017 1.00 28.95 N ATOM 87 CA TRP A 60 0.114 55.205 34.844 1.00 26.59 C ATOM 88 C TRP A 60 0.900 54.097 34.150 1.00 26.40 C ATOM 89 O TRP A 60 1.578 53.318 34.828 1.00 23.78 O ATOM 90 CB TRP A 60 -0.846 54.571 35.864 1.00 25.08 C ATOM 91 CG TRP A 60 -2.175 54.125 35.316 1.00 24.67 C ATOM 92 CD1 TRP A 60 -3.367 54.786 35.428 1.00 24.49 C ATOM 93 CD2 TRP A 60 -2.459 52.902 34.619 1.00 24.61 C ATOM 94 NE1 TRP A 60 -4.377 54.048 34.852 1.00 26.03 N ATOM 95 CE2 TRP A 60 -3.848 52.890 34.346 1.00 24.79 C ATOM 96 CE3 TRP A 60 -1.675 51.816 34.198 1.00 22.65 C ATOM 97 CZ2 TRP A 60 -4.472 51.832 33.675 1.00 25.30 C ATOM 98 CZ3 TRP A 60 -2.296 50.764 33.530 1.00 24.24 C ATOM 99 CH2 TRP A 60 -3.683 50.781 33.275 1.00 24.34 C ATOM 100 HA TRP A 60 0.885 55.820 35.308 1.00 0.00 H ATOM 101 HB2 TRP A 60 -0.351 53.700 36.295 1.00 0.00 H ATOM 102 HB3 TRP A 60 -1.035 55.304 36.648 1.00 0.00 H ATOM 103 HE1 TRP A 60 -5.379 54.325 34.808 1.00 0.00 H ATOM 104 HD1 TRP A 60 -3.499 55.757 35.905 1.00 0.00 H ATOM 105 HZ2 TRP A 60 -5.544 51.842 33.477 1.00 0.00 H ATOM 106 HH2 TRP A 60 -4.139 49.942 32.749 1.00 0.00 H ATOM 107 HZ3 TRP A 60 -1.700 49.913 33.199 1.00 0.00 H ATOM 108 HE3 TRP A 60 -0.602 51.797 34.390 1.00 0.00 H ATOM 109 H TRP A 60 -1.492 55.899 33.561 1.00 0.00 H ATOM 110 N PHE A 61 0.822 54.003 32.824 1.00 23.68 N ATOM 111 CA PHE A 61 1.568 52.958 32.124 1.00 24.56 C ATOM 112 C PHE A 61 2.938 53.481 31.703 1.00 24.24 C ATOM 113 O PHE A 61 3.042 54.335 30.823 1.00 24.57 O ATOM 114 CB PHE A 61 0.806 52.465 30.887 1.00 24.09 C ATOM 115 CG PHE A 61 1.374 51.204 30.301 1.00 24.55 C ATOM 116 CD1 PHE A 61 1.082 49.967 30.869 1.00 26.94 C ATOM 117 CD2 PHE A 61 2.253 51.258 29.220 1.00 24.59 C ATOM 118 CE1 PHE A 61 1.659 48.798 30.375 1.00 28.73 C ATOM 119 CE2 PHE A 61 2.839 50.100 28.716 1.00 25.54 C ATOM 120 CZ PHE A 61 2.543 48.863 29.295 1.00 27.76 C ATOM 121 HA PHE A 61 1.692 52.121 32.811 1.00 0.00 H ATOM 122 HB2 PHE A 61 -0.230 52.279 31.170 1.00 0.00 H ATOM 123 HB3 PHE A 61 0.839 53.245 30.127 1.00 0.00 H ATOM 124 HD2 PHE A 61 2.485 52.220 28.763 1.00 0.00 H ATOM 125 HE2 PHE A 61 3.527 50.158 27.872 1.00 0.00 H ATOM 126 HZ PHE A 61 3.000 47.953 28.906 1.00 0.00 H ATOM 127 HE1 PHE A 61 1.421 47.836 30.830 1.00 0.00 H ATOM 128 HD1 PHE A 61 0.393 49.912 31.712 1.00 0.00 H ATOM 129 H PHE A 61 0.232 54.671 32.288 1.00 0.00 H ATOM 130 N PHE A 62 3.987 52.959 32.332 1.00 24.18 N ATOM 131 CA PHE A 62 5.353 53.389 32.045 1.00 24.68 C ATOM 132 C PHE A 62 6.174 52.435 31.176 1.00 24.20 C ATOM 133 O PHE A 62 7.347 52.686 30.908 1.00 23.94 O ATOM 134 CB PHE A 62 6.094 53.659 33.362 1.00 26.56 C ATOM 135 CG PHE A 62 5.730 54.972 33.999 1.00 26.03 C ATOM 136 CD1 PHE A 62 4.433 55.211 34.448 1.00 25.29 C ATOM 137 CD2 PHE A 62 6.675 55.987 34.110 1.00 29.02 C ATOM 138 CE1 PHE A 62 4.080 56.440 34.993 1.00 26.57 C ATOM 139 CE2 PHE A 62 6.333 57.227 34.656 1.00 29.53 C ATOM 140 CZ PHE A 62 5.031 57.452 35.098 1.00 28.59 C ATOM 141 HA PHE A 62 5.250 54.297 31.450 1.00 0.00 H ATOM 142 HB2 PHE A 62 5.856 52.858 34.062 1.00 0.00 H ATOM 143 HB3 PHE A 62 7.165 53.658 33.161 1.00 0.00 H ATOM 144 HD2 PHE A 62 7.695 55.813 33.767 1.00 0.00 H ATOM 145 HE2 PHE A 62 7.082 58.015 34.736 1.00 0.00 H ATOM 146 HZ PHE A 62 4.758 58.417 35.525 1.00 0.00 H ATOM 147 HE1 PHE A 62 3.060 56.611 35.338 1.00 0.00 H ATOM 148 HD1 PHE A 62 3.684 54.423 34.371 1.00 0.00 H ATOM 149 H PHE A 62 3.830 52.223 33.050 1.00 0.00 H ATOM 150 N GLY A 63 5.566 51.342 30.734 1.00 23.83 N ATOM 151 CA GLY A 63 6.294 50.407 29.899 1.00 24.78 C ATOM 152 C GLY A 63 7.418 49.697 30.625 1.00 26.97 C ATOM 153 O GLY A 63 7.301 49.338 31.798 1.00 26.07 O ATOM 154 HA3 GLY A 63 6.718 50.954 29.057 1.00 0.00 H ATOM 155 HA2 GLY A 63 5.594 49.658 29.529 1.00 0.00 H ATOM 156 H GLY A 63 4.574 51.157 30.985 1.00 0.00 H ATOM 157 N LYS A 64 8.526 49.506 29.923 1.00 29.28 N ATOM 158 CA LYS A 64 9.665 48.803 30.479 1.00 32.62 C ATOM 159 C LYS A 64 10.641 49.685 31.266 1.00 34.18 C ATOM 160 O LYS A 64 11.777 49.898 30.847 1.00 38.56 O ATOM 161 CB LYS A 64 10.403 48.068 29.351 1.00 32.73 C ATOM 162 CG LYS A 64 11.318 46.953 29.836 1.00 36.21 C ATOM 163 CD LYS A 64 11.959 46.219 28.671 1.00 37.29 C ATOM 164 CE LYS A 64 12.835 45.085 29.171 1.00 38.04 C ATOM 165 NZ LYS A 64 13.520 44.379 28.059 1.00 38.85 N ATOM 166 HA LYS A 64 9.265 48.100 31.210 1.00 0.00 H ATOM 167 HB2 LYS A 64 9.661 47.636 28.680 1.00 0.00 H ATOM 168 HB3 LYS A 64 11.006 48.794 28.805 1.00 0.00 H ATOM 169 HG2 LYS A 64 12.102 47.383 30.460 1.00 0.00 H ATOM 170 HG3 LYS A 64 10.734 46.245 30.424 1.00 0.00 H ATOM 171 HD2 LYS A 64 11.177 45.812 28.030 1.00 0.00 H ATOM 172 HD3 LYS A 64 12.569 46.918 28.099 1.00 0.00 H ATOM 173 HE2 LYS A 64 12.213 44.371 29.711 1.00 0.00 H ATOM 174 HE3 LYS A 64 13.588 45.493 29.846 1.00 0.00 H ATOM 175 HZ1 LYS A 64 12.809 43.980 27.413 1.00 0.00 H ATOM 176 HZ2 LYS A 64 14.122 45.051 27.542 1.00 0.00 H ATOM 177 HZ3 LYS A 64 14.107 43.613 28.446 1.00 0.00 H ATOM 178 H LYS A 64 8.579 49.869 28.950 1.00 0.00 H ATOM 179 N ILE A 65 10.189 50.199 32.405 1.00 35.28 N ATOM 180 CA ILE A 65 11.034 51.025 33.257 1.00 35.50 C ATOM 181 C ILE A 65 11.621 50.091 34.316 1.00 34.88 C ATOM 182 O ILE A 65 10.904 49.279 34.905 1.00 34.75 O ATOM 183 CB ILE A 65 10.219 52.168 33.934 1.00 36.90 C ATOM 184 CG1 ILE A 65 11.103 52.927 34.933 1.00 39.34 C ATOM 185 CG2 ILE A 65 9.006 51.603 34.661 1.00 35.58 C ATOM 186 CD1 ILE A 65 10.397 54.062 35.653 1.00 37.76 C ATOM 187 HA ILE A 65 11.815 51.507 32.669 1.00 0.00 H ATOM 188 HB ILE A 65 9.880 52.852 33.156 1.00 0.00 H ATOM 189 HG12 ILE A 65 11.461 52.218 35.680 1.00 0.00 H ATOM 190 HG13 ILE A 65 11.953 53.342 34.391 1.00 0.00 H ATOM 191 HD11 ILE A 65 10.042 54.789 34.923 1.00 0.00 H ATOM 192 HD12 ILE A 65 9.550 53.665 36.213 1.00 0.00 H ATOM 193 HD13 ILE A 65 11.093 54.544 36.339 1.00 0.00 H ATOM 194 HG21 ILE A 65 8.365 51.086 33.947 1.00 0.00 H ATOM 195 HG22 ILE A 65 9.337 50.903 35.428 1.00 0.00 H ATOM 196 HG23 ILE A 65 8.451 52.418 35.126 1.00 0.00 H ATOM 197 H ILE A 65 9.209 50.007 32.695 1.00 0.00 H ATOM 198 N PRO A 66 12.941 50.170 34.549 1.00 32.58 N ATOM 199 CA PRO A 66 13.573 49.305 35.551 1.00 32.07 C ATOM 200 C PRO A 66 12.948 49.487 36.938 1.00 30.09 C ATOM 201 O PRO A 66 12.490 50.574 37.286 1.00 29.42 O ATOM 202 CB PRO A 66 15.034 49.753 35.521 1.00 33.01 C ATOM 203 CG PRO A 66 15.215 50.210 34.098 1.00 35.80 C ATOM 204 CD PRO A 66 13.947 50.995 33.859 1.00 33.52 C ATOM 205 HA PRO A 66 13.449 48.244 35.336 1.00 0.00 H ATOM 206 HD3 PRO A 66 14.010 51.992 34.296 1.00 0.00 H ATOM 207 HD2 PRO A 66 13.728 51.079 32.795 1.00 0.00 H ATOM 208 HG3 PRO A 66 15.292 49.363 33.416 1.00 0.00 H ATOM 209 HG2 PRO A 66 16.098 50.841 33.993 1.00 0.00 H ATOM 210 HB2 PRO A 66 15.209 50.570 36.221 1.00 0.00 H ATOM 211 HB3 PRO A 66 15.703 48.925 35.756 1.00 0.00 H ATOM 212 N ARG A 67 12.935 48.415 37.721 1.00 28.95 N ATOM 213 CA ARG A 67 12.382 48.449 39.067 1.00 29.76 C ATOM 214 C ARG A 67 13.047 49.551 39.886 1.00 31.06 C ATOM 215 O ARG A 67 12.385 50.279 40.624 1.00 30.98 O ATOM 216 CB ARG A 67 12.593 47.089 39.739 1.00 29.43 C ATOM 217 CG ARG A 67 12.213 47.013 41.216 1.00 29.87 C ATOM 218 CD ARG A 67 12.451 45.596 41.734 1.00 30.51 C ATOM 219 NE ARG A 67 12.212 45.461 43.169 1.00 30.96 N ATOM 220 CZ ARG A 67 11.338 44.617 43.711 1.00 31.15 C ATOM 221 NH1 ARG A 67 10.602 43.823 42.942 1.00 30.48 N ATOM 222 NH2 ARG A 67 11.207 44.558 45.029 1.00 31.90 N ATOM 223 HA ARG A 67 11.314 48.661 39.010 1.00 0.00 H ATOM 224 HB2 ARG A 67 11.995 46.353 39.201 1.00 0.00 H ATOM 225 HB3 ARG A 67 13.649 46.832 39.651 1.00 0.00 H ATOM 226 HG2 ARG A 67 12.823 47.715 41.785 1.00 0.00 H ATOM 227 HG3 ARG A 67 11.160 47.271 41.334 1.00 0.00 H ATOM 228 HD2 ARG A 67 13.485 45.320 41.527 1.00 0.00 H ATOM 229 HD3 ARG A 67 11.782 44.917 41.206 1.00 0.00 H ATOM 230 HE ARG A 67 12.763 46.066 43.811 1.00 0.00 H ATOM 231 HH12 ARG A 67 9.921 43.166 43.374 1.00 0.00 H ATOM 232 HH11 ARG A 67 10.706 43.858 41.908 1.00 0.00 H ATOM 233 HH22 ARG A 67 10.524 43.899 45.455 1.00 0.00 H ATOM 234 HH21 ARG A 67 11.787 45.171 45.637 1.00 0.00 H ATOM 235 H ARG A 67 13.332 47.524 37.362 1.00 0.00 H ATOM 236 N ALA A 68 14.364 49.669 39.752 1.00 30.96 N ATOM 237 CA ALA A 68 15.109 50.685 40.482 1.00 30.76 C ATOM 238 C ALA A 68 14.678 52.097 40.113 1.00 31.18 C ATOM 239 O ALA A 68 14.592 52.968 40.983 1.00 29.16 O ATOM 240 CB ALA A 68 16.608 50.520 40.235 1.00 32.70 C ATOM 241 HA ALA A 68 14.892 50.542 41.540 1.00 0.00 H ATOM 242 HB1 ALA A 68 16.924 49.533 40.573 1.00 0.00 H ATOM 243 HB2 ALA A 68 16.813 50.623 39.169 1.00 0.00 H ATOM 244 HB3 ALA A 68 17.152 51.286 40.787 1.00 0.00 H ATOM 245 H ALA A 68 14.872 49.024 39.114 1.00 0.00 H ATOM 246 N LYS A 69 14.405 52.331 38.831 1.00 30.26 N ATOM 247 CA LYS A 69 13.994 53.658 38.386 1.00 31.21 C ATOM 248 C LYS A 69 12.567 53.966 38.803 1.00 29.16 C ATOM 249 O LYS A 69 12.205 55.124 39.006 1.00 27.03 O ATOM 250 CB LYS A 69 14.117 53.779 36.868 1.00 36.80 C ATOM 251 CG LYS A 69 15.556 53.772 36.349 1.00 45.32 C ATOM 252 CD LYS A 69 16.359 54.962 36.871 1.00 51.18 C ATOM 253 CE LYS A 69 17.796 54.939 36.343 1.00 56.14 C ATOM 254 NZ LYS A 69 18.606 56.101 36.817 1.00 58.78 N ATOM 255 HA LYS A 69 14.658 54.380 38.862 1.00 0.00 H ATOM 256 HB2 LYS A 69 13.587 52.942 36.415 1.00 0.00 H ATOM 257 HB3 LYS A 69 13.648 54.714 36.561 1.00 0.00 H ATOM 258 HG2 LYS A 69 16.042 52.851 36.671 1.00 0.00 H ATOM 259 HG3 LYS A 69 15.538 53.810 35.260 1.00 0.00 H ATOM 260 HD2 LYS A 69 15.877 55.885 36.549 1.00 0.00 H ATOM 261 HD3 LYS A 69 16.380 54.926 37.960 1.00 0.00 H ATOM 262 HE2 LYS A 69 17.767 54.956 35.254 1.00 0.00 H ATOM 263 HE3 LYS A 69 18.276 54.020 36.679 1.00 0.00 H ATOM 264 HZ1 LYS A 69 18.163 56.985 36.495 1.00 0.00 H ATOM 265 HZ2 LYS A 69 18.649 56.091 37.856 1.00 0.00 H ATOM 266 HZ3 LYS A 69 19.568 56.033 36.429 1.00 0.00 H ATOM 267 H LYS A 69 14.486 51.559 38.139 1.00 0.00 H ATOM 268 N ALA A 70 11.749 52.928 38.924 1.00 25.79 N ATOM 269 CA ALA A 70 10.370 53.121 39.341 1.00 25.00 C ATOM 270 C ALA A 70 10.405 53.600 40.787 1.00 25.71 C ATOM 271 O ALA A 70 9.680 54.519 41.163 1.00 25.43 O ATOM 272 CB ALA A 70 9.605 51.812 39.239 1.00 23.83 C ATOM 273 HA ALA A 70 9.868 53.849 38.704 1.00 0.00 H ATOM 274 HB1 ALA A 70 9.621 51.463 38.207 1.00 0.00 H ATOM 275 HB2 ALA A 70 10.073 51.068 39.883 1.00 0.00 H ATOM 276 HB3 ALA A 70 8.574 51.970 39.554 1.00 0.00 H ATOM 277 H ALA A 70 12.097 51.970 38.719 1.00 0.00 H ATOM 278 N GLU A 71 11.265 52.974 41.586 1.00 26.90 N ATOM 279 CA GLU A 71 11.411 53.339 42.989 1.00 30.06 C ATOM 280 C GLU A 71 11.942 54.765 43.134 1.00 31.93 C ATOM 281 O GLU A 71 11.473 55.518 43.987 1.00 30.50 O ATOM 282 CB GLU A 71 12.347 52.363 43.715 1.00 31.28 C ATOM 283 CG GLU A 71 11.834 50.926 43.796 1.00 37.55 C ATOM 284 CD GLU A 71 12.720 50.030 44.659 1.00 40.43 C ATOM 285 OE1 GLU A 71 13.944 49.986 44.428 1.00 42.88 O ATOM 286 OE2 GLU A 71 12.197 49.362 45.570 1.00 42.73 O ATOM 287 HA GLU A 71 10.422 53.285 43.445 1.00 0.00 H ATOM 288 HB2 GLU A 71 13.302 52.354 43.189 1.00 0.00 H ATOM 289 HB3 GLU A 71 12.497 52.728 44.731 1.00 0.00 H ATOM 290 HG2 GLU A 71 10.830 50.937 44.221 1.00 0.00 H ATOM 291 HG3 GLU A 71 11.796 50.512 42.788 1.00 0.00 H ATOM 292 H GLU A 71 11.848 52.204 41.199 1.00 0.00 H ATOM 293 N GLU A 72 12.902 55.141 42.292 1.00 34.31 N ATOM 294 CA GLU A 72 13.481 56.477 42.351 1.00 36.90 C ATOM 295 C GLU A 72 12.448 57.522 41.970 1.00 35.74 C ATOM 296 O GLU A 72 12.380 58.591 42.571 1.00 34.41 O ATOM 297 CB GLU A 72 14.674 56.580 41.404 1.00 43.83 C ATOM 298 CG GLU A 72 15.831 55.647 41.735 1.00 55.59 C ATOM 299 CD GLU A 72 17.009 55.828 40.786 1.00 61.89 C ATOM 300 OE1 GLU A 72 17.975 55.038 40.873 1.00 63.90 O ATOM 301 OE2 GLU A 72 16.969 56.762 39.953 1.00 64.09 O ATOM 302 HA GLU A 72 13.813 56.657 43.373 1.00 0.00 H ATOM 303 HB2 GLU A 72 14.329 56.349 40.396 1.00 0.00 H ATOM 304 HB3 GLU A 72 15.044 57.605 41.434 1.00 0.00 H ATOM 305 HG2 GLU A 72 16.166 55.850 42.752 1.00 0.00 H ATOM 306 HG3 GLU A 72 15.481 54.617 41.668 1.00 0.00 H ATOM 307 H GLU A 72 13.246 54.468 41.578 1.00 0.00 H ATOM 308 N MET A 73 11.638 57.208 40.967 1.00 33.51 N ATOM 309 CA MET A 73 10.615 58.131 40.510 1.00 32.77 C ATOM 310 C MET A 73 9.491 58.275 41.531 1.00 30.53 C ATOM 311 O MET A 73 9.088 59.389 41.866 1.00 32.54 O ATOM 312 CB MET A 73 10.066 57.652 39.159 1.00 35.26 C ATOM 313 CG MET A 73 9.043 58.571 38.509 1.00 40.77 C ATOM 314 SD MET A 73 7.368 58.383 39.150 1.00 46.13 S ATOM 315 CE MET A 73 6.513 59.726 38.293 1.00 46.45 C ATOM 316 HA MET A 73 11.065 59.116 40.390 1.00 0.00 H ATOM 317 HB2 MET A 73 10.906 57.545 38.473 1.00 0.00 H ATOM 318 HB3 MET A 73 9.597 56.680 39.312 1.00 0.00 H ATOM 319 HG2 MET A 73 9.026 58.361 37.439 1.00 0.00 H ATOM 320 HG3 MET A 73 9.358 59.602 38.671 1.00 0.00 H ATOM 321 HE1 MET A 73 6.975 60.677 38.558 1.00 0.00 H ATOM 322 HE2 MET A 73 6.586 59.573 37.216 1.00 0.00 H ATOM 323 HE3 MET A 73 5.464 59.735 38.590 1.00 0.00 H ATOM 324 H MET A 73 11.738 56.284 40.500 1.00 0.00 H ATOM 325 N LEU A 74 8.993 57.150 42.033 1.00 29.08 N ATOM 326 CA LEU A 74 7.897 57.168 42.997 1.00 28.26 C ATOM 327 C LEU A 74 8.298 57.712 44.368 1.00 28.35 C ATOM 328 O LEU A 74 7.459 58.247 45.087 1.00 27.92 O ATOM 329 CB LEU A 74 7.285 55.765 43.133 1.00 25.38 C ATOM 330 CG LEU A 74 6.472 55.264 41.931 1.00 26.43 C ATOM 331 CD1 LEU A 74 6.014 53.830 42.179 1.00 25.77 C ATOM 332 CD2 LEU A 74 5.262 56.169 41.710 1.00 24.83 C ATOM 333 HA LEU A 74 7.151 57.858 42.603 1.00 0.00 H ATOM 334 HB2 LEU A 74 8.100 55.061 43.301 1.00 0.00 H ATOM 335 HB3 LEU A 74 6.627 55.771 44.002 1.00 0.00 H ATOM 336 HG LEU A 74 7.099 55.287 41.040 1.00 0.00 H ATOM 337 HD21 LEU A 74 4.634 56.157 42.601 1.00 0.00 H ATOM 338 HD22 LEU A 74 5.601 57.187 41.517 1.00 0.00 H ATOM 339 HD23 LEU A 74 4.690 55.807 40.855 1.00 0.00 H ATOM 340 HD11 LEU A 74 6.886 53.190 42.317 1.00 0.00 H ATOM 341 HD12 LEU A 74 5.393 53.798 43.074 1.00 0.00 H ATOM 342 HD13 LEU A 74 5.438 53.481 41.322 1.00 0.00 H ATOM 343 H LEU A 74 9.392 56.238 41.733 1.00 0.00 H ATOM 344 N SER A 75 9.571 57.591 44.728 1.00 31.65 N ATOM 345 CA SER A 75 10.038 58.100 46.018 1.00 35.66 C ATOM 346 C SER A 75 9.911 59.619 46.072 1.00 35.19 C ATOM 347 O SER A 75 9.814 60.204 47.149 1.00 33.92 O ATOM 348 CB SER A 75 11.500 57.714 46.249 1.00 39.25 C ATOM 349 OG SER A 75 11.636 56.329 46.506 1.00 47.03 O ATOM 350 HA SER A 75 9.418 57.657 46.797 1.00 0.00 H ATOM 351 HB2 SER A 75 11.883 58.272 47.103 1.00 0.00 H ATOM 352 HB3 SER A 75 12.078 57.968 45.361 1.00 0.00 H ATOM 353 HG SER A 75 11.294 55.816 45.731 1.00 0.00 H ATOM 354 H SER A 75 10.245 57.128 44.085 1.00 0.00 H ATOM 355 N LYS A 76 9.910 60.244 44.898 1.00 34.37 N ATOM 356 CA LYS A 76 9.807 61.696 44.782 1.00 34.75 C ATOM 357 C LYS A 76 8.366 62.191 44.823 1.00 33.79 C ATOM 358 O LYS A 76 8.120 63.394 44.949 1.00 34.53 O ATOM 359 CB LYS A 76 10.445 62.170 43.471 1.00 36.83 C ATOM 360 CG LYS A 76 11.877 61.727 43.259 1.00 39.46 C ATOM 361 CD LYS A 76 12.341 62.098 41.855 1.00 40.73 C ATOM 362 CE LYS A 76 13.745 61.589 41.579 1.00 42.41 C ATOM 363 NZ LYS A 76 14.163 61.877 40.177 1.00 44.56 N ATOM 364 HA LYS A 76 10.334 62.110 45.642 1.00 0.00 H ATOM 365 HB2 LYS A 76 9.846 61.786 42.645 1.00 0.00 H ATOM 366 HB3 LYS A 76 10.423 63.260 43.458 1.00 0.00 H ATOM 367 HG2 LYS A 76 12.518 62.217 43.992 1.00 0.00 H ATOM 368 HG3 LYS A 76 11.942 60.646 43.386 1.00 0.00 H ATOM 369 HD2 LYS A 76 11.656 61.661 41.128 1.00 0.00 H ATOM 370 HD3 LYS A 76 12.331 63.183 41.754 1.00 0.00 H ATOM 371 HE2 LYS A 76 13.770 60.512 41.743 1.00 0.00 H ATOM 372 HE3 LYS A 76 14.440 62.076 42.263 1.00 0.00 H ATOM 373 HZ1 LYS A 76 13.507 61.411 39.518 1.00 0.00 H ATOM 374 HZ2 LYS A 76 14.146 62.904 40.016 1.00 0.00 H ATOM 375 HZ3 LYS A 76 15.126 61.516 40.023 1.00 0.00 H ATOM 376 H LYS A 76 9.985 59.677 44.029 1.00 0.00 H ATOM 377 N GLN A 77 7.414 61.272 44.710 1.00 30.61 N ATOM 378 CA GLN A 77 6.008 61.649 44.724 1.00 28.81 C ATOM 379 C GLN A 77 5.591 62.164 46.090 1.00 28.91 C ATOM 380 O GLN A 77 6.141 61.758 47.111 1.00 27.05 O ATOM 381 CB GLN A 77 5.128 60.464 44.311 1.00 27.57 C ATOM 382 CG GLN A 77 5.125 60.177 42.815 1.00 26.97 C ATOM 383 CD GLN A 77 4.427 61.262 42.011 1.00 25.96 C ATOM 384 OE1 GLN A 77 3.241 61.520 42.200 1.00 25.15 O ATOM 385 NE2 GLN A 77 5.162 61.898 41.105 1.00 26.86 N ATOM 386 HA GLN A 77 5.872 62.455 44.002 1.00 0.00 H ATOM 387 HB2 GLN A 77 5.487 59.575 44.829 1.00 0.00 H ATOM 388 HB3 GLN A 77 4.104 60.674 44.621 1.00 0.00 H ATOM 389 HG2 GLN A 77 6.157 60.098 42.473 1.00 0.00 H ATOM 390 HG3 GLN A 77 4.613 59.230 42.642 1.00 0.00 H ATOM 391 HE22 GLN A 77 6.163 61.647 40.978 1.00 0.00 H ATOM 392 HE21 GLN A 77 4.736 62.647 40.522 1.00 0.00 H ATOM 393 H GLN A 77 7.676 60.271 44.610 1.00 0.00 H ATOM 394 N ARG A 78 4.606 63.058 46.098 1.00 30.59 N ATOM 395 CA ARG A 78 4.116 63.662 47.336 1.00 32.53 C ATOM 396 C ARG A 78 3.160 62.823 48.175 1.00 32.71 C ATOM 397 O ARG A 78 3.180 62.905 49.408 1.00 32.52 O ATOM 398 CB ARG A 78 3.425 64.998 47.034 1.00 35.54 C ATOM 399 CG ARG A 78 4.362 66.146 46.687 1.00 40.17 C ATOM 400 CD ARG A 78 3.605 67.473 46.672 1.00 43.23 C ATOM 401 NE ARG A 78 2.718 67.621 45.518 1.00 46.09 N ATOM 402 CZ ARG A 78 3.141 67.863 44.280 1.00 49.34 C ATOM 403 NH1 ARG A 78 2.268 67.985 43.287 1.00 51.24 N ATOM 404 NH2 ARG A 78 4.439 67.983 44.031 1.00 50.06 N ATOM 405 HA ARG A 78 5.019 63.775 47.936 1.00 0.00 H ATOM 406 HB2 ARG A 78 2.750 64.846 46.192 1.00 0.00 H ATOM 407 HB3 ARG A 78 2.848 65.286 47.913 1.00 0.00 H ATOM 408 HG2 ARG A 78 5.158 66.196 47.430 1.00 0.00 H ATOM 409 HG3 ARG A 78 4.796 65.970 45.703 1.00 0.00 H ATOM 410 HD2 ARG A 78 4.331 68.286 46.657 1.00 0.00 H ATOM 411 HD3 ARG A 78 3.006 67.540 47.580 1.00 0.00 H ATOM 412 HE ARG A 78 1.694 67.532 45.675 1.00 0.00 H ATOM 413 HH12 ARG A 78 2.603 68.174 42.321 1.00 0.00 H ATOM 414 HH11 ARG A 78 1.250 67.891 43.476 1.00 0.00 H ATOM 415 HH22 ARG A 78 4.767 68.172 43.063 1.00 0.00 H ATOM 416 HH21 ARG A 78 5.128 67.888 44.804 1.00 0.00 H ATOM 417 H ARG A 78 4.171 63.336 45.195 1.00 0.00 H ATOM 418 N HIS A 79 2.330 62.017 47.521 1.00 30.69 N ATOM 419 CA HIS A 79 1.335 61.243 48.244 1.00 30.82 C ATOM 420 C HIS A 79 1.412 59.726 48.162 1.00 31.33 C ATOM 421 O HIS A 79 1.737 59.153 47.117 1.00 30.83 O ATOM 422 CB HIS A 79 -0.055 61.695 47.801 1.00 31.67 C ATOM 423 CG HIS A 79 -0.275 63.171 47.931 1.00 35.46 C ATOM 424 ND1 HIS A 79 -0.214 63.830 49.141 1.00 35.69 N ATOM 425 CD2 HIS A 79 -0.545 64.117 47.001 1.00 35.58 C ATOM 426 CE1 HIS A 79 -0.436 65.118 48.950 1.00 34.49 C ATOM 427 NE2 HIS A 79 -0.639 65.319 47.661 1.00 36.34 N ATOM 428 HA HIS A 79 1.553 61.453 49.291 1.00 0.00 H ATOM 429 HB2 HIS A 79 -0.192 61.417 46.756 1.00 0.00 H ATOM 430 HB3 HIS A 79 -0.796 61.181 48.413 1.00 0.00 H ATOM 431 HD2 HIS A 79 -0.665 63.956 45.930 1.00 0.00 H ATOM 432 HE1 HIS A 79 -0.449 65.885 49.725 1.00 0.00 H ATOM 433 H HIS A 79 2.393 61.940 46.486 1.00 0.00 H ATOM 434 N ASP A 80 1.093 59.086 49.284 1.00 29.97 N ATOM 435 CA ASP A 80 1.092 57.632 49.369 1.00 28.25 C ATOM 436 C ASP A 80 0.021 57.145 48.415 1.00 27.01 C ATOM 437 O ASP A 80 -1.044 57.755 48.302 1.00 27.28 O ATOM 438 CB ASP A 80 0.764 57.163 50.790 1.00 27.88 C ATOM 439 CG ASP A 80 1.763 57.652 51.815 1.00 28.93 C ATOM 440 OD1 ASP A 80 2.967 57.738 51.493 1.00 29.80 O ATOM 441 OD2 ASP A 80 1.347 57.929 52.959 1.00 32.57 O ATOM 442 HA ASP A 80 2.075 57.236 49.113 1.00 0.00 H ATOM 443 HB2 ASP A 80 -0.224 57.536 51.061 1.00 0.00 H ATOM 444 HB3 ASP A 80 0.756 56.073 50.804 1.00 0.00 H ATOM 445 H ASP A 80 0.837 59.641 50.126 1.00 0.00 H ATOM 446 N GLY A 81 0.294 56.043 47.726 1.00 25.49 N ATOM 447 CA GLY A 81 -0.679 55.539 46.780 1.00 25.59 C ATOM 448 C GLY A 81 -0.283 55.892 45.358 1.00 25.41 C ATOM 449 O GLY A 81 -0.790 55.291 44.410 1.00 25.78 O ATOM 450 HA3 GLY A 81 -1.652 55.978 47.000 1.00 0.00 H ATOM 451 HA2 GLY A 81 -0.742 54.455 46.875 1.00 0.00 H ATOM 452 H GLY A 81 1.198 55.547 47.865 1.00 0.00 H ATOM 453 N ALA A 82 0.607 56.876 45.203 1.00 24.22 N ATOM 454 CA ALA A 82 1.084 57.272 43.872 1.00 25.52 C ATOM 455 C ALA A 82 1.654 55.993 43.275 1.00 24.30 C ATOM 456 O ALA A 82 2.438 55.306 43.923 1.00 25.38 O ATOM 457 CB ALA A 82 2.168 58.331 43.988 1.00 24.49 C ATOM 458 HA ALA A 82 0.292 57.701 43.259 1.00 0.00 H ATOM 459 HB1 ALA A 82 1.765 59.207 44.496 1.00 0.00 H ATOM 460 HB2 ALA A 82 3.005 57.931 44.560 1.00 0.00 H ATOM 461 HB3 ALA A 82 2.508 58.611 42.991 1.00 0.00 H ATOM 462 H ALA A 82 0.969 57.372 46.042 1.00 0.00 H ATOM 463 N PHE A 83 1.298 55.688 42.032 1.00 24.87 N ATOM 464 CA PHE A 83 1.725 54.426 41.446 1.00 24.90 C ATOM 465 C PHE A 83 1.955 54.451 39.940 1.00 24.96 C ATOM 466 O PHE A 83 1.695 55.435 39.251 1.00 24.45 O ATOM 467 CB PHE A 83 0.637 53.388 41.719 1.00 23.25 C ATOM 468 CG PHE A 83 -0.600 53.603 40.881 1.00 24.00 C ATOM 469 CD1 PHE A 83 -0.807 52.867 39.716 1.00 23.96 C ATOM 470 CD2 PHE A 83 -1.503 54.616 41.199 1.00 24.02 C ATOM 471 CE1 PHE A 83 -1.884 53.136 38.880 1.00 23.06 C ATOM 472 CE2 PHE A 83 -2.585 54.896 40.370 1.00 23.93 C ATOM 473 CZ PHE A 83 -2.776 54.155 39.205 1.00 25.64 C ATOM 474 HA PHE A 83 2.687 54.196 41.904 1.00 0.00 H ATOM 475 HB2 PHE A 83 1.038 52.398 41.502 1.00 0.00 H ATOM 476 HB3 PHE A 83 0.359 53.443 42.771 1.00 0.00 H ATOM 477 HD2 PHE A 83 -1.360 55.197 42.110 1.00 0.00 H ATOM 478 HE2 PHE A 83 -3.281 55.693 40.631 1.00 0.00 H ATOM 479 HZ PHE A 83 -3.620 54.372 38.551 1.00 0.00 H ATOM 480 HE1 PHE A 83 -2.030 52.551 37.972 1.00 0.00 H ATOM 481 HD1 PHE A 83 -0.113 52.068 39.456 1.00 0.00 H ATOM 482 H PHE A 83 0.716 56.349 41.479 1.00 0.00 H ATOM 483 N LEU A 84 2.409 53.311 39.443 1.00 24.56 N ATOM 484 CA LEU A 84 2.637 53.113 38.024 1.00 23.49 C ATOM 485 C LEU A 84 2.644 51.620 37.783 1.00 23.76 C ATOM 486 O LEU A 84 2.899 50.834 38.701 1.00 22.09 O ATOM 487 CB LEU A 84 3.975 53.727 37.598 1.00 24.42 C ATOM 488 CG LEU A 84 5.254 53.212 38.260 1.00 24.09 C ATOM 489 CD1 LEU A 84 5.707 51.901 37.606 1.00 25.91 C ATOM 490 CD2 LEU A 84 6.329 54.263 38.114 1.00 25.03 C ATOM 491 HA LEU A 84 1.857 53.600 37.439 1.00 0.00 H ATOM 492 HB2 LEU A 84 4.078 53.563 36.525 1.00 0.00 H ATOM 493 HB3 LEU A 84 3.917 54.797 37.797 1.00 0.00 H ATOM 494 HG LEU A 84 5.065 53.016 39.315 1.00 0.00 H ATOM 495 HD21 LEU A 84 6.509 54.453 37.056 1.00 0.00 H ATOM 496 HD22 LEU A 84 6.004 55.183 38.599 1.00 0.00 H ATOM 497 HD23 LEU A 84 7.248 53.909 38.582 1.00 0.00 H ATOM 498 HD11 LEU A 84 4.924 51.151 37.717 1.00 0.00 H ATOM 499 HD12 LEU A 84 5.900 52.072 36.547 1.00 0.00 H ATOM 500 HD13 LEU A 84 6.618 51.551 38.091 1.00 0.00 H ATOM 501 H LEU A 84 2.610 52.527 40.095 1.00 0.00 H ATOM 502 N ILE A 85 2.327 51.239 36.551 1.00 22.29 N ATOM 503 CA ILE A 85 2.337 49.851 36.131 1.00 22.05 C ATOM 504 C ILE A 85 3.545 49.777 35.206 1.00 22.73 C ATOM 505 O ILE A 85 3.707 50.624 34.322 1.00 20.97 O ATOM 506 CB ILE A 85 1.056 49.477 35.318 1.00 22.14 C ATOM 507 CG1 ILE A 85 -0.155 49.348 36.250 1.00 22.63 C ATOM 508 CG2 ILE A 85 1.278 48.166 34.562 1.00 23.40 C ATOM 509 CD1 ILE A 85 -0.097 48.146 37.181 1.00 24.16 C ATOM 510 HA ILE A 85 2.371 49.171 36.982 1.00 0.00 H ATOM 511 HB ILE A 85 0.857 50.272 34.600 1.00 0.00 H ATOM 512 HG12 ILE A 85 -0.217 50.250 36.859 1.00 0.00 H ATOM 513 HG13 ILE A 85 -1.052 49.263 35.637 1.00 0.00 H ATOM 514 HD11 ILE A 85 -0.048 47.232 36.589 1.00 0.00 H ATOM 515 HD12 ILE A 85 0.788 48.220 37.813 1.00 0.00 H ATOM 516 HD13 ILE A 85 -0.990 48.128 37.806 1.00 0.00 H ATOM 517 HG21 ILE A 85 2.117 48.281 33.876 1.00 0.00 H ATOM 518 HG22 ILE A 85 1.496 47.370 35.274 1.00 0.00 H ATOM 519 HG23 ILE A 85 0.379 47.916 33.999 1.00 0.00 H ATOM 520 H ILE A 85 2.060 51.967 35.858 1.00 0.00 H ATOM 521 N ARG A 86 4.400 48.784 35.412 1.00 20.74 N ATOM 522 CA ARG A 86 5.575 48.641 34.574 1.00 22.49 C ATOM 523 C ARG A 86 5.662 47.220 34.064 1.00 23.91 C ATOM 524 O ARG A 86 5.091 46.300 34.658 1.00 23.52 O ATOM 525 CB ARG A 86 6.846 48.995 35.360 1.00 23.52 C ATOM 526 CG ARG A 86 7.045 48.187 36.631 1.00 22.67 C ATOM 527 CD ARG A 86 8.277 48.639 37.404 1.00 25.13 C ATOM 528 NE ARG A 86 8.374 47.968 38.697 1.00 26.49 N ATOM 529 CZ ARG A 86 8.864 46.746 38.881 1.00 27.20 C ATOM 530 NH1 ARG A 86 9.323 46.047 37.853 1.00 26.87 N ATOM 531 NH2 ARG A 86 8.864 46.209 40.093 1.00 24.82 N ATOM 532 HA ARG A 86 5.491 49.326 33.730 1.00 0.00 H ATOM 533 HB2 ARG A 86 7.706 48.827 34.711 1.00 0.00 H ATOM 534 HB3 ARG A 86 6.797 50.050 35.631 1.00 0.00 H ATOM 535 HG2 ARG A 86 6.167 48.306 37.266 1.00 0.00 H ATOM 536 HG3 ARG A 86 7.161 47.136 36.366 1.00 0.00 H ATOM 537 HD2 ARG A 86 8.218 49.715 37.567 1.00 0.00 H ATOM 538 HD3 ARG A 86 9.167 48.410 36.818 1.00 0.00 H ATOM 539 HE ARG A 86 8.035 48.483 39.535 1.00 0.00 H ATOM 540 HH12 ARG A 86 9.705 45.091 38.003 1.00 0.00 H ATOM 541 HH11 ARG A 86 9.301 46.454 36.896 1.00 0.00 H ATOM 542 HH22 ARG A 86 9.247 45.253 40.238 1.00 0.00 H ATOM 543 HH21 ARG A 86 8.481 46.744 40.899 1.00 0.00 H ATOM 544 H ARG A 86 4.227 48.104 36.179 1.00 0.00 H ATOM 545 N GLU A 87 6.359 47.046 32.945 1.00 22.24 N ATOM 546 CA GLU A 87 6.541 45.728 32.368 1.00 23.88 C ATOM 547 C GLU A 87 7.786 45.157 33.020 1.00 25.95 C ATOM 548 O GLU A 87 8.865 45.731 32.916 1.00 26.41 O ATOM 549 CB GLU A 87 6.719 45.836 30.854 1.00 22.68 C ATOM 550 CG GLU A 87 5.572 46.570 30.179 1.00 22.40 C ATOM 551 CD GLU A 87 5.577 46.390 28.679 1.00 22.30 C ATOM 552 OE1 GLU A 87 5.318 45.255 28.218 1.00 24.40 O ATOM 553 OE2 GLU A 87 5.849 47.375 27.967 1.00 20.30 O ATOM 554 HA GLU A 87 5.677 45.086 32.541 1.00 0.00 H ATOM 555 HB2 GLU A 87 7.645 46.373 30.649 1.00 0.00 H ATOM 556 HB3 GLU A 87 6.783 44.831 30.438 1.00 0.00 H ATOM 557 HG2 GLU A 87 4.631 46.188 30.575 1.00 0.00 H ATOM 558 HG3 GLU A 87 5.655 47.633 30.405 1.00 0.00 H ATOM 559 H GLU A 87 6.782 47.871 32.474 1.00 0.00 H ATOM 560 N SER A 88 7.616 44.033 33.707 1.00 28.13 N ATOM 561 CA SER A 88 8.705 43.374 34.423 1.00 30.96 C ATOM 562 C SER A 88 9.893 42.995 33.551 1.00 31.20 C ATOM 563 O SER A 88 9.733 42.613 32.396 1.00 31.15 O ATOM 564 CB SER A 88 8.175 42.119 35.122 1.00 32.62 C ATOM 565 OG SER A 88 9.179 41.513 35.922 1.00 38.34 O ATOM 566 HA SER A 88 9.074 44.106 35.142 1.00 0.00 H ATOM 567 HB2 SER A 88 7.842 41.406 34.368 1.00 0.00 H ATOM 568 HB3 SER A 88 7.333 42.394 35.757 1.00 0.00 H ATOM 569 HG SER A 88 9.482 42.155 36.612 1.00 0.00 H ATOM 570 H SER A 88 6.669 43.605 33.736 1.00 0.00 H ATOM 571 N GLU A 89 11.092 43.114 34.105 1.00 32.87 N ATOM 572 CA GLU A 89 12.293 42.746 33.368 1.00 37.23 C ATOM 573 C GLU A 89 12.679 41.333 33.789 1.00 38.38 C ATOM 574 O GLU A 89 13.461 40.662 33.116 1.00 39.00 O ATOM 575 CB GLU A 89 13.440 43.713 33.673 1.00 38.52 C ATOM 576 CG GLU A 89 13.238 45.122 33.113 1.00 43.27 C ATOM 577 CD GLU A 89 14.485 45.995 33.203 1.00 45.20 C ATOM 578 OE1 GLU A 89 14.980 46.231 34.325 1.00 44.54 O ATOM 579 OE2 GLU A 89 14.968 46.451 32.146 1.00 48.13 O ATOM 580 HA GLU A 89 12.099 42.793 32.296 1.00 0.00 H ATOM 581 HB2 GLU A 89 13.546 43.787 34.755 1.00 0.00 H ATOM 582 HB3 GLU A 89 14.356 43.303 33.246 1.00 0.00 H ATOM 583 HG2 GLU A 89 12.949 45.039 32.065 1.00 0.00 H ATOM 584 HG3 GLU A 89 12.437 45.605 33.673 1.00 0.00 H ATOM 585 H GLU A 89 11.176 43.474 35.077 1.00 0.00 H ATOM 586 N SER A 90 12.109 40.881 34.904 1.00 40.75 N ATOM 587 CA SER A 90 12.388 39.545 35.419 1.00 44.51 C ATOM 588 C SER A 90 11.444 38.510 34.813 1.00 47.51 C ATOM 589 O SER A 90 11.804 37.344 34.660 1.00 48.96 O ATOM 590 CB SER A 90 12.275 39.537 36.947 1.00 44.61 C ATOM 591 OG SER A 90 10.954 39.812 37.376 1.00 46.51 O ATOM 592 HA SER A 90 13.406 39.277 35.134 1.00 0.00 H ATOM 593 HB2 SER A 90 12.944 40.295 37.355 1.00 0.00 H ATOM 594 HB3 SER A 90 12.570 38.556 37.318 1.00 0.00 H ATOM 595 HG SER A 90 10.681 40.705 37.048 1.00 0.00 H ATOM 596 H SER A 90 11.448 41.496 35.421 1.00 0.00 H ATOM 597 N ALA A 91 10.239 38.943 34.464 1.00 48.80 N ATOM 598 CA ALA A 91 9.261 38.049 33.865 1.00 51.34 C ATOM 599 C ALA A 91 8.752 38.657 32.557 1.00 51.23 C ATOM 600 O ALA A 91 7.774 39.399 32.551 1.00 52.98 O ATOM 601 CB ALA A 91 8.100 37.826 34.833 1.00 52.23 C ATOM 602 HA ALA A 91 9.728 37.087 33.654 1.00 0.00 H ATOM 603 HB1 ALA A 91 8.477 37.382 35.755 1.00 0.00 H ATOM 604 HB2 ALA A 91 7.626 38.782 35.056 1.00 0.00 H ATOM 605 HB3 ALA A 91 7.372 37.155 34.377 1.00 0.00 H ATOM 606 H ALA A 91 9.990 39.940 34.622 1.00 0.00 H ATOM 607 N PRO A 92 9.431 38.374 31.434 1.00 49.42 N ATOM 608 CA PRO A 92 9.023 38.902 30.129 1.00 45.10 C ATOM 609 C PRO A 92 7.534 38.667 29.895 1.00 38.94 C ATOM 610 O PRO A 92 7.042 37.542 30.009 1.00 31.94 O ATOM 611 CB PRO A 92 9.878 38.103 29.155 1.00 48.07 C ATOM 612 CG PRO A 92 11.132 37.867 29.941 1.00 52.03 C ATOM 613 CD PRO A 92 10.594 37.481 31.295 1.00 51.22 C ATOM 614 HA PRO A 92 9.164 39.978 30.028 1.00 0.00 H ATOM 615 HD3 PRO A 92 10.293 36.434 31.317 1.00 0.00 H ATOM 616 HD2 PRO A 92 11.329 37.663 32.079 1.00 0.00 H ATOM 617 HG3 PRO A 92 11.738 38.771 30.000 1.00 0.00 H ATOM 618 HG2 PRO A 92 11.725 37.062 29.507 1.00 0.00 H ATOM 619 HB2 PRO A 92 9.397 37.162 28.889 1.00 0.00 H ATOM 620 HB3 PRO A 92 10.082 38.674 28.249 1.00 0.00 H ATOM 621 N GLY A 93 6.821 39.732 29.559 1.00 31.93 N ATOM 622 CA GLY A 93 5.398 39.602 29.329 1.00 28.62 C ATOM 623 C GLY A 93 4.569 39.780 30.591 1.00 28.81 C ATOM 624 O GLY A 93 3.341 39.774 30.539 1.00 31.99 O ATOM 625 HA3 GLY A 93 5.202 38.610 28.922 1.00 0.00 H ATOM 626 HA2 GLY A 93 5.093 40.357 28.605 1.00 0.00 H ATOM 627 H GLY A 93 7.283 40.659 29.461 1.00 0.00 H ATOM 628 N ASP A 94 5.236 39.939 31.728 1.00 28.48 N ATOM 629 CA ASP A 94 4.550 40.129 33.005 1.00 29.41 C ATOM 630 C ASP A 94 4.564 41.598 33.447 1.00 27.29 C ATOM 631 O ASP A 94 5.449 42.367 33.060 1.00 24.14 O ATOM 632 CB ASP A 94 5.210 39.270 34.090 1.00 35.51 C ATOM 633 CG ASP A 94 4.748 37.811 34.062 1.00 41.53 C ATOM 634 OD1 ASP A 94 4.359 37.311 32.987 1.00 45.06 O ATOM 635 OD2 ASP A 94 4.789 37.153 35.123 1.00 45.35 O ATOM 636 HA ASP A 94 3.513 39.824 32.865 1.00 0.00 H ATOM 637 HB2 ASP A 94 6.290 39.295 33.944 1.00 0.00 H ATOM 638 HB3 ASP A 94 4.966 39.693 35.064 1.00 0.00 H ATOM 639 H ASP A 94 6.276 39.928 31.710 1.00 0.00 H ATOM 640 N PHE A 95 3.584 41.980 34.266 1.00 25.17 N ATOM 641 CA PHE A 95 3.500 43.349 34.761 1.00 22.07 C ATOM 642 C PHE A 95 3.659 43.439 36.278 1.00 22.63 C ATOM 643 O PHE A 95 3.347 42.501 37.011 1.00 20.31 O ATOM 644 CB PHE A 95 2.158 43.981 34.369 1.00 22.82 C ATOM 645 CG PHE A 95 1.902 43.986 32.889 1.00 22.62 C ATOM 646 CD1 PHE A 95 1.280 42.906 32.278 1.00 23.93 C ATOM 647 CD2 PHE A 95 2.323 45.051 32.099 1.00 22.73 C ATOM 648 CE1 PHE A 95 1.079 42.882 30.894 1.00 24.82 C ATOM 649 CE2 PHE A 95 2.127 45.040 30.708 1.00 21.85 C ATOM 650 CZ PHE A 95 1.505 43.953 30.110 1.00 21.92 C ATOM 651 HA PHE A 95 4.326 43.891 34.300 1.00 0.00 H ATOM 652 HB2 PHE A 95 1.359 43.421 34.855 1.00 0.00 H ATOM 653 HB3 PHE A 95 2.146 45.011 34.724 1.00 0.00 H ATOM 654 HD2 PHE A 95 2.812 45.906 32.566 1.00 0.00 H ATOM 655 HE2 PHE A 95 2.462 45.881 30.101 1.00 0.00 H ATOM 656 HZ PHE A 95 1.350 43.937 29.031 1.00 0.00 H ATOM 657 HE1 PHE A 95 0.590 42.026 30.429 1.00 0.00 H ATOM 658 HD1 PHE A 95 0.944 42.065 32.885 1.00 0.00 H ATOM 659 H PHE A 95 2.865 41.288 34.558 1.00 0.00 H ATOM 660 N SER A 96 4.146 44.587 36.734 1.00 22.64 N ATOM 661 CA SER A 96 4.316 44.846 38.156 1.00 23.30 C ATOM 662 C SER A 96 3.688 46.190 38.488 1.00 22.71 C ATOM 663 O SER A 96 3.644 47.093 37.648 1.00 22.69 O ATOM 664 CB SER A 96 5.797 44.878 38.538 1.00 24.29 C ATOM 665 OG SER A 96 6.371 43.586 38.489 1.00 27.83 O ATOM 666 HA SER A 96 3.833 44.045 38.717 1.00 0.00 H ATOM 667 HB2 SER A 96 5.894 45.271 39.550 1.00 0.00 H ATOM 668 HB3 SER A 96 6.329 45.529 37.844 1.00 0.00 H ATOM 669 HG SER A 96 7.327 43.641 38.741 1.00 0.00 H ATOM 670 H SER A 96 4.415 45.325 36.053 1.00 0.00 H ATOM 671 N LEU A 97 3.210 46.310 39.719 1.00 20.82 N ATOM 672 CA LEU A 97 2.585 47.528 40.204 1.00 21.58 C ATOM 673 C LEU A 97 3.475 48.102 41.301 1.00 21.93 C ATOM 674 O LEU A 97 3.712 47.451 42.321 1.00 23.46 O ATOM 675 CB LEU A 97 1.191 47.207 40.763 1.00 21.02 C ATOM 676 CG LEU A 97 0.445 48.278 41.563 1.00 23.30 C ATOM 677 CD1 LEU A 97 0.135 49.460 40.673 1.00 21.79 C ATOM 678 CD2 LEU A 97 -0.852 47.688 42.113 1.00 24.23 C ATOM 679 HA LEU A 97 2.470 48.251 39.397 1.00 0.00 H ATOM 680 HB2 LEU A 97 0.559 46.945 39.914 1.00 0.00 H ATOM 681 HB3 LEU A 97 1.300 46.340 41.415 1.00 0.00 H ATOM 682 HG LEU A 97 1.070 48.613 42.391 1.00 0.00 H ATOM 683 HD21 LEU A 97 -1.476 47.350 41.285 1.00 0.00 H ATOM 684 HD22 LEU A 97 -0.619 46.844 42.762 1.00 0.00 H ATOM 685 HD23 LEU A 97 -1.384 48.450 42.683 1.00 0.00 H ATOM 686 HD11 LEU A 97 1.066 49.879 40.290 1.00 0.00 H ATOM 687 HD12 LEU A 97 -0.488 49.133 39.840 1.00 0.00 H ATOM 688 HD13 LEU A 97 -0.396 50.218 41.249 1.00 0.00 H ATOM 689 H LEU A 97 3.286 45.498 40.364 1.00 0.00 H ATOM 690 N SER A 98 3.980 49.312 41.079 1.00 21.05 N ATOM 691 CA SER A 98 4.843 49.981 42.046 1.00 22.56 C ATOM 692 C SER A 98 4.054 51.114 42.690 1.00 21.22 C ATOM 693 O SER A 98 3.443 51.924 41.994 1.00 20.55 O ATOM 694 CB SER A 98 6.088 50.517 41.339 1.00 21.99 C ATOM 695 OG SER A 98 6.801 49.448 40.738 1.00 23.24 O ATOM 696 HA SER A 98 5.167 49.283 42.818 1.00 0.00 H ATOM 697 HB2 SER A 98 6.729 51.016 42.065 1.00 0.00 H ATOM 698 HB3 SER A 98 5.789 51.229 40.570 1.00 0.00 H ATOM 699 HG SER A 98 7.075 48.802 41.436 1.00 0.00 H ATOM 700 H SER A 98 3.752 49.797 40.187 1.00 0.00 H ATOM 701 N VAL A 99 4.078 51.172 44.019 1.00 21.96 N ATOM 702 CA VAL A 99 3.311 52.168 44.757 1.00 23.47 C ATOM 703 C VAL A 99 4.103 52.833 45.884 1.00 23.65 C ATOM 704 O VAL A 99 4.841 52.170 46.611 1.00 23.21 O ATOM 705 CB VAL A 99 2.059 51.506 45.404 1.00 22.64 C ATOM 706 CG1 VAL A 99 1.132 52.574 45.959 1.00 23.41 C ATOM 707 CG2 VAL A 99 1.337 50.613 44.388 1.00 22.77 C ATOM 708 HA VAL A 99 3.040 52.930 44.026 1.00 0.00 H ATOM 709 HB VAL A 99 2.380 50.873 46.231 1.00 0.00 H ATOM 710 HG11 VAL A 99 1.661 53.155 46.714 1.00 0.00 H ATOM 711 HG12 VAL A 99 0.812 53.232 45.151 1.00 0.00 H ATOM 712 HG13 VAL A 99 0.260 52.099 46.409 1.00 0.00 H ATOM 713 HG21 VAL A 99 1.019 51.216 43.537 1.00 0.00 H ATOM 714 HG22 VAL A 99 2.015 49.831 44.047 1.00 0.00 H ATOM 715 HG23 VAL A 99 0.465 50.160 44.860 1.00 0.00 H ATOM 716 H VAL A 99 4.659 50.489 44.545 1.00 0.00 H ATOM 717 N LYS A 100 3.939 54.142 46.037 1.00 24.03 N ATOM 718 CA LYS A 100 4.625 54.845 47.111 1.00 25.11 C ATOM 719 C LYS A 100 3.865 54.708 48.428 1.00 23.97 C ATOM 720 O LYS A 100 2.638 54.792 48.466 1.00 21.79 O ATOM 721 CB LYS A 100 4.755 56.340 46.802 1.00 27.97 C ATOM 722 CG LYS A 100 5.357 57.144 47.959 1.00 29.71 C ATOM 723 CD LYS A 100 4.986 58.613 47.885 1.00 32.36 C ATOM 724 CE LYS A 100 5.286 59.327 49.196 1.00 33.01 C ATOM 725 NZ LYS A 100 6.739 59.396 49.497 1.00 36.04 N ATOM 726 HA LYS A 100 5.614 54.394 47.197 1.00 0.00 H ATOM 727 HB2 LYS A 100 5.394 56.459 45.927 1.00 0.00 H ATOM 728 HB3 LYS A 100 3.764 56.736 46.583 1.00 0.00 H ATOM 729 HG2 LYS A 100 4.990 56.735 48.900 1.00 0.00 H ATOM 730 HG3 LYS A 100 6.443 57.053 47.924 1.00 0.00 H ATOM 731 HD2 LYS A 100 5.558 59.084 47.085 1.00 0.00 H ATOM 732 HD3 LYS A 100 3.921 58.700 47.669 1.00 0.00 H ATOM 733 HE2 LYS A 100 4.788 58.793 50.005 1.00 0.00 H ATOM 734 HE3 LYS A 100 4.894 60.342 49.137 1.00 0.00 H ATOM 735 HZ1 LYS A 100 7.124 58.432 49.565 1.00 0.00 H ATOM 736 HZ2 LYS A 100 7.225 59.912 48.736 1.00 0.00 H ATOM 737 HZ3 LYS A 100 6.882 59.892 50.400 1.00 0.00 H ATOM 738 H LYS A 100 3.319 54.666 45.387 1.00 0.00 H ATOM 739 N PHE A 101 4.603 54.487 49.507 1.00 24.72 N ATOM 740 CA PHE A 101 4.010 54.422 50.832 1.00 26.23 C ATOM 741 C PHE A 101 5.074 54.860 51.828 1.00 26.87 C ATOM 742 O PHE A 101 6.031 54.132 52.092 1.00 26.93 O ATOM 743 CB PHE A 101 3.516 53.016 51.189 1.00 25.03 C ATOM 744 CG PHE A 101 2.817 52.964 52.517 1.00 26.48 C ATOM 745 CD1 PHE A 101 3.412 52.352 53.617 1.00 27.06 C ATOM 746 CD2 PHE A 101 1.596 53.608 52.691 1.00 25.98 C ATOM 747 CE1 PHE A 101 2.797 52.390 54.873 1.00 28.80 C ATOM 748 CE2 PHE A 101 0.977 53.651 53.940 1.00 27.72 C ATOM 749 CZ PHE A 101 1.581 53.042 55.031 1.00 26.83 C ATOM 750 HA PHE A 101 3.136 55.073 50.859 1.00 0.00 H ATOM 751 HB2 PHE A 101 2.822 52.684 50.417 1.00 0.00 H ATOM 752 HB3 PHE A 101 4.373 52.343 51.220 1.00 0.00 H ATOM 753 HD2 PHE A 101 1.116 54.087 51.838 1.00 0.00 H ATOM 754 HE2 PHE A 101 0.021 54.162 54.059 1.00 0.00 H ATOM 755 HZ PHE A 101 1.102 53.075 56.010 1.00 0.00 H ATOM 756 HE1 PHE A 101 3.272 51.908 55.727 1.00 0.00 H ATOM 757 HD1 PHE A 101 4.366 51.838 53.498 1.00 0.00 H ATOM 758 H PHE A 101 5.630 54.357 49.403 1.00 0.00 H ATOM 759 N GLY A 102 4.910 56.059 52.374 1.00 29.66 N ATOM 760 CA GLY A 102 5.894 56.563 53.315 1.00 31.66 C ATOM 761 C GLY A 102 7.219 56.755 52.604 1.00 33.84 C ATOM 762 O GLY A 102 7.254 57.279 51.491 1.00 34.16 O ATOM 763 HA3 GLY A 102 6.018 55.849 54.129 1.00 0.00 H ATOM 764 HA2 GLY A 102 5.556 57.517 53.719 1.00 0.00 H ATOM 765 H GLY A 102 4.080 56.635 52.129 1.00 0.00 H ATOM 766 N ASN A 103 8.310 56.323 53.228 1.00 37.93 N ATOM 767 CA ASN A 103 9.624 56.469 52.622 1.00 42.64 C ATOM 768 C ASN A 103 10.045 55.197 51.888 1.00 39.57 C ATOM 769 O ASN A 103 11.229 54.959 51.664 1.00 34.42 O ATOM 770 CB ASN A 103 10.662 56.830 53.687 1.00 54.28 C ATOM 771 CG ASN A 103 11.951 57.358 53.085 1.00 68.14 C ATOM 772 OD1 ASN A 103 11.944 58.336 52.336 1.00 74.99 O ATOM 773 ND2 ASN A 103 13.065 56.713 53.412 1.00 75.11 N ATOM 774 HA ASN A 103 9.566 57.275 51.891 1.00 0.00 H ATOM 775 HB2 ASN A 103 10.242 57.595 54.340 1.00 0.00 H ATOM 776 HB3 ASN A 103 10.888 55.938 54.272 1.00 0.00 H ATOM 777 HD22 ASN A 103 13.023 55.892 54.048 1.00 0.00 H ATOM 778 HD21 ASN A 103 13.980 57.029 53.032 1.00 0.00 H ATOM 779 H ASN A 103 8.223 55.874 54.162 1.00 0.00 H ATOM 780 N ASP A 104 9.065 54.380 51.514 1.00 38.21 N ATOM 781 CA ASP A 104 9.334 53.142 50.787 1.00 36.47 C ATOM 782 C ASP A 104 8.525 53.124 49.505 1.00 31.65 C ATOM 783 O ASP A 104 7.693 53.990 49.272 1.00 28.64 O ATOM 784 CB ASP A 104 8.919 51.917 51.608 1.00 44.07 C ATOM 785 CG ASP A 104 9.743 51.740 52.864 1.00 53.86 C ATOM 786 OD1 ASP A 104 9.375 50.875 53.689 1.00 58.74 O ATOM 787 OD2 ASP A 104 10.755 52.451 53.028 1.00 58.14 O ATOM 788 HA ASP A 104 10.404 53.103 50.584 1.00 0.00 H ATOM 789 HB2 ASP A 104 7.872 52.027 51.892 1.00 0.00 H ATOM 790 HB3 ASP A 104 9.035 51.028 50.988 1.00 0.00 H ATOM 791 H ASP A 104 8.082 54.629 51.745 1.00 0.00 H ATOM 792 N VAL A 105 8.794 52.126 48.676 1.00 27.22 N ATOM 793 CA VAL A 105 8.049 51.915 47.450 1.00 26.53 C ATOM 794 C VAL A 105 7.747 50.428 47.473 1.00 25.66 C ATOM 795 O VAL A 105 8.654 49.596 47.557 1.00 27.67 O ATOM 796 CB VAL A 105 8.856 52.275 46.190 1.00 24.29 C ATOM 797 CG1 VAL A 105 8.088 51.831 44.939 1.00 24.58 C ATOM 798 CG2 VAL A 105 9.071 53.780 46.132 1.00 23.91 C ATOM 799 HA VAL A 105 7.163 52.549 47.406 1.00 0.00 H ATOM 800 HB VAL A 105 9.820 51.767 46.228 1.00 0.00 H ATOM 801 HG11 VAL A 105 7.933 50.753 44.973 1.00 0.00 H ATOM 802 HG12 VAL A 105 7.123 52.337 44.908 1.00 0.00 H ATOM 803 HG13 VAL A 105 8.664 52.088 44.050 1.00 0.00 H ATOM 804 HG21 VAL A 105 8.104 54.283 46.099 1.00 0.00 H ATOM 805 HG22 VAL A 105 9.619 54.102 47.017 1.00 0.00 H ATOM 806 HG23 VAL A 105 9.643 54.030 45.238 1.00 0.00 H ATOM 807 H VAL A 105 9.566 51.471 48.913 1.00 0.00 H ATOM 808 N GLN A 106 6.466 50.092 47.452 1.00 25.00 N ATOM 809 CA GLN A 106 6.065 48.699 47.480 1.00 24.36 C ATOM 810 C GLN A 106 5.815 48.205 46.062 1.00 24.57 C ATOM 811 O GLN A 106 5.364 48.963 45.201 1.00 24.37 O ATOM 812 CB GLN A 106 4.813 48.530 48.344 1.00 24.10 C ATOM 813 CG GLN A 106 5.081 48.651 49.849 1.00 27.89 C ATOM 814 CD GLN A 106 3.823 48.501 50.678 1.00 30.95 C ATOM 815 OE1 GLN A 106 2.888 47.798 50.287 1.00 33.75 O ATOM 816 NE2 GLN A 106 3.795 49.147 51.837 1.00 31.89 N ATOM 817 HA GLN A 106 6.865 48.103 47.918 1.00 0.00 H ATOM 818 HB2 GLN A 106 4.092 49.297 48.060 1.00 0.00 H ATOM 819 HB3 GLN A 106 4.390 47.545 48.148 1.00 0.00 H ATOM 820 HG2 GLN A 106 5.787 47.874 50.142 1.00 0.00 H ATOM 821 HG3 GLN A 106 5.517 49.630 50.049 1.00 0.00 H ATOM 822 HE22 GLN A 106 4.606 49.729 52.128 1.00 0.00 H ATOM 823 HE21 GLN A 106 2.962 49.071 52.455 1.00 0.00 H ATOM 824 H GLN A 106 5.740 50.836 47.415 1.00 0.00 H ATOM 825 N HIS A 107 6.119 46.935 45.826 1.00 23.76 N ATOM 826 CA HIS A 107 5.941 46.327 44.511 1.00 24.38 C ATOM 827 C HIS A 107 4.992 45.148 44.603 1.00 25.17 C ATOM 828 O HIS A 107 5.131 44.310 45.490 1.00 25.46 O ATOM 829 CB HIS A 107 7.286 45.832 43.971 1.00 25.22 C ATOM 830 CG HIS A 107 8.309 46.912 43.825 1.00 27.11 C ATOM 831 ND1 HIS A 107 8.183 47.933 42.908 1.00 24.51 N ATOM 832 CD2 HIS A 107 9.459 47.149 44.499 1.00 26.66 C ATOM 833 CE1 HIS A 107 9.213 48.754 43.025 1.00 26.89 C ATOM 834 NE2 HIS A 107 10.000 48.301 43.983 1.00 25.98 N ATOM 835 HA HIS A 107 5.529 47.081 43.840 1.00 0.00 H ATOM 836 HB2 HIS A 107 7.676 45.079 44.656 1.00 0.00 H ATOM 837 HB3 HIS A 107 7.119 45.381 42.993 1.00 0.00 H ATOM 838 HD2 HIS A 107 9.877 46.540 45.301 1.00 0.00 H ATOM 839 HE1 HIS A 107 9.383 49.652 42.431 1.00 0.00 H ATOM 840 H HIS A 107 6.496 46.355 46.602 1.00 0.00 H ATOM 841 N PHE A 108 4.034 45.085 43.684 1.00 22.64 N ATOM 842 CA PHE A 108 3.077 43.990 43.658 1.00 23.45 C ATOM 843 C PHE A 108 3.181 43.313 42.302 1.00 24.72 C ATOM 844 O PHE A 108 3.239 43.987 41.266 1.00 22.47 O ATOM 845 CB PHE A 108 1.648 44.509 43.873 1.00 22.43 C ATOM 846 CG PHE A 108 1.456 45.221 45.179 1.00 24.44 C ATOM 847 CD1 PHE A 108 1.822 46.557 45.319 1.00 23.86 C ATOM 848 CD2 PHE A 108 0.957 44.541 46.287 1.00 24.98 C ATOM 849 CE1 PHE A 108 1.697 47.206 46.545 1.00 25.80 C ATOM 850 CE2 PHE A 108 0.827 45.182 47.522 1.00 24.25 C ATOM 851 CZ PHE A 108 1.198 46.515 47.652 1.00 25.13 C ATOM 852 HA PHE A 108 3.300 43.286 44.460 1.00 0.00 H ATOM 853 HB2 PHE A 108 1.407 45.200 43.065 1.00 0.00 H ATOM 854 HB3 PHE A 108 0.965 43.661 43.839 1.00 0.00 H ATOM 855 HD2 PHE A 108 0.664 43.496 46.190 1.00 0.00 H ATOM 856 HE2 PHE A 108 0.435 44.638 48.381 1.00 0.00 H ATOM 857 HZ PHE A 108 1.100 47.019 48.613 1.00 0.00 H ATOM 858 HE1 PHE A 108 1.988 48.252 46.641 1.00 0.00 H ATOM 859 HD1 PHE A 108 2.211 47.102 44.459 1.00 0.00 H ATOM 860 H PHE A 108 3.967 45.836 42.967 1.00 0.00 H ATOM 861 N LYS A 109 3.241 41.985 42.297 1.00 22.56 N ATOM 862 CA LYS A 109 3.322 41.290 41.025 1.00 26.15 C ATOM 863 C LYS A 109 1.916 41.074 40.490 1.00 25.66 C ATOM 864 O LYS A 109 1.033 40.607 41.211 1.00 27.21 O ATOM 865 CB LYS A 109 4.028 39.940 41.168 1.00 28.75 C ATOM 866 CG LYS A 109 4.315 39.281 39.823 1.00 34.82 C ATOM 867 CD LYS A 109 5.133 38.007 39.972 1.00 41.01 C ATOM 868 CE LYS A 109 5.584 37.496 38.610 1.00 42.23 C ATOM 869 NZ LYS A 109 6.462 38.492 37.927 1.00 43.93 N ATOM 870 HA LYS A 109 3.903 41.901 40.334 1.00 0.00 H ATOM 871 HB2 LYS A 109 4.972 40.094 41.690 1.00 0.00 H ATOM 872 HB3 LYS A 109 3.394 39.275 41.754 1.00 0.00 H ATOM 873 HG2 LYS A 109 3.368 39.037 39.342 1.00 0.00 H ATOM 874 HG3 LYS A 109 4.868 39.983 39.198 1.00 0.00 H ATOM 875 HD2 LYS A 109 6.010 38.214 40.585 1.00 0.00 H ATOM 876 HD3 LYS A 109 4.524 37.244 40.457 1.00 0.00 H ATOM 877 HE2 LYS A 109 4.707 37.310 37.991 1.00 0.00 H ATOM 878 HE3 LYS A 109 6.137 36.566 38.743 1.00 0.00 H ATOM 879 HZ1 LYS A 109 5.938 39.380 37.793 1.00 0.00 H ATOM 880 HZ2 LYS A 109 7.303 38.669 38.512 1.00 0.00 H ATOM 881 HZ3 LYS A 109 6.754 38.118 37.002 1.00 0.00 H ATOM 882 H LYS A 109 3.230 41.452 43.190 1.00 0.00 H ATOM 883 N VAL A 110 1.692 41.450 39.236 1.00 23.56 N ATOM 884 CA VAL A 110 0.383 41.242 38.646 1.00 23.94 C ATOM 885 C VAL A 110 0.376 39.813 38.123 1.00 25.16 C ATOM 886 O VAL A 110 1.138 39.465 37.216 1.00 26.27 O ATOM 887 CB VAL A 110 0.098 42.226 37.492 1.00 23.29 C ATOM 888 CG1 VAL A 110 -1.245 41.892 36.858 1.00 20.51 C ATOM 889 CG2 VAL A 110 0.069 43.665 38.025 1.00 20.42 C ATOM 890 HA VAL A 110 -0.393 41.414 39.392 1.00 0.00 H ATOM 891 HB VAL A 110 0.887 42.137 36.745 1.00 0.00 H ATOM 892 HG11 VAL A 110 -1.219 40.874 36.469 1.00 0.00 H ATOM 893 HG12 VAL A 110 -2.031 41.975 37.609 1.00 0.00 H ATOM 894 HG13 VAL A 110 -1.444 42.588 36.043 1.00 0.00 H ATOM 895 HG21 VAL A 110 -0.714 43.757 38.777 1.00 0.00 H ATOM 896 HG22 VAL A 110 1.034 43.905 38.472 1.00 0.00 H ATOM 897 HG23 VAL A 110 -0.133 44.352 37.203 1.00 0.00 H ATOM 898 H VAL A 110 2.452 41.892 38.680 1.00 0.00 H ATOM 899 N LEU A 111 -0.470 38.988 38.732 1.00 24.88 N ATOM 900 CA LEU A 111 -0.602 37.582 38.370 1.00 26.61 C ATOM 901 C LEU A 111 -1.751 37.388 37.388 1.00 26.19 C ATOM 902 O LEU A 111 -2.601 38.260 37.234 1.00 24.91 O ATOM 903 CB LEU A 111 -0.855 36.751 39.630 1.00 25.72 C ATOM 904 CG LEU A 111 0.130 37.016 40.777 1.00 27.45 C ATOM 905 CD1 LEU A 111 -0.377 36.387 42.064 1.00 27.30 C ATOM 906 CD2 LEU A 111 1.500 36.483 40.404 1.00 26.68 C ATOM 907 HA LEU A 111 0.322 37.254 37.894 1.00 0.00 H ATOM 908 HB2 LEU A 111 -1.861 36.972 39.987 1.00 0.00 H ATOM 909 HB3 LEU A 111 -0.789 35.697 39.361 1.00 0.00 H ATOM 910 HG LEU A 111 0.212 38.090 40.944 1.00 0.00 H ATOM 911 HD21 LEU A 111 1.434 35.410 40.223 1.00 0.00 H ATOM 912 HD22 LEU A 111 1.850 36.984 39.502 1.00 0.00 H ATOM 913 HD23 LEU A 111 2.197 36.673 41.220 1.00 0.00 H ATOM 914 HD11 LEU A 111 -1.346 36.816 42.320 1.00 0.00 H ATOM 915 HD12 LEU A 111 -0.481 35.311 41.925 1.00 0.00 H ATOM 916 HD13 LEU A 111 0.333 36.584 42.867 1.00 0.00 H ATOM 917 H LEU A 111 -1.063 39.362 39.500 1.00 0.00 H ATOM 918 N ARG A 112 -1.758 36.241 36.716 1.00 29.69 N ATOM 919 CA ARG A 112 -2.804 35.910 35.756 1.00 32.18 C ATOM 920 C ARG A 112 -3.257 34.482 36.013 1.00 30.41 C ATOM 921 O ARG A 112 -2.434 33.584 36.170 1.00 31.07 O ATOM 922 CB ARG A 112 -2.288 36.037 34.312 1.00 37.65 C ATOM 923 CG ARG A 112 -2.069 37.470 33.814 1.00 45.80 C ATOM 924 CD ARG A 112 -1.811 37.502 32.296 1.00 51.62 C ATOM 925 NE ARG A 112 -3.008 37.178 31.517 1.00 56.43 N ATOM 926 CZ ARG A 112 -3.007 36.832 30.230 1.00 58.87 C ATOM 927 NH1 ARG A 112 -1.869 36.754 29.553 1.00 61.86 N ATOM 928 NH2 ARG A 112 -4.149 36.561 29.613 1.00 60.36 N ATOM 929 HA ARG A 112 -3.636 36.604 35.878 1.00 0.00 H ATOM 930 HB2 ARG A 112 -1.336 35.509 34.247 1.00 0.00 H ATOM 931 HB3 ARG A 112 -3.013 35.559 33.653 1.00 0.00 H ATOM 932 HG2 ARG A 112 -2.956 38.063 34.036 1.00 0.00 H ATOM 933 HG3 ARG A 112 -1.209 37.898 34.330 1.00 0.00 H ATOM 934 HD2 ARG A 112 -1.032 36.778 32.058 1.00 0.00 H ATOM 935 HD3 ARG A 112 -1.473 38.501 32.019 1.00 0.00 H ATOM 936 HE ARG A 112 -3.926 37.221 32.004 1.00 0.00 H ATOM 937 HH12 ARG A 112 -1.879 36.483 28.549 1.00 0.00 H ATOM 938 HH11 ARG A 112 -0.967 36.964 30.026 1.00 0.00 H ATOM 939 HH22 ARG A 112 -4.146 36.291 28.609 1.00 0.00 H ATOM 940 HH21 ARG A 112 -5.048 36.618 30.133 1.00 0.00 H ATOM 941 H ARG A 112 -0.992 35.557 36.881 1.00 0.00 H ATOM 942 N ASP A 113 -4.563 34.262 36.059 1.00 30.65 N ATOM 943 CA ASP A 113 -5.061 32.923 36.319 1.00 30.17 C ATOM 944 C ASP A 113 -5.158 32.088 35.042 1.00 30.71 C ATOM 945 O ASP A 113 -4.652 32.478 33.979 1.00 28.50 O ATOM 946 CB ASP A 113 -6.415 32.987 37.036 1.00 29.92 C ATOM 947 CG ASP A 113 -7.487 33.634 36.202 1.00 29.46 C ATOM 948 OD1 ASP A 113 -7.342 33.677 34.963 1.00 29.07 O ATOM 949 OD2 ASP A 113 -8.488 34.082 36.785 1.00 30.45 O ATOM 950 HA ASP A 113 -4.342 32.426 36.970 1.00 0.00 H ATOM 951 HB2 ASP A 113 -6.728 31.972 37.280 1.00 0.00 H ATOM 952 HB3 ASP A 113 -6.296 33.560 37.956 1.00 0.00 H ATOM 953 H ASP A 113 -5.229 35.046 35.909 1.00 0.00 H ATOM 954 N GLY A 114 -5.806 30.934 35.158 1.00 30.13 N ATOM 955 CA GLY A 114 -5.938 30.035 34.026 1.00 30.14 C ATOM 956 C GLY A 114 -6.695 30.563 32.825 1.00 28.37 C ATOM 957 O GLY A 114 -6.454 30.124 31.700 1.00 29.01 O ATOM 958 HA3 GLY A 114 -6.452 29.139 34.373 1.00 0.00 H ATOM 959 HA2 GLY A 114 -4.934 29.771 33.694 1.00 0.00 H ATOM 960 H GLY A 114 -6.225 30.671 36.073 1.00 0.00 H ATOM 961 N ALA A 115 -7.614 31.493 33.060 1.00 27.61 N ATOM 962 CA ALA A 115 -8.410 32.078 31.989 1.00 28.50 C ATOM 963 C ALA A 115 -7.739 33.323 31.409 1.00 28.13 C ATOM 964 O ALA A 115 -8.224 33.897 30.432 1.00 29.12 O ATOM 965 CB ALA A 115 -9.800 32.431 32.512 1.00 28.49 C ATOM 966 HA ALA A 115 -8.495 31.341 31.190 1.00 0.00 H ATOM 967 HB1 ALA A 115 -10.291 31.528 32.875 1.00 0.00 H ATOM 968 HB2 ALA A 115 -9.709 33.149 33.327 1.00 0.00 H ATOM 969 HB3 ALA A 115 -10.390 32.868 31.706 1.00 0.00 H ATOM 970 H ALA A 115 -7.770 31.813 34.037 1.00 0.00 H ATOM 971 N GLY A 116 -6.622 33.731 32.010 1.00 26.94 N ATOM 972 CA GLY A 116 -5.911 34.908 31.538 1.00 25.50 C ATOM 973 C GLY A 116 -6.265 36.203 32.262 1.00 25.38 C ATOM 974 O GLY A 116 -5.772 37.273 31.903 1.00 24.41 O ATOM 975 HA3 GLY A 116 -6.136 35.039 30.480 1.00 0.00 H ATOM 976 HA2 GLY A 116 -4.843 34.731 31.662 1.00 0.00 H ATOM 977 H GLY A 116 -6.255 33.201 32.826 1.00 0.00 H ATOM 978 N LYS A 117 -7.123 36.126 33.273 1.00 26.80 N ATOM 979 CA LYS A 117 -7.508 37.322 34.019 1.00 29.89 C ATOM 980 C LYS A 117 -6.367 37.767 34.941 1.00 28.70 C ATOM 981 O LYS A 117 -5.554 36.946 35.359 1.00 30.73 O ATOM 982 CB LYS A 117 -8.779 37.043 34.828 1.00 33.74 C ATOM 983 CG LYS A 117 -9.944 36.583 33.954 1.00 41.60 C ATOM 984 CD LYS A 117 -11.246 36.408 34.725 1.00 44.71 C ATOM 985 CE LYS A 117 -11.850 37.742 35.124 1.00 48.06 C ATOM 986 NZ LYS A 117 -13.250 37.595 35.619 1.00 49.53 N ATOM 987 HA LYS A 117 -7.711 38.129 33.315 1.00 0.00 H ATOM 988 HB2 LYS A 117 -8.563 36.265 35.560 1.00 0.00 H ATOM 989 HB3 LYS A 117 -9.071 37.957 35.346 1.00 0.00 H ATOM 990 HG2 LYS A 117 -10.103 37.324 33.171 1.00 0.00 H ATOM 991 HG3 LYS A 117 -9.680 35.628 33.500 1.00 0.00 H ATOM 992 HD2 LYS A 117 -11.958 35.872 34.098 1.00 0.00 H ATOM 993 HD3 LYS A 117 -11.047 35.827 35.626 1.00 0.00 H ATOM 994 HE2 LYS A 117 -11.850 38.402 34.257 1.00 0.00 H ATOM 995 HE3 LYS A 117 -11.241 38.182 35.914 1.00 0.00 H ATOM 996 HZ1 LYS A 117 -13.840 37.182 34.869 1.00 0.00 H ATOM 997 HZ2 LYS A 117 -13.258 36.972 36.451 1.00 0.00 H ATOM 998 HZ3 LYS A 117 -13.624 38.530 35.880 1.00 0.00 H ATOM 999 H LYS A 117 -7.525 35.204 33.537 1.00 0.00 H ATOM 1000 N TYR A 118 -6.293 39.064 35.232 1.00 26.12 N ATOM 1001 CA TYR A 118 -5.245 39.596 36.107 1.00 25.86 C ATOM 1002 C TYR A 118 -5.733 39.674 37.549 1.00 25.95 C ATOM 1003 O TYR A 118 -6.931 39.779 37.800 1.00 24.40 O ATOM 1004 CB TYR A 118 -4.833 41.017 35.702 1.00 24.38 C ATOM 1005 CG TYR A 118 -4.329 41.184 34.289 1.00 25.66 C ATOM 1006 CD1 TYR A 118 -5.186 41.605 33.269 1.00 25.38 C ATOM 1007 CD2 TYR A 118 -2.986 40.981 33.982 1.00 24.29 C ATOM 1008 CE1 TYR A 118 -4.714 41.830 31.985 1.00 25.73 C ATOM 1009 CE2 TYR A 118 -2.502 41.203 32.698 1.00 25.72 C ATOM 1010 CZ TYR A 118 -3.369 41.631 31.709 1.00 25.45 C ATOM 1011 OH TYR A 118 -2.886 41.894 30.449 1.00 27.15 O ATOM 1012 HA TYR A 118 -4.398 38.917 36.013 1.00 0.00 H ATOM 1013 HB3 TYR A 118 -4.042 41.341 36.379 1.00 0.00 H ATOM 1014 HB2 TYR A 118 -5.702 41.664 35.825 1.00 0.00 H ATOM 1015 HD2 TYR A 118 -2.303 40.642 34.761 1.00 0.00 H ATOM 1016 HE2 TYR A 118 -1.448 41.041 32.472 1.00 0.00 H ATOM 1017 HE1 TYR A 118 -5.394 42.160 31.199 1.00 0.00 H ATOM 1018 HD1 TYR A 118 -6.243 41.759 33.486 1.00 0.00 H ATOM 1019 HH TYR A 118 -3.630 42.188 29.866 1.00 0.00 H ATOM 1020 H TYR A 118 -6.996 39.715 34.828 1.00 0.00 H ATOM 1021 N PHE A 119 -4.797 39.633 38.492 1.00 24.27 N ATOM 1022 CA PHE A 119 -5.152 39.736 39.902 1.00 25.11 C ATOM 1023 C PHE A 119 -3.914 39.913 40.763 1.00 25.01 C ATOM 1024 O PHE A 119 -2.793 39.639 40.330 1.00 25.67 O ATOM 1025 CB PHE A 119 -5.946 38.499 40.357 1.00 23.63 C ATOM 1026 CG PHE A 119 -5.128 37.238 40.446 1.00 24.93 C ATOM 1027 CD1 PHE A 119 -4.530 36.862 41.644 1.00 24.83 C ATOM 1028 CD2 PHE A 119 -4.965 36.419 39.334 1.00 23.21 C ATOM 1029 CE1 PHE A 119 -3.783 35.686 41.732 1.00 25.13 C ATOM 1030 CE2 PHE A 119 -4.222 35.243 39.410 1.00 24.82 C ATOM 1031 CZ PHE A 119 -3.630 34.876 40.613 1.00 25.57 C ATOM 1032 HA PHE A 119 -5.783 40.617 40.023 1.00 0.00 H ATOM 1033 HB2 PHE A 119 -6.365 38.705 41.342 1.00 0.00 H ATOM 1034 HB3 PHE A 119 -6.756 38.332 39.647 1.00 0.00 H ATOM 1035 HD2 PHE A 119 -5.426 36.702 38.388 1.00 0.00 H ATOM 1036 HE2 PHE A 119 -4.105 34.612 38.529 1.00 0.00 H ATOM 1037 HZ PHE A 119 -3.048 33.957 40.678 1.00 0.00 H ATOM 1038 HE1 PHE A 119 -3.320 35.403 42.677 1.00 0.00 H ATOM 1039 HD1 PHE A 119 -4.646 37.493 42.525 1.00 0.00 H ATOM 1040 H PHE A 119 -3.799 39.526 38.220 1.00 0.00 H ATOM 1041 N LEU A 120 -4.130 40.395 41.979 1.00 22.98 N ATOM 1042 CA LEU A 120 -3.052 40.609 42.924 1.00 24.10 C ATOM 1043 C LEU A 120 -3.234 39.652 44.096 1.00 24.65 C ATOM 1044 O LEU A 120 -2.271 39.079 44.605 1.00 25.24 O ATOM 1045 CB LEU A 120 -3.089 42.046 43.457 1.00 23.82 C ATOM 1046 CG LEU A 120 -2.922 43.218 42.488 1.00 25.59 C ATOM 1047 CD1 LEU A 120 -2.904 44.520 43.288 1.00 24.13 C ATOM 1048 CD2 LEU A 120 -1.626 43.066 41.697 1.00 24.83 C ATOM 1049 HA LEU A 120 -2.099 40.435 42.425 1.00 0.00 H ATOM 1050 HB2 LEU A 120 -4.053 42.177 43.948 1.00 0.00 H ATOM 1051 HB3 LEU A 120 -2.292 42.130 44.196 1.00 0.00 H ATOM 1052 HG LEU A 120 -3.753 43.233 41.783 1.00 0.00 H ATOM 1053 HD21 LEU A 120 -0.781 43.048 42.386 1.00 0.00 H ATOM 1054 HD22 LEU A 120 -1.654 42.135 41.131 1.00 0.00 H ATOM 1055 HD23 LEU A 120 -1.520 43.907 41.011 1.00 0.00 H ATOM 1056 HD11 LEU A 120 -3.842 44.622 43.834 1.00 0.00 H ATOM 1057 HD12 LEU A 120 -2.072 44.501 43.992 1.00 0.00 H ATOM 1058 HD13 LEU A 120 -2.785 45.362 42.606 1.00 0.00 H ATOM 1059 H LEU A 120 -5.103 40.627 42.264 1.00 0.00 H ATOM 1060 N TRP A 121 -4.485 39.489 44.508 1.00 24.53 N ATOM 1061 CA TRP A 121 -4.811 38.645 45.646 1.00 26.53 C ATOM 1062 C TRP A 121 -5.865 37.579 45.353 1.00 26.07 C ATOM 1063 O TRP A 121 -5.524 36.426 45.103 1.00 29.09 O ATOM 1064 CB TRP A 121 -5.277 39.529 46.804 1.00 24.11 C ATOM 1065 CG TRP A 121 -4.278 40.592 47.193 1.00 24.51 C ATOM 1066 CD1 TRP A 121 -4.291 41.908 46.828 1.00 23.12 C ATOM 1067 CD2 TRP A 121 -3.114 40.415 48.014 1.00 23.47 C ATOM 1068 NE1 TRP A 121 -3.211 42.563 47.370 1.00 22.94 N ATOM 1069 CE2 TRP A 121 -2.473 41.671 48.105 1.00 24.67 C ATOM 1070 CE3 TRP A 121 -2.555 39.319 48.684 1.00 23.35 C ATOM 1071 CZ2 TRP A 121 -1.296 41.860 48.836 1.00 23.47 C ATOM 1072 CZ3 TRP A 121 -1.383 39.507 49.412 1.00 23.10 C ATOM 1073 CH2 TRP A 121 -0.769 40.770 49.483 1.00 24.74 C ATOM 1074 HA TRP A 121 -3.902 38.101 45.903 1.00 0.00 H ATOM 1075 HB2 TRP A 121 -6.206 40.019 46.512 1.00 0.00 H ATOM 1076 HB3 TRP A 121 -5.460 38.894 47.671 1.00 0.00 H ATOM 1077 HE1 TRP A 121 -2.990 43.571 47.243 1.00 0.00 H ATOM 1078 HD1 TRP A 121 -5.049 42.372 46.197 1.00 0.00 H ATOM 1079 HZ2 TRP A 121 -0.815 42.837 48.890 1.00 0.00 H ATOM 1080 HH2 TRP A 121 0.146 40.886 50.065 1.00 0.00 H ATOM 1081 HZ3 TRP A 121 -0.935 38.662 49.935 1.00 0.00 H ATOM 1082 HE3 TRP A 121 -3.028 38.338 48.636 1.00 0.00 H ATOM 1083 H TRP A 121 -5.252 39.978 44.004 1.00 0.00 H ATOM 1084 N VAL A 122 -7.136 37.970 45.385 1.00 26.81 N ATOM 1085 CA VAL A 122 -8.244 37.046 45.145 1.00 28.53 C ATOM 1086 C VAL A 122 -9.161 37.457 43.994 1.00 28.39 C ATOM 1087 O VAL A 122 -9.479 36.639 43.131 1.00 29.14 O ATOM 1088 CB VAL A 122 -9.116 36.881 46.413 1.00 29.03 C ATOM 1089 CG1 VAL A 122 -10.302 35.971 46.122 1.00 31.12 C ATOM 1090 CG2 VAL A 122 -8.287 36.304 47.538 1.00 29.19 C ATOM 1091 HA VAL A 122 -7.764 36.106 44.873 1.00 0.00 H ATOM 1092 HB VAL A 122 -9.490 37.860 46.712 1.00 0.00 H ATOM 1093 HG11 VAL A 122 -10.907 36.407 45.327 1.00 0.00 H ATOM 1094 HG12 VAL A 122 -9.939 34.992 45.808 1.00 0.00 H ATOM 1095 HG13 VAL A 122 -10.906 35.864 47.023 1.00 0.00 H ATOM 1096 HG21 VAL A 122 -7.899 35.330 47.239 1.00 0.00 H ATOM 1097 HG22 VAL A 122 -7.457 36.976 47.757 1.00 0.00 H ATOM 1098 HG23 VAL A 122 -8.909 36.192 48.426 1.00 0.00 H ATOM 1099 H VAL A 122 -7.349 38.968 45.588 1.00 0.00 H ATOM 1100 N VAL A 123 -9.590 38.716 43.986 1.00 27.97 N ATOM 1101 CA VAL A 123 -10.478 39.212 42.938 1.00 29.25 C ATOM 1102 C VAL A 123 -9.756 39.231 41.588 1.00 29.00 C ATOM 1103 O VAL A 123 -8.594 39.635 41.504 1.00 28.19 O ATOM 1104 CB VAL A 123 -10.993 40.631 43.279 1.00 30.53 C ATOM 1105 CG1 VAL A 123 -11.983 41.102 42.232 1.00 30.60 C ATOM 1106 CG2 VAL A 123 -11.653 40.618 44.649 1.00 32.23 C ATOM 1107 HA VAL A 123 -11.332 38.538 42.874 1.00 0.00 H ATOM 1108 HB VAL A 123 -10.148 41.320 43.290 1.00 0.00 H ATOM 1109 HG11 VAL A 123 -11.495 41.126 41.257 1.00 0.00 H ATOM 1110 HG12 VAL A 123 -12.829 40.416 42.199 1.00 0.00 H ATOM 1111 HG13 VAL A 123 -12.334 42.101 42.489 1.00 0.00 H ATOM 1112 HG21 VAL A 123 -12.490 39.920 44.641 1.00 0.00 H ATOM 1113 HG22 VAL A 123 -10.926 40.306 45.398 1.00 0.00 H ATOM 1114 HG23 VAL A 123 -12.015 41.619 44.886 1.00 0.00 H ATOM 1115 H VAL A 123 -9.286 39.361 44.743 1.00 0.00 H ATOM 1116 N LYS A 124 -10.455 38.787 40.544 1.00 28.36 N ATOM 1117 CA LYS A 124 -9.904 38.719 39.189 1.00 28.13 C ATOM 1118 C LYS A 124 -10.422 39.848 38.295 1.00 28.42 C ATOM 1119 O LYS A 124 -11.575 40.261 38.413 1.00 28.88 O ATOM 1120 CB LYS A 124 -10.264 37.371 38.542 1.00 30.54 C ATOM 1121 CG LYS A 124 -9.934 36.137 39.377 1.00 30.94 C ATOM 1122 CD LYS A 124 -8.446 36.040 39.677 1.00 31.31 C ATOM 1123 CE LYS A 124 -8.106 34.761 40.437 1.00 32.08 C ATOM 1124 NZ LYS A 124 -8.407 33.520 39.658 1.00 32.30 N ATOM 1125 HA LYS A 124 -8.823 38.824 39.280 1.00 0.00 H ATOM 1126 HB2 LYS A 124 -11.336 37.368 38.345 1.00 0.00 H ATOM 1127 HB3 LYS A 124 -9.722 37.295 37.599 1.00 0.00 H ATOM 1128 HG2 LYS A 124 -10.481 36.191 40.318 1.00 0.00 H ATOM 1129 HG3 LYS A 124 -10.243 35.247 38.829 1.00 0.00 H ATOM 1130 HD2 LYS A 124 -7.894 36.050 38.737 1.00 0.00 H ATOM 1131 HD3 LYS A 124 -8.150 36.899 40.280 1.00 0.00 H ATOM 1132 HE2 LYS A 124 -8.685 34.741 41.360 1.00 0.00 H ATOM 1133 HE3 LYS A 124 -7.043 34.771 40.677 1.00 0.00 H ATOM 1134 HZ1 LYS A 124 -9.421 33.493 39.430 1.00 0.00 H ATOM 1135 HZ2 LYS A 124 -7.853 33.522 38.778 1.00 0.00 H ATOM 1136 HZ3 LYS A 124 -8.155 32.686 40.226 1.00 0.00 H ATOM 1137 H LYS A 124 -11.435 38.475 40.698 1.00 0.00 H ATOM 1138 N PHE A 125 -9.567 40.333 37.393 1.00 27.03 N ATOM 1139 CA PHE A 125 -9.938 41.407 36.478 1.00 25.70 C ATOM 1140 C PHE A 125 -9.614 41.025 35.041 1.00 25.22 C ATOM 1141 O PHE A 125 -8.625 40.339 34.774 1.00 26.30 O ATOM 1142 CB PHE A 125 -9.202 42.706 36.836 1.00 24.30 C ATOM 1143 CG PHE A 125 -9.258 43.051 38.300 1.00 25.09 C ATOM 1144 CD1 PHE A 125 -8.264 42.612 39.166 1.00 24.21 C ATOM 1145 CD2 PHE A 125 -10.316 43.792 38.815 1.00 24.08 C ATOM 1146 CE1 PHE A 125 -8.321 42.906 40.526 1.00 25.98 C ATOM 1147 CE2 PHE A 125 -10.383 44.090 40.170 1.00 24.80 C ATOM 1148 CZ PHE A 125 -9.385 43.648 41.027 1.00 23.96 C ATOM 1149 HA PHE A 125 -11.012 41.567 36.573 1.00 0.00 H ATOM 1150 HB2 PHE A 125 -8.156 42.600 36.547 1.00 0.00 H ATOM 1151 HB3 PHE A 125 -9.652 43.523 36.272 1.00 0.00 H ATOM 1152 HD2 PHE A 125 -11.102 44.143 38.147 1.00 0.00 H ATOM 1153 HE2 PHE A 125 -11.219 44.671 40.560 1.00 0.00 H ATOM 1154 HZ PHE A 125 -9.435 43.882 42.090 1.00 0.00 H ATOM 1155 HE1 PHE A 125 -7.535 42.556 41.195 1.00 0.00 H ATOM 1156 HD1 PHE A 125 -7.429 42.030 38.776 1.00 0.00 H ATOM 1157 H PHE A 125 -8.608 39.934 37.341 1.00 0.00 H ATOM 1158 N ASN A 126 -10.453 41.479 34.117 1.00 25.66 N ATOM 1159 CA ASN A 126 -10.266 41.187 32.705 1.00 26.43 C ATOM 1160 C ASN A 126 -9.211 42.087 32.068 1.00 25.99 C ATOM 1161 O ASN A 126 -8.808 41.865 30.929 1.00 26.78 O ATOM 1162 CB ASN A 126 -11.598 41.327 31.958 1.00 27.66 C ATOM 1163 CG ASN A 126 -12.579 40.226 32.313 1.00 29.95 C ATOM 1164 OD1 ASN A 126 -12.231 39.049 32.297 1.00 30.18 O ATOM 1165 ND2 ASN A 126 -13.813 40.604 32.632 1.00 33.77 N ATOM 1166 HA ASN A 126 -9.910 40.160 32.627 1.00 0.00 H ATOM 1167 HB2 ASN A 126 -12.043 42.289 32.213 1.00 0.00 H ATOM 1168 HB3 ASN A 126 -11.404 41.291 30.886 1.00 0.00 H ATOM 1169 HD22 ASN A 126 -14.064 41.613 32.632 1.00 0.00 H ATOM 1170 HD21 ASN A 126 -14.527 39.890 32.881 1.00 0.00 H ATOM 1171 H ASN A 126 -11.265 42.059 34.411 1.00 0.00 H ATOM 1172 N SER A 127 -8.757 43.097 32.802 1.00 25.01 N ATOM 1173 CA SER A 127 -7.743 44.004 32.275 1.00 24.65 C ATOM 1174 C SER A 127 -6.954 44.692 33.381 1.00 24.89 C ATOM 1175 O SER A 127 -7.374 44.709 34.545 1.00 23.39 O ATOM 1176 CB SER A 127 -8.389 45.069 31.381 1.00 24.70 C ATOM 1177 OG SER A 127 -9.193 45.960 32.134 1.00 23.88 O ATOM 1178 HA SER A 127 -7.051 43.397 31.691 1.00 0.00 H ATOM 1179 HB2 SER A 127 -9.011 44.575 30.634 1.00 0.00 H ATOM 1180 HB3 SER A 127 -7.604 45.636 30.881 1.00 0.00 H ATOM 1181 HG SER A 127 -9.912 45.452 32.587 1.00 0.00 H ATOM 1182 H SER A 127 -9.128 43.243 33.762 1.00 0.00 H ATOM 1183 N LEU A 128 -5.802 45.245 33.013 1.00 22.59 N ATOM 1184 CA LEU A 128 -4.967 45.961 33.969 1.00 23.12 C ATOM 1185 C LEU A 128 -5.738 47.219 34.354 1.00 23.20 C ATOM 1186 O LEU A 128 -5.694 47.672 35.496 1.00 23.11 O ATOM 1187 CB LEU A 128 -3.625 46.340 33.322 1.00 19.82 C ATOM 1188 CG LEU A 128 -2.723 45.156 32.930 1.00 20.11 C ATOM 1189 CD1 LEU A 128 -1.685 45.608 31.925 1.00 20.43 C ATOM 1190 CD2 LEU A 128 -2.062 44.567 34.168 1.00 18.12 C ATOM 1191 HA LEU A 128 -4.749 45.346 34.842 1.00 0.00 H ATOM 1192 HB2 LEU A 128 -3.837 46.915 32.420 1.00 0.00 H ATOM 1193 HB3 LEU A 128 -3.075 46.963 34.028 1.00 0.00 H ATOM 1194 HG LEU A 128 -3.332 44.379 32.469 1.00 0.00 H ATOM 1195 HD21 LEU A 128 -1.457 45.332 34.654 1.00 0.00 H ATOM 1196 HD22 LEU A 128 -2.831 44.218 34.857 1.00 0.00 H ATOM 1197 HD23 LEU A 128 -1.427 43.731 33.876 1.00 0.00 H ATOM 1198 HD11 LEU A 128 -2.185 45.989 31.035 1.00 0.00 H ATOM 1199 HD12 LEU A 128 -1.074 46.396 32.365 1.00 0.00 H ATOM 1200 HD13 LEU A 128 -1.052 44.763 31.654 1.00 0.00 H ATOM 1201 H LEU A 128 -5.491 45.165 32.024 1.00 0.00 H ATOM 1202 N ASN A 129 -6.467 47.757 33.384 1.00 23.99 N ATOM 1203 CA ASN A 129 -7.255 48.967 33.572 1.00 24.01 C ATOM 1204 C ASN A 129 -8.261 48.818 34.719 1.00 25.07 C ATOM 1205 O ASN A 129 -8.401 49.719 35.549 1.00 23.95 O ATOM 1206 CB ASN A 129 -7.966 49.301 32.255 1.00 24.97 C ATOM 1207 CG ASN A 129 -8.492 50.725 32.206 1.00 24.33 C ATOM 1208 OD1 ASN A 129 -8.775 51.247 31.128 1.00 26.34 O ATOM 1209 ND2 ASN A 129 -8.637 51.353 33.367 1.00 23.11 N ATOM 1210 HA ASN A 129 -6.589 49.785 33.848 1.00 0.00 H ATOM 1211 HB2 ASN A 129 -7.261 49.163 31.435 1.00 0.00 H ATOM 1212 HB3 ASN A 129 -8.805 48.617 32.130 1.00 0.00 H ATOM 1213 HD22 ASN A 129 -8.385 50.872 34.254 1.00 0.00 H ATOM 1214 HD21 ASN A 129 -9.003 52.326 33.390 1.00 0.00 H ATOM 1215 H ASN A 129 -6.476 47.296 32.452 1.00 0.00 H ATOM 1216 N GLU A 130 -8.945 47.677 34.776 1.00 24.17 N ATOM 1217 CA GLU A 130 -9.933 47.435 35.824 1.00 23.80 C ATOM 1218 C GLU A 130 -9.277 47.115 37.161 1.00 23.55 C ATOM 1219 O GLU A 130 -9.780 47.506 38.220 1.00 21.82 O ATOM 1220 CB GLU A 130 -10.871 46.301 35.400 1.00 23.83 C ATOM 1221 CG GLU A 130 -11.657 46.637 34.137 1.00 26.04 C ATOM 1222 CD GLU A 130 -12.330 45.426 33.527 1.00 27.06 C ATOM 1223 OE1 GLU A 130 -13.499 45.142 33.865 1.00 30.81 O ATOM 1224 OE2 GLU A 130 -11.678 44.746 32.714 1.00 26.15 O ATOM 1225 HA GLU A 130 -10.510 48.350 35.960 1.00 0.00 H ATOM 1226 HB2 GLU A 130 -10.277 45.406 35.215 1.00 0.00 H ATOM 1227 HB3 GLU A 130 -11.575 46.108 36.209 1.00 0.00 H ATOM 1228 HG2 GLU A 130 -12.422 47.372 34.387 1.00 0.00 H ATOM 1229 HG3 GLU A 130 -10.973 47.062 33.403 1.00 0.00 H ATOM 1230 H GLU A 130 -8.772 46.943 34.060 1.00 0.00 H ATOM 1231 N LEU A 131 -8.156 46.401 37.116 1.00 21.67 N ATOM 1232 CA LEU A 131 -7.425 46.070 38.332 1.00 23.56 C ATOM 1233 C LEU A 131 -7.009 47.374 39.003 1.00 22.70 C ATOM 1234 O LEU A 131 -7.202 47.558 40.209 1.00 22.99 O ATOM 1235 CB LEU A 131 -6.182 45.233 37.999 1.00 20.95 C ATOM 1236 CG LEU A 131 -5.291 44.791 39.169 1.00 23.49 C ATOM 1237 CD1 LEU A 131 -4.475 43.564 38.754 1.00 23.56 C ATOM 1238 CD2 LEU A 131 -4.370 45.927 39.590 1.00 21.94 C ATOM 1239 HA LEU A 131 -8.058 45.484 38.998 1.00 0.00 H ATOM 1240 HB2 LEU A 131 -6.522 44.332 37.488 1.00 0.00 H ATOM 1241 HB3 LEU A 131 -5.564 45.822 37.321 1.00 0.00 H ATOM 1242 HG LEU A 131 -5.919 44.529 40.020 1.00 0.00 H ATOM 1243 HD21 LEU A 131 -3.738 46.212 38.749 1.00 0.00 H ATOM 1244 HD22 LEU A 131 -4.969 46.782 39.902 1.00 0.00 H ATOM 1245 HD23 LEU A 131 -3.745 45.598 40.420 1.00 0.00 H ATOM 1246 HD11 LEU A 131 -5.152 42.753 38.485 1.00 0.00 H ATOM 1247 HD12 LEU A 131 -3.851 43.817 37.897 1.00 0.00 H ATOM 1248 HD13 LEU A 131 -3.843 43.251 39.585 1.00 0.00 H ATOM 1249 H LEU A 131 -7.795 46.073 36.197 1.00 0.00 H ATOM 1250 N VAL A 132 -6.438 48.276 38.211 1.00 22.79 N ATOM 1251 CA VAL A 132 -5.989 49.575 38.709 1.00 24.48 C ATOM 1252 C VAL A 132 -7.140 50.406 39.282 1.00 25.71 C ATOM 1253 O VAL A 132 -7.054 50.908 40.408 1.00 26.33 O ATOM 1254 CB VAL A 132 -5.287 50.383 37.587 1.00 25.00 C ATOM 1255 CG1 VAL A 132 -5.082 51.830 38.018 1.00 23.72 C ATOM 1256 CG2 VAL A 132 -3.936 49.746 37.260 1.00 24.91 C ATOM 1257 HA VAL A 132 -5.282 49.371 39.513 1.00 0.00 H ATOM 1258 HB VAL A 132 -5.920 50.370 36.700 1.00 0.00 H ATOM 1259 HG11 VAL A 132 -6.049 52.285 38.230 1.00 0.00 H ATOM 1260 HG12 VAL A 132 -4.462 51.856 38.914 1.00 0.00 H ATOM 1261 HG13 VAL A 132 -4.588 52.380 37.217 1.00 0.00 H ATOM 1262 HG21 VAL A 132 -3.310 49.747 38.152 1.00 0.00 H ATOM 1263 HG22 VAL A 132 -4.091 48.721 36.924 1.00 0.00 H ATOM 1264 HG23 VAL A 132 -3.447 50.318 36.471 1.00 0.00 H ATOM 1265 H VAL A 132 -6.306 48.050 37.204 1.00 0.00 H ATOM 1266 N ASP A 133 -8.217 50.559 38.521 1.00 24.13 N ATOM 1267 CA ASP A 133 -9.341 51.346 39.014 1.00 27.73 C ATOM 1268 C ASP A 133 -9.958 50.767 40.282 1.00 26.78 C ATOM 1269 O ASP A 133 -10.357 51.509 41.173 1.00 27.06 O ATOM 1270 CB ASP A 133 -10.403 51.519 37.923 1.00 27.07 C ATOM 1271 CG ASP A 133 -9.945 52.459 36.821 1.00 28.87 C ATOM 1272 OD1 ASP A 133 -9.059 53.295 37.094 1.00 29.78 O ATOM 1273 OD2 ASP A 133 -10.470 52.376 35.691 1.00 29.23 O ATOM 1274 HA ASP A 133 -8.944 52.326 39.279 1.00 0.00 H ATOM 1275 HB2 ASP A 133 -10.620 50.544 37.486 1.00 0.00 H ATOM 1276 HB3 ASP A 133 -11.309 51.923 38.375 1.00 0.00 H ATOM 1277 H ASP A 133 -8.259 50.120 37.579 1.00 0.00 H ATOM 1278 N TYR A 134 -10.019 49.442 40.372 1.00 27.21 N ATOM 1279 CA TYR A 134 -10.576 48.782 41.551 1.00 27.05 C ATOM 1280 C TYR A 134 -9.798 49.171 42.804 1.00 26.19 C ATOM 1281 O TYR A 134 -10.375 49.441 43.852 1.00 26.87 O ATOM 1282 CB TYR A 134 -10.520 47.260 41.366 1.00 28.36 C ATOM 1283 CG TYR A 134 -10.911 46.439 42.583 1.00 31.58 C ATOM 1284 CD1 TYR A 134 -12.248 46.137 42.851 1.00 33.01 C ATOM 1285 CD2 TYR A 134 -9.937 45.939 43.450 1.00 32.01 C ATOM 1286 CE1 TYR A 134 -12.604 45.355 43.950 1.00 35.40 C ATOM 1287 CE2 TYR A 134 -10.283 45.157 44.553 1.00 34.01 C ATOM 1288 CZ TYR A 134 -11.617 44.869 44.795 1.00 35.29 C ATOM 1289 OH TYR A 134 -11.961 44.097 45.880 1.00 38.45 O ATOM 1290 HA TYR A 134 -11.612 49.101 41.669 1.00 0.00 H ATOM 1291 HB3 TYR A 134 -9.499 46.992 41.093 1.00 0.00 H ATOM 1292 HB2 TYR A 134 -11.194 46.995 40.551 1.00 0.00 H ATOM 1293 HD2 TYR A 134 -8.887 46.164 43.262 1.00 0.00 H ATOM 1294 HE2 TYR A 134 -9.510 44.775 45.219 1.00 0.00 H ATOM 1295 HE1 TYR A 134 -13.652 45.127 44.144 1.00 0.00 H ATOM 1296 HD1 TYR A 134 -13.026 46.519 42.190 1.00 0.00 H ATOM 1297 HH TYR A 134 -12.945 43.988 45.907 1.00 0.00 H ATOM 1298 H TYR A 134 -9.662 48.862 39.586 1.00 0.00 H ATOM 1299 N HIS A 135 -8.478 49.203 42.691 1.00 26.07 N ATOM 1300 CA HIS A 135 -7.645 49.529 43.831 1.00 25.79 C ATOM 1301 C HIS A 135 -7.505 51.008 44.174 1.00 26.44 C ATOM 1302 O HIS A 135 -6.677 51.389 44.991 1.00 24.78 O ATOM 1303 CB HIS A 135 -6.294 48.851 43.669 1.00 23.70 C ATOM 1304 CG HIS A 135 -6.355 47.370 43.896 1.00 24.50 C ATOM 1305 ND1 HIS A 135 -6.566 46.821 45.143 1.00 23.27 N ATOM 1306 CD2 HIS A 135 -6.288 46.328 43.034 1.00 22.84 C ATOM 1307 CE1 HIS A 135 -6.622 45.505 45.040 1.00 25.07 C ATOM 1308 NE2 HIS A 135 -6.457 45.180 43.772 1.00 23.99 N ATOM 1309 HA HIS A 135 -8.173 49.140 44.701 1.00 0.00 H ATOM 1310 HB2 HIS A 135 -5.932 49.034 42.657 1.00 0.00 H ATOM 1311 HB3 HIS A 135 -5.598 49.285 44.387 1.00 0.00 H ATOM 1312 HD2 HIS A 135 -6.130 46.388 41.957 1.00 0.00 H ATOM 1313 HE1 HIS A 135 -6.778 44.807 45.862 1.00 0.00 H ATOM 1314 H HIS A 135 -8.035 48.992 41.774 1.00 0.00 H ATOM 1315 N ARG A 136 -8.326 51.839 43.546 1.00 27.72 N ATOM 1316 CA ARG A 136 -8.338 53.256 43.870 1.00 28.62 C ATOM 1317 C ARG A 136 -9.290 53.372 45.065 1.00 30.23 C ATOM 1318 O ARG A 136 -9.217 54.324 45.840 1.00 31.71 O ATOM 1319 CB ARG A 136 -8.885 54.083 42.706 1.00 27.87 C ATOM 1320 CG ARG A 136 -7.968 54.187 41.496 1.00 24.50 C ATOM 1321 CD ARG A 136 -8.654 54.969 40.384 1.00 26.36 C ATOM 1322 NE ARG A 136 -7.868 55.023 39.154 1.00 26.23 N ATOM 1323 CZ ARG A 136 -6.818 55.814 38.959 1.00 26.15 C ATOM 1324 NH1 ARG A 136 -6.409 56.635 39.916 1.00 26.56 N ATOM 1325 NH2 ARG A 136 -6.180 55.787 37.797 1.00 24.22 N ATOM 1326 HA ARG A 136 -7.335 53.626 44.081 1.00 0.00 H ATOM 1327 HB2 ARG A 136 -9.822 53.630 42.381 1.00 0.00 H ATOM 1328 HB3 ARG A 136 -9.078 55.092 43.071 1.00 0.00 H ATOM 1329 HG2 ARG A 136 -7.049 54.698 41.783 1.00 0.00 H ATOM 1330 HG3 ARG A 136 -7.728 53.186 41.138 1.00 0.00 H ATOM 1331 HD2 ARG A 136 -8.826 55.988 40.731 1.00 0.00 H ATOM 1332 HD3 ARG A 136 -9.610 54.494 40.165 1.00 0.00 H ATOM 1333 HE ARG A 136 -8.151 54.396 38.374 1.00 0.00 H ATOM 1334 HH12 ARG A 136 -5.587 57.251 39.756 1.00 0.00 H ATOM 1335 HH11 ARG A 136 -6.911 56.663 40.827 1.00 0.00 H ATOM 1336 HH22 ARG A 136 -5.358 56.405 37.641 1.00 0.00 H ATOM 1337 HH21 ARG A 136 -6.502 55.148 37.042 1.00 0.00 H ATOM 1338 H ARG A 136 -8.968 51.473 42.814 1.00 0.00 H ATOM 1339 N SER A 137 -10.177 52.386 45.214 1.00 30.97 N ATOM 1340 CA SER A 137 -11.151 52.383 46.309 1.00 33.94 C ATOM 1341 C SER A 137 -11.001 51.202 47.276 1.00 33.62 C ATOM 1342 O SER A 137 -11.624 51.178 48.341 1.00 34.08 O ATOM 1343 CB SER A 137 -12.579 52.428 45.752 1.00 32.96 C ATOM 1344 OG SER A 137 -12.857 51.311 44.929 1.00 36.03 O ATOM 1345 HA SER A 137 -10.946 53.281 46.892 1.00 0.00 H ATOM 1346 HB2 SER A 137 -12.701 53.338 45.165 1.00 0.00 H ATOM 1347 HB3 SER A 137 -13.283 52.437 46.584 1.00 0.00 H ATOM 1348 HG SER A 137 -12.755 50.480 45.457 1.00 0.00 H ATOM 1349 H SER A 137 -10.177 51.599 44.535 1.00 0.00 H ATOM 1350 N THR A 138 -10.180 50.225 46.898 1.00 33.11 N ATOM 1351 CA THR A 138 -9.900 49.063 47.746 1.00 31.37 C ATOM 1352 C THR A 138 -8.374 48.968 47.870 1.00 30.75 C ATOM 1353 O THR A 138 -7.661 48.997 46.861 1.00 29.73 O ATOM 1354 CB THR A 138 -10.457 47.747 47.141 1.00 31.46 C ATOM 1355 OG1 THR A 138 -11.887 47.802 47.110 1.00 30.79 O ATOM 1356 CG2 THR A 138 -10.035 46.550 47.978 1.00 29.21 C ATOM 1357 HA THR A 138 -10.385 49.191 48.714 1.00 0.00 H ATOM 1358 HB THR A 138 -10.059 47.638 46.132 1.00 0.00 H ATOM 1359 HG1 THR A 138 -12.175 48.569 46.554 1.00 0.00 H ATOM 1360 HG23 THR A 138 -8.947 46.496 48.010 1.00 0.00 H ATOM 1361 HG21 THR A 138 -10.425 46.660 48.990 1.00 0.00 H ATOM 1362 HG22 THR A 138 -10.432 45.638 47.532 1.00 0.00 H ATOM 1363 H THR A 138 -9.721 50.288 45.967 1.00 0.00 H ATOM 1364 N SER A 139 -7.881 48.853 49.102 1.00 27.01 N ATOM 1365 CA SER A 139 -6.446 48.794 49.352 1.00 26.71 C ATOM 1366 C SER A 139 -5.696 47.700 48.602 1.00 26.87 C ATOM 1367 O SER A 139 -6.165 46.567 48.491 1.00 24.94 O ATOM 1368 CB SER A 139 -6.173 48.644 50.851 1.00 26.03 C ATOM 1369 OG SER A 139 -4.778 48.649 51.124 1.00 26.24 O ATOM 1370 HA SER A 139 -6.063 49.739 48.967 1.00 0.00 H ATOM 1371 HB2 SER A 139 -6.600 47.703 51.198 1.00 0.00 H ATOM 1372 HB3 SER A 139 -6.642 49.472 51.382 1.00 0.00 H ATOM 1373 HG SER A 139 -4.633 48.551 52.098 1.00 0.00 H ATOM 1374 H SER A 139 -8.537 48.804 49.907 1.00 0.00 H ATOM 1375 N VAL A 140 -4.520 48.052 48.093 1.00 26.23 N ATOM 1376 CA VAL A 140 -3.684 47.101 47.371 1.00 27.06 C ATOM 1377 C VAL A 140 -2.885 46.297 48.379 1.00 26.55 C ATOM 1378 O VAL A 140 -2.367 45.235 48.055 1.00 24.89 O ATOM 1379 CB VAL A 140 -2.672 47.806 46.424 1.00 28.47 C ATOM 1380 CG1 VAL A 140 -3.385 48.376 45.229 1.00 32.94 C ATOM 1381 CG2 VAL A 140 -1.927 48.904 47.175 1.00 29.81 C ATOM 1382 HA VAL A 140 -4.342 46.473 46.771 1.00 0.00 H ATOM 1383 HB VAL A 140 -1.947 47.071 46.075 1.00 0.00 H ATOM 1384 HG11 VAL A 140 -3.881 47.572 44.686 1.00 0.00 H ATOM 1385 HG12 VAL A 140 -4.127 49.102 45.562 1.00 0.00 H ATOM 1386 HG13 VAL A 140 -2.663 48.866 44.576 1.00 0.00 H ATOM 1387 HG21 VAL A 140 -2.642 49.639 47.545 1.00 0.00 H ATOM 1388 HG22 VAL A 140 -1.387 48.466 48.014 1.00 0.00 H ATOM 1389 HG23 VAL A 140 -1.222 49.390 46.501 1.00 0.00 H ATOM 1390 H VAL A 140 -4.188 49.030 48.213 1.00 0.00 H ATOM 1391 N SER A 141 -2.807 46.806 49.609 1.00 25.55 N ATOM 1392 CA SER A 141 -2.030 46.156 50.653 1.00 26.07 C ATOM 1393 C SER A 141 -2.825 45.415 51.720 1.00 25.84 C ATOM 1394 O SER A 141 -3.921 45.818 52.099 1.00 25.41 O ATOM 1395 CB SER A 141 -1.121 47.179 51.332 1.00 23.84 C ATOM 1396 OG SER A 141 -0.434 46.589 52.421 1.00 24.55 O ATOM 1397 HA SER A 141 -1.465 45.384 50.130 1.00 0.00 H ATOM 1398 HB2 SER A 141 -1.725 48.010 51.697 1.00 0.00 H ATOM 1399 HB3 SER A 141 -0.395 47.550 50.608 1.00 0.00 H ATOM 1400 HG SER A 141 0.149 47.266 52.848 1.00 0.00 H ATOM 1401 H SER A 141 -3.313 47.688 49.827 1.00 0.00 H ATOM 1402 N ARG A 142 -2.236 44.320 52.183 1.00 26.56 N ATOM 1403 CA ARG A 142 -2.794 43.457 53.217 1.00 29.57 C ATOM 1404 C ARG A 142 -2.426 44.015 54.595 1.00 31.05 C ATOM 1405 O ARG A 142 -3.123 43.775 55.585 1.00 30.98 O ATOM 1406 CB ARG A 142 -2.164 42.066 53.106 1.00 29.64 C ATOM 1407 CG ARG A 142 -3.127 40.931 52.940 1.00 34.01 C ATOM 1408 CD ARG A 142 -2.628 39.696 53.669 1.00 32.96 C ATOM 1409 NE ARG A 142 -1.240 39.346 53.371 1.00 33.84 N ATOM 1410 CZ ARG A 142 -0.855 38.162 52.896 1.00 36.58 C ATOM 1411 NH1 ARG A 142 -1.755 37.215 52.650 1.00 37.50 N ATOM 1412 NH2 ARG A 142 0.430 37.907 52.698 1.00 36.36 N ATOM 1413 HA ARG A 142 -3.876 43.407 53.094 1.00 0.00 H ATOM 1414 HB2 ARG A 142 -1.496 42.068 52.245 1.00 0.00 H ATOM 1415 HB3 ARG A 142 -1.586 41.886 54.012 1.00 0.00 H ATOM 1416 HG2 ARG A 142 -4.096 41.220 53.347 1.00 0.00 H ATOM 1417 HG3 ARG A 142 -3.233 40.703 51.879 1.00 0.00 H ATOM 1418 HD2 ARG A 142 -3.261 38.854 53.389 1.00 0.00 H ATOM 1419 HD3 ARG A 142 -2.714 39.873 54.741 1.00 0.00 H ATOM 1420 HE ARG A 142 -0.508 40.065 53.540 1.00 0.00 H ATOM 1421 HH12 ARG A 142 -1.451 36.292 52.279 1.00 0.00 H ATOM 1422 HH11 ARG A 142 -2.763 37.397 52.828 1.00 0.00 H ATOM 1423 HH22 ARG A 142 0.725 36.981 52.327 1.00 0.00 H ATOM 1424 HH21 ARG A 142 1.143 38.632 52.913 1.00 0.00 H ATOM 1425 H ARG A 142 -1.313 44.059 51.781 1.00 0.00 H ATOM 1426 N ASN A 143 -1.320 44.751 54.644 1.00 32.89 N ATOM 1427 CA ASN A 143 -0.793 45.295 55.896 1.00 35.12 C ATOM 1428 C ASN A 143 -1.229 46.695 56.306 1.00 35.80 C ATOM 1429 O ASN A 143 -1.229 47.020 57.495 1.00 35.64 O ATOM 1430 CB ASN A 143 0.730 45.230 55.859 1.00 36.82 C ATOM 1431 CG ASN A 143 1.240 43.819 55.677 1.00 39.63 C ATOM 1432 OD1 ASN A 143 0.925 42.928 56.464 1.00 42.24 O ATOM 1433 ND2 ASN A 143 2.032 43.606 54.636 1.00 41.30 N ATOM 1434 HA ASN A 143 -1.236 44.660 56.663 1.00 0.00 H ATOM 1435 HB2 ASN A 143 1.087 45.842 55.031 1.00 0.00 H ATOM 1436 HB3 ASN A 143 1.121 45.626 56.796 1.00 0.00 H ATOM 1437 HD22 ASN A 143 2.272 44.390 53.996 1.00 0.00 H ATOM 1438 HD21 ASN A 143 2.414 42.655 54.459 1.00 0.00 H ATOM 1439 H ASN A 143 -0.810 44.948 53.759 1.00 0.00 H ATOM 1440 N GLN A 144 -1.592 47.525 55.337 1.00 34.32 N ATOM 1441 CA GLN A 144 -2.040 48.880 55.638 1.00 34.44 C ATOM 1442 C GLN A 144 -2.971 49.333 54.539 1.00 33.35 C ATOM 1443 O GLN A 144 -3.025 48.719 53.474 1.00 31.34 O ATOM 1444 CB GLN A 144 -0.855 49.845 55.714 1.00 34.12 C ATOM 1445 CG GLN A 144 0.031 49.824 54.489 1.00 35.44 C ATOM 1446 CD GLN A 144 1.141 48.802 54.597 1.00 36.88 C ATOM 1447 OE1 GLN A 144 1.514 48.165 53.611 1.00 37.95 O ATOM 1448 NE2 GLN A 144 1.690 48.650 55.798 1.00 36.50 N ATOM 1449 HA GLN A 144 -2.547 48.878 56.603 1.00 0.00 H ATOM 1450 HB2 GLN A 144 -1.243 50.856 55.840 1.00 0.00 H ATOM 1451 HB3 GLN A 144 -0.250 49.578 56.580 1.00 0.00 H ATOM 1452 HG2 GLN A 144 -0.580 49.586 53.619 1.00 0.00 H ATOM 1453 HG3 GLN A 144 0.475 50.811 54.361 1.00 0.00 H ATOM 1454 HE22 GLN A 144 1.343 49.209 56.603 1.00 0.00 H ATOM 1455 HE21 GLN A 144 2.467 47.972 55.933 1.00 0.00 H ATOM 1456 H GLN A 144 -1.557 47.205 54.348 1.00 0.00 H ATOM 1457 N GLN A 145 -3.706 50.404 54.790 1.00 32.89 N ATOM 1458 CA GLN A 145 -4.612 50.913 53.778 1.00 35.38 C ATOM 1459 C GLN A 145 -3.843 51.764 52.782 1.00 33.08 C ATOM 1460 O GLN A 145 -3.271 52.797 53.138 1.00 32.37 O ATOM 1461 CB GLN A 145 -5.725 51.753 54.404 1.00 39.11 C ATOM 1462 CG GLN A 145 -6.781 52.172 53.387 1.00 48.11 C ATOM 1463 CD GLN A 145 -7.905 52.989 53.991 1.00 52.37 C ATOM 1464 OE1 GLN A 145 -7.731 54.165 54.317 1.00 54.62 O ATOM 1465 NE2 GLN A 145 -9.068 52.365 54.148 1.00 54.08 N ATOM 1466 HA GLN A 145 -5.064 50.061 53.271 1.00 0.00 H ATOM 1467 HB2 GLN A 145 -6.206 51.168 55.188 1.00 0.00 H ATOM 1468 HB3 GLN A 145 -5.284 52.649 54.840 1.00 0.00 H ATOM 1469 HG2 GLN A 145 -6.298 52.767 52.612 1.00 0.00 H ATOM 1470 HG3 GLN A 145 -7.207 51.274 52.941 1.00 0.00 H ATOM 1471 HE22 GLN A 145 -9.168 51.371 53.858 1.00 0.00 H ATOM 1472 HE21 GLN A 145 -9.878 52.870 54.561 1.00 0.00 H ATOM 1473 H GLN A 145 -3.634 50.880 55.712 1.00 0.00 H ATOM 1474 N ILE A 146 -3.813 51.309 51.534 1.00 30.77 N ATOM 1475 CA ILE A 146 -3.141 52.042 50.470 1.00 29.18 C ATOM 1476 C ILE A 146 -4.038 52.055 49.237 1.00 28.18 C ATOM 1477 O ILE A 146 -4.240 51.027 48.590 1.00 28.27 O ATOM 1478 CB ILE A 146 -1.787 51.411 50.090 1.00 28.14 C ATOM 1479 CG1 ILE A 146 -0.877 51.332 51.316 1.00 28.13 C ATOM 1480 CG2 ILE A 146 -1.105 52.268 49.019 1.00 28.94 C ATOM 1481 CD1 ILE A 146 0.475 50.699 51.035 1.00 25.95 C ATOM 1482 HA ILE A 146 -2.950 53.052 50.833 1.00 0.00 H ATOM 1483 HB ILE A 146 -1.965 50.406 49.707 1.00 0.00 H ATOM 1484 HG12 ILE A 146 -0.713 52.343 51.688 1.00 0.00 H ATOM 1485 HG13 ILE A 146 -1.381 50.742 52.081 1.00 0.00 H ATOM 1486 HD11 ILE A 146 0.330 49.681 50.672 1.00 0.00 H ATOM 1487 HD12 ILE A 146 0.999 51.284 50.279 1.00 0.00 H ATOM 1488 HD13 ILE A 146 1.063 50.679 51.953 1.00 0.00 H ATOM 1489 HG21 ILE A 146 -1.742 52.319 48.136 1.00 0.00 H ATOM 1490 HG22 ILE A 146 -0.941 53.272 49.409 1.00 0.00 H ATOM 1491 HG23 ILE A 146 -0.148 51.820 48.752 1.00 0.00 H ATOM 1492 H ILE A 146 -4.281 50.407 51.312 1.00 0.00 H ATOM 1493 N PHE A 147 -4.595 53.222 48.940 1.00 27.74 N ATOM 1494 CA PHE A 147 -5.467 53.407 47.790 1.00 26.82 C ATOM 1495 C PHE A 147 -4.637 54.021 46.669 1.00 26.13 C ATOM 1496 O PHE A 147 -3.865 54.947 46.903 1.00 25.24 O ATOM 1497 CB PHE A 147 -6.619 54.349 48.159 1.00 29.23 C ATOM 1498 CG PHE A 147 -7.581 53.771 49.164 1.00 32.35 C ATOM 1499 CD1 PHE A 147 -8.149 54.577 50.144 1.00 36.38 C ATOM 1500 CD2 PHE A 147 -7.934 52.428 49.118 1.00 33.25 C ATOM 1501 CE1 PHE A 147 -9.055 54.049 51.066 1.00 36.80 C ATOM 1502 CE2 PHE A 147 -8.835 51.894 50.031 1.00 34.14 C ATOM 1503 CZ PHE A 147 -9.397 52.703 51.007 1.00 36.05 C ATOM 1504 HA PHE A 147 -5.888 52.453 47.473 1.00 0.00 H ATOM 1505 HB2 PHE A 147 -6.196 55.263 48.575 1.00 0.00 H ATOM 1506 HB3 PHE A 147 -7.173 54.587 47.251 1.00 0.00 H ATOM 1507 HD2 PHE A 147 -7.498 51.784 48.355 1.00 0.00 H ATOM 1508 HE2 PHE A 147 -9.100 50.838 49.980 1.00 0.00 H ATOM 1509 HZ PHE A 147 -10.103 52.285 51.724 1.00 0.00 H ATOM 1510 HE1 PHE A 147 -9.493 54.691 51.830 1.00 0.00 H ATOM 1511 HD1 PHE A 147 -7.884 55.633 50.193 1.00 0.00 H ATOM 1512 H PHE A 147 -4.400 54.038 49.554 1.00 0.00 H ATOM 1513 N LEU A 148 -4.785 53.507 45.455 1.00 25.40 N ATOM 1514 CA LEU A 148 -4.030 54.040 44.325 1.00 25.96 C ATOM 1515 C LEU A 148 -4.471 55.465 43.965 1.00 27.44 C ATOM 1516 O LEU A 148 -5.664 55.762 43.959 1.00 28.43 O ATOM 1517 CB LEU A 148 -4.186 53.115 43.112 1.00 24.81 C ATOM 1518 CG LEU A 148 -3.696 51.673 43.305 1.00 23.89 C ATOM 1519 CD1 LEU A 148 -3.797 50.915 41.995 1.00 24.51 C ATOM 1520 CD2 LEU A 148 -2.255 51.678 43.795 1.00 22.29 C ATOM 1521 HA LEU A 148 -2.981 54.086 44.616 1.00 0.00 H ATOM 1522 HB2 LEU A 148 -5.244 53.077 42.854 1.00 0.00 H ATOM 1523 HB3 LEU A 148 -3.626 53.551 42.284 1.00 0.00 H ATOM 1524 HG LEU A 148 -4.321 51.179 44.049 1.00 0.00 H ATOM 1525 HD21 LEU A 148 -1.624 52.178 43.060 1.00 0.00 H ATOM 1526 HD22 LEU A 148 -2.198 52.209 44.745 1.00 0.00 H ATOM 1527 HD23 LEU A 148 -1.915 50.651 43.929 1.00 0.00 H ATOM 1528 HD11 LEU A 148 -4.835 50.902 41.664 1.00 0.00 H ATOM 1529 HD12 LEU A 148 -3.181 51.408 41.243 1.00 0.00 H ATOM 1530 HD13 LEU A 148 -3.448 49.893 42.140 1.00 0.00 H ATOM 1531 H LEU A 148 -5.445 52.717 45.307 1.00 0.00 H ATOM 1532 N ARG A 149 -3.494 56.335 43.690 1.00 27.85 N ATOM 1533 CA ARG A 149 -3.714 57.743 43.312 1.00 29.10 C ATOM 1534 C ARG A 149 -2.786 58.015 42.132 1.00 28.28 C ATOM 1535 O ARG A 149 -1.629 57.616 42.170 1.00 27.50 O ATOM 1536 CB ARG A 149 -3.256 58.719 44.403 1.00 29.86 C ATOM 1537 CG ARG A 149 -3.912 58.685 45.750 1.00 33.06 C ATOM 1538 CD ARG A 149 -3.193 59.716 46.623 1.00 33.03 C ATOM 1539 NE ARG A 149 -3.072 60.996 45.925 1.00 33.49 N ATOM 1540 CZ ARG A 149 -3.761 62.090 46.238 1.00 35.06 C ATOM 1541 NH1 ARG A 149 -4.617 62.070 47.250 1.00 33.30 N ATOM 1542 NH2 ARG A 149 -3.620 63.195 45.519 1.00 36.83 N ATOM 1543 HA ARG A 149 -4.777 57.884 43.117 1.00 0.00 H ATOM 1544 HB2 ARG A 149 -2.193 58.538 44.564 1.00 0.00 H ATOM 1545 HB3 ARG A 149 -3.397 59.725 44.007 1.00 0.00 H ATOM 1546 HG2 ARG A 149 -4.968 58.941 45.659 1.00 0.00 H ATOM 1547 HG3 ARG A 149 -3.817 57.691 46.188 1.00 0.00 H ATOM 1548 HD2 ARG A 149 -2.197 59.346 46.866 1.00 0.00 H ATOM 1549 HD3 ARG A 149 -3.759 59.863 47.543 1.00 0.00 H ATOM 1550 HE ARG A 149 -2.403 61.055 45.131 1.00 0.00 H ATOM 1551 HH12 ARG A 149 -5.155 62.926 47.493 1.00 0.00 H ATOM 1552 HH11 ARG A 149 -4.751 61.198 47.801 1.00 0.00 H ATOM 1553 HH22 ARG A 149 -4.160 64.049 45.766 1.00 0.00 H ATOM 1554 HH21 ARG A 149 -2.969 63.208 44.708 1.00 0.00 H ATOM 1555 H ARG A 149 -2.513 55.996 43.747 1.00 0.00 H ATOM 1556 N ASP A 150 -3.258 58.726 41.112 1.00 29.84 N ATOM 1557 CA ASP A 150 -2.400 59.021 39.960 1.00 30.49 C ATOM 1558 C ASP A 150 -1.195 59.880 40.335 1.00 29.83 C ATOM 1559 O ASP A 150 -1.293 60.761 41.180 1.00 28.43 O ATOM 1560 CB ASP A 150 -3.193 59.730 38.858 1.00 32.91 C ATOM 1561 CG ASP A 150 -4.226 58.834 38.220 1.00 34.92 C ATOM 1562 OD1 ASP A 150 -4.060 57.603 38.295 1.00 38.07 O ATOM 1563 OD2 ASP A 150 -5.190 59.356 37.627 1.00 38.30 O ATOM 1564 HA ASP A 150 -2.035 58.060 39.597 1.00 0.00 H ATOM 1565 HB2 ASP A 150 -3.698 60.593 39.291 1.00 0.00 H ATOM 1566 HB3 ASP A 150 -2.498 60.066 38.088 1.00 0.00 H ATOM 1567 H ASP A 150 -4.238 59.074 41.131 1.00 0.00 H ATOM 1568 N ILE A 151 -0.055 59.619 39.702 1.00 31.53 N ATOM 1569 CA ILE A 151 1.157 60.387 39.969 1.00 31.93 C ATOM 1570 C ILE A 151 0.909 61.859 39.650 1.00 33.68 C ATOM 1571 O ILE A 151 -0.040 62.196 38.947 1.00 31.78 O ATOM 1572 CB ILE A 151 2.341 59.910 39.103 1.00 31.47 C ATOM 1573 CG1 ILE A 151 1.881 59.744 37.651 1.00 33.19 C ATOM 1574 CG2 ILE A 151 2.920 58.617 39.665 1.00 30.15 C ATOM 1575 CD1 ILE A 151 3.012 59.715 36.648 1.00 35.77 C ATOM 1576 HA ILE A 151 1.406 60.245 41.021 1.00 0.00 H ATOM 1577 HB ILE A 151 3.135 60.657 39.123 1.00 0.00 H ATOM 1578 HG12 ILE A 151 1.327 58.808 37.571 1.00 0.00 H ATOM 1579 HG13 ILE A 151 1.223 60.576 37.402 1.00 0.00 H ATOM 1580 HD11 ILE A 151 3.570 60.649 36.705 1.00 0.00 H ATOM 1581 HD12 ILE A 151 3.675 58.880 36.874 1.00 0.00 H ATOM 1582 HD13 ILE A 151 2.603 59.595 35.645 1.00 0.00 H ATOM 1583 HG21 ILE A 151 3.269 58.789 40.683 1.00 0.00 H ATOM 1584 HG22 ILE A 151 2.149 57.847 39.670 1.00 0.00 H ATOM 1585 HG23 ILE A 151 3.754 58.293 39.043 1.00 0.00 H ATOM 1586 H ILE A 151 -0.026 58.851 39.001 1.00 0.00 H ATOM 1587 N GLU A 152 1.772 62.729 40.163 1.00 37.16 N ATOM 1588 CA GLU A 152 1.645 64.165 39.929 1.00 40.72 C ATOM 1589 C GLU A 152 2.812 64.716 39.114 1.00 43.12 C ATOM 1590 O GLU A 152 3.523 63.965 38.448 1.00 46.32 O ATOM 1591 CB GLU A 152 1.562 64.905 41.260 1.00 41.32 C ATOM 1592 CG GLU A 152 0.319 64.588 42.058 1.00 43.47 C ATOM 1593 CD GLU A 152 0.293 65.308 43.386 1.00 45.47 C ATOM 1594 OE1 GLU A 152 0.424 64.636 44.426 1.00 48.00 O ATOM 1595 OE2 GLU A 152 0.148 66.549 43.386 1.00 46.79 O ATOM 1596 HA GLU A 152 0.731 64.322 39.357 1.00 0.00 H ATOM 1597 OXT GLU A 152 3.011 65.949 39.131 1.00 33.19 O ATOM 1598 HB2 GLU A 152 2.433 64.636 41.858 1.00 0.00 H ATOM 1599 HB3 GLU A 152 1.578 65.976 41.059 1.00 0.00 H ATOM 1600 HG2 GLU A 152 -0.555 64.887 41.480 1.00 0.00 H ATOM 1601 HG3 GLU A 152 0.283 63.514 42.240 1.00 0.00 H ATOM 1602 H GLU A 152 2.558 62.378 40.746 1.00 0.00 H TER 1603 GLU A 152 HETATM 1604 O HOH 1 4.780 43.129 29.603 1.00 23.70 O HETATM 1605 O HOH 2 -6.762 40.862 43.122 1.00 21.77 O HETATM 1606 O HOH 3 -7.219 54.456 35.462 1.00 26.70 O HETATM 1607 O HOH 4 0.562 43.631 51.322 1.00 29.61 O HETATM 1608 O HOH 5 8.178 61.489 40.682 1.00 31.10 O HETATM 1609 O HOH 6 -7.053 42.481 44.911 1.00 33.54 O HETATM 1610 O HOH 7 -12.791 42.634 35.376 1.00 30.80 O HETATM 1611 O HOH 8 -10.208 54.151 33.394 1.00 28.43 O HETATM 1612 O HOH 9 -8.684 40.206 46.413 1.00 26.86 O HETATM 1613 O HOH 10 -12.819 48.682 44.759 1.00 43.12 O HETATM 1614 O HOH 11 7.625 42.327 30.536 1.00 28.81 O HETATM 1615 O HOH 12 10.129 46.753 35.209 1.00 28.01 O HETATM 1616 O HOH 13 10.352 35.006 36.788 1.00 29.55 O HETATM 1617 O HOH 14 1.568 38.287 32.807 1.00 38.16 O HETATM 1618 O HOH 15 10.855 42.088 29.847 1.00 56.35 O HETATM 1619 O HOH 16 13.434 35.205 35.264 1.00 28.56 O HETATM 1620 O HOH 17 -4.117 55.679 50.742 1.00 31.22 O HETATM 1621 O HOH 18 6.197 49.831 53.005 1.00 30.70 O HETATM 1622 O HOH 19 -11.820 50.276 34.636 1.00 31.16 O HETATM 1623 O HOH 20 1.914 62.118 44.593 1.00 30.04 O HETATM 1624 O HOH 21 8.304 55.322 30.781 1.00 41.05 O HETATM 1625 O HOH 22 4.286 64.540 43.770 1.00 36.02 O HETATM 1626 O HOH 23 -13.041 53.146 49.659 1.00 40.89 O HETATM 1627 O HOH 24 -1.345 36.787 45.840 1.00 32.79 O HETATM 1628 O HOH 25 1.240 40.263 34.495 1.00 28.08 O HETATM 1629 O HOH 26 -13.043 37.257 41.084 1.00 35.21 O HETATM 1630 O HOH 27 -3.560 57.102 48.662 1.00 33.58 O HETATM 1631 O HOH 28 -0.551 61.211 43.896 1.00 35.56 O HETATM 1632 O HOH 29 4.373 60.086 52.347 1.00 35.29 O HETATM 1633 O HOH 30 -6.363 31.738 40.429 1.00 36.50 O HETATM 1634 O HOH 31 -11.710 35.245 42.646 1.00 25.57 O HETATM 1635 O HOH 32 14.626 59.382 44.183 1.00 41.95 O HETATM 1636 O HOH 33 -0.286 57.019 38.370 1.00 30.25 O HETATM 1637 O HOH 34 1.259 67.537 38.677 1.00 46.02 O HETATM 1638 O HOH 35 -1.036 56.952 53.842 1.00 35.89 O HETATM 1639 O HOH 36 -13.662 49.221 36.196 1.00 36.59 O HETATM 1640 O HOH 37 -8.681 49.489 53.869 1.00 36.37 O HETATM 1641 O HOH 38 2.352 45.681 51.903 1.00 38.94 O HETATM 1642 O HOH 39 11.715 43.892 36.830 1.00 32.36 O HETATM 1643 O HOH 40 11.747 60.911 37.948 1.00 48.83 O HETATM 1644 O HOH 41 13.660 35.121 32.139 1.00 38.44 O HETATM 1645 O HOH 42 -4.983 44.994 57.264 1.00 43.66 O HETATM 1646 O HOH 43 4.855 59.951 55.039 1.00 50.85 O HETATM 1647 O HOH 44 -14.312 37.211 30.979 1.00 40.76 O HETATM 1648 O HOH 45 0.575 34.682 37.204 1.00 39.11 O HETATM 1649 O HOH 46 3.030 57.840 55.060 1.00 43.84 O HETATM 1650 O HOH 47 -8.927 58.266 30.658 1.00 48.60 O HETATM 1651 O HOH 48 -1.424 61.675 36.464 1.00 55.11 O HETATM 1652 O HOH 49 -15.014 43.110 32.545 1.00 38.15 O HETATM 1653 O HOH 50 13.649 46.811 45.182 1.00 47.46 O HETATM 1654 O HOH 51 -10.433 56.004 36.633 1.00 51.88 O HETATM 1655 O HOH 52 -8.422 30.086 38.168 1.00 49.59 O HETATM 1656 O HOH 53 -8.460 42.786 47.151 1.00 38.62 O HETATM 1657 O HOH 54 10.325 53.504 29.437 1.00 57.15 O HETATM 1658 O HOH 55 -13.152 34.128 44.373 1.00 28.94 O HETATM 1659 O HOH 56 -12.240 43.805 50.116 1.00 35.88 O HETATM 1660 O HOH 57 2.757 56.256 57.072 1.00 51.54 O HETATM 1661 O HOH 58 -9.623 48.398 51.409 1.00 35.00 O HETATM 1662 O HOH 59 12.123 55.715 59.259 1.00 56.10 O HETATM 1663 O HOH 60 16.023 47.548 38.882 1.00 46.21 O HETATM 1664 O HOH 61 4.749 66.511 36.604 1.00 43.23 O HETATM 1665 O HOH 62 -10.451 31.409 38.448 1.00 53.54 O HETATM 1666 O HOH 63 -2.269 54.137 56.163 1.00 58.31 O HETATM 1667 O HOH 64 -12.383 47.691 38.161 1.00 33.41 O HETATM 1668 O HOH 65 5.815 65.266 41.034 1.00 44.07 O HETATM 1669 O HOH 66 5.179 63.169 36.730 1.00 43.42 O HETATM 1670 O HOH 67 -3.377 62.417 42.342 1.00 38.35 O HETATM 1671 O HOH 68 -3.474 30.941 39.102 1.00 53.07 O HETATM 1672 O HOH 69 13.807 45.694 36.925 1.00 44.07 O HETATM 1673 O HOH 70 -6.649 57.462 33.169 1.00 41.01 O HETATM 1674 O HOH 71 9.037 57.034 56.651 1.00 56.39 O HETATM 1675 O HOH 72 -4.025 51.502 58.472 1.00 53.70 O HETATM 1676 O HOH 73 -6.223 53.913 57.452 1.00 50.41 O HETATM 1677 O HOH 74 -14.880 49.721 41.786 1.00 57.23 O HETATM 1678 O HOH 75 -1.869 54.927 52.116 1.00 38.77 O HETATM 1679 O HOH 76 15.656 52.727 44.585 1.00 39.12 O HETATM 1680 O HOH 77 -6.250 29.378 37.177 1.00 60.45 O HETATM 1681 O HOH 78 -6.538 48.161 54.286 1.00 32.14 O HETATM 1682 O HOH 79 12.863 55.355 55.877 1.00 57.38 O HETATM 1683 O HOH 80 -15.581 44.955 47.120 1.00 55.36 O HETATM 1684 O HOH 81 -2.829 29.031 36.941 1.00 55.85 O HETATM 1685 O HOH 82 -10.948 33.336 36.142 1.00 49.21 O HETATM 1686 O HOH 83 -12.811 35.215 31.717 1.00 43.59 O HETATM 1687 O HOH 84 -13.349 48.684 40.206 1.00 45.78 O HETATM 1688 O HOH 85 11.360 66.013 44.086 1.00 55.86 O HETATM 1689 O HOH 86 -5.884 58.360 48.551 1.00 48.19 O HETATM 1690 O HOH 87 14.688 55.084 45.495 1.00 43.18 O HETATM 1691 O HOH 88 -11.728 49.584 32.093 1.00 40.18 O HETATM 1692 O HOH 89 5.863 41.072 37.364 1.00 45.86 O HETATM 1693 O HOH 90 4.300 56.417 60.455 1.00 51.83 O HETATM 1694 O HOH 91 -14.213 36.565 45.819 1.00 51.91 O HETATM 1695 O HOH 92 -1.145 53.709 58.632 1.00 57.03 O HETATM 1696 O HOH 93 -0.565 52.333 56.935 1.00 56.83 O HETATM 1697 O HOH 94 -16.274 37.839 33.581 1.00 54.92 O HETATM 1698 O HOH 95 -13.457 33.099 33.293 1.00 49.11 O HETATM 1699 O HOH 96 10.160 64.977 40.789 1.00 55.88 O HETATM 1700 O HOH 97 9.207 65.694 46.414 1.00 56.02 O HETATM 1701 O HOH 98 -14.165 49.085 31.265 1.00 56.51 O HETATM 1702 O HOH 99 -14.537 43.255 40.427 1.00 54.01 O HETATM 1703 O HOH 100 8.812 56.647 48.889 1.00 48.94 O HETATM 1704 O HOH 101 14.364 41.857 29.552 1.00 50.68 O HETATM 1705 O HOH 102 -1.826 67.437 45.482 1.00 51.35 O HETATM 1706 O HOH 103 18.010 49.019 37.631 1.00 54.73 O HETATM 1707 O HOH 104 13.293 53.874 47.576 1.00 67.18 O HETATM 1708 O HOH 105 -15.253 47.591 43.844 1.00 52.78 O HETATM 1709 O HOH 106 10.848 62.199 48.848 1.00 57.78 O HETATM 1710 O HOH 107 -11.833 52.158 30.859 1.00 58.26 O HETATM 1711 O HOH 108 1.189 39.945 28.952 1.00 55.60 O HETATM 1712 O HOH 109 -4.800 47.609 56.427 1.00 55.69 O HETATM 1713 O HOH 110 -12.619 52.329 42.284 1.00 49.67 O HETATM 1714 O HOH 111 15.361 57.649 46.134 1.00 60.38 O HETATM 1715 O HOH 112 12.158 51.484 48.263 1.00 54.94 O HETATM 1716 O HOH 113 7.742 45.361 47.734 1.00 31.91 O HETATM 1717 O HOH 114 2.238 41.480 51.988 1.00 41.18 O HETATM 1718 O HOH 115 -0.700 32.493 42.083 1.00 38.67 O HETATM 1719 O HOH 116 6.165 37.448 47.077 1.00 44.37 O HETATM 1720 O HOH 117 5.262 42.221 53.019 1.00 55.01 O HETATM 1721 O HOH 118 8.588 38.064 46.602 1.00 49.23 O HETATM 1722 O HOH 119 8.103 46.835 52.173 1.00 60.39 O HETATM 1723 O HOH 120 11.378 43.441 55.230 1.00 49.48 O HETATM 1724 O HOH 121 0.100 33.551 44.598 1.00 43.74 O HETATM 1725 O HOH 122 10.284 42.331 49.293 1.00 60.16 O HETATM 1726 N GLY A 123 11.766 41.457 45.818 1.00 0.24 N HETATM 1727 CA GLY A 123 10.570 40.637 45.802 1.00 0.05 C HETATM 1728 C GLY A 123 9.292 41.451 45.798 1.00 0.22 C HETATM 1729 O GLY A 123 9.316 42.682 45.739 1.00 -0.39 O HETATM 1730 N GLY A 123 8.164 40.761 45.891 1.00 -0.26 N HETATM 1731 CA GLY A 123 6.881 41.438 45.861 1.00 0.15 C HETATM 1732 C GLY A 123 6.067 41.268 47.157 1.00 0.21 C HETATM 1733 O GLY A 123 6.262 40.308 47.906 1.00 -0.39 O HETATM 1734 N GLY A 123 5.176 42.220 47.427 1.00 -0.26 N HETATM 1735 CA GLY A 123 4.342 42.187 48.631 1.00 0.13 C HETATM 1736 C GLY A 123 3.335 41.046 48.624 1.00 0.20 C HETATM 1737 O GLY A 123 2.986 40.506 49.674 1.00 -0.39 O HETATM 1738 N GLY A 123 2.848 40.693 47.442 1.00 -0.26 N HETATM 1739 CA GLY A 123 1.871 39.623 47.333 1.00 0.15 C HETATM 1740 C GLY A 123 2.538 38.321 46.919 1.00 0.21 C HETATM 1741 O GLY A 123 3.318 38.285 45.967 1.00 -0.39 O HETATM 1742 N GLY A 123 2.245 37.168 47.810 1.00 -0.25 N HETATM 1743 CA GLY A 123 2.846 35.860 47.529 1.00 0.13 C HETATM 1744 C GLY A 123 2.619 35.596 46.026 1.00 0.20 C HETATM 1745 O GLY A 123 1.528 35.848 45.520 1.00 -0.39 O HETATM 1746 N GLY A 123 3.608 35.178 45.101 1.00 -0.26 N HETATM 1747 CA GLY A 123 3.469 35.013 43.620 1.00 0.16 C HETATM 1748 C GLY A 123 3.205 33.592 43.003 1.00 0.21 C HETATM 1749 O GLY A 123 3.129 33.431 41.773 1.00 -0.39 O HETATM 1750 N GLY A 123 3.083 32.646 43.905 1.00 -0.27 N HETATM 1751 CA GLY A 123 2.792 31.268 43.639 1.00 0.09 C HETATM 1752 C GLY A 123 1.531 30.926 44.381 1.00 0.06 C HETATM 1753 O GLY A 123 1.290 31.429 45.478 1.00 -0.57 O HETATM 1754 OXT GLY A 123 0.610 30.409 43.749 1.00 -0.57 O HETATM 1755 CB GLY A 123 3.921 30.368 44.129 1.00 -0.02 C HETATM 1756 CG GLY A 123 4.069 30.459 45.532 1.00 -0.06 C HETATM 1757 H GLY A 123 4.298 31.489 45.806 1.00 0.02 H HETATM 1758 H GLY A 123 3.141 30.151 46.015 1.00 0.02 H HETATM 1759 H GLY A 123 4.881 29.807 45.853 1.00 0.02 H HETATM 1760 H GLY A 123 4.851 30.686 43.658 1.00 0.03 H HETATM 1761 H GLY A 123 3.684 29.337 43.869 1.00 0.03 H HETATM 1762 H GLY A 123 2.680 31.114 42.566 1.00 0.07 H HETATM 1763 H GLY A 123 3.206 32.915 44.881 1.00 0.19 H HETATM 1764 CB GLY A 123 4.706 35.654 42.968 1.00 0.09 C HETATM 1765 OG1 GLY A 123 5.865 34.921 43.391 1.00 -0.39 O HETATM 1766 H GLY A 123 6.649 35.307 42.993 1.00 0.21 H HETATM 1767 CG2 GLY A 123 4.836 37.120 43.362 1.00 -0.03 C HETATM 1768 H GLY A 123 3.949 37.663 43.036 1.00 0.03 H HETATM 1769 H GLY A 123 4.933 37.197 44.445 1.00 0.03 H HETATM 1770 H GLY A 123 5.719 37.546 42.886 1.00 0.03 H HETATM 1771 H GLY A 123 4.607 35.615 41.883 1.00 0.06 H HETATM 1772 H GLY A 123 2.522 35.503 43.395 1.00 0.08 H HETATM 1773 H GLY A 123 4.525 34.964 45.492 1.00 0.19 H HETATM 1774 CB GLY A 123 2.080 34.923 48.473 1.00 -0.01 C HETATM 1775 CG GLY A 123 0.760 35.630 48.678 1.00 -0.03 C HETATM 1776 CD GLY A 123 1.172 37.063 48.811 1.00 0.04 C HETATM 1777 H GLY A 123 0.355 37.764 48.642 1.00 0.05 H HETATM 1778 H GLY A 123 1.494 37.327 49.818 1.00 0.05 H HETATM 1779 H GLY A 123 0.211 35.263 49.545 1.00 0.03 H HETATM 1780 H GLY A 123 0.057 35.464 47.862 1.00 0.03 H HETATM 1781 H GLY A 123 2.610 34.749 49.409 1.00 0.03 H HETATM 1782 H GLY A 123 1.958 33.922 48.059 1.00 0.03 H HETATM 1783 H GLY A 123 3.917 35.748 47.699 1.00 0.08 H HETATM 1784 CB GLY A 123 0.777 40.007 46.325 1.00 0.08 C HETATM 1785 CG GLY A 123 1.333 40.322 44.951 1.00 0.18 C HETATM 1786 OD1 GLY A 123 2.396 40.928 44.828 1.00 -0.40 O HETATM 1787 ND2 GLY A 123 0.607 39.926 43.909 1.00 -0.30 N HETATM 1788 H GLY A 123 0.927 40.123 42.961 1.00 0.18 H HETATM 1789 H GLY A 123 -0.269 39.426 44.059 1.00 0.18 H HETATM 1790 H GLY A 123 0.278 40.901 46.697 1.00 0.06 H HETATM 1791 H GLY A 123 0.100 39.158 46.226 1.00 0.06 H HETATM 1792 H GLY A 123 1.414 39.474 48.311 1.00 0.08 H HETATM 1793 H GLY A 123 3.162 41.177 46.601 1.00 0.19 H HETATM 1794 CB GLY A 123 3.571 43.500 48.795 1.00 -0.00 C HETATM 1795 CG GLY A 123 4.426 44.728 49.007 1.00 0.00 C HETATM 1796 CD GLY A 123 5.261 44.645 50.265 1.00 0.04 C HETATM 1797 OE1 GLY A 123 4.692 44.409 51.351 1.00 -0.57 O HETATM 1798 OE2 GLY A 123 6.491 44.822 50.173 1.00 -0.57 O HETATM 1799 H GLY A 123 3.762 45.587 49.101 1.00 0.04 H HETATM 1800 H GLY A 123 5.105 44.815 48.159 1.00 0.04 H HETATM 1801 H GLY A 123 2.954 43.391 49.687 1.00 0.03 H HETATM 1802 H GLY A 123 3.022 43.658 47.867 1.00 0.03 H HETATM 1803 H GLY A 123 5.031 42.037 49.462 1.00 0.08 H HETATM 1804 H GLY A 123 5.071 42.997 46.775 1.00 0.19 H HETATM 1805 CB GLY A 123 6.049 41.012 44.710 1.00 0.04 C HETATM 1806 CG GLY A 123 6.726 41.286 43.371 1.00 -0.00 C HETATM 1807 CD1 GLY A 123 7.580 40.351 42.814 1.00 -0.02 C HETATM 1808 CE1 GLY A 123 8.203 40.586 41.583 1.00 0.01 C HETATM 1809 CZ GLY A 123 7.963 41.759 40.889 1.00 0.17 C HETATM 1810 CE2 GLY A 123 7.103 42.715 41.428 1.00 0.01 C HETATM 1811 CD2 GLY A 123 6.475 42.442 42.649 1.00 -0.02 C HETATM 1812 H GLY A 123 5.763 43.165 43.046 1.00 0.07 H HETATM 1813 H GLY A 123 6.923 43.656 40.909 1.00 0.07 H HETATM 1814 OH GLY A 123 8.493 41.993 39.726 1.00 -0.20 O HETATM 1815 P GLY A 123 9.888 42.779 39.509 1.00 0.13 P HETATM 1816 O1P GLY A 123 10.950 41.780 39.366 1.00 -0.67 O HETATM 1817 O2P GLY A 123 10.084 43.703 40.695 1.00 -0.67 O HETATM 1818 O3P GLY A 123 9.610 43.549 38.250 1.00 -0.67 O HETATM 1819 H GLY A 123 8.882 39.840 41.168 1.00 0.07 H HETATM 1820 H GLY A 123 7.771 39.417 43.342 1.00 0.07 H HETATM 1821 H GLY A 123 5.118 41.578 44.739 1.00 0.06 H HETATM 1822 H GLY A 123 5.885 39.938 44.792 1.00 0.06 H HETATM 1823 H GLY A 123 7.132 42.493 45.756 1.00 0.08 H HETATM 1824 H GLY A 123 8.198 39.746 45.984 1.00 0.19 H HETATM 1825 H GLY A 123 10.573 40.029 46.707 1.00 0.11 H HETATM 1826 H GLY A 123 10.588 40.043 44.888 1.00 0.11 H HETATM 1827 H GLY A 123 12.589 40.855 45.820 1.00 0.20 H HETATM 1828 H GLY A 123 11.780 42.052 44.989 1.00 0.20 H HETATM 1829 H GLY A 123 11.767 42.039 46.656 1.00 0.20 H CONECT 1 2 17 18 19 CONECT 17 1 CONECT 18 1 CONECT 19 1 CONECT 1726 1727 1827 1828 1829 CONECT 1727 1726 1728 1825 1826 CONECT 1728 1727 1729 1730 CONECT 1729 1728 CONECT 1730 1728 1731 1824 CONECT 1731 1730 1732 1805 1823 CONECT 1732 1731 1733 1734 CONECT 1733 1732 CONECT 1734 1732 1735 1804 CONECT 1735 1734 1736 1794 1803 CONECT 1736 1735 1737 1738 CONECT 1737 1736 CONECT 1738 1736 1739 1793 CONECT 1739 1738 1740 1784 1792 CONECT 1740 1739 1741 1742 CONECT 1741 1740 CONECT 1742 1740 1743 1776 CONECT 1743 1742 1744 1774 1783 CONECT 1744 1743 1745 1746 CONECT 1745 1744 CONECT 1746 1744 1747 1773 CONECT 1747 1746 1748 1764 1772 CONECT 1748 1747 1749 1750 CONECT 1749 1748 CONECT 1750 1748 1751 1763 CONECT 1751 1750 1752 1755 1762 CONECT 1752 1751 1753 1754 CONECT 1753 1752 CONECT 1754 1752 CONECT 1755 1751 1756 1760 1761 CONECT 1756 1755 1757 1758 1759 CONECT 1757 1756 CONECT 1758 1756 CONECT 1759 1756 CONECT 1760 1755 CONECT 1761 1755 CONECT 1762 1751 CONECT 1763 1750 CONECT 1764 1747 1765 1767 1771 CONECT 1765 1764 1766 CONECT 1766 1765 CONECT 1767 1764 1768 1769 1770 CONECT 1768 1767 CONECT 1769 1767 CONECT 1770 1767 CONECT 1771 1764 CONECT 1772 1747 CONECT 1773 1746 CONECT 1774 1743 1775 1781 1782 CONECT 1775 1774 1776 1779 1780 CONECT 1776 1742 1775 1777 1778 CONECT 1777 1776 CONECT 1778 1776 CONECT 1779 1775 CONECT 1780 1775 CONECT 1781 1774 CONECT 1782 1774 CONECT 1783 1743 CONECT 1784 1739 1785 1790 1791 CONECT 1785 1784 1786 1787 CONECT 1786 1785 CONECT 1787 1785 1788 1789 CONECT 1788 1787 CONECT 1789 1787 CONECT 1790 1784 CONECT 1791 1784 CONECT 1792 1739 CONECT 1793 1738 CONECT 1794 1735 1795 1801 1802 CONECT 1795 1794 1796 1799 1800 CONECT 1796 1795 1797 1798 CONECT 1797 1796 CONECT 1798 1796 CONECT 1799 1795 CONECT 1800 1795 CONECT 1801 1794 CONECT 1802 1794 CONECT 1803 1735 CONECT 1804 1734 CONECT 1805 1731 1806 1821 1822 CONECT 1806 1805 1807 1811 CONECT 1807 1806 1808 1820 CONECT 1808 1807 1809 1819 CONECT 1809 1808 1810 1814 CONECT 1810 1809 1811 1813 CONECT 1811 1806 1810 1812 CONECT 1812 1811 CONECT 1813 1810 CONECT 1814 1809 1815 CONECT 1815 1814 1816 1817 1818 CONECT 1816 1815 CONECT 1817 1815 CONECT 1818 1815 CONECT 1819 1808 CONECT 1820 1807 CONECT 1821 1805 CONECT 1822 1805 CONECT 1823 1731 CONECT 1824 1730 CONECT 1825 1727 CONECT 1826 1727 CONECT 1827 1726 CONECT 1828 1726 CONECT 1829 1726 MASTER 0 0 0 0 0 0 0 0 1828 1 108 8 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 3mxc
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
Check Database
Protein Sequence Similarity
1bm2
RCSB PDB
PDBbind
117aa, >1BM2_1|Chain... at 100%
1bmb
RCSB PDB
PDBbind
123aa, >1BMB_1|Chain... *
1cj1
RCSB PDB
PDBbind
96aa, >1CJ1_1|Chains... at 100%
1fyr
RCSB PDB
PDBbind
114aa, >1FYR_1|Chains... at 98%
1jyq
RCSB PDB
PDBbind
96aa, >1JYQ_1|Chains... at 95%
1tze
RCSB PDB
PDBbind
98aa, >1TZE_1|Chain... at 100%
1x0n
RCSB PDB
PDBbind
104aa, >1X0N_1|Chain... at 98%
1zfp
RCSB PDB
PDBbind
98aa, >1ZFP_1|Chain... at 100%
3mxy
RCSB PDB
PDBbind
101aa, >3MXY_1|Chain... at 97%
3ov1
RCSB PDB
PDBbind
117aa, >3OV1_1|Chain... at 94%
3ove
RCSB PDB
PDBbind
117aa, >3OVE_1|Chain... at 94%
3s8l
RCSB PDB
PDBbind
117aa, >3S8L_1|Chain... at 94%
3s8n
RCSB PDB
PDBbind
117aa, >3S8N_1|Chain... at 94%
3s8o
RCSB PDB
PDBbind
117aa, >3S8O_1|Chain... at 94%
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1bmb
RCSB PDB
PDBbind
9-mer
1f90
RCSB PDB
PDBbind
9-mer
1fzk
RCSB PDB
PDBbind
9-mer
1fzo
RCSB PDB
PDBbind
9-mer
1g3f
RCSB PDB
PDBbind
9-mer
1g7p
RCSB PDB
PDBbind
9-mer
1gux
RCSB PDB
PDBbind
9-mer
1gwq
RCSB PDB
PDBbind
9-mer
1h24
RCSB PDB
PDBbind
9-mer
1inq
RCSB PDB
PDBbind
9-mer
1jp5
RCSB PDB
PDBbind
9-mer
1juf
RCSB PDB
PDBbind
9-mer
1kl3
RCSB PDB
PDBbind
9-mer
1kl5
RCSB PDB
PDBbind
9-mer
1lb6
RCSB PDB
PDBbind
9-mer
1mfg
RCSB PDB
PDBbind
9-mer
1mpa
RCSB PDB
PDBbind
9-mer
1nlo
RCSB PDB
PDBbind
9-mer
1oai
RCSB PDB
PDBbind
9-mer
1oxn
RCSB PDB
PDBbind
9-mer
1oxq
RCSB PDB
PDBbind
9-mer
1oy7
RCSB PDB
PDBbind
9-mer
1pcg
RCSB PDB
PDBbind
9-mer
1prl
RCSB PDB
PDBbind
9-mer
1prm
RCSB PDB
PDBbind
9-mer
1rlp
RCSB PDB
PDBbind
9-mer
1rlq
RCSB PDB
PDBbind
9-mer
1rst
RCSB PDB
PDBbind
9-mer
1utc
RCSB PDB
PDBbind
9-mer
1vwf
RCSB PDB
PDBbind
9-mer
1vwl
RCSB PDB
PDBbind
9-mer
1x7q
RCSB PDB
PDBbind
9-mer
1xr8
RCSB PDB
PDBbind
9-mer
1xr9
RCSB PDB
PDBbind
9-mer
1zea
RCSB PDB
PDBbind
9-mer
2bgn
RCSB PDB
PDBbind
9-mer
2bgr
RCSB PDB
PDBbind
9-mer
2e7l
RCSB PDB
PDBbind
9-mer
2gv2
RCSB PDB
PDBbind
9-mer
2h6q
RCSB PDB
PDBbind
9-mer
2hkf
RCSB PDB
PDBbind
9-mer
2jo9
RCSB PDB
PDBbind
9-mer
2jup
RCSB PDB
PDBbind
9-mer
2kgi
RCSB PDB
PDBbind
9-mer
2khh
RCSB PDB
PDBbind
9-mer
2lnw
RCSB PDB
PDBbind
9-mer
2lsv
RCSB PDB
PDBbind
9-mer
2mpa
RCSB PDB
PDBbind
9-mer
2ms4
RCSB PDB
PDBbind
9-mer
2oei
RCSB PDB
PDBbind
9-mer
2oi9
RCSB PDB
PDBbind
9-mer
2q8y
RCSB PDB
PDBbind
9-mer
2qt5
RCSB PDB
PDBbind
9-mer
2rm0
RCSB PDB
PDBbind
9-mer
2v83
RCSB PDB
PDBbind
9-mer
2v86
RCSB PDB
PDBbind
9-mer
2vpe
RCSB PDB
PDBbind
9-mer
2w0z
RCSB PDB
PDBbind
9-mer
2x3t
RCSB PDB
PDBbind
9-mer
2x4o
RCSB PDB
PDBbind
9-mer
2x4r
RCSB PDB
PDBbind
9-mer
2x4s
RCSB PDB
PDBbind
9-mer
2x4t
RCSB PDB
PDBbind
9-mer
2x4u
RCSB PDB
PDBbind
9-mer
2xhs
RCSB PDB
PDBbind
9-mer
2ymt
RCSB PDB
PDBbind
9-mer
3ah8
RCSB PDB
PDBbind
9-mer
3bgm
RCSB PDB
PDBbind
9-mer
3bze
RCSB PDB
PDBbind
9-mer
3bzf
RCSB PDB
PDBbind
9-mer
3bzi
RCSB PDB
PDBbind
9-mer
3cii
RCSB PDB
PDBbind
9-mer
3cyy
RCSB PDB
PDBbind
9-mer
3d1f
RCSB PDB
PDBbind
9-mer
3d25
RCSB PDB
PDBbind
9-mer
3drg
RCSB PDB
PDBbind
9-mer
3ery
RCSB PDB
PDBbind
9-mer
3fbr
RCSB PDB
PDBbind
9-mer
3fn0
RCSB PDB
PDBbind
9-mer
3ft2
RCSB PDB
PDBbind
9-mer
3ft3
RCSB PDB
PDBbind
9-mer
3ft4
RCSB PDB
PDBbind
9-mer
3gl6
RCSB PDB
PDBbind
9-mer
3iet
RCSB PDB
PDBbind
9-mer
3k27
RCSB PDB
PDBbind
9-mer
3lqi
RCSB PDB
PDBbind
9-mer
3lqj
RCSB PDB
PDBbind
9-mer
3mxy
RCSB PDB
PDBbind
9-mer
3o4l
RCSB PDB
PDBbind
9-mer
3o6m
RCSB PDB
PDBbind
9-mer
3obq
RCSB PDB
PDBbind
9-mer
3obu
RCSB PDB
PDBbind
9-mer
3obx
RCSB PDB
PDBbind
9-mer
3qfd
RCSB PDB
PDBbind
9-mer
3r0h
RCSB PDB
PDBbind
9-mer
3r42
RCSB PDB
PDBbind
9-mer
3rwc
RCSB PDB
PDBbind
9-mer
3rwe
RCSB PDB
PDBbind
9-mer
3rwf
RCSB PDB
PDBbind
9-mer
3rwg
RCSB PDB
PDBbind
9-mer
3soq
RCSB PDB
PDBbind
9-mer
3sou
RCSB PDB
PDBbind
9-mer
3sov
RCSB PDB
PDBbind
9-mer
3sow
RCSB PDB
PDBbind
9-mer
3t5i
RCSB PDB
PDBbind
9-mer
3tf7
RCSB PDB
PDBbind
9-mer
3tfk
RCSB PDB
PDBbind
9-mer
3tjh
RCSB PDB
PDBbind
9-mer
3tpu
RCSB PDB
PDBbind
9-mer
3zhf
RCSB PDB
PDBbind
9-mer
4bt9
RCSB PDB
PDBbind
9-mer
4btb
RCSB PDB
PDBbind
9-mer
4cdr
RCSB PDB
PDBbind
9-mer
4ezq
RCSB PDB
PDBbind
9-mer
4ezt
RCSB PDB
PDBbind
9-mer
4fcm
RCSB PDB
PDBbind
9-mer
4fmn
RCSB PDB
PDBbind
9-mer
4i80
RCSB PDB
PDBbind
9-mer
4iho
RCSB PDB
PDBbind
9-mer
4j3u
RCSB PDB
PDBbind
9-mer
4mex
RCSB PDB
PDBbind
9-mer
4mnq
RCSB PDB
PDBbind
9-mer
4mzf
RCSB PDB
PDBbind
9-mer
4mzh
RCSB PDB
PDBbind
9-mer
4o2e
RCSB PDB
PDBbind
9-mer
4od7
RCSB PDB
PDBbind
9-mer
4pg9
RCSB PDB
PDBbind
9-mer
4pgb
RCSB PDB
PDBbind
9-mer
4pgc
RCSB PDB
PDBbind
9-mer
4pgd
RCSB PDB
PDBbind
9-mer
4pge
RCSB PDB
PDBbind
9-mer
4qbm
RCSB PDB
PDBbind
9-mer
4rh5
RCSB PDB
PDBbind
9-mer
4utn
RCSB PDB
PDBbind
9-mer
4utr
RCSB PDB
PDBbind
9-mer
4utv
RCSB PDB
PDBbind
9-mer
4utx
RCSB PDB
PDBbind
9-mer
4uu7
RCSB PDB
PDBbind
9-mer
4uu8
RCSB PDB
PDBbind
9-mer
4uua
RCSB PDB
PDBbind
9-mer
4uub
RCSB PDB
PDBbind
9-mer
4x3h
RCSB PDB
PDBbind
9-mer
4y5i
RCSB PDB
PDBbind
9-mer
4yoz
RCSB PDB
PDBbind
9-mer
5apr
RCSB PDB
PDBbind
9-mer
5brz
RCSB PDB
PDBbind
9-mer
5bs0
RCSB PDB
PDBbind
9-mer
5cvd
RCSB PDB
PDBbind
9-mer
5d0j
RCSB PDB
PDBbind
9-mer
5dms
RCSB PDB
PDBbind
9-mer
5e4w
RCSB PDB
PDBbind
9-mer
5eel
RCSB PDB
PDBbind
9-mer
5eok
RCSB PDB
PDBbind
9-mer
5fjw
RCSB PDB
PDBbind
9-mer
5gu4
RCSB PDB
PDBbind
9-mer
5hda
RCSB PDB
PDBbind
9-mer
5heb
RCSB PDB
PDBbind
9-mer
5hed
RCSB PDB
PDBbind
9-mer
5hey
RCSB PDB
PDBbind
9-mer
5hf1
RCSB PDB
PDBbind
9-mer
5hfb
RCSB PDB
PDBbind
9-mer
5hfc
RCSB PDB
PDBbind
9-mer
5hff
RCSB PDB
PDBbind
9-mer
5hjc
RCSB PDB
PDBbind
9-mer
5hkh
RCSB PDB
PDBbind
9-mer
5i8c
RCSB PDB
PDBbind
9-mer
5isz
RCSB PDB
PDBbind
9-mer
5jhd
RCSB PDB
PDBbind
9-mer
5lb7
RCSB PDB
PDBbind
9-mer
5lgs
RCSB PDB
PDBbind
9-mer
5nme
RCSB PDB
PDBbind
9-mer
5nmf
RCSB PDB
PDBbind
9-mer
5nmg
RCSB PDB
PDBbind
9-mer
5npr
RCSB PDB
PDBbind
9-mer
5nps
RCSB PDB
PDBbind
9-mer
5swf
RCSB PDB
PDBbind
9-mer
5u98
RCSB PDB
PDBbind
9-mer
5w1v
RCSB PDB
PDBbind
9-mer
5w1w
RCSB PDB
PDBbind
9-mer
5w7x
RCSB PDB
PDBbind
9-mer
5yc3
RCSB PDB
PDBbind
9-mer
5yc4
RCSB PDB
PDBbind
9-mer
5ygf
RCSB PDB
PDBbind
9-mer
5yvx
RCSB PDB
PDBbind
9-mer
5yy4
RCSB PDB
PDBbind
9-mer
5zia
RCSB PDB
PDBbind
9-mer
6bj2
RCSB PDB
PDBbind
9-mer
6bj3
RCSB PDB
PDBbind
9-mer
6c4u
RCSB PDB
PDBbind
9-mer
6evm
RCSB PDB
PDBbind
9-mer
6evn
RCSB PDB
PDBbind
9-mer
6evo
RCSB PDB
PDBbind
9-mer
6evp
RCSB PDB
PDBbind
9-mer
6fdp
RCSB PDB
PDBbind
9-mer
6fdt
RCSB PDB
PDBbind
9-mer
6qts
RCSB PDB
PDBbind
9-mer
6qtq
RCSB PDB
PDBbind
9-mer
6q38
RCSB PDB
PDBbind
9-mer
6o9c
RCSB PDB
PDBbind
9-mer
6o9b
RCSB PDB
PDBbind
9-mer
6ncp
RCSB PDB
PDBbind
9-mer
6mt6
RCSB PDB
PDBbind
9-mer
6mt5
RCSB PDB
PDBbind
9-mer
6mt4
RCSB PDB
PDBbind
9-mer
6i7a
RCSB PDB
PDBbind
9-mer
6i68
RCSB PDB
PDBbind
9-mer
6i5p
RCSB PDB
PDBbind
9-mer
6i41
RCSB PDB
PDBbind
9-mer
6hlb
RCSB PDB
PDBbind
9-mer
6eqa
RCSB PDB
PDBbind
9-mer
6d78
RCSB PDB
PDBbind
9-mer
6aee
RCSB PDB
PDBbind
9-mer
5y5w
RCSB PDB
PDBbind
9-mer
5wlg
RCSB PDB
PDBbind
9-mer
5u1q
RCSB PDB
PDBbind
9-mer
5u06
RCSB PDB
PDBbind
9-mer
5tyi
RCSB PDB
PDBbind
9-mer
5iza
RCSB PDB
PDBbind
9-mer
5iz9
RCSB PDB
PDBbind
9-mer
5iz6
RCSB PDB
PDBbind
9-mer
6a9c
RCSB PDB
PDBbind
9-mer
5b6g
RCSB PDB
PDBbind
9-mer
Entry Information
PDB ID
3mxc
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Growth factor receptor-bound protein 2, Grb2-SH2
Ligand Name
9-mer
EC.Number
E.C.-.-.-.-
Resolution
2(Å)
Affinity (Kd/Ki/IC50)
Kd=286.1nM
Release Year
2011
Protein/NA Sequence
Check fasta file
Primary Reference
(2011) J.Mol.Biol. Vol. 414: pp. 217-230
Ligand Properties
Formula
C
3
3
H
5
1
N
8
O
1
6
P
Molecular Weight
846.776
Exact Mass
846.316
No. of atoms
109
No. of bonds
110
Polar Surface Area
414.88
LOGP Value
-4.64 (
Computed with XLOGP3
)
-2.87 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 8
No. of Hydrogen Bond Acceptors: 15
No. of Rotatable Bonds: 27
No. of Nitrogen and Oxygen Atoms: 24
No. of Rings: 2
Canonical SMILES
[NH3+]CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC)[C@H](O)C)CC(=O)N)CCC(=O)O)Cc1ccc(cc1)OP(O)(O)O
InChI String
InChI=1S/C33H51N8O16P/c1-3-19(33(52)53)37-31(50)27(16(2)42)40-30(49)23-5-4-12-41(23)32(51)22(14-24(35)43)39-28(47)20(10-11-26(45)46)38-29(48)21(36-25(44)15-34)13-17-6-8-18(9-7-17)57-58(54,55)56/h6-9,16,19-23,27,42,54-56,58H,3-5,10-15,34H2,1-2H3,(H2,35,43)(H,36,44)(H,37,50)(H,38,48)(H,39,47)(H,40,49)(H,45,46)(H,52,53)/p+1/t16-,19+,20+,21+,22+,23+,27+/m1/s1
Links to External Databases
RCSB PDB
The mother database
PDBsum
Enhanced annotations on PDB entries
Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
P62993
P05067
Entrez Gene ID
NCBI Entrez Gene ID:
2885
351
ASD
Information of known allosteric effects of PDB entries
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