Browse entries in the PDBbind-CN Database
HEADER 3MXY_COMPLEX COMPND 3MXY_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 101 GLY SER HIS MET LYS PRO HIS PRO TRP PHE PHE GLY LYS SEQRES 2 A 101 ILE PRO ARG ALA LYS ALA GLU GLU MET LEU SER LYS GLN SEQRES 3 A 101 ARG HIS ASP GLY ALA PHE LEU ILE ARG GLU SER GLU SER SEQRES 4 A 101 ALA PRO GLY ASP PHE SER LEU SER VAL LYS PHE GLY ASN SEQRES 5 A 101 ASP VAL GLN HIS PHE LYS VAL LEU ARG ASP GLY ALA GLY SEQRES 6 A 101 LYS TYR PHE LEU TRP VAL VAL LYS PHE ASN SER LEU ASN SEQRES 7 A 101 GLU LEU VAL ASP TYR HIS ARG SER THR SER VAL SER ARG SEQRES 8 A 101 ASN GLN GLN ILE PHE LEU ARG ASP ILE GLU HET GLY A 224 113 ATOM 1 N GLY A 52 11.991 -14.302 31.920 1.00 56.17 N ATOM 2 CA GLY A 52 11.828 -12.885 31.484 1.00 56.16 C ATOM 3 C GLY A 52 13.050 -12.377 30.708 1.00 56.23 C ATOM 4 O GLY A 52 14.155 -12.909 30.854 1.00 57.02 O ATOM 5 HA3 GLY A 52 11.686 -12.260 32.365 1.00 0.00 H ATOM 6 HA2 GLY A 52 10.949 -12.813 30.843 1.00 0.00 H ATOM 7 HN3 GLY A 52 12.824 -14.380 32.538 1.00 0.00 H ATOM 8 HN2 GLY A 52 12.120 -14.908 31.085 1.00 0.00 H ATOM 9 HN1 GLY A 52 11.142 -14.603 32.440 1.00 0.00 H ATOM 10 N SER A 53 12.895 -11.279 29.949 1.00 58.52 N ATOM 11 CA SER A 53 13.997 -10.671 29.168 1.00 57.00 C ATOM 12 C SER A 53 15.229 -10.561 30.004 1.00 55.88 C ATOM 13 O SER A 53 15.366 -9.667 30.822 1.00 58.46 O ATOM 14 CB SER A 53 13.635 -9.265 28.728 1.00 59.44 C ATOM 15 OG SER A 53 12.668 -9.221 27.697 1.00 54.76 O ATOM 16 HA SER A 53 14.168 -11.311 28.303 1.00 0.00 H ATOM 17 HB2 SER A 53 14.540 -8.772 28.372 1.00 0.00 H ATOM 18 HB3 SER A 53 13.244 -8.725 29.590 1.00 0.00 H ATOM 19 HG SER A 53 12.481 -8.278 27.461 1.00 0.00 H ATOM 20 H SER A 53 11.956 -10.835 29.908 1.00 0.00 H ATOM 21 N HIS A 54 16.093 -11.524 29.834 1.00 58.38 N ATOM 22 CA HIS A 54 17.306 -11.606 30.594 1.00 55.65 C ATOM 23 C HIS A 54 18.096 -10.232 30.791 1.00 54.43 C ATOM 24 O HIS A 54 18.481 -9.598 29.819 1.00 53.64 O ATOM 25 CB HIS A 54 18.021 -12.767 29.886 1.00 53.42 C ATOM 26 CG HIS A 54 17.046 -13.729 29.242 1.00 50.06 C ATOM 27 ND1 HIS A 54 16.007 -14.309 29.945 1.00 48.94 N ATOM 28 CD2 HIS A 54 16.866 -14.095 27.949 1.00 48.09 C ATOM 29 CE1 HIS A 54 15.229 -14.980 29.113 1.00 45.45 C ATOM 30 NE2 HIS A 54 15.726 -14.867 27.896 1.00 44.72 N ATOM 31 HA HIS A 54 17.166 -11.804 31.657 1.00 0.00 H ATOM 32 HB2 HIS A 54 18.674 -12.360 29.115 1.00 0.00 H ATOM 33 HB3 HIS A 54 18.619 -13.310 30.618 1.00 0.00 H ATOM 34 HD2 HIS A 54 17.505 -13.828 27.107 1.00 0.00 H ATOM 35 HE1 HIS A 54 14.330 -15.533 29.386 1.00 0.00 H ATOM 36 H HIS A 54 15.895 -12.257 29.123 1.00 0.00 H ATOM 37 N MET A 55 18.228 -9.742 32.047 1.00 56.99 N ATOM 38 CA MET A 55 18.946 -8.474 32.427 1.00 54.38 C ATOM 39 C MET A 55 20.436 -8.767 32.449 1.00 50.66 C ATOM 40 O MET A 55 20.964 -9.297 33.432 1.00 49.55 O ATOM 41 CB MET A 55 18.569 -7.986 33.849 1.00 59.54 C ATOM 42 CG MET A 55 17.938 -6.557 34.018 1.00 61.59 C ATOM 43 SD MET A 55 18.863 -5.047 33.618 1.00 68.58 S ATOM 44 CE MET A 55 17.546 -4.055 32.828 1.00 71.41 C ATOM 45 HA MET A 55 18.668 -7.707 31.704 1.00 0.00 H ATOM 46 HB2 MET A 55 17.854 -8.702 34.254 1.00 0.00 H ATOM 47 HB3 MET A 55 19.480 -8.007 34.447 1.00 0.00 H ATOM 48 HG2 MET A 55 17.651 -6.471 35.066 1.00 0.00 H ATOM 49 HG3 MET A 55 17.044 -6.542 33.395 1.00 0.00 H ATOM 50 HE1 MET A 55 17.168 -4.585 31.954 1.00 0.00 H ATOM 51 HE2 MET A 55 16.734 -3.899 33.539 1.00 0.00 H ATOM 52 HE3 MET A 55 17.953 -3.091 32.522 1.00 0.00 H ATOM 53 H MET A 55 17.795 -10.290 32.817 1.00 0.00 H ATOM 54 N LYS A 56 21.113 -8.409 31.372 1.00 48.54 N ATOM 55 CA LYS A 56 22.530 -8.677 31.250 1.00 45.38 C ATOM 56 C LYS A 56 23.293 -7.422 30.858 1.00 42.90 C ATOM 57 O LYS A 56 22.753 -6.548 30.182 1.00 43.03 O ATOM 58 CB LYS A 56 22.734 -9.747 30.179 1.00 46.00 C ATOM 59 CG LYS A 56 22.044 -11.076 30.465 1.00 49.07 C ATOM 60 CD LYS A 56 23.051 -12.092 30.978 1.00 52.50 C ATOM 61 CE LYS A 56 22.495 -13.503 30.933 1.00 52.83 C ATOM 62 NZ LYS A 56 22.574 -14.152 32.267 1.00 54.34 N ATOM 63 HA LYS A 56 22.908 -9.019 32.213 1.00 0.00 H ATOM 64 HB2 LYS A 56 22.349 -9.361 29.235 1.00 0.00 H ATOM 65 HB3 LYS A 56 23.804 -9.933 30.084 1.00 0.00 H ATOM 66 HG2 LYS A 56 21.270 -10.925 31.217 1.00 0.00 H ATOM 67 HG3 LYS A 56 21.590 -11.451 29.548 1.00 0.00 H ATOM 68 HD2 LYS A 56 23.947 -12.045 30.360 1.00 0.00 H ATOM 69 HD3 LYS A 56 23.309 -11.846 32.008 1.00 0.00 H ATOM 70 HE2 LYS A 56 23.070 -14.090 30.217 1.00 0.00 H ATOM 71 HE3 LYS A 56 21.453 -13.465 30.616 1.00 0.00 H ATOM 72 HZ1 LYS A 56 23.567 -14.195 32.572 1.00 0.00 H ATOM 73 HZ2 LYS A 56 22.023 -13.598 32.954 1.00 0.00 H ATOM 74 HZ3 LYS A 56 22.187 -15.115 32.206 1.00 0.00 H ATOM 75 H LYS A 56 20.617 -7.925 30.596 1.00 0.00 H ATOM 76 N PRO A 57 24.563 -7.312 31.279 1.00 40.72 N ATOM 77 CA PRO A 57 25.318 -6.115 30.902 1.00 37.71 C ATOM 78 C PRO A 57 25.475 -6.141 29.385 1.00 35.62 C ATOM 79 O PRO A 57 25.249 -7.178 28.761 1.00 35.19 O ATOM 80 CB PRO A 57 26.641 -6.304 31.633 1.00 38.87 C ATOM 81 CG PRO A 57 26.805 -7.796 31.632 1.00 39.68 C ATOM 82 CD PRO A 57 25.422 -8.275 31.991 1.00 40.62 C ATOM 83 HA PRO A 57 24.863 -5.158 31.159 1.00 0.00 H ATOM 84 HD3 PRO A 57 25.252 -9.292 31.638 1.00 0.00 H ATOM 85 HD2 PRO A 57 25.256 -8.232 33.067 1.00 0.00 H ATOM 86 HG3 PRO A 57 27.537 -8.113 32.375 1.00 0.00 H ATOM 87 HG2 PRO A 57 27.106 -8.159 30.649 1.00 0.00 H ATOM 88 HB2 PRO A 57 27.458 -5.818 31.100 1.00 0.00 H ATOM 89 HB3 PRO A 57 26.589 -5.914 32.650 1.00 0.00 H ATOM 90 N HIS A 58 25.840 -5.013 28.789 1.00 33.01 N ATOM 91 CA HIS A 58 26.015 -4.956 27.342 1.00 31.80 C ATOM 92 C HIS A 58 27.420 -5.396 26.963 1.00 31.83 C ATOM 93 O HIS A 58 28.409 -4.882 27.484 1.00 32.33 O ATOM 94 CB HIS A 58 25.753 -3.538 26.829 1.00 30.97 C ATOM 95 CG HIS A 58 24.322 -3.112 26.942 1.00 28.09 C ATOM 96 ND1 HIS A 58 23.305 -3.733 26.251 1.00 29.81 N ATOM 97 CD2 HIS A 58 23.736 -2.145 27.686 1.00 26.49 C ATOM 98 CE1 HIS A 58 22.153 -3.169 26.565 1.00 28.64 C ATOM 99 NE2 HIS A 58 22.387 -2.203 27.434 1.00 29.44 N ATOM 100 HA HIS A 58 25.297 -5.634 26.880 1.00 0.00 H ATOM 101 HB2 HIS A 58 26.365 -2.845 27.405 1.00 0.00 H ATOM 102 HB3 HIS A 58 26.044 -3.492 25.780 1.00 0.00 H ATOM 103 HD2 HIS A 58 24.240 -1.451 28.359 1.00 0.00 H ATOM 104 HE1 HIS A 58 21.176 -3.453 26.174 1.00 0.00 H ATOM 105 H HIS A 58 26.003 -4.159 29.360 1.00 0.00 H ATOM 106 N PRO A 59 27.529 -6.357 26.037 1.00 33.31 N ATOM 107 CA PRO A 59 28.848 -6.843 25.617 1.00 32.48 C ATOM 108 C PRO A 59 29.634 -5.873 24.737 1.00 31.02 C ATOM 109 O PRO A 59 30.736 -6.195 24.295 1.00 33.14 O ATOM 110 CB PRO A 59 28.519 -8.152 24.902 1.00 33.54 C ATOM 111 CG PRO A 59 27.196 -7.868 24.287 1.00 35.65 C ATOM 112 CD PRO A 59 26.443 -7.068 25.336 1.00 33.53 C ATOM 113 HA PRO A 59 29.520 -6.965 26.466 1.00 0.00 H ATOM 114 HD3 PRO A 59 25.748 -6.368 24.873 1.00 0.00 H ATOM 115 HD2 PRO A 59 25.898 -7.723 26.015 1.00 0.00 H ATOM 116 HG3 PRO A 59 26.670 -8.796 24.061 1.00 0.00 H ATOM 117 HG2 PRO A 59 27.314 -7.287 23.372 1.00 0.00 H ATOM 118 HB2 PRO A 59 29.265 -8.382 24.141 1.00 0.00 H ATOM 119 HB3 PRO A 59 28.455 -8.980 25.608 1.00 0.00 H ATOM 120 N TRP A 60 29.086 -4.682 24.496 1.00 27.53 N ATOM 121 CA TRP A 60 29.773 -3.704 23.661 1.00 23.37 C ATOM 122 C TRP A 60 30.524 -2.582 24.378 1.00 23.35 C ATOM 123 O TRP A 60 31.202 -1.790 23.726 1.00 22.24 O ATOM 124 CB TRP A 60 28.809 -3.090 22.631 1.00 21.68 C ATOM 125 CG TRP A 60 27.448 -2.666 23.151 1.00 18.86 C ATOM 126 CD1 TRP A 60 26.272 -3.340 22.997 1.00 17.01 C ATOM 127 CD2 TRP A 60 27.124 -1.453 23.846 1.00 17.26 C ATOM 128 NE1 TRP A 60 25.234 -2.622 23.545 1.00 18.05 N ATOM 129 CE2 TRP A 60 25.730 -1.458 24.073 1.00 16.29 C ATOM 130 CE3 TRP A 60 27.874 -0.359 24.297 1.00 18.72 C ATOM 131 CZ2 TRP A 60 25.068 -0.414 24.729 1.00 14.57 C ATOM 132 CZ3 TRP A 60 27.208 0.687 24.956 1.00 18.07 C ATOM 133 CH2 TRP A 60 25.822 0.646 25.162 1.00 15.37 C ATOM 134 HA TRP A 60 30.552 -4.298 23.183 1.00 0.00 H ATOM 135 HB2 TRP A 60 29.292 -2.209 22.208 1.00 0.00 H ATOM 136 HB3 TRP A 60 28.649 -3.828 21.845 1.00 0.00 H ATOM 137 HE1 TRP A 60 24.236 -2.915 23.557 1.00 0.00 H ATOM 138 HD1 TRP A 60 26.169 -4.309 22.509 1.00 0.00 H ATOM 139 HZ2 TRP A 60 23.990 -0.443 24.890 1.00 0.00 H ATOM 140 HH2 TRP A 60 25.334 1.474 25.677 1.00 0.00 H ATOM 141 HZ3 TRP A 60 27.778 1.545 25.313 1.00 0.00 H ATOM 142 HE3 TRP A 60 28.952 -0.321 24.140 1.00 0.00 H ATOM 143 H TRP A 60 28.160 -4.448 24.907 1.00 0.00 H ATOM 144 N PHE A 61 30.421 -2.499 25.703 1.00 22.52 N ATOM 145 CA PHE A 61 31.127 -1.440 26.428 1.00 22.52 C ATOM 146 C PHE A 61 32.466 -1.953 26.958 1.00 22.61 C ATOM 147 O PHE A 61 32.515 -2.660 27.963 1.00 23.59 O ATOM 148 CB PHE A 61 30.285 -0.914 27.593 1.00 20.50 C ATOM 149 CG PHE A 61 30.865 0.307 28.249 1.00 23.48 C ATOM 150 CD1 PHE A 61 30.539 1.580 27.790 1.00 25.15 C ATOM 151 CD2 PHE A 61 31.762 0.187 29.308 1.00 23.66 C ATOM 152 CE1 PHE A 61 31.097 2.717 28.374 1.00 24.95 C ATOM 153 CE2 PHE A 61 32.327 1.313 29.899 1.00 23.53 C ATOM 154 CZ PHE A 61 31.993 2.581 29.430 1.00 25.99 C ATOM 155 HA PHE A 61 31.305 -0.624 25.728 1.00 0.00 H ATOM 156 HB2 PHE A 61 29.293 -0.665 27.217 1.00 0.00 H ATOM 157 HB3 PHE A 61 30.202 -1.702 28.342 1.00 0.00 H ATOM 158 HD2 PHE A 61 32.025 -0.803 29.679 1.00 0.00 H ATOM 159 HE2 PHE A 61 33.028 1.203 30.726 1.00 0.00 H ATOM 160 HZ PHE A 61 32.433 3.466 29.890 1.00 0.00 H ATOM 161 HE1 PHE A 61 30.832 3.708 28.005 1.00 0.00 H ATOM 162 HD1 PHE A 61 29.838 1.690 26.963 1.00 0.00 H ATOM 163 H PHE A 61 29.839 -3.186 26.223 1.00 0.00 H ATOM 164 N PHE A 62 33.547 -1.572 26.285 1.00 22.23 N ATOM 165 CA PHE A 62 34.890 -2.004 26.659 1.00 22.38 C ATOM 166 C PHE A 62 35.658 -1.064 27.586 1.00 22.00 C ATOM 167 O PHE A 62 36.826 -1.305 27.894 1.00 22.22 O ATOM 168 CB PHE A 62 35.715 -2.269 25.391 1.00 22.09 C ATOM 169 CG PHE A 62 35.431 -3.602 24.760 1.00 21.46 C ATOM 170 CD1 PHE A 62 34.179 -3.879 24.229 1.00 20.75 C ATOM 171 CD2 PHE A 62 36.405 -4.596 24.738 1.00 22.64 C ATOM 172 CE1 PHE A 62 33.894 -5.129 23.685 1.00 23.32 C ATOM 173 CE2 PHE A 62 36.132 -5.853 24.196 1.00 24.19 C ATOM 174 CZ PHE A 62 34.872 -6.119 23.669 1.00 24.14 C ATOM 175 HA PHE A 62 34.743 -2.913 27.243 1.00 0.00 H ATOM 176 HB2 PHE A 62 35.492 -1.488 24.664 1.00 0.00 H ATOM 177 HB3 PHE A 62 36.772 -2.229 25.652 1.00 0.00 H ATOM 178 HD2 PHE A 62 37.393 -4.390 25.149 1.00 0.00 H ATOM 179 HE2 PHE A 62 36.903 -6.623 24.186 1.00 0.00 H ATOM 180 HZ PHE A 62 34.652 -7.099 23.245 1.00 0.00 H ATOM 181 HE1 PHE A 62 32.906 -5.332 23.272 1.00 0.00 H ATOM 182 HD1 PHE A 62 33.409 -3.108 24.238 1.00 0.00 H ATOM 183 H PHE A 62 33.432 -0.944 25.464 1.00 0.00 H ATOM 184 N GLY A 63 35.009 0.003 28.035 1.00 21.12 N ATOM 185 CA GLY A 63 35.677 0.928 28.926 1.00 20.56 C ATOM 186 C GLY A 63 36.845 1.624 28.265 1.00 21.66 C ATOM 187 O GLY A 63 36.788 1.940 27.082 1.00 21.10 O ATOM 188 HA3 GLY A 63 36.042 0.377 29.793 1.00 0.00 H ATOM 189 HA2 GLY A 63 34.959 1.681 29.252 1.00 0.00 H ATOM 190 H GLY A 63 34.024 0.174 27.748 1.00 0.00 H ATOM 191 N LYS A 64 37.910 1.857 29.026 1.00 23.44 N ATOM 192 CA LYS A 64 39.082 2.540 28.499 1.00 25.77 C ATOM 193 C LYS A 64 40.125 1.611 27.887 1.00 27.65 C ATOM 194 O LYS A 64 40.878 0.940 28.596 1.00 29.49 O ATOM 195 CB LYS A 64 39.740 3.380 29.597 1.00 26.87 C ATOM 196 CG LYS A 64 40.780 4.370 29.070 1.00 27.91 C ATOM 197 CD LYS A 64 41.352 5.226 30.187 1.00 28.81 C ATOM 198 CE LYS A 64 42.335 6.251 29.641 1.00 30.74 C ATOM 199 NZ LYS A 64 42.922 7.080 30.729 1.00 31.85 N ATOM 200 HA LYS A 64 38.714 3.172 27.691 1.00 0.00 H ATOM 201 HB2 LYS A 64 38.962 3.940 30.115 1.00 0.00 H ATOM 202 HB3 LYS A 64 40.230 2.706 30.300 1.00 0.00 H ATOM 203 HG2 LYS A 64 41.591 3.815 28.599 1.00 0.00 H ATOM 204 HG3 LYS A 64 40.309 5.019 28.332 1.00 0.00 H ATOM 205 HD2 LYS A 64 40.537 5.746 30.690 1.00 0.00 H ATOM 206 HD3 LYS A 64 41.867 4.583 30.901 1.00 0.00 H ATOM 207 HE2 LYS A 64 41.814 6.903 28.941 1.00 0.00 H ATOM 208 HE3 LYS A 64 43.138 5.729 29.121 1.00 0.00 H ATOM 209 HZ1 LYS A 64 42.162 7.586 31.227 1.00 0.00 H ATOM 210 HZ2 LYS A 64 43.426 6.464 31.399 1.00 0.00 H ATOM 211 HZ3 LYS A 64 43.587 7.767 30.319 1.00 0.00 H ATOM 212 H LYS A 64 37.905 1.545 30.018 1.00 0.00 H ATOM 213 N ILE A 65 40.163 1.582 26.561 1.00 28.91 N ATOM 214 CA ILE A 65 41.123 0.767 25.829 1.00 30.17 C ATOM 215 C ILE A 65 41.632 1.610 24.671 1.00 28.71 C ATOM 216 O ILE A 65 40.879 2.386 24.083 1.00 28.36 O ATOM 217 CB ILE A 65 40.481 -0.525 25.280 1.00 30.86 C ATOM 218 CG1 ILE A 65 39.374 -0.187 24.284 1.00 31.07 C ATOM 219 CG2 ILE A 65 39.904 -1.336 26.428 1.00 33.90 C ATOM 220 CD1 ILE A 65 38.893 -1.391 23.508 1.00 34.81 C ATOM 221 HA ILE A 65 41.929 0.465 26.498 1.00 0.00 H ATOM 222 HB ILE A 65 41.247 -1.108 24.769 1.00 0.00 H ATOM 223 HG12 ILE A 65 38.530 0.234 24.831 1.00 0.00 H ATOM 224 HG13 ILE A 65 39.754 0.552 23.579 1.00 0.00 H ATOM 225 HD11 ILE A 65 39.725 -1.817 22.948 1.00 0.00 H ATOM 226 HD12 ILE A 65 38.501 -2.135 24.201 1.00 0.00 H ATOM 227 HD13 ILE A 65 38.107 -1.086 22.817 1.00 0.00 H ATOM 228 HG21 ILE A 65 40.701 -1.595 27.125 1.00 0.00 H ATOM 229 HG22 ILE A 65 39.147 -0.746 26.944 1.00 0.00 H ATOM 230 HG23 ILE A 65 39.452 -2.247 26.036 1.00 0.00 H ATOM 231 H ILE A 65 39.484 2.161 26.026 1.00 0.00 H ATOM 232 N PRO A 66 42.923 1.481 24.337 1.00 27.23 N ATOM 233 CA PRO A 66 43.469 2.273 23.232 1.00 26.07 C ATOM 234 C PRO A 66 42.783 1.997 21.899 1.00 24.90 C ATOM 235 O PRO A 66 42.245 0.918 21.672 1.00 23.19 O ATOM 236 CB PRO A 66 44.948 1.875 23.216 1.00 26.24 C ATOM 237 CG PRO A 66 45.223 1.501 24.652 1.00 26.21 C ATOM 238 CD PRO A 66 43.985 0.716 25.017 1.00 26.97 C ATOM 239 HA PRO A 66 43.313 3.342 23.374 1.00 0.00 H ATOM 240 HD3 PRO A 66 44.039 -0.306 24.642 1.00 0.00 H ATOM 241 HD2 PRO A 66 43.831 0.698 26.096 1.00 0.00 H ATOM 242 HG3 PRO A 66 45.329 2.387 25.278 1.00 0.00 H ATOM 243 HG2 PRO A 66 46.120 0.888 24.737 1.00 0.00 H ATOM 244 HB2 PRO A 66 45.117 1.027 22.552 1.00 0.00 H ATOM 245 HB3 PRO A 66 45.574 2.711 22.903 1.00 0.00 H ATOM 246 N ARG A 67 42.811 3.000 21.029 1.00 25.59 N ATOM 247 CA ARG A 67 42.229 2.924 19.692 1.00 25.63 C ATOM 248 C ARG A 67 42.929 1.806 18.920 1.00 25.92 C ATOM 249 O ARG A 67 42.339 1.164 18.057 1.00 25.53 O ATOM 250 CB ARG A 67 42.429 4.276 19.000 1.00 23.99 C ATOM 251 CG ARG A 67 41.912 4.416 17.573 1.00 23.49 C ATOM 252 CD ARG A 67 42.190 5.842 17.085 1.00 20.60 C ATOM 253 NE ARG A 67 42.040 5.999 15.642 1.00 21.43 N ATOM 254 CZ ARG A 67 41.211 6.865 15.058 1.00 23.54 C ATOM 255 NH1 ARG A 67 40.439 7.665 15.793 1.00 18.83 N ATOM 256 NH2 ARG A 67 41.160 6.936 13.730 1.00 22.59 N ATOM 257 HA ARG A 67 41.162 2.705 19.737 1.00 0.00 H ATOM 258 HB2 ARG A 67 41.928 5.031 19.605 1.00 0.00 H ATOM 259 HB3 ARG A 67 43.500 4.479 18.982 1.00 0.00 H ATOM 260 HG2 ARG A 67 42.421 3.701 16.927 1.00 0.00 H ATOM 261 HG3 ARG A 67 40.839 4.223 17.551 1.00 0.00 H ATOM 262 HD2 ARG A 67 43.211 6.108 17.358 1.00 0.00 H ATOM 263 HD3 ARG A 67 41.495 6.519 17.581 1.00 0.00 H ATOM 264 HE ARG A 67 42.620 5.394 15.026 1.00 0.00 H ATOM 265 HH12 ARG A 67 39.796 8.337 15.328 1.00 0.00 H ATOM 266 HH11 ARG A 67 40.480 7.617 16.831 1.00 0.00 H ATOM 267 HH22 ARG A 67 40.515 7.610 13.270 1.00 0.00 H ATOM 268 HH21 ARG A 67 41.765 6.318 13.153 1.00 0.00 H ATOM 269 H ARG A 67 43.272 3.887 21.315 1.00 0.00 H ATOM 270 N ALA A 68 44.190 1.569 19.262 1.00 28.52 N ATOM 271 CA ALA A 68 44.987 0.535 18.610 1.00 29.84 C ATOM 272 C ALA A 68 44.513 -0.871 18.961 1.00 29.06 C ATOM 273 O ALA A 68 44.403 -1.721 18.084 1.00 30.18 O ATOM 274 CB ALA A 68 46.464 0.705 18.977 1.00 28.51 C ATOM 275 HA ALA A 68 44.861 0.655 17.534 1.00 0.00 H ATOM 276 HB1 ALA A 68 46.808 1.686 18.648 1.00 0.00 H ATOM 277 HB2 ALA A 68 46.581 0.621 20.058 1.00 0.00 H ATOM 278 HB3 ALA A 68 47.051 -0.071 18.486 1.00 0.00 H ATOM 279 H ALA A 68 44.623 2.138 20.018 1.00 0.00 H ATOM 280 N LYS A 69 44.227 -1.119 20.238 1.00 30.57 N ATOM 281 CA LYS A 69 43.767 -2.441 20.663 1.00 32.91 C ATOM 282 C LYS A 69 42.356 -2.751 20.158 1.00 31.02 C ATOM 283 O LYS A 69 42.012 -3.911 19.941 1.00 29.53 O ATOM 284 CB LYS A 69 43.811 -2.576 22.197 1.00 36.30 C ATOM 285 CG LYS A 69 45.214 -2.747 22.799 1.00 42.30 C ATOM 286 CD LYS A 69 45.142 -3.028 24.307 1.00 47.35 C ATOM 287 CE LYS A 69 46.524 -3.110 24.971 1.00 50.45 C ATOM 288 NZ LYS A 69 46.923 -1.859 25.691 1.00 51.20 N ATOM 289 HA LYS A 69 44.451 -3.165 20.220 1.00 0.00 H ATOM 290 HB2 LYS A 69 43.366 -1.679 22.628 1.00 0.00 H ATOM 291 HB3 LYS A 69 43.216 -3.445 22.476 1.00 0.00 H ATOM 292 HG2 LYS A 69 45.714 -3.581 22.305 1.00 0.00 H ATOM 293 HG3 LYS A 69 45.785 -1.834 22.634 1.00 0.00 H ATOM 294 HD2 LYS A 69 44.575 -2.228 24.783 1.00 0.00 H ATOM 295 HD3 LYS A 69 44.627 -3.976 24.459 1.00 0.00 H ATOM 296 HE2 LYS A 69 47.265 -3.314 24.198 1.00 0.00 H ATOM 297 HE3 LYS A 69 46.513 -3.931 25.688 1.00 0.00 H ATOM 298 HZ1 LYS A 69 46.949 -1.067 25.018 1.00 0.00 H ATOM 299 HZ2 LYS A 69 46.231 -1.656 26.440 1.00 0.00 H ATOM 300 HZ3 LYS A 69 47.865 -1.989 26.113 1.00 0.00 H ATOM 301 H LYS A 69 44.332 -0.362 20.943 1.00 0.00 H ATOM 302 N ALA A 70 41.541 -1.716 19.977 1.00 31.46 N ATOM 303 CA ALA A 70 40.177 -1.894 19.480 1.00 32.15 C ATOM 304 C ALA A 70 40.221 -2.277 18.001 1.00 32.12 C ATOM 305 O ALA A 70 39.428 -3.096 17.540 1.00 30.88 O ATOM 306 CB ALA A 70 39.374 -0.614 19.666 1.00 31.45 C ATOM 307 HA ALA A 70 39.692 -2.690 20.045 1.00 0.00 H ATOM 308 HB1 ALA A 70 39.337 -0.361 20.726 1.00 0.00 H ATOM 309 HB2 ALA A 70 39.851 0.196 19.114 1.00 0.00 H ATOM 310 HB3 ALA A 70 38.362 -0.764 19.291 1.00 0.00 H ATOM 311 H ALA A 70 41.881 -0.758 20.194 1.00 0.00 H ATOM 312 N GLU A 71 41.144 -1.668 17.262 1.00 33.43 N ATOM 313 CA GLU A 71 41.307 -1.987 15.853 1.00 36.50 C ATOM 314 C GLU A 71 41.890 -3.391 15.784 1.00 36.34 C ATOM 315 O GLU A 71 41.501 -4.197 14.944 1.00 37.26 O ATOM 316 CB GLU A 71 42.267 -1.005 15.167 1.00 37.07 C ATOM 317 CG GLU A 71 41.756 0.417 15.083 1.00 41.80 C ATOM 318 CD GLU A 71 42.587 1.290 14.162 1.00 43.47 C ATOM 319 OE1 GLU A 71 43.808 1.405 14.388 1.00 47.89 O ATOM 320 OE2 GLU A 71 42.016 1.866 13.215 1.00 41.25 O ATOM 321 HA GLU A 71 40.347 -1.919 15.342 1.00 0.00 H ATOM 322 HB2 GLU A 71 43.203 -0.998 15.725 1.00 0.00 H ATOM 323 HB3 GLU A 71 42.452 -1.361 14.154 1.00 0.00 H ATOM 324 HG2 GLU A 71 40.731 0.397 14.713 1.00 0.00 H ATOM 325 HG3 GLU A 71 41.771 0.852 16.082 1.00 0.00 H ATOM 326 H GLU A 71 41.759 -0.952 17.699 1.00 0.00 H ATOM 327 N GLU A 72 42.823 -3.680 16.685 1.00 37.64 N ATOM 328 CA GLU A 72 43.471 -4.985 16.718 1.00 39.80 C ATOM 329 C GLU A 72 42.450 -6.080 17.014 1.00 39.22 C ATOM 330 O GLU A 72 42.511 -7.174 16.456 1.00 40.50 O ATOM 331 CB GLU A 72 44.565 -5.013 17.788 1.00 41.57 C ATOM 332 CG GLU A 72 45.626 -6.077 17.559 1.00 48.29 C ATOM 333 CD GLU A 72 46.257 -6.582 18.848 1.00 53.16 C ATOM 334 OE1 GLU A 72 46.663 -5.750 19.691 1.00 56.02 O ATOM 335 OE2 GLU A 72 46.354 -7.820 19.014 1.00 55.21 O ATOM 336 HA GLU A 72 43.919 -5.164 15.741 1.00 0.00 H ATOM 337 HB2 GLU A 72 45.054 -4.039 17.805 1.00 0.00 H ATOM 338 HB3 GLU A 72 44.096 -5.199 18.754 1.00 0.00 H ATOM 339 HG2 GLU A 72 45.166 -6.921 17.045 1.00 0.00 H ATOM 340 HG3 GLU A 72 46.411 -5.655 16.931 1.00 0.00 H ATOM 341 H GLU A 72 43.097 -2.959 17.382 1.00 0.00 H ATOM 342 N MET A 73 41.508 -5.775 17.896 1.00 37.86 N ATOM 343 CA MET A 73 40.484 -6.734 18.280 1.00 36.58 C ATOM 344 C MET A 73 39.401 -6.878 17.213 1.00 35.02 C ATOM 345 O MET A 73 39.037 -7.994 16.840 1.00 35.57 O ATOM 346 CB MET A 73 39.874 -6.312 19.627 1.00 37.66 C ATOM 347 CG MET A 73 38.799 -7.229 20.183 1.00 39.53 C ATOM 348 SD MET A 73 37.145 -6.830 19.584 1.00 44.21 S ATOM 349 CE MET A 73 36.253 -8.322 19.987 1.00 42.68 C ATOM 350 HA MET A 73 40.953 -7.713 18.381 1.00 0.00 H ATOM 351 HB2 MET A 73 40.681 -6.261 20.358 1.00 0.00 H ATOM 352 HB3 MET A 73 39.436 -5.322 19.500 1.00 0.00 H ATOM 353 HG2 MET A 73 38.803 -7.149 21.270 1.00 0.00 H ATOM 354 HG3 MET A 73 39.034 -8.254 19.895 1.00 0.00 H ATOM 355 HE1 MET A 73 36.708 -9.167 19.470 1.00 0.00 H ATOM 356 HE2 MET A 73 36.294 -8.489 21.063 1.00 0.00 H ATOM 357 HE3 MET A 73 35.214 -8.219 19.673 1.00 0.00 H ATOM 358 H MET A 73 41.501 -4.827 18.324 1.00 0.00 H ATOM 359 N LEU A 74 38.904 -5.751 16.713 1.00 31.87 N ATOM 360 CA LEU A 74 37.850 -5.758 15.704 1.00 31.26 C ATOM 361 C LEU A 74 38.259 -6.274 14.317 1.00 30.58 C ATOM 362 O LEU A 74 37.417 -6.758 13.568 1.00 30.02 O ATOM 363 CB LEU A 74 37.236 -4.357 15.578 1.00 29.13 C ATOM 364 CG LEU A 74 36.395 -3.833 16.754 1.00 29.27 C ATOM 365 CD1 LEU A 74 36.009 -2.377 16.501 1.00 27.66 C ATOM 366 CD2 LEU A 74 35.141 -4.681 16.929 1.00 27.97 C ATOM 367 HA LEU A 74 37.119 -6.480 16.069 1.00 0.00 H ATOM 368 HB2 LEU A 74 38.056 -3.655 15.426 1.00 0.00 H ATOM 369 HB3 LEU A 74 36.595 -4.361 14.696 1.00 0.00 H ATOM 370 HG LEU A 74 36.987 -3.896 17.667 1.00 0.00 H ATOM 371 HD21 LEU A 74 34.544 -4.638 16.018 1.00 0.00 H ATOM 372 HD22 LEU A 74 35.427 -5.714 17.129 1.00 0.00 H ATOM 373 HD23 LEU A 74 34.558 -4.296 17.765 1.00 0.00 H ATOM 374 HD11 LEU A 74 36.912 -1.774 16.405 1.00 0.00 H ATOM 375 HD12 LEU A 74 35.427 -2.311 15.582 1.00 0.00 H ATOM 376 HD13 LEU A 74 35.413 -2.010 17.337 1.00 0.00 H ATOM 377 H LEU A 74 39.276 -4.840 17.050 1.00 0.00 H ATOM 378 N SER A 75 39.536 -6.178 13.967 1.00 32.07 N ATOM 379 CA SER A 75 39.978 -6.664 12.661 1.00 34.50 C ATOM 380 C SER A 75 39.860 -8.185 12.638 1.00 34.28 C ATOM 381 O SER A 75 39.763 -8.797 11.575 1.00 35.21 O ATOM 382 CB SER A 75 41.428 -6.252 12.388 1.00 34.83 C ATOM 383 OG SER A 75 42.317 -6.904 13.280 1.00 38.02 O ATOM 384 HA SER A 75 39.350 -6.226 11.885 1.00 0.00 H ATOM 385 HB2 SER A 75 41.523 -5.174 12.515 1.00 0.00 H ATOM 386 HB3 SER A 75 41.689 -6.521 11.364 1.00 0.00 H ATOM 387 HG SER A 75 42.086 -6.660 14.211 1.00 0.00 H ATOM 388 H SER A 75 40.224 -5.756 14.623 1.00 0.00 H ATOM 389 N LYS A 76 39.860 -8.786 13.825 1.00 35.29 N ATOM 390 CA LYS A 76 39.737 -10.235 13.956 1.00 36.08 C ATOM 391 C LYS A 76 38.275 -10.684 13.916 1.00 35.22 C ATOM 392 O LYS A 76 37.996 -11.883 13.898 1.00 36.01 O ATOM 393 CB LYS A 76 40.347 -10.719 15.274 1.00 36.53 C ATOM 394 CG LYS A 76 41.817 -10.422 15.480 1.00 40.09 C ATOM 395 CD LYS A 76 42.283 -11.130 16.739 1.00 44.95 C ATOM 396 CE LYS A 76 43.450 -10.431 17.400 1.00 46.96 C ATOM 397 NZ LYS A 76 43.664 -10.995 18.767 1.00 50.75 N ATOM 398 HA LYS A 76 40.273 -10.669 13.112 1.00 0.00 H ATOM 399 HB2 LYS A 76 39.795 -10.249 16.088 1.00 0.00 H ATOM 400 HB3 LYS A 76 40.216 -11.800 15.324 1.00 0.00 H ATOM 401 HG2 LYS A 76 42.388 -10.781 14.624 1.00 0.00 H ATOM 402 HG3 LYS A 76 41.963 -9.347 15.587 1.00 0.00 H ATOM 403 HD2 LYS A 76 41.454 -11.170 17.445 1.00 0.00 H ATOM 404 HD3 LYS A 76 42.585 -12.144 16.478 1.00 0.00 H ATOM 405 HE2 LYS A 76 43.238 -9.364 17.476 1.00 0.00 H ATOM 406 HE3 LYS A 76 44.349 -10.580 16.801 1.00 0.00 H ATOM 407 HZ1 LYS A 76 42.807 -10.852 19.338 1.00 0.00 H ATOM 408 HZ2 LYS A 76 43.867 -12.012 18.693 1.00 0.00 H ATOM 409 HZ3 LYS A 76 44.467 -10.512 19.218 1.00 0.00 H ATOM 410 H LYS A 76 39.950 -8.207 14.684 1.00 0.00 H ATOM 411 N GLN A 77 37.342 -9.737 13.919 1.00 33.14 N ATOM 412 CA GLN A 77 35.926 -10.098 13.890 1.00 33.14 C ATOM 413 C GLN A 77 35.512 -10.631 12.522 1.00 32.84 C ATOM 414 O GLN A 77 36.057 -10.231 11.495 1.00 34.17 O ATOM 415 CB GLN A 77 35.053 -8.898 14.285 1.00 32.12 C ATOM 416 CG GLN A 77 35.001 -8.615 15.795 1.00 27.31 C ATOM 417 CD GLN A 77 34.339 -9.739 16.595 1.00 26.11 C ATOM 418 OE1 GLN A 77 33.192 -10.106 16.346 1.00 25.44 O ATOM 419 NE2 GLN A 77 35.065 -10.281 17.562 1.00 24.29 N ATOM 420 HA GLN A 77 35.775 -10.895 14.618 1.00 0.00 H ATOM 421 HB2 GLN A 77 35.446 -8.012 13.786 1.00 0.00 H ATOM 422 HB3 GLN A 77 34.037 -9.088 13.939 1.00 0.00 H ATOM 423 HG2 GLN A 77 36.020 -8.484 16.159 1.00 0.00 H ATOM 424 HG3 GLN A 77 34.438 -7.696 15.957 1.00 0.00 H ATOM 425 HE22 GLN A 77 36.032 -9.941 17.740 1.00 0.00 H ATOM 426 HE21 GLN A 77 34.668 -11.047 18.143 1.00 0.00 H ATOM 427 H GLN A 77 37.621 -8.735 13.942 1.00 0.00 H ATOM 428 N ARG A 78 34.540 -11.535 12.516 1.00 33.92 N ATOM 429 CA ARG A 78 34.068 -12.147 11.280 1.00 35.03 C ATOM 430 C ARG A 78 33.097 -11.317 10.467 1.00 34.81 C ATOM 431 O ARG A 78 33.088 -11.396 9.243 1.00 34.67 O ATOM 432 CB ARG A 78 33.401 -13.489 11.576 1.00 37.47 C ATOM 433 CG ARG A 78 34.362 -14.627 11.861 1.00 42.20 C ATOM 434 CD ARG A 78 33.609 -15.944 12.013 1.00 44.04 C ATOM 435 NE ARG A 78 32.985 -16.081 13.325 1.00 47.64 N ATOM 436 CZ ARG A 78 33.663 -16.211 14.461 1.00 49.54 C ATOM 437 NH1 ARG A 78 34.990 -16.222 14.446 1.00 49.44 N ATOM 438 NH2 ARG A 78 33.017 -16.339 15.614 1.00 50.32 N ATOM 439 HA ARG A 78 34.969 -12.254 10.677 1.00 0.00 H ATOM 440 HB2 ARG A 78 32.756 -13.363 12.446 1.00 0.00 H ATOM 441 HB3 ARG A 78 32.795 -13.765 10.713 1.00 0.00 H ATOM 442 HG2 ARG A 78 35.070 -14.713 11.037 1.00 0.00 H ATOM 443 HG3 ARG A 78 34.904 -14.416 12.783 1.00 0.00 H ATOM 444 HD2 ARG A 78 34.310 -16.767 11.871 1.00 0.00 H ATOM 445 HD3 ARG A 78 32.833 -15.994 11.249 1.00 0.00 H ATOM 446 HE ARG A 78 31.946 -16.077 13.374 1.00 0.00 H ATOM 447 HH12 ARG A 78 35.519 -16.324 15.335 1.00 0.00 H ATOM 448 HH11 ARG A 78 35.501 -16.129 13.545 1.00 0.00 H ATOM 449 HH22 ARG A 78 33.551 -16.440 16.501 1.00 0.00 H ATOM 450 HH21 ARG A 78 31.977 -16.338 15.630 1.00 0.00 H ATOM 451 H ARG A 78 34.103 -11.814 13.418 1.00 0.00 H ATOM 452 N HIS A 79 32.286 -10.509 11.137 1.00 34.24 N ATOM 453 CA HIS A 79 31.289 -9.740 10.421 1.00 32.37 C ATOM 454 C HIS A 79 31.367 -8.222 10.446 1.00 31.84 C ATOM 455 O HIS A 79 31.758 -7.607 11.442 1.00 31.95 O ATOM 456 CB HIS A 79 29.913 -10.195 10.890 1.00 32.53 C ATOM 457 CG HIS A 79 29.647 -11.642 10.617 1.00 33.97 C ATOM 458 ND1 HIS A 79 29.435 -12.127 9.344 1.00 34.94 N ATOM 459 CD2 HIS A 79 29.613 -12.716 11.440 1.00 33.40 C ATOM 460 CE1 HIS A 79 29.284 -13.438 9.396 1.00 33.92 C ATOM 461 NE2 HIS A 79 29.388 -13.821 10.655 1.00 32.88 N ATOM 462 HA HIS A 79 31.498 -9.956 9.373 1.00 0.00 H ATOM 463 HB2 HIS A 79 29.839 -10.025 11.964 1.00 0.00 H ATOM 464 HB3 HIS A 79 29.157 -9.600 10.377 1.00 0.00 H ATOM 465 HD2 HIS A 79 29.740 -12.706 12.523 1.00 0.00 H ATOM 466 HE1 HIS A 79 29.104 -14.093 8.544 1.00 0.00 H ATOM 467 H HIS A 79 32.366 -10.428 12.171 1.00 0.00 H ATOM 468 N ASP A 80 30.981 -7.635 9.317 1.00 29.22 N ATOM 469 CA ASP A 80 30.951 -6.194 9.151 1.00 26.49 C ATOM 470 C ASP A 80 29.879 -5.658 10.083 1.00 24.63 C ATOM 471 O ASP A 80 28.766 -6.181 10.129 1.00 22.78 O ATOM 472 CB ASP A 80 30.608 -5.826 7.704 1.00 26.76 C ATOM 473 CG ASP A 80 31.700 -6.219 6.724 1.00 28.13 C ATOM 474 OD1 ASP A 80 32.878 -6.310 7.139 1.00 29.07 O ATOM 475 OD2 ASP A 80 31.383 -6.416 5.531 1.00 26.92 O ATOM 476 HA ASP A 80 31.926 -5.765 9.383 1.00 0.00 H ATOM 477 HB2 ASP A 80 29.687 -6.337 7.423 1.00 0.00 H ATOM 478 HB3 ASP A 80 30.457 -4.748 7.644 1.00 0.00 H ATOM 479 H ASP A 80 30.688 -8.234 8.519 1.00 0.00 H ATOM 480 N GLY A 81 30.214 -4.612 10.826 1.00 21.89 N ATOM 481 CA GLY A 81 29.256 -4.054 11.760 1.00 22.23 C ATOM 482 C GLY A 81 29.679 -4.375 13.180 1.00 21.63 C ATOM 483 O GLY A 81 29.204 -3.746 14.127 1.00 22.65 O ATOM 484 HA3 GLY A 81 28.272 -4.482 11.569 1.00 0.00 H ATOM 485 HA2 GLY A 81 29.211 -2.973 11.631 1.00 0.00 H ATOM 486 H GLY A 81 31.162 -4.193 10.739 1.00 0.00 H ATOM 487 N ALA A 82 30.560 -5.364 13.331 1.00 20.35 N ATOM 488 CA ALA A 82 31.064 -5.743 14.649 1.00 21.30 C ATOM 489 C ALA A 82 31.615 -4.446 15.237 1.00 21.35 C ATOM 490 O ALA A 82 32.382 -3.744 14.578 1.00 19.81 O ATOM 491 CB ALA A 82 32.162 -6.780 14.512 1.00 22.36 C ATOM 492 HA ALA A 82 30.294 -6.185 15.281 1.00 0.00 H ATOM 493 HB1 ALA A 82 31.765 -7.664 14.014 1.00 0.00 H ATOM 494 HB2 ALA A 82 32.980 -6.366 13.922 1.00 0.00 H ATOM 495 HB3 ALA A 82 32.528 -7.053 15.502 1.00 0.00 H ATOM 496 H ALA A 82 30.896 -5.878 12.491 1.00 0.00 H ATOM 497 N PHE A 83 31.235 -4.133 16.471 1.00 21.24 N ATOM 498 CA PHE A 83 31.641 -2.870 17.076 1.00 19.47 C ATOM 499 C PHE A 83 31.812 -2.916 18.590 1.00 19.26 C ATOM 500 O PHE A 83 31.587 -3.932 19.242 1.00 18.01 O ATOM 501 CB PHE A 83 30.572 -1.829 16.776 1.00 20.97 C ATOM 502 CG PHE A 83 29.303 -2.061 17.549 1.00 20.59 C ATOM 503 CD1 PHE A 83 29.017 -1.313 18.690 1.00 18.71 C ATOM 504 CD2 PHE A 83 28.452 -3.113 17.203 1.00 20.61 C ATOM 505 CE1 PHE A 83 27.909 -1.611 19.480 1.00 18.96 C ATOM 506 CE2 PHE A 83 27.339 -3.424 17.989 1.00 21.46 C ATOM 507 CZ PHE A 83 27.070 -2.669 19.133 1.00 21.82 C ATOM 508 HA PHE A 83 32.615 -2.632 16.649 1.00 0.00 H ATOM 509 HB2 PHE A 83 30.962 -0.844 17.033 1.00 0.00 H ATOM 510 HB3 PHE A 83 30.343 -1.861 15.711 1.00 0.00 H ATOM 511 HD2 PHE A 83 28.659 -3.699 16.308 1.00 0.00 H ATOM 512 HE2 PHE A 83 26.685 -4.251 17.711 1.00 0.00 H ATOM 513 HZ PHE A 83 26.206 -2.907 19.753 1.00 0.00 H ATOM 514 HE1 PHE A 83 27.698 -1.017 20.369 1.00 0.00 H ATOM 515 HD1 PHE A 83 29.669 -0.484 18.968 1.00 0.00 H ATOM 516 H PHE A 83 30.642 -4.795 17.011 1.00 0.00 H ATOM 517 N LEU A 84 32.185 -1.765 19.134 1.00 18.44 N ATOM 518 CA LEU A 84 32.369 -1.598 20.563 1.00 17.47 C ATOM 519 C LEU A 84 32.408 -0.107 20.846 1.00 19.02 C ATOM 520 O LEU A 84 32.750 0.692 19.970 1.00 18.05 O ATOM 521 CB LEU A 84 33.676 -2.256 21.021 1.00 15.71 C ATOM 522 CG LEU A 84 34.998 -1.777 20.406 1.00 15.06 C ATOM 523 CD1 LEU A 84 35.451 -0.505 21.092 1.00 14.69 C ATOM 524 CD2 LEU A 84 36.061 -2.853 20.566 1.00 14.19 C ATOM 525 HA LEU A 84 31.553 -2.074 21.106 1.00 0.00 H ATOM 526 HB2 LEU A 84 33.750 -2.107 22.098 1.00 0.00 H ATOM 527 HB3 LEU A 84 33.591 -3.322 20.808 1.00 0.00 H ATOM 528 HG LEU A 84 34.847 -1.578 19.345 1.00 0.00 H ATOM 529 HD21 LEU A 84 36.210 -3.060 21.626 1.00 0.00 H ATOM 530 HD22 LEU A 84 35.736 -3.762 20.059 1.00 0.00 H ATOM 531 HD23 LEU A 84 36.996 -2.506 20.127 1.00 0.00 H ATOM 532 HD11 LEU A 84 34.692 0.266 20.962 1.00 0.00 H ATOM 533 HD12 LEU A 84 35.596 -0.699 22.155 1.00 0.00 H ATOM 534 HD13 LEU A 84 36.390 -0.170 20.651 1.00 0.00 H ATOM 535 H LEU A 84 32.352 -0.949 18.511 1.00 0.00 H ATOM 536 N ILE A 85 32.019 0.262 22.058 1.00 19.33 N ATOM 537 CA ILE A 85 32.047 1.648 22.495 1.00 18.84 C ATOM 538 C ILE A 85 33.226 1.700 23.455 1.00 19.35 C ATOM 539 O ILE A 85 33.356 0.836 24.316 1.00 18.49 O ATOM 540 CB ILE A 85 30.759 2.032 23.257 1.00 20.12 C ATOM 541 CG1 ILE A 85 29.590 2.166 22.276 1.00 18.50 C ATOM 542 CG2 ILE A 85 30.980 3.324 24.045 1.00 17.90 C ATOM 543 CD1 ILE A 85 29.719 3.324 21.321 1.00 16.72 C ATOM 544 HA ILE A 85 32.127 2.335 21.652 1.00 0.00 H ATOM 545 HB ILE A 85 30.511 1.245 23.969 1.00 0.00 H ATOM 546 HG12 ILE A 85 29.524 1.247 21.694 1.00 0.00 H ATOM 547 HG13 ILE A 85 28.673 2.296 22.851 1.00 0.00 H ATOM 548 HD11 ILE A 85 29.773 4.255 21.886 1.00 0.00 H ATOM 549 HD12 ILE A 85 30.625 3.204 20.727 1.00 0.00 H ATOM 550 HD13 ILE A 85 28.851 3.348 20.662 1.00 0.00 H ATOM 551 HG21 ILE A 85 31.789 3.178 24.760 1.00 0.00 H ATOM 552 HG22 ILE A 85 31.242 4.128 23.357 1.00 0.00 H ATOM 553 HG23 ILE A 85 30.065 3.584 24.578 1.00 0.00 H ATOM 554 H ILE A 85 31.682 -0.466 22.720 1.00 0.00 H ATOM 555 N ARG A 86 34.097 2.690 23.295 1.00 19.76 N ATOM 556 CA ARG A 86 35.254 2.809 24.170 1.00 19.27 C ATOM 557 C ARG A 86 35.354 4.224 24.695 1.00 20.85 C ATOM 558 O ARG A 86 34.829 5.161 24.088 1.00 21.73 O ATOM 559 CB ARG A 86 36.543 2.431 23.425 1.00 18.27 C ATOM 560 CG ARG A 86 36.874 3.312 22.226 1.00 18.82 C ATOM 561 CD ARG A 86 38.000 2.716 21.375 1.00 17.32 C ATOM 562 NE ARG A 86 38.137 3.403 20.091 1.00 18.43 N ATOM 563 CZ ARG A 86 38.673 4.608 19.934 1.00 18.18 C ATOM 564 NH1 ARG A 86 39.140 5.272 20.982 1.00 17.63 N ATOM 565 NH2 ARG A 86 38.723 5.161 18.728 1.00 15.76 N ATOM 566 HA ARG A 86 35.129 2.121 25.006 1.00 0.00 H ATOM 567 HB2 ARG A 86 37.372 2.493 24.130 1.00 0.00 H ATOM 568 HB3 ARG A 86 36.442 1.404 23.073 1.00 0.00 H ATOM 569 HG2 ARG A 86 35.982 3.417 21.608 1.00 0.00 H ATOM 570 HG3 ARG A 86 37.184 4.294 22.584 1.00 0.00 H ATOM 571 HD2 ARG A 86 37.783 1.664 21.190 1.00 0.00 H ATOM 572 HD3 ARG A 86 38.939 2.802 21.922 1.00 0.00 H ATOM 573 HE ARG A 86 37.790 2.914 19.241 1.00 0.00 H ATOM 574 HH12 ARG A 86 39.559 6.215 20.855 1.00 0.00 H ATOM 575 HH11 ARG A 86 39.087 4.850 21.931 1.00 0.00 H ATOM 576 HH22 ARG A 86 39.143 6.105 18.606 1.00 0.00 H ATOM 577 HH21 ARG A 86 38.342 4.651 17.906 1.00 0.00 H ATOM 578 H ARG A 86 33.951 3.387 22.537 1.00 0.00 H ATOM 579 N GLU A 87 36.002 4.370 25.844 1.00 20.85 N ATOM 580 CA GLU A 87 36.186 5.677 26.442 1.00 21.46 C ATOM 581 C GLU A 87 37.486 6.211 25.880 1.00 23.55 C ATOM 582 O GLU A 87 38.556 5.667 26.144 1.00 23.52 O ATOM 583 CB GLU A 87 36.260 5.568 27.966 1.00 19.66 C ATOM 584 CG GLU A 87 35.074 4.833 28.573 1.00 18.60 C ATOM 585 CD GLU A 87 35.001 4.987 30.079 1.00 19.63 C ATOM 586 OE1 GLU A 87 34.734 6.118 30.560 1.00 19.42 O ATOM 587 OE2 GLU A 87 35.219 3.976 30.777 1.00 15.40 O ATOM 588 HA GLU A 87 35.352 6.341 26.215 1.00 0.00 H ATOM 589 HB2 GLU A 87 37.172 5.033 28.231 1.00 0.00 H ATOM 590 HB3 GLU A 87 36.295 6.574 28.384 1.00 0.00 H ATOM 591 HG2 GLU A 87 34.157 5.229 28.137 1.00 0.00 H ATOM 592 HG3 GLU A 87 35.160 3.773 28.334 1.00 0.00 H ATOM 593 H GLU A 87 36.385 3.531 26.324 1.00 0.00 H ATOM 594 N SER A 88 37.375 7.271 25.087 1.00 26.72 N ATOM 595 CA SER A 88 38.524 7.896 24.446 1.00 32.23 C ATOM 596 C SER A 88 39.607 8.317 25.426 1.00 34.20 C ATOM 597 O SER A 88 39.306 8.818 26.506 1.00 34.30 O ATOM 598 CB SER A 88 38.060 9.124 23.655 1.00 32.37 C ATOM 599 OG SER A 88 39.156 9.798 23.058 1.00 35.59 O ATOM 600 HA SER A 88 38.962 7.145 23.788 1.00 0.00 H ATOM 601 HB2 SER A 88 37.547 9.809 24.331 1.00 0.00 H ATOM 602 HB3 SER A 88 37.372 8.803 22.873 1.00 0.00 H ATOM 603 HG SER A 88 38.825 10.584 22.556 1.00 0.00 H ATOM 604 H SER A 88 36.430 7.671 24.917 1.00 0.00 H ATOM 605 N GLU A 89 40.870 8.102 25.066 1.00 37.88 N ATOM 606 CA GLU A 89 41.943 8.539 25.947 1.00 42.16 C ATOM 607 C GLU A 89 42.572 9.814 25.410 1.00 44.21 C ATOM 608 O GLU A 89 43.517 10.346 25.988 1.00 45.65 O ATOM 609 CB GLU A 89 42.993 7.434 26.182 1.00 42.37 C ATOM 610 CG GLU A 89 43.530 6.673 24.991 1.00 44.19 C ATOM 611 CD GLU A 89 44.241 5.396 25.425 1.00 46.03 C ATOM 612 OE1 GLU A 89 44.904 4.754 24.584 1.00 48.92 O ATOM 613 OE2 GLU A 89 44.129 5.026 26.614 1.00 47.64 O ATOM 614 HA GLU A 89 41.510 8.754 26.924 1.00 0.00 H ATOM 615 HB2 GLU A 89 43.846 7.902 26.674 1.00 0.00 H ATOM 616 HB3 GLU A 89 42.544 6.702 26.854 1.00 0.00 H ATOM 617 HG2 GLU A 89 42.701 6.412 24.333 1.00 0.00 H ATOM 618 HG3 GLU A 89 44.235 7.307 24.453 1.00 0.00 H ATOM 619 H GLU A 89 41.088 7.628 24.166 1.00 0.00 H ATOM 620 N SER A 90 42.005 10.315 24.314 1.00 47.93 N ATOM 621 CA SER A 90 42.469 11.548 23.686 1.00 50.38 C ATOM 622 C SER A 90 41.847 12.748 24.399 1.00 50.92 C ATOM 623 O SER A 90 42.345 13.864 24.293 1.00 53.17 O ATOM 624 CB SER A 90 42.090 11.569 22.197 1.00 51.10 C ATOM 625 OG SER A 90 40.685 11.517 22.008 1.00 54.54 O ATOM 626 HA SER A 90 43.555 11.599 23.767 1.00 0.00 H ATOM 627 HB2 SER A 90 42.544 10.709 21.705 1.00 0.00 H ATOM 628 HB3 SER A 90 42.473 12.486 21.749 1.00 0.00 H ATOM 629 HG SER A 90 40.330 10.683 22.407 1.00 0.00 H ATOM 630 H SER A 90 41.202 9.809 23.890 1.00 0.00 H ATOM 631 N ALA A 91 40.758 12.504 25.127 1.00 51.06 N ATOM 632 CA ALA A 91 40.052 13.546 25.879 1.00 49.32 C ATOM 633 C ALA A 91 39.084 12.885 26.868 1.00 46.85 C ATOM 634 O ALA A 91 38.230 12.091 26.477 1.00 47.13 O ATOM 635 CB ALA A 91 39.289 14.467 24.925 1.00 50.59 C ATOM 636 HA ALA A 91 40.776 14.148 26.428 1.00 0.00 H ATOM 637 HB1 ALA A 91 39.991 14.938 24.238 1.00 0.00 H ATOM 638 HB2 ALA A 91 38.563 13.882 24.360 1.00 0.00 H ATOM 639 HB3 ALA A 91 38.771 15.235 25.500 1.00 0.00 H ATOM 640 H ALA A 91 40.392 11.531 25.163 1.00 0.00 H ATOM 641 N PRO A 92 39.200 13.221 28.161 1.00 44.85 N ATOM 642 CA PRO A 92 38.362 12.676 29.238 1.00 41.12 C ATOM 643 C PRO A 92 36.855 12.821 29.069 1.00 36.72 C ATOM 644 O PRO A 92 36.354 13.885 28.709 1.00 35.87 O ATOM 645 CB PRO A 92 38.852 13.427 30.478 1.00 42.64 C ATOM 646 CG PRO A 92 40.254 13.805 30.132 1.00 44.00 C ATOM 647 CD PRO A 92 40.135 14.225 28.693 1.00 44.70 C ATOM 648 HA PRO A 92 38.474 11.592 29.276 1.00 0.00 H ATOM 649 HD3 PRO A 92 39.728 15.232 28.606 1.00 0.00 H ATOM 650 HD2 PRO A 92 41.098 14.179 28.185 1.00 0.00 H ATOM 651 HG3 PRO A 92 40.929 12.956 30.240 1.00 0.00 H ATOM 652 HG2 PRO A 92 40.605 14.628 30.755 1.00 0.00 H ATOM 653 HB2 PRO A 92 38.244 14.313 30.662 1.00 0.00 H ATOM 654 HB3 PRO A 92 38.828 12.783 31.357 1.00 0.00 H ATOM 655 N GLY A 93 36.135 11.742 29.354 1.00 34.08 N ATOM 656 CA GLY A 93 34.688 11.773 29.265 1.00 29.99 C ATOM 657 C GLY A 93 34.108 11.627 27.877 1.00 27.37 C ATOM 658 O GLY A 93 32.898 11.676 27.707 1.00 30.39 O ATOM 659 HA3 GLY A 93 34.349 12.726 29.670 1.00 0.00 H ATOM 660 HA2 GLY A 93 34.298 10.960 29.877 1.00 0.00 H ATOM 661 H GLY A 93 36.614 10.866 29.644 1.00 0.00 H ATOM 662 N ASP A 94 34.951 11.458 26.872 1.00 25.61 N ATOM 663 CA ASP A 94 34.441 11.298 25.521 1.00 25.39 C ATOM 664 C ASP A 94 34.367 9.814 25.181 1.00 23.44 C ATOM 665 O ASP A 94 35.123 9.006 25.722 1.00 22.53 O ATOM 666 CB ASP A 94 35.343 12.032 24.518 1.00 26.71 C ATOM 667 CG ASP A 94 34.983 13.507 24.372 1.00 28.92 C ATOM 668 OD1 ASP A 94 34.248 14.051 25.225 1.00 30.21 O ATOM 669 OD2 ASP A 94 35.447 14.129 23.399 1.00 30.66 O ATOM 670 HA ASP A 94 33.442 11.731 25.461 1.00 0.00 H ATOM 671 HB2 ASP A 94 36.376 11.957 24.858 1.00 0.00 H ATOM 672 HB3 ASP A 94 35.246 11.551 23.545 1.00 0.00 H ATOM 673 H ASP A 94 35.976 11.440 27.048 1.00 0.00 H ATOM 674 N PHE A 95 33.436 9.456 24.304 1.00 20.82 N ATOM 675 CA PHE A 95 33.296 8.074 23.892 1.00 19.87 C ATOM 676 C PHE A 95 33.524 7.989 22.395 1.00 19.63 C ATOM 677 O PHE A 95 33.284 8.950 21.666 1.00 19.83 O ATOM 678 CB PHE A 95 31.903 7.532 24.218 1.00 19.14 C ATOM 679 CG PHE A 95 31.584 7.505 25.686 1.00 19.75 C ATOM 680 CD1 PHE A 95 30.940 8.579 26.293 1.00 20.86 C ATOM 681 CD2 PHE A 95 31.916 6.401 26.460 1.00 18.05 C ATOM 682 CE1 PHE A 95 30.629 8.546 27.655 1.00 21.21 C ATOM 683 CE2 PHE A 95 31.610 6.360 27.817 1.00 18.60 C ATOM 684 CZ PHE A 95 30.965 7.431 28.413 1.00 19.40 C ATOM 685 HA PHE A 95 34.028 7.474 24.432 1.00 0.00 H ATOM 686 HB2 PHE A 95 31.165 8.160 23.718 1.00 0.00 H ATOM 687 HB3 PHE A 95 31.832 6.515 23.833 1.00 0.00 H ATOM 688 HD2 PHE A 95 32.424 5.554 25.998 1.00 0.00 H ATOM 689 HE2 PHE A 95 31.878 5.486 28.410 1.00 0.00 H ATOM 690 HZ PHE A 95 30.721 7.399 29.475 1.00 0.00 H ATOM 691 HE1 PHE A 95 30.124 9.392 28.121 1.00 0.00 H ATOM 692 HD1 PHE A 95 30.676 9.455 25.700 1.00 0.00 H ATOM 693 H PHE A 95 32.799 10.177 23.908 1.00 0.00 H ATOM 694 N SER A 96 33.995 6.832 21.948 1.00 19.15 N ATOM 695 CA SER A 96 34.237 6.594 20.537 1.00 19.42 C ATOM 696 C SER A 96 33.584 5.275 20.164 1.00 19.06 C ATOM 697 O SER A 96 33.484 4.362 20.987 1.00 18.04 O ATOM 698 CB SER A 96 35.740 6.525 20.244 1.00 20.54 C ATOM 699 OG SER A 96 36.338 7.802 20.349 1.00 22.57 O ATOM 700 HA SER A 96 33.818 7.413 19.952 1.00 0.00 H ATOM 701 HB2 SER A 96 35.889 6.144 19.234 1.00 0.00 H ATOM 702 HB3 SER A 96 36.212 5.851 20.959 1.00 0.00 H ATOM 703 HG SER A 96 36.209 8.151 21.266 1.00 0.00 H ATOM 704 H SER A 96 34.197 6.073 22.629 1.00 0.00 H ATOM 705 N LEU A 97 33.141 5.183 18.918 1.00 19.00 N ATOM 706 CA LEU A 97 32.496 3.982 18.411 1.00 19.77 C ATOM 707 C LEU A 97 33.420 3.426 17.329 1.00 19.28 C ATOM 708 O LEU A 97 33.741 4.120 16.366 1.00 19.37 O ATOM 709 CB LEU A 97 31.139 4.344 17.798 1.00 19.69 C ATOM 710 CG LEU A 97 30.037 3.300 17.602 1.00 21.83 C ATOM 711 CD1 LEU A 97 29.153 3.777 16.455 1.00 18.69 C ATOM 712 CD2 LEU A 97 30.599 1.923 17.291 1.00 22.08 C ATOM 713 HA LEU A 97 32.326 3.254 19.204 1.00 0.00 H ATOM 714 HB2 LEU A 97 30.714 5.122 18.432 1.00 0.00 H ATOM 715 HB3 LEU A 97 31.349 4.756 16.811 1.00 0.00 H ATOM 716 HG LEU A 97 29.468 3.201 18.527 1.00 0.00 H ATOM 717 HD21 LEU A 97 31.188 1.971 16.375 1.00 0.00 H ATOM 718 HD22 LEU A 97 31.233 1.596 18.115 1.00 0.00 H ATOM 719 HD23 LEU A 97 29.778 1.218 17.161 1.00 0.00 H ATOM 720 HD11 LEU A 97 28.721 4.745 16.709 1.00 0.00 H ATOM 721 HD12 LEU A 97 29.754 3.872 15.550 1.00 0.00 H ATOM 722 HD13 LEU A 97 28.355 3.054 16.288 1.00 0.00 H ATOM 723 H LEU A 97 33.259 5.997 18.282 1.00 0.00 H ATOM 724 N SER A 98 33.861 2.185 17.496 1.00 18.32 N ATOM 725 CA SER A 98 34.743 1.563 16.518 1.00 18.87 C ATOM 726 C SER A 98 33.990 0.425 15.843 1.00 20.38 C ATOM 727 O SER A 98 33.457 -0.462 16.511 1.00 21.33 O ATOM 728 CB SER A 98 36.003 1.039 17.203 1.00 17.85 C ATOM 729 OG SER A 98 36.692 2.094 17.850 1.00 18.52 O ATOM 730 HA SER A 98 35.047 2.296 15.771 1.00 0.00 H ATOM 731 HB2 SER A 98 36.657 0.588 16.456 1.00 0.00 H ATOM 732 HB3 SER A 98 35.724 0.287 17.941 1.00 0.00 H ATOM 733 HG SER A 98 36.949 2.777 17.182 1.00 0.00 H ATOM 734 H SER A 98 33.572 1.648 18.339 1.00 0.00 H ATOM 735 N VAL A 99 33.950 0.451 14.516 1.00 20.39 N ATOM 736 CA VAL A 99 33.221 -0.560 13.772 1.00 21.64 C ATOM 737 C VAL A 99 34.041 -1.244 12.684 1.00 22.66 C ATOM 738 O VAL A 99 34.781 -0.595 11.941 1.00 22.59 O ATOM 739 CB VAL A 99 31.979 0.064 13.105 1.00 21.53 C ATOM 740 CG1 VAL A 99 31.069 -1.032 12.543 1.00 22.40 C ATOM 741 CG2 VAL A 99 31.240 0.941 14.109 1.00 21.45 C ATOM 742 HA VAL A 99 32.949 -1.317 14.507 1.00 0.00 H ATOM 743 HB VAL A 99 32.294 0.691 12.271 1.00 0.00 H ATOM 744 HG11 VAL A 99 31.617 -1.613 11.801 1.00 0.00 H ATOM 745 HG12 VAL A 99 30.747 -1.686 13.353 1.00 0.00 H ATOM 746 HG13 VAL A 99 30.197 -0.574 12.076 1.00 0.00 H ATOM 747 HG21 VAL A 99 30.927 0.334 14.959 1.00 0.00 H ATOM 748 HG22 VAL A 99 31.903 1.735 14.453 1.00 0.00 H ATOM 749 HG23 VAL A 99 30.364 1.379 13.631 1.00 0.00 H ATOM 750 H VAL A 99 34.448 1.206 14.003 1.00 0.00 H ATOM 751 N LYS A 100 33.902 -2.561 12.590 1.00 22.93 N ATOM 752 CA LYS A 100 34.601 -3.308 11.563 1.00 23.71 C ATOM 753 C LYS A 100 33.840 -3.196 10.249 1.00 24.15 C ATOM 754 O LYS A 100 32.611 -3.280 10.220 1.00 24.06 O ATOM 755 CB LYS A 100 34.713 -4.792 11.931 1.00 24.27 C ATOM 756 CG LYS A 100 35.160 -5.664 10.748 1.00 24.73 C ATOM 757 CD LYS A 100 35.144 -7.142 11.072 1.00 26.66 C ATOM 758 CE LYS A 100 35.218 -7.989 9.806 1.00 30.36 C ATOM 759 NZ LYS A 100 36.475 -7.787 9.037 1.00 32.74 N ATOM 760 HA LYS A 100 35.603 -2.890 11.469 1.00 0.00 H ATOM 761 HB2 LYS A 100 35.439 -4.898 12.737 1.00 0.00 H ATOM 762 HB3 LYS A 100 33.739 -5.141 12.273 1.00 0.00 H ATOM 763 HG2 LYS A 100 34.489 -5.484 9.908 1.00 0.00 H ATOM 764 HG3 LYS A 100 36.174 -5.379 10.468 1.00 0.00 H ATOM 765 HD2 LYS A 100 35.999 -7.376 11.706 1.00 0.00 H ATOM 766 HD3 LYS A 100 34.223 -7.379 11.604 1.00 0.00 H ATOM 767 HE2 LYS A 100 34.375 -7.730 9.166 1.00 0.00 H ATOM 768 HE3 LYS A 100 35.149 -9.040 10.088 1.00 0.00 H ATOM 769 HZ1 LYS A 100 36.549 -6.789 8.752 1.00 0.00 H ATOM 770 HZ2 LYS A 100 37.289 -8.040 9.633 1.00 0.00 H ATOM 771 HZ3 LYS A 100 36.463 -8.390 8.190 1.00 0.00 H ATOM 772 H LYS A 100 33.285 -3.062 13.260 1.00 0.00 H ATOM 773 N PHE A 101 34.581 -2.984 9.170 1.00 26.13 N ATOM 774 CA PHE A 101 34.008 -2.918 7.833 1.00 29.32 C ATOM 775 C PHE A 101 35.101 -3.326 6.855 1.00 30.79 C ATOM 776 O PHE A 101 36.085 -2.606 6.666 1.00 30.62 O ATOM 777 CB PHE A 101 33.490 -1.516 7.488 1.00 28.94 C ATOM 778 CG PHE A 101 32.891 -1.430 6.108 1.00 30.49 C ATOM 779 CD1 PHE A 101 33.603 -0.863 5.056 1.00 30.29 C ATOM 780 CD2 PHE A 101 31.643 -1.986 5.843 1.00 30.75 C ATOM 781 CE1 PHE A 101 33.081 -0.857 3.761 1.00 30.11 C ATOM 782 CE2 PHE A 101 31.114 -1.987 4.555 1.00 29.52 C ATOM 783 CZ PHE A 101 31.837 -1.421 3.511 1.00 28.82 C ATOM 784 HA PHE A 101 33.148 -3.585 7.776 1.00 0.00 H ATOM 785 HB2 PHE A 101 32.727 -1.239 8.216 1.00 0.00 H ATOM 786 HB3 PHE A 101 34.321 -0.814 7.550 1.00 0.00 H ATOM 787 HD2 PHE A 101 31.070 -2.428 6.658 1.00 0.00 H ATOM 788 HE2 PHE A 101 30.136 -2.430 4.366 1.00 0.00 H ATOM 789 HZ PHE A 101 31.429 -1.420 2.500 1.00 0.00 H ATOM 790 HE1 PHE A 101 33.650 -0.410 2.946 1.00 0.00 H ATOM 791 HD1 PHE A 101 34.580 -0.418 5.245 1.00 0.00 H ATOM 792 H PHE A 101 35.607 -2.861 9.283 1.00 0.00 H ATOM 793 N GLY A 102 34.933 -4.495 6.246 1.00 33.07 N ATOM 794 CA GLY A 102 35.934 -4.980 5.315 1.00 35.40 C ATOM 795 C GLY A 102 37.207 -5.259 6.083 1.00 37.52 C ATOM 796 O GLY A 102 37.162 -5.839 7.169 1.00 36.87 O ATOM 797 HA3 GLY A 102 36.123 -4.226 4.551 1.00 0.00 H ATOM 798 HA2 GLY A 102 35.582 -5.896 4.840 1.00 0.00 H ATOM 799 H GLY A 102 34.083 -5.063 6.437 1.00 0.00 H ATOM 800 N ASN A 103 38.347 -4.850 5.539 1.00 39.56 N ATOM 801 CA ASN A 103 39.602 -5.079 6.233 1.00 41.23 C ATOM 802 C ASN A 103 40.060 -3.810 6.946 1.00 40.54 C ATOM 803 O ASN A 103 41.239 -3.635 7.237 1.00 41.03 O ATOM 804 CB ASN A 103 40.676 -5.553 5.262 1.00 44.00 C ATOM 805 CG ASN A 103 41.797 -6.296 5.959 1.00 48.83 C ATOM 806 OD1 ASN A 103 42.899 -6.411 5.429 1.00 54.32 O ATOM 807 ND2 ASN A 103 41.515 -6.818 7.149 1.00 50.63 N ATOM 808 HA ASN A 103 39.440 -5.858 6.978 1.00 0.00 H ATOM 809 HB2 ASN A 103 40.218 -6.217 4.530 1.00 0.00 H ATOM 810 HB3 ASN A 103 41.095 -4.686 4.752 1.00 0.00 H ATOM 811 HD22 ASN A 103 40.567 -6.695 7.559 1.00 0.00 H ATOM 812 HD21 ASN A 103 42.242 -7.349 7.669 1.00 0.00 H ATOM 813 H ASN A 103 38.341 -4.367 4.618 1.00 0.00 H ATOM 814 N ASP A 104 39.106 -2.928 7.218 1.00 40.47 N ATOM 815 CA ASP A 104 39.372 -1.682 7.924 1.00 39.29 C ATOM 816 C ASP A 104 38.500 -1.664 9.175 1.00 36.87 C ATOM 817 O ASP A 104 37.557 -2.446 9.307 1.00 36.35 O ATOM 818 CB ASP A 104 38.981 -0.464 7.073 1.00 42.39 C ATOM 819 CG ASP A 104 39.793 -0.337 5.793 1.00 47.12 C ATOM 820 OD1 ASP A 104 39.396 0.474 4.923 1.00 49.18 O ATOM 821 OD2 ASP A 104 40.826 -1.028 5.655 1.00 49.91 O ATOM 822 HA ASP A 104 40.436 -1.628 8.154 1.00 0.00 H ATOM 823 HB2 ASP A 104 37.928 -0.551 6.807 1.00 0.00 H ATOM 824 HB3 ASP A 104 39.131 0.437 7.669 1.00 0.00 H ATOM 825 H ASP A 104 38.132 -3.134 6.916 1.00 0.00 H ATOM 826 N VAL A 105 38.836 -0.775 10.097 1.00 33.45 N ATOM 827 CA VAL A 105 38.048 -0.574 11.298 1.00 30.45 C ATOM 828 C VAL A 105 37.785 0.922 11.247 1.00 29.21 C ATOM 829 O VAL A 105 38.721 1.709 11.126 1.00 28.34 O ATOM 830 CB VAL A 105 38.819 -0.903 12.599 1.00 30.02 C ATOM 831 CG1 VAL A 105 38.014 -0.427 13.806 1.00 28.25 C ATOM 832 CG2 VAL A 105 39.059 -2.402 12.707 1.00 27.64 C ATOM 833 HA VAL A 105 37.167 -1.216 11.319 1.00 0.00 H ATOM 834 HB VAL A 105 39.782 -0.392 12.576 1.00 0.00 H ATOM 835 HG11 VAL A 105 37.861 0.650 13.737 1.00 0.00 H ATOM 836 HG12 VAL A 105 37.048 -0.932 13.819 1.00 0.00 H ATOM 837 HG13 VAL A 105 38.560 -0.660 14.720 1.00 0.00 H ATOM 838 HG21 VAL A 105 38.101 -2.922 12.719 1.00 0.00 H ATOM 839 HG22 VAL A 105 39.645 -2.737 11.851 1.00 0.00 H ATOM 840 HG23 VAL A 105 39.602 -2.616 13.627 1.00 0.00 H ATOM 841 H VAL A 105 39.693 -0.202 9.955 1.00 0.00 H ATOM 842 N GLN A 106 36.517 1.309 11.296 1.00 27.13 N ATOM 843 CA GLN A 106 36.153 2.719 11.269 1.00 25.18 C ATOM 844 C GLN A 106 35.868 3.235 12.679 1.00 24.15 C ATOM 845 O GLN A 106 35.307 2.527 13.514 1.00 23.19 O ATOM 846 CB GLN A 106 34.934 2.927 10.366 1.00 26.76 C ATOM 847 CG GLN A 106 35.281 2.951 8.878 1.00 30.45 C ATOM 848 CD GLN A 106 34.063 2.890 7.987 1.00 31.12 C ATOM 849 OE1 GLN A 106 32.981 3.329 8.363 1.00 34.99 O ATOM 850 NE2 GLN A 106 34.236 2.355 6.790 1.00 32.99 N ATOM 851 HA GLN A 106 36.993 3.286 10.866 1.00 0.00 H ATOM 852 HB2 GLN A 106 34.229 2.115 10.544 1.00 0.00 H ATOM 853 HB3 GLN A 106 34.467 3.876 10.628 1.00 0.00 H ATOM 854 HG2 GLN A 106 35.824 3.871 8.662 1.00 0.00 H ATOM 855 HG3 GLN A 106 35.918 2.095 8.656 1.00 0.00 H ATOM 856 HE22 GLN A 106 35.171 1.995 6.512 1.00 0.00 H ATOM 857 HE21 GLN A 106 33.437 2.295 6.127 1.00 0.00 H ATOM 858 H GLN A 106 35.767 0.591 11.355 1.00 0.00 H ATOM 859 N HIS A 107 36.267 4.474 12.935 1.00 21.98 N ATOM 860 CA HIS A 107 36.078 5.096 14.234 1.00 21.85 C ATOM 861 C HIS A 107 35.165 6.296 14.120 1.00 21.15 C ATOM 862 O HIS A 107 35.390 7.166 13.284 1.00 22.44 O ATOM 863 CB HIS A 107 37.425 5.544 14.797 1.00 21.13 C ATOM 864 CG HIS A 107 38.409 4.429 14.952 1.00 23.07 C ATOM 865 ND1 HIS A 107 38.330 3.506 15.973 1.00 22.06 N ATOM 866 CD2 HIS A 107 39.464 4.059 14.187 1.00 21.01 C ATOM 867 CE1 HIS A 107 39.295 2.614 15.829 1.00 23.59 C ATOM 868 NE2 HIS A 107 39.996 2.926 14.753 1.00 22.57 N ATOM 869 HA HIS A 107 35.624 4.364 14.902 1.00 0.00 H ATOM 870 HB2 HIS A 107 37.850 6.288 14.124 1.00 0.00 H ATOM 871 HB3 HIS A 107 37.257 5.995 15.775 1.00 0.00 H ATOM 872 HD2 HIS A 107 39.823 4.565 13.291 1.00 0.00 H ATOM 873 HE1 HIS A 107 39.481 1.765 16.487 1.00 0.00 H ATOM 874 H HIS A 107 36.731 5.018 12.180 1.00 0.00 H ATOM 875 N PHE A 108 34.137 6.330 14.964 1.00 20.29 N ATOM 876 CA PHE A 108 33.175 7.427 14.992 1.00 20.12 C ATOM 877 C PHE A 108 33.249 8.119 16.344 1.00 20.20 C ATOM 878 O PHE A 108 33.288 7.458 17.377 1.00 20.75 O ATOM 879 CB PHE A 108 31.749 6.905 14.799 1.00 19.83 C ATOM 880 CG PHE A 108 31.526 6.232 13.485 1.00 21.28 C ATOM 881 CD1 PHE A 108 31.965 4.931 13.274 1.00 18.01 C ATOM 882 CD2 PHE A 108 30.923 6.920 12.436 1.00 20.14 C ATOM 883 CE1 PHE A 108 31.812 4.323 12.037 1.00 17.51 C ATOM 884 CE2 PHE A 108 30.767 6.317 11.192 1.00 20.28 C ATOM 885 CZ PHE A 108 31.215 5.015 10.994 1.00 19.77 C ATOM 886 HA PHE A 108 33.418 8.119 14.185 1.00 0.00 H ATOM 887 HB2 PHE A 108 31.534 6.189 15.593 1.00 0.00 H ATOM 888 HB3 PHE A 108 31.061 7.747 14.875 1.00 0.00 H ATOM 889 HD2 PHE A 108 30.570 7.940 12.590 1.00 0.00 H ATOM 890 HE2 PHE A 108 30.295 6.863 10.375 1.00 0.00 H ATOM 891 HZ PHE A 108 31.097 4.539 10.020 1.00 0.00 H ATOM 892 HE1 PHE A 108 32.161 3.302 11.885 1.00 0.00 H ATOM 893 HD1 PHE A 108 32.435 4.382 14.090 1.00 0.00 H ATOM 894 H PHE A 108 34.014 5.542 15.632 1.00 0.00 H ATOM 895 N LYS A 109 33.264 9.444 16.348 1.00 19.70 N ATOM 896 CA LYS A 109 33.307 10.158 17.613 1.00 20.61 C ATOM 897 C LYS A 109 31.893 10.414 18.096 1.00 19.67 C ATOM 898 O LYS A 109 31.052 10.889 17.338 1.00 20.30 O ATOM 899 CB LYS A 109 34.042 11.492 17.477 1.00 22.68 C ATOM 900 CG LYS A 109 33.974 12.320 18.751 1.00 26.49 C ATOM 901 CD LYS A 109 35.004 13.421 18.752 1.00 31.02 C ATOM 902 CE LYS A 109 35.561 13.591 20.150 1.00 35.45 C ATOM 903 NZ LYS A 109 35.470 12.306 20.898 1.00 37.83 N ATOM 904 HA LYS A 109 33.847 9.541 18.332 1.00 0.00 H ATOM 905 HB2 LYS A 109 35.088 11.294 17.242 1.00 0.00 H ATOM 906 HB3 LYS A 109 33.590 12.061 16.664 1.00 0.00 H ATOM 907 HG2 LYS A 109 32.982 12.763 18.833 1.00 0.00 H ATOM 908 HG3 LYS A 109 34.151 11.668 19.607 1.00 0.00 H ATOM 909 HD2 LYS A 109 35.812 13.163 18.068 1.00 0.00 H ATOM 910 HD3 LYS A 109 34.540 14.353 18.430 1.00 0.00 H ATOM 911 HE2 LYS A 109 34.989 14.356 20.676 1.00 0.00 H ATOM 912 HE3 LYS A 109 36.605 13.899 20.087 1.00 0.00 H ATOM 913 HZ1 LYS A 109 34.474 12.012 20.960 1.00 0.00 H ATOM 914 HZ2 LYS A 109 36.017 11.576 20.399 1.00 0.00 H ATOM 915 HZ3 LYS A 109 35.855 12.436 21.855 1.00 0.00 H ATOM 916 H LYS A 109 33.245 9.970 15.451 1.00 0.00 H ATOM 917 N VAL A 110 31.627 10.085 19.354 1.00 19.75 N ATOM 918 CA VAL A 110 30.302 10.311 19.914 1.00 20.11 C ATOM 919 C VAL A 110 30.247 11.742 20.417 1.00 21.63 C ATOM 920 O VAL A 110 30.951 12.111 21.357 1.00 20.81 O ATOM 921 CB VAL A 110 30.011 9.345 21.078 1.00 21.94 C ATOM 922 CG1 VAL A 110 28.642 9.661 21.693 1.00 20.02 C ATOM 923 CG2 VAL A 110 30.057 7.908 20.572 1.00 16.57 C ATOM 924 HA VAL A 110 29.551 10.135 19.144 1.00 0.00 H ATOM 925 HB VAL A 110 30.769 9.468 21.851 1.00 0.00 H ATOM 926 HG11 VAL A 110 28.641 10.685 22.067 1.00 0.00 H ATOM 927 HG12 VAL A 110 27.869 9.550 20.932 1.00 0.00 H ATOM 928 HG13 VAL A 110 28.447 8.972 22.515 1.00 0.00 H ATOM 929 HG21 VAL A 110 29.307 7.774 19.793 1.00 0.00 H ATOM 930 HG22 VAL A 110 31.046 7.699 20.165 1.00 0.00 H ATOM 931 HG23 VAL A 110 29.851 7.227 21.397 1.00 0.00 H ATOM 932 H VAL A 110 32.371 9.662 19.945 1.00 0.00 H ATOM 933 N LEU A 111 29.414 12.552 19.779 1.00 23.08 N ATOM 934 CA LEU A 111 29.291 13.953 20.153 1.00 24.07 C ATOM 935 C LEU A 111 28.159 14.178 21.145 1.00 24.72 C ATOM 936 O LEU A 111 27.273 13.340 21.290 1.00 24.07 O ATOM 937 CB LEU A 111 29.066 14.790 18.897 1.00 24.19 C ATOM 938 CG LEU A 111 30.071 14.472 17.780 1.00 25.48 C ATOM 939 CD1 LEU A 111 29.621 15.100 16.476 1.00 24.89 C ATOM 940 CD2 LEU A 111 31.449 14.967 18.172 1.00 26.01 C ATOM 941 HA LEU A 111 30.215 14.258 20.644 1.00 0.00 H ATOM 942 HB2 LEU A 111 28.060 14.597 18.525 1.00 0.00 H ATOM 943 HB3 LEU A 111 29.159 15.844 19.159 1.00 0.00 H ATOM 944 HG LEU A 111 30.119 13.392 17.637 1.00 0.00 H ATOM 945 HD21 LEU A 111 31.415 16.045 18.331 1.00 0.00 H ATOM 946 HD22 LEU A 111 31.763 14.473 19.091 1.00 0.00 H ATOM 947 HD23 LEU A 111 32.156 14.738 17.375 1.00 0.00 H ATOM 948 HD11 LEU A 111 28.644 14.703 16.201 1.00 0.00 H ATOM 949 HD12 LEU A 111 29.554 16.181 16.599 1.00 0.00 H ATOM 950 HD13 LEU A 111 30.343 14.866 15.693 1.00 0.00 H ATOM 951 H LEU A 111 28.838 12.180 18.997 1.00 0.00 H ATOM 952 N ARG A 112 28.210 15.307 21.843 1.00 26.71 N ATOM 953 CA ARG A 112 27.176 15.666 22.807 1.00 28.97 C ATOM 954 C ARG A 112 26.708 17.094 22.521 1.00 28.52 C ATOM 955 O ARG A 112 27.513 17.939 22.139 1.00 29.87 O ATOM 956 CB ARG A 112 27.719 15.564 24.238 1.00 30.97 C ATOM 957 CG ARG A 112 27.971 14.134 24.724 1.00 36.18 C ATOM 958 CD ARG A 112 28.178 14.092 26.244 1.00 41.34 C ATOM 959 NE ARG A 112 26.941 14.349 26.982 1.00 44.84 N ATOM 960 CZ ARG A 112 26.887 14.774 28.244 1.00 47.83 C ATOM 961 NH1 ARG A 112 27.999 15.001 28.930 1.00 48.83 N ATOM 962 NH2 ARG A 112 25.712 14.973 28.827 1.00 50.16 N ATOM 963 HA ARG A 112 26.336 14.977 22.713 1.00 0.00 H ATOM 964 HB2 ARG A 112 28.661 16.110 24.284 1.00 0.00 H ATOM 965 HB3 ARG A 112 26.998 16.029 24.910 1.00 0.00 H ATOM 966 HG2 ARG A 112 27.113 13.514 24.465 1.00 0.00 H ATOM 967 HG3 ARG A 112 28.862 13.743 24.233 1.00 0.00 H ATOM 968 HD2 ARG A 112 28.913 14.848 26.519 1.00 0.00 H ATOM 969 HD3 ARG A 112 28.552 13.106 26.520 1.00 0.00 H ATOM 970 HE ARG A 112 26.041 14.189 26.487 1.00 0.00 H ATOM 971 HH12 ARG A 112 27.944 15.333 29.914 1.00 0.00 H ATOM 972 HH11 ARG A 112 28.926 14.848 28.484 1.00 0.00 H ATOM 973 HH22 ARG A 112 25.670 15.305 29.812 1.00 0.00 H ATOM 974 HH21 ARG A 112 24.833 14.797 28.299 1.00 0.00 H ATOM 975 H ARG A 112 29.011 15.954 21.698 1.00 0.00 H ATOM 976 N ASP A 113 25.416 17.365 22.686 1.00 27.39 N ATOM 977 CA ASP A 113 24.906 18.712 22.434 1.00 27.63 C ATOM 978 C ASP A 113 24.706 19.516 23.717 1.00 27.84 C ATOM 979 O ASP A 113 25.071 19.069 24.804 1.00 26.79 O ATOM 980 CB ASP A 113 23.589 18.672 21.647 1.00 26.52 C ATOM 981 CG ASP A 113 22.494 17.919 22.372 1.00 26.90 C ATOM 982 OD1 ASP A 113 22.509 17.894 23.621 1.00 26.17 O ATOM 983 OD2 ASP A 113 21.609 17.363 21.690 1.00 26.31 O ATOM 984 HA ASP A 113 25.669 19.213 21.839 1.00 0.00 H ATOM 985 HB2 ASP A 113 23.254 19.695 21.476 1.00 0.00 H ATOM 986 HB3 ASP A 113 23.771 18.186 20.689 1.00 0.00 H ATOM 987 H ASP A 113 24.765 16.615 22.996 1.00 0.00 H ATOM 988 N GLY A 114 24.123 20.704 23.572 1.00 28.73 N ATOM 989 CA GLY A 114 23.889 21.578 24.707 1.00 28.25 C ATOM 990 C GLY A 114 23.093 20.961 25.839 1.00 28.64 C ATOM 991 O GLY A 114 23.294 21.315 27.001 1.00 28.68 O ATOM 992 HA3 GLY A 114 23.348 22.455 24.352 1.00 0.00 H ATOM 993 HA2 GLY A 114 24.857 21.885 25.103 1.00 0.00 H ATOM 994 H GLY A 114 23.828 21.013 22.624 1.00 0.00 H ATOM 995 N ALA A 115 22.198 20.034 25.511 1.00 28.78 N ATOM 996 CA ALA A 115 21.365 19.390 26.524 1.00 30.36 C ATOM 997 C ALA A 115 21.977 18.103 27.060 1.00 30.62 C ATOM 998 O ALA A 115 21.426 17.481 27.971 1.00 31.76 O ATOM 999 CB ALA A 115 19.981 19.106 25.956 1.00 30.66 C ATOM 1000 HA ALA A 115 21.291 20.083 27.362 1.00 0.00 H ATOM 1001 HB1 ALA A 115 19.516 20.043 25.651 1.00 0.00 H ATOM 1002 HB2 ALA A 115 20.072 18.446 25.093 1.00 0.00 H ATOM 1003 HB3 ALA A 115 19.368 18.626 26.719 1.00 0.00 H ATOM 1004 H ALA A 115 22.089 19.762 24.513 1.00 0.00 H ATOM 1005 N GLY A 116 23.109 17.702 26.491 1.00 29.33 N ATOM 1006 CA GLY A 116 23.761 16.488 26.943 1.00 27.86 C ATOM 1007 C GLY A 116 23.417 15.233 26.158 1.00 28.74 C ATOM 1008 O GLY A 116 23.921 14.156 26.477 1.00 28.94 O ATOM 1009 HA3 GLY A 116 23.480 16.322 27.983 1.00 0.00 H ATOM 1010 HA2 GLY A 116 24.838 16.641 26.879 1.00 0.00 H ATOM 1011 H GLY A 116 23.528 18.260 25.720 1.00 0.00 H ATOM 1012 N LYS A 117 22.562 15.345 25.144 1.00 27.62 N ATOM 1013 CA LYS A 117 22.207 14.176 24.340 1.00 29.44 C ATOM 1014 C LYS A 117 23.412 13.705 23.515 1.00 27.42 C ATOM 1015 O LYS A 117 24.355 14.463 23.283 1.00 27.51 O ATOM 1016 CB LYS A 117 21.044 14.507 23.398 1.00 32.82 C ATOM 1017 CG LYS A 117 19.657 14.435 24.027 1.00 36.29 C ATOM 1018 CD LYS A 117 18.606 14.921 23.036 1.00 41.27 C ATOM 1019 CE LYS A 117 17.190 14.621 23.503 1.00 42.05 C ATOM 1020 NZ LYS A 117 16.520 13.621 22.614 1.00 43.52 N ATOM 1021 HA LYS A 117 21.904 13.379 25.018 1.00 0.00 H ATOM 1022 HB2 LYS A 117 21.192 15.519 23.022 1.00 0.00 H ATOM 1023 HB3 LYS A 117 21.074 13.804 22.565 1.00 0.00 H ATOM 1024 HG2 LYS A 117 19.440 13.404 24.306 1.00 0.00 H ATOM 1025 HG3 LYS A 117 19.631 15.064 24.917 1.00 0.00 H ATOM 1026 HD2 LYS A 117 18.713 15.998 22.911 1.00 0.00 H ATOM 1027 HD3 LYS A 117 18.772 14.427 22.079 1.00 0.00 H ATOM 1028 HE2 LYS A 117 16.611 15.545 23.497 1.00 0.00 H ATOM 1029 HE3 LYS A 117 17.228 14.224 24.518 1.00 0.00 H ATOM 1030 HZ1 LYS A 117 16.475 13.996 21.645 1.00 0.00 H ATOM 1031 HZ2 LYS A 117 17.064 12.735 22.620 1.00 0.00 H ATOM 1032 HZ3 LYS A 117 15.557 13.440 22.962 1.00 0.00 H ATOM 1033 H LYS A 117 22.143 16.271 24.922 1.00 0.00 H ATOM 1034 N TYR A 118 23.381 12.454 23.071 1.00 24.68 N ATOM 1035 CA TYR A 118 24.472 11.907 22.266 1.00 22.86 C ATOM 1036 C TYR A 118 24.069 11.880 20.793 1.00 22.91 C ATOM 1037 O TYR A 118 22.879 11.823 20.478 1.00 22.95 O ATOM 1038 CB TYR A 118 24.804 10.479 22.705 1.00 21.97 C ATOM 1039 CG TYR A 118 25.306 10.331 24.127 1.00 21.67 C ATOM 1040 CD1 TYR A 118 24.478 9.837 25.136 1.00 19.99 C ATOM 1041 CD2 TYR A 118 26.627 10.624 24.448 1.00 19.32 C ATOM 1042 CE1 TYR A 118 24.965 9.630 26.433 1.00 21.46 C ATOM 1043 CE2 TYR A 118 27.120 10.422 25.730 1.00 20.07 C ATOM 1044 CZ TYR A 118 26.290 9.924 26.717 1.00 20.24 C ATOM 1045 OH TYR A 118 26.799 9.716 27.981 1.00 22.91 O ATOM 1046 HA TYR A 118 25.346 12.543 22.406 1.00 0.00 H ATOM 1047 HB3 TYR A 118 25.573 10.092 22.036 1.00 0.00 H ATOM 1048 HB2 TYR A 118 23.900 9.878 22.604 1.00 0.00 H ATOM 1049 HD2 TYR A 118 27.289 11.020 23.678 1.00 0.00 H ATOM 1050 HE2 TYR A 118 28.160 10.656 25.958 1.00 0.00 H ATOM 1051 HE1 TYR A 118 24.309 9.241 27.212 1.00 0.00 H ATOM 1052 HD1 TYR A 118 23.436 9.609 24.911 1.00 0.00 H ATOM 1053 HH TYR A 118 26.086 9.360 28.568 1.00 0.00 H ATOM 1054 H TYR A 118 22.565 11.852 23.300 1.00 0.00 H ATOM 1055 N PHE A 119 25.055 11.925 19.897 1.00 22.83 N ATOM 1056 CA PHE A 119 24.787 11.877 18.459 1.00 21.01 C ATOM 1057 C PHE A 119 26.054 11.650 17.627 1.00 21.70 C ATOM 1058 O PHE A 119 27.171 11.842 18.105 1.00 20.49 O ATOM 1059 CB PHE A 119 24.046 13.156 18.005 1.00 21.72 C ATOM 1060 CG PHE A 119 24.920 14.389 17.870 1.00 20.80 C ATOM 1061 CD1 PHE A 119 25.530 14.701 16.653 1.00 21.33 C ATOM 1062 CD2 PHE A 119 25.094 15.261 18.939 1.00 21.06 C ATOM 1063 CE1 PHE A 119 26.298 15.866 16.503 1.00 19.40 C ATOM 1064 CE2 PHE A 119 25.861 16.429 18.800 1.00 22.13 C ATOM 1065 CZ PHE A 119 26.462 16.727 17.574 1.00 19.90 C ATOM 1066 HA PHE A 119 24.144 11.015 18.282 1.00 0.00 H ATOM 1067 HB2 PHE A 119 23.590 12.957 17.035 1.00 0.00 H ATOM 1068 HB3 PHE A 119 23.266 13.372 18.735 1.00 0.00 H ATOM 1069 HD2 PHE A 119 24.629 15.035 19.898 1.00 0.00 H ATOM 1070 HE2 PHE A 119 25.988 17.103 19.648 1.00 0.00 H ATOM 1071 HZ PHE A 119 27.057 17.633 17.462 1.00 0.00 H ATOM 1072 HE1 PHE A 119 26.765 16.092 15.544 1.00 0.00 H ATOM 1073 HD1 PHE A 119 25.407 14.028 15.805 1.00 0.00 H ATOM 1074 H PHE A 119 26.038 11.996 20.228 1.00 0.00 H ATOM 1075 N LEU A 120 25.869 11.207 16.388 1.00 21.75 N ATOM 1076 CA LEU A 120 26.983 10.968 15.476 1.00 21.33 C ATOM 1077 C LEU A 120 26.862 11.920 14.297 1.00 23.31 C ATOM 1078 O LEU A 120 27.852 12.487 13.836 1.00 25.54 O ATOM 1079 CB LEU A 120 26.962 9.530 14.942 1.00 19.89 C ATOM 1080 CG LEU A 120 27.150 8.353 15.902 1.00 19.06 C ATOM 1081 CD1 LEU A 120 27.135 7.051 15.103 1.00 17.82 C ATOM 1082 CD2 LEU A 120 28.464 8.502 16.657 1.00 17.87 C ATOM 1083 HA LEU A 120 27.915 11.128 16.018 1.00 0.00 H ATOM 1084 HB2 LEU A 120 25.996 9.389 14.456 1.00 0.00 H ATOM 1085 HB3 LEU A 120 27.755 9.459 14.198 1.00 0.00 H ATOM 1086 HG LEU A 120 26.338 8.337 16.629 1.00 0.00 H ATOM 1087 HD21 LEU A 120 29.290 8.521 15.946 1.00 0.00 H ATOM 1088 HD22 LEU A 120 28.451 9.431 17.226 1.00 0.00 H ATOM 1089 HD23 LEU A 120 28.588 7.660 17.337 1.00 0.00 H ATOM 1090 HD11 LEU A 120 26.181 6.955 14.585 1.00 0.00 H ATOM 1091 HD12 LEU A 120 27.945 7.064 14.374 1.00 0.00 H ATOM 1092 HD13 LEU A 120 27.269 6.208 15.781 1.00 0.00 H ATOM 1093 H LEU A 120 24.900 11.025 16.058 1.00 0.00 H ATOM 1094 N TRP A 121 25.637 12.085 13.806 1.00 23.86 N ATOM 1095 CA TRP A 121 25.389 12.959 12.669 1.00 23.90 C ATOM 1096 C TRP A 121 24.358 14.040 12.986 1.00 24.57 C ATOM 1097 O TRP A 121 24.727 15.186 13.236 1.00 26.10 O ATOM 1098 CB TRP A 121 24.942 12.131 11.460 1.00 22.25 C ATOM 1099 CG TRP A 121 25.885 10.995 11.128 1.00 18.43 C ATOM 1100 CD1 TRP A 121 25.772 9.686 11.521 1.00 17.85 C ATOM 1101 CD2 TRP A 121 27.072 11.072 10.326 1.00 16.21 C ATOM 1102 NE1 TRP A 121 26.814 8.948 11.011 1.00 16.70 N ATOM 1103 CE2 TRP A 121 27.627 9.773 10.280 1.00 16.79 C ATOM 1104 CE3 TRP A 121 27.721 12.113 9.653 1.00 17.65 C ATOM 1105 CZ2 TRP A 121 28.793 9.488 9.569 1.00 14.09 C ATOM 1106 CZ3 TRP A 121 28.879 11.831 8.949 1.00 16.93 C ATOM 1107 CH2 TRP A 121 29.408 10.524 8.917 1.00 20.14 C ATOM 1108 HA TRP A 121 26.324 13.468 12.435 1.00 0.00 H ATOM 1109 HB2 TRP A 121 23.958 11.713 11.672 1.00 0.00 H ATOM 1110 HB3 TRP A 121 24.877 12.790 10.594 1.00 0.00 H ATOM 1111 HE1 TRP A 121 26.961 7.929 11.157 1.00 0.00 H ATOM 1112 HD1 TRP A 121 24.973 9.289 12.146 1.00 0.00 H ATOM 1113 HZ2 TRP A 121 29.200 8.477 9.534 1.00 0.00 H ATOM 1114 HH2 TRP A 121 30.326 10.334 8.361 1.00 0.00 H ATOM 1115 HZ3 TRP A 121 29.389 12.630 8.412 1.00 0.00 H ATOM 1116 HE3 TRP A 121 27.322 13.127 9.683 1.00 0.00 H ATOM 1117 H TRP A 121 24.840 11.579 14.243 1.00 0.00 H ATOM 1118 N VAL A 122 23.073 13.694 12.976 1.00 25.36 N ATOM 1119 CA VAL A 122 22.051 14.688 13.288 1.00 26.77 C ATOM 1120 C VAL A 122 21.004 14.242 14.310 1.00 27.79 C ATOM 1121 O VAL A 122 20.582 15.044 15.145 1.00 29.46 O ATOM 1122 CB VAL A 122 21.350 15.220 11.992 1.00 27.94 C ATOM 1123 CG1 VAL A 122 21.264 14.132 10.944 1.00 27.69 C ATOM 1124 CG2 VAL A 122 19.957 15.732 12.320 1.00 28.23 C ATOM 1125 HA VAL A 122 22.603 15.498 13.765 1.00 0.00 H ATOM 1126 HB VAL A 122 21.947 16.040 11.594 1.00 0.00 H ATOM 1127 HG11 VAL A 122 22.269 13.795 10.688 1.00 0.00 H ATOM 1128 HG12 VAL A 122 20.688 13.295 11.338 1.00 0.00 H ATOM 1129 HG13 VAL A 122 20.774 14.525 10.053 1.00 0.00 H ATOM 1130 HG21 VAL A 122 19.363 14.921 12.740 1.00 0.00 H ATOM 1131 HG22 VAL A 122 20.031 16.543 13.045 1.00 0.00 H ATOM 1132 HG23 VAL A 122 19.482 16.098 11.410 1.00 0.00 H ATOM 1133 H VAL A 122 22.798 12.718 12.746 1.00 0.00 H ATOM 1134 N VAL A 123 20.585 12.981 14.263 1.00 27.42 N ATOM 1135 CA VAL A 123 19.592 12.496 15.221 1.00 26.91 C ATOM 1136 C VAL A 123 20.229 12.378 16.608 1.00 27.25 C ATOM 1137 O VAL A 123 21.346 11.881 16.744 1.00 26.45 O ATOM 1138 CB VAL A 123 19.023 11.119 14.800 1.00 27.91 C ATOM 1139 CG1 VAL A 123 17.936 10.679 15.773 1.00 26.00 C ATOM 1140 CG2 VAL A 123 18.465 11.199 13.390 1.00 28.99 C ATOM 1141 HA VAL A 123 18.771 13.212 15.245 1.00 0.00 H ATOM 1142 HB VAL A 123 19.827 10.383 14.820 1.00 0.00 H ATOM 1143 HG11 VAL A 123 18.357 10.600 16.775 1.00 0.00 H ATOM 1144 HG12 VAL A 123 17.131 11.414 15.773 1.00 0.00 H ATOM 1145 HG13 VAL A 123 17.545 9.709 15.465 1.00 0.00 H ATOM 1146 HG21 VAL A 123 17.669 11.943 13.357 1.00 0.00 H ATOM 1147 HG22 VAL A 123 19.260 11.486 12.702 1.00 0.00 H ATOM 1148 HG23 VAL A 123 18.067 10.226 13.102 1.00 0.00 H ATOM 1149 H VAL A 123 20.965 12.336 13.541 1.00 0.00 H ATOM 1150 N LYS A 124 19.509 12.836 17.632 1.00 26.99 N ATOM 1151 CA LYS A 124 19.997 12.806 19.013 1.00 24.97 C ATOM 1152 C LYS A 124 19.422 11.649 19.836 1.00 24.60 C ATOM 1153 O LYS A 124 18.288 11.226 19.620 1.00 25.39 O ATOM 1154 CB LYS A 124 19.646 14.124 19.711 1.00 26.05 C ATOM 1155 CG LYS A 124 20.028 15.378 18.931 1.00 26.48 C ATOM 1156 CD LYS A 124 21.536 15.541 18.819 1.00 27.10 C ATOM 1157 CE LYS A 124 21.896 16.816 18.073 1.00 26.56 C ATOM 1158 NZ LYS A 124 21.330 18.021 18.724 1.00 27.67 N ATOM 1159 HA LYS A 124 21.076 12.662 18.955 1.00 0.00 H ATOM 1160 HB2 LYS A 124 18.569 14.143 19.880 1.00 0.00 H ATOM 1161 HB3 LYS A 124 20.163 14.149 20.670 1.00 0.00 H ATOM 1162 HG2 LYS A 124 19.605 15.312 17.928 1.00 0.00 H ATOM 1163 HG3 LYS A 124 19.616 16.249 19.441 1.00 0.00 H ATOM 1164 HD2 LYS A 124 21.965 15.581 19.820 1.00 0.00 H ATOM 1165 HD3 LYS A 124 21.948 14.686 18.282 1.00 0.00 H ATOM 1166 HE2 LYS A 124 21.508 16.750 17.056 1.00 0.00 H ATOM 1167 HE3 LYS A 124 22.981 16.910 18.041 1.00 0.00 H ATOM 1168 HZ1 LYS A 124 20.293 17.943 18.753 1.00 0.00 H ATOM 1169 HZ2 LYS A 124 21.700 18.096 19.693 1.00 0.00 H ATOM 1170 HZ3 LYS A 124 21.601 18.866 18.182 1.00 0.00 H ATOM 1171 H LYS A 124 18.565 13.230 17.443 1.00 0.00 H ATOM 1172 N PHE A 125 20.209 11.152 20.788 1.00 24.08 N ATOM 1173 CA PHE A 125 19.784 10.058 21.656 1.00 22.91 C ATOM 1174 C PHE A 125 20.050 10.426 23.118 1.00 24.27 C ATOM 1175 O PHE A 125 21.028 11.107 23.423 1.00 25.60 O ATOM 1176 CB PHE A 125 20.533 8.768 21.293 1.00 22.04 C ATOM 1177 CG PHE A 125 20.538 8.470 19.819 1.00 22.03 C ATOM 1178 CD1 PHE A 125 21.580 8.922 19.004 1.00 20.79 C ATOM 1179 CD2 PHE A 125 19.469 7.802 19.230 1.00 18.92 C ATOM 1180 CE1 PHE A 125 21.548 8.718 17.621 1.00 21.37 C ATOM 1181 CE2 PHE A 125 19.428 7.594 17.856 1.00 19.04 C ATOM 1182 CZ PHE A 125 20.467 8.053 17.047 1.00 19.57 C ATOM 1183 HA PHE A 125 18.716 9.890 21.517 1.00 0.00 H ATOM 1184 HB2 PHE A 125 21.565 8.862 21.629 1.00 0.00 H ATOM 1185 HB3 PHE A 125 20.058 7.935 21.812 1.00 0.00 H ATOM 1186 HD2 PHE A 125 18.653 7.437 19.854 1.00 0.00 H ATOM 1187 HE2 PHE A 125 18.582 7.071 17.410 1.00 0.00 H ATOM 1188 HZ PHE A 125 20.433 7.892 15.969 1.00 0.00 H ATOM 1189 HE1 PHE A 125 22.365 9.078 16.995 1.00 0.00 H ATOM 1190 HD1 PHE A 125 22.428 9.440 19.452 1.00 0.00 H ATOM 1191 H PHE A 125 21.158 11.557 20.918 1.00 0.00 H ATOM 1192 N ASN A 126 19.179 9.980 24.019 1.00 23.90 N ATOM 1193 CA ASN A 126 19.338 10.276 25.443 1.00 24.68 C ATOM 1194 C ASN A 126 20.358 9.368 26.136 1.00 23.87 C ATOM 1195 O ASN A 126 20.651 9.546 27.318 1.00 22.96 O ATOM 1196 CB ASN A 126 17.987 10.153 26.166 1.00 25.71 C ATOM 1197 CG ASN A 126 17.007 11.249 25.771 1.00 26.84 C ATOM 1198 OD1 ASN A 126 17.278 12.433 25.953 1.00 27.38 O ATOM 1199 ND2 ASN A 126 15.864 10.854 25.229 1.00 26.49 N ATOM 1200 HA ASN A 126 19.713 11.298 25.502 1.00 0.00 H ATOM 1201 HB2 ASN A 126 17.547 9.186 25.921 1.00 0.00 H ATOM 1202 HB3 ASN A 126 18.160 10.210 27.241 1.00 0.00 H ATOM 1203 HD22 ASN A 126 15.676 9.840 25.093 1.00 0.00 H ATOM 1204 HD21 ASN A 126 15.155 11.558 24.939 1.00 0.00 H ATOM 1205 H ASN A 126 18.368 9.409 23.705 1.00 0.00 H ATOM 1206 N SER A 127 20.893 8.393 25.409 1.00 21.25 N ATOM 1207 CA SER A 127 21.860 7.481 26.003 1.00 21.34 C ATOM 1208 C SER A 127 22.706 6.788 24.940 1.00 20.52 C ATOM 1209 O SER A 127 22.323 6.733 23.770 1.00 19.61 O ATOM 1210 CB SER A 127 21.130 6.421 26.837 1.00 21.38 C ATOM 1211 OG SER A 127 20.376 5.541 26.010 1.00 22.15 O ATOM 1212 HA SER A 127 22.523 8.069 26.638 1.00 0.00 H ATOM 1213 HB2 SER A 127 20.456 6.919 27.533 1.00 0.00 H ATOM 1214 HB3 SER A 127 21.864 5.841 27.396 1.00 0.00 H ATOM 1215 HG SER A 127 19.704 6.062 25.503 1.00 0.00 H ATOM 1216 H SER A 127 20.620 8.281 24.412 1.00 0.00 H ATOM 1217 N LEU A 128 23.859 6.268 25.351 1.00 18.97 N ATOM 1218 CA LEU A 128 24.739 5.544 24.436 1.00 19.61 C ATOM 1219 C LEU A 128 24.024 4.253 24.049 1.00 19.67 C ATOM 1220 O LEU A 128 24.222 3.712 22.959 1.00 20.08 O ATOM 1221 CB LEU A 128 26.066 5.200 25.120 1.00 18.59 C ATOM 1222 CG LEU A 128 27.003 6.363 25.458 1.00 19.22 C ATOM 1223 CD1 LEU A 128 28.085 5.880 26.391 1.00 15.88 C ATOM 1224 CD2 LEU A 128 27.600 6.951 24.179 1.00 18.25 C ATOM 1225 HA LEU A 128 24.957 6.158 23.562 1.00 0.00 H ATOM 1226 HB2 LEU A 128 25.831 4.687 26.052 1.00 0.00 H ATOM 1227 HB3 LEU A 128 26.609 4.523 24.461 1.00 0.00 H ATOM 1228 HG LEU A 128 26.440 7.152 25.956 1.00 0.00 H ATOM 1229 HD21 LEU A 128 28.164 6.179 23.655 1.00 0.00 H ATOM 1230 HD22 LEU A 128 26.797 7.315 23.538 1.00 0.00 H ATOM 1231 HD23 LEU A 128 28.264 7.777 24.436 1.00 0.00 H ATOM 1232 HD11 LEU A 128 27.631 5.500 27.306 1.00 0.00 H ATOM 1233 HD12 LEU A 128 28.651 5.084 25.907 1.00 0.00 H ATOM 1234 HD13 LEU A 128 28.752 6.708 26.631 1.00 0.00 H ATOM 1235 H LEU A 128 24.141 6.379 26.346 1.00 0.00 H ATOM 1236 N ASN A 129 23.179 3.776 24.957 1.00 18.72 N ATOM 1237 CA ASN A 129 22.421 2.554 24.745 1.00 17.46 C ATOM 1238 C ASN A 129 21.434 2.723 23.582 1.00 18.41 C ATOM 1239 O ASN A 129 21.321 1.838 22.735 1.00 18.63 O ATOM 1240 CB ASN A 129 21.685 2.189 26.042 1.00 17.44 C ATOM 1241 CG ASN A 129 21.212 0.729 26.083 1.00 19.17 C ATOM 1242 OD1 ASN A 129 20.843 0.218 27.145 1.00 19.17 O ATOM 1243 ND2 ASN A 129 21.211 0.064 24.938 1.00 20.43 N ATOM 1244 HA ASN A 129 23.103 1.745 24.481 1.00 0.00 H ATOM 1245 HB2 ASN A 129 22.359 2.358 26.882 1.00 0.00 H ATOM 1246 HB3 ASN A 129 20.815 2.838 26.140 1.00 0.00 H ATOM 1247 HD22 ASN A 129 21.530 0.531 24.065 1.00 0.00 H ATOM 1248 HD21 ASN A 129 20.892 -0.925 24.912 1.00 0.00 H ATOM 1249 H ASN A 129 23.056 4.295 25.850 1.00 0.00 H ATOM 1250 N GLU A 130 20.731 3.855 23.531 1.00 20.31 N ATOM 1251 CA GLU A 130 19.755 4.092 22.464 1.00 20.45 C ATOM 1252 C GLU A 130 20.453 4.420 21.148 1.00 21.18 C ATOM 1253 O GLU A 130 19.953 4.082 20.075 1.00 22.99 O ATOM 1254 CB GLU A 130 18.780 5.216 22.861 1.00 19.37 C ATOM 1255 CG GLU A 130 17.918 4.871 24.076 1.00 21.80 C ATOM 1256 CD GLU A 130 17.196 6.074 24.660 1.00 25.93 C ATOM 1257 OE1 GLU A 130 16.014 6.293 24.320 1.00 27.06 O ATOM 1258 OE2 GLU A 130 17.819 6.806 25.462 1.00 27.05 O ATOM 1259 HA GLU A 130 19.181 3.176 22.320 1.00 0.00 H ATOM 1260 HB2 GLU A 130 19.359 6.111 23.090 1.00 0.00 H ATOM 1261 HB3 GLU A 130 18.122 5.417 22.016 1.00 0.00 H ATOM 1262 HG2 GLU A 130 17.174 4.133 23.775 1.00 0.00 H ATOM 1263 HG3 GLU A 130 18.560 4.444 24.847 1.00 0.00 H ATOM 1264 H GLU A 130 20.878 4.582 24.260 1.00 0.00 H ATOM 1265 N LEU A 131 21.609 5.073 21.228 1.00 20.51 N ATOM 1266 CA LEU A 131 22.366 5.403 20.025 1.00 19.79 C ATOM 1267 C LEU A 131 22.811 4.089 19.387 1.00 20.96 C ATOM 1268 O LEU A 131 22.608 3.866 18.196 1.00 22.63 O ATOM 1269 CB LEU A 131 23.584 6.269 20.374 1.00 18.65 C ATOM 1270 CG LEU A 131 24.543 6.684 19.246 1.00 17.54 C ATOM 1271 CD1 LEU A 131 25.306 7.943 19.625 1.00 15.07 C ATOM 1272 CD2 LEU A 131 25.510 5.555 18.962 1.00 19.32 C ATOM 1273 HA LEU A 131 21.747 5.974 19.332 1.00 0.00 H ATOM 1274 HB2 LEU A 131 23.207 7.185 20.828 1.00 0.00 H ATOM 1275 HB3 LEU A 131 24.171 5.716 21.108 1.00 0.00 H ATOM 1276 HG LEU A 131 23.960 6.896 18.350 1.00 0.00 H ATOM 1277 HD21 LEU A 131 26.083 5.334 19.863 1.00 0.00 H ATOM 1278 HD22 LEU A 131 24.953 4.669 18.657 1.00 0.00 H ATOM 1279 HD23 LEU A 131 26.188 5.852 18.162 1.00 0.00 H ATOM 1280 HD11 LEU A 131 24.600 8.754 19.804 1.00 0.00 H ATOM 1281 HD12 LEU A 131 25.885 7.757 20.530 1.00 0.00 H ATOM 1282 HD13 LEU A 131 25.978 8.218 18.812 1.00 0.00 H ATOM 1283 H LEU A 131 21.978 5.352 22.160 1.00 0.00 H ATOM 1284 N VAL A 132 23.411 3.215 20.189 1.00 21.17 N ATOM 1285 CA VAL A 132 23.867 1.924 19.695 1.00 20.95 C ATOM 1286 C VAL A 132 22.727 1.129 19.056 1.00 21.98 C ATOM 1287 O VAL A 132 22.833 0.709 17.903 1.00 23.98 O ATOM 1288 CB VAL A 132 24.498 1.081 20.833 1.00 21.52 C ATOM 1289 CG1 VAL A 132 24.674 -0.363 20.388 1.00 21.03 C ATOM 1290 CG2 VAL A 132 25.843 1.670 21.224 1.00 19.67 C ATOM 1291 HA VAL A 132 24.622 2.128 18.936 1.00 0.00 H ATOM 1292 HB VAL A 132 23.832 1.101 21.696 1.00 0.00 H ATOM 1293 HG11 VAL A 132 23.702 -0.784 20.131 1.00 0.00 H ATOM 1294 HG12 VAL A 132 25.328 -0.396 19.516 1.00 0.00 H ATOM 1295 HG13 VAL A 132 25.118 -0.940 21.199 1.00 0.00 H ATOM 1296 HG21 VAL A 132 26.506 1.663 20.359 1.00 0.00 H ATOM 1297 HG22 VAL A 132 25.703 2.695 21.568 1.00 0.00 H ATOM 1298 HG23 VAL A 132 26.281 1.073 22.024 1.00 0.00 H ATOM 1299 H VAL A 132 23.558 3.459 21.189 1.00 0.00 H ATOM 1300 N ASP A 133 21.637 0.924 19.792 1.00 20.55 N ATOM 1301 CA ASP A 133 20.513 0.164 19.254 1.00 21.44 C ATOM 1302 C ASP A 133 19.944 0.777 17.974 1.00 21.83 C ATOM 1303 O ASP A 133 19.569 0.059 17.050 1.00 22.20 O ATOM 1304 CB ASP A 133 19.416 -0.009 20.315 1.00 19.26 C ATOM 1305 CG ASP A 133 19.832 -0.968 21.426 1.00 21.56 C ATOM 1306 OD1 ASP A 133 20.752 -1.777 21.188 1.00 21.24 O ATOM 1307 OD2 ASP A 133 19.238 -0.928 22.528 1.00 20.76 O ATOM 1308 HA ASP A 133 20.898 -0.819 18.984 1.00 0.00 H ATOM 1309 HB2 ASP A 133 19.197 0.964 20.755 1.00 0.00 H ATOM 1310 HB3 ASP A 133 18.520 -0.399 19.833 1.00 0.00 H ATOM 1311 H ASP A 133 21.586 1.308 20.757 1.00 0.00 H ATOM 1312 N TYR A 134 19.896 2.102 17.911 1.00 22.25 N ATOM 1313 CA TYR A 134 19.399 2.790 16.722 1.00 22.56 C ATOM 1314 C TYR A 134 20.190 2.371 15.489 1.00 23.09 C ATOM 1315 O TYR A 134 19.619 2.038 14.449 1.00 23.76 O ATOM 1316 CB TYR A 134 19.542 4.300 16.892 1.00 22.49 C ATOM 1317 CG TYR A 134 19.137 5.120 15.680 1.00 24.57 C ATOM 1318 CD1 TYR A 134 17.801 5.460 15.455 1.00 24.87 C ATOM 1319 CD2 TYR A 134 20.096 5.587 14.779 1.00 24.75 C ATOM 1320 CE1 TYR A 134 17.431 6.254 14.368 1.00 23.90 C ATOM 1321 CE2 TYR A 134 19.740 6.378 13.686 1.00 25.02 C ATOM 1322 CZ TYR A 134 18.405 6.711 13.489 1.00 27.73 C ATOM 1323 OH TYR A 134 18.045 7.518 12.427 1.00 28.70 O ATOM 1324 HA TYR A 134 18.350 2.522 16.594 1.00 0.00 H ATOM 1325 HB3 TYR A 134 20.586 4.519 17.116 1.00 0.00 H ATOM 1326 HB2 TYR A 134 18.920 4.607 17.732 1.00 0.00 H ATOM 1327 HD2 TYR A 134 21.144 5.328 14.933 1.00 0.00 H ATOM 1328 HE2 TYR A 134 20.503 6.732 12.992 1.00 0.00 H ATOM 1329 HE1 TYR A 134 16.384 6.514 14.210 1.00 0.00 H ATOM 1330 HD1 TYR A 134 17.034 5.099 16.140 1.00 0.00 H ATOM 1331 HH TYR A 134 17.064 7.654 12.435 1.00 0.00 H ATOM 1332 H TYR A 134 20.219 2.662 18.725 1.00 0.00 H ATOM 1333 N HIS A 135 21.512 2.387 15.604 1.00 22.99 N ATOM 1334 CA HIS A 135 22.340 2.035 14.470 1.00 22.23 C ATOM 1335 C HIS A 135 22.458 0.557 14.165 1.00 22.37 C ATOM 1336 O HIS A 135 23.306 0.142 13.387 1.00 21.59 O ATOM 1337 CB HIS A 135 23.708 2.696 14.594 1.00 19.57 C ATOM 1338 CG HIS A 135 23.660 4.175 14.370 1.00 21.61 C ATOM 1339 ND1 HIS A 135 23.516 5.082 15.400 1.00 21.38 N ATOM 1340 CD2 HIS A 135 23.647 4.900 13.225 1.00 20.53 C ATOM 1341 CE1 HIS A 135 23.417 6.301 14.898 1.00 21.78 C ATOM 1342 NE2 HIS A 135 23.492 6.219 13.582 1.00 20.26 N ATOM 1343 HA HIS A 135 21.812 2.427 13.601 1.00 0.00 H ATOM 1344 HB2 HIS A 135 24.097 2.507 15.595 1.00 0.00 H ATOM 1345 HB3 HIS A 135 24.377 2.253 13.856 1.00 0.00 H ATOM 1346 HD2 HIS A 135 23.742 4.511 12.211 1.00 0.00 H ATOM 1347 HE1 HIS A 135 23.294 7.219 15.473 1.00 0.00 H ATOM 1348 H HIS A 135 21.953 2.652 16.508 1.00 0.00 H ATOM 1349 N ARG A 136 21.597 -0.241 14.782 1.00 24.55 N ATOM 1350 CA ARG A 136 21.577 -1.664 14.484 1.00 24.12 C ATOM 1351 C ARG A 136 20.704 -1.767 13.231 1.00 24.67 C ATOM 1352 O ARG A 136 20.897 -2.658 12.412 1.00 25.36 O ATOM 1353 CB ARG A 136 20.944 -2.468 15.625 1.00 22.55 C ATOM 1354 CG ARG A 136 21.828 -2.647 16.857 1.00 22.11 C ATOM 1355 CD ARG A 136 21.095 -3.423 17.941 1.00 20.23 C ATOM 1356 NE ARG A 136 21.842 -3.506 19.194 1.00 20.64 N ATOM 1357 CZ ARG A 136 22.895 -4.289 19.395 1.00 19.64 C ATOM 1358 NH1 ARG A 136 23.341 -5.069 18.424 1.00 20.94 N ATOM 1359 NH2 ARG A 136 23.496 -4.301 20.576 1.00 19.89 N ATOM 1360 HA ARG A 136 22.582 -2.065 14.349 1.00 0.00 H ATOM 1361 HB2 ARG A 136 20.032 -1.957 15.934 1.00 0.00 H ATOM 1362 HB3 ARG A 136 20.692 -3.457 15.243 1.00 0.00 H ATOM 1363 HG2 ARG A 136 22.729 -3.192 16.574 1.00 0.00 H ATOM 1364 HG3 ARG A 136 22.104 -1.666 17.244 1.00 0.00 H ATOM 1365 HD2 ARG A 136 20.911 -4.435 17.579 1.00 0.00 H ATOM 1366 HD3 ARG A 136 20.143 -2.930 18.137 1.00 0.00 H ATOM 1367 HE ARG A 136 21.526 -2.909 19.985 1.00 0.00 H ATOM 1368 HH12 ARG A 136 24.166 -5.681 18.586 1.00 0.00 H ATOM 1369 HH11 ARG A 136 22.866 -5.070 17.499 1.00 0.00 H ATOM 1370 HH22 ARG A 136 24.321 -4.914 20.733 1.00 0.00 H ATOM 1371 HH21 ARG A 136 23.143 -3.697 21.345 1.00 0.00 H ATOM 1372 H ARG A 136 20.934 0.152 15.481 1.00 0.00 H ATOM 1373 N SER A 137 19.761 -0.832 13.078 1.00 25.20 N ATOM 1374 CA SER A 137 18.850 -0.829 11.930 1.00 26.23 C ATOM 1375 C SER A 137 18.937 0.385 10.980 1.00 27.21 C ATOM 1376 O SER A 137 18.185 0.464 10.006 1.00 29.22 O ATOM 1377 CB SER A 137 17.402 -1.017 12.413 1.00 25.63 C ATOM 1378 OG SER A 137 17.009 0.005 13.312 1.00 26.48 O ATOM 1379 HA SER A 137 19.184 -1.668 11.319 1.00 0.00 H ATOM 1380 HB2 SER A 137 17.320 -1.980 12.916 1.00 0.00 H ATOM 1381 HB3 SER A 137 16.737 -1.002 11.549 1.00 0.00 H ATOM 1382 HG SER A 137 16.074 -0.151 13.599 1.00 0.00 H ATOM 1383 H SER A 137 19.671 -0.084 13.795 1.00 0.00 H ATOM 1384 N THR A 138 19.832 1.328 11.276 1.00 26.62 N ATOM 1385 CA THR A 138 20.068 2.506 10.431 1.00 24.37 C ATOM 1386 C THR A 138 21.594 2.649 10.355 1.00 24.87 C ATOM 1387 O THR A 138 22.282 2.609 11.377 1.00 22.93 O ATOM 1388 CB THR A 138 19.455 3.808 11.022 1.00 25.21 C ATOM 1389 OG1 THR A 138 18.032 3.675 11.113 1.00 26.90 O ATOM 1390 CG2 THR A 138 19.770 5.010 10.118 1.00 22.28 C ATOM 1391 HA THR A 138 19.596 2.368 9.458 1.00 0.00 H ATOM 1392 HB THR A 138 19.886 3.969 12.010 1.00 0.00 H ATOM 1393 HG1 THR A 138 17.810 2.911 11.702 1.00 0.00 H ATOM 1394 HG23 THR A 138 20.850 5.128 10.036 1.00 0.00 H ATOM 1395 HG21 THR A 138 19.346 4.840 9.128 1.00 0.00 H ATOM 1396 HG22 THR A 138 19.336 5.912 10.550 1.00 0.00 H ATOM 1397 H THR A 138 20.390 1.224 12.147 1.00 0.00 H ATOM 1398 N SER A 139 22.124 2.808 9.149 1.00 24.25 N ATOM 1399 CA SER A 139 23.569 2.892 8.953 1.00 26.15 C ATOM 1400 C SER A 139 24.344 3.951 9.753 1.00 26.13 C ATOM 1401 O SER A 139 23.898 5.089 9.896 1.00 26.74 O ATOM 1402 CB SER A 139 23.868 3.069 7.462 1.00 24.88 C ATOM 1403 OG SER A 139 25.253 2.928 7.210 1.00 26.21 O ATOM 1404 HA SER A 139 23.935 1.948 9.356 1.00 0.00 H ATOM 1405 HB2 SER A 139 23.546 4.062 7.147 1.00 0.00 H ATOM 1406 HB3 SER A 139 23.322 2.315 6.895 1.00 0.00 H ATOM 1407 HG SER A 139 25.425 3.046 6.242 1.00 0.00 H ATOM 1408 H SER A 139 21.495 2.874 8.323 1.00 0.00 H ATOM 1409 N VAL A 140 25.514 3.563 10.265 1.00 25.58 N ATOM 1410 CA VAL A 140 26.371 4.477 11.026 1.00 27.82 C ATOM 1411 C VAL A 140 27.225 5.282 10.051 1.00 28.89 C ATOM 1412 O VAL A 140 27.831 6.294 10.421 1.00 27.16 O ATOM 1413 CB VAL A 140 27.364 3.725 11.956 1.00 28.17 C ATOM 1414 CG1 VAL A 140 26.628 3.017 13.061 1.00 29.98 C ATOM 1415 CG2 VAL A 140 28.183 2.730 11.143 1.00 28.18 C ATOM 1416 HA VAL A 140 25.710 5.101 11.628 1.00 0.00 H ATOM 1417 HB VAL A 140 28.036 4.454 12.409 1.00 0.00 H ATOM 1418 HG11 VAL A 140 26.075 3.746 13.653 1.00 0.00 H ATOM 1419 HG12 VAL A 140 25.934 2.296 12.630 1.00 0.00 H ATOM 1420 HG13 VAL A 140 27.344 2.498 13.698 1.00 0.00 H ATOM 1421 HG21 VAL A 140 27.514 2.009 10.672 1.00 0.00 H ATOM 1422 HG22 VAL A 140 28.743 3.264 10.375 1.00 0.00 H ATOM 1423 HG23 VAL A 140 28.876 2.207 11.802 1.00 0.00 H ATOM 1424 H VAL A 140 25.827 2.582 10.120 1.00 0.00 H ATOM 1425 N SER A 141 27.270 4.814 8.806 1.00 29.68 N ATOM 1426 CA SER A 141 28.076 5.447 7.768 1.00 30.84 C ATOM 1427 C SER A 141 27.293 6.234 6.722 1.00 31.47 C ATOM 1428 O SER A 141 26.149 5.915 6.412 1.00 30.29 O ATOM 1429 CB SER A 141 28.919 4.383 7.067 1.00 30.47 C ATOM 1430 OG SER A 141 29.618 4.927 5.964 1.00 32.21 O ATOM 1431 HA SER A 141 28.691 6.182 8.286 1.00 0.00 H ATOM 1432 HB2 SER A 141 28.264 3.586 6.715 1.00 0.00 H ATOM 1433 HB3 SER A 141 29.638 3.974 7.777 1.00 0.00 H ATOM 1434 HG SER A 141 30.218 5.649 6.279 1.00 0.00 H ATOM 1435 H SER A 141 26.712 3.970 8.565 1.00 0.00 H ATOM 1436 N ARG A 142 27.937 7.265 6.184 1.00 34.50 N ATOM 1437 CA ARG A 142 27.355 8.112 5.150 1.00 37.76 C ATOM 1438 C ARG A 142 27.612 7.498 3.776 1.00 39.23 C ATOM 1439 O ARG A 142 26.746 7.526 2.905 1.00 39.69 O ATOM 1440 CB ARG A 142 27.988 9.516 5.165 1.00 37.23 C ATOM 1441 CG ARG A 142 27.107 10.629 5.712 1.00 36.29 C ATOM 1442 CD ARG A 142 27.380 11.975 5.030 1.00 35.14 C ATOM 1443 NE ARG A 142 28.770 12.421 5.110 1.00 31.52 N ATOM 1444 CZ ARG A 142 29.146 13.610 5.574 1.00 32.09 C ATOM 1445 NH1 ARG A 142 28.241 14.480 6.012 1.00 31.95 N ATOM 1446 NH2 ARG A 142 30.427 13.944 5.583 1.00 30.18 N ATOM 1447 HA ARG A 142 26.286 8.190 5.348 1.00 0.00 H ATOM 1448 HB2 ARG A 142 28.890 9.471 5.776 1.00 0.00 H ATOM 1449 HB3 ARG A 142 28.257 9.774 4.141 1.00 0.00 H ATOM 1450 HG2 ARG A 142 26.063 10.360 5.553 1.00 0.00 H ATOM 1451 HG3 ARG A 142 27.295 10.732 6.781 1.00 0.00 H ATOM 1452 HD2 ARG A 142 26.751 12.730 5.502 1.00 0.00 H ATOM 1453 HD3 ARG A 142 27.110 11.885 3.978 1.00 0.00 H ATOM 1454 HE ARG A 142 29.511 11.768 4.784 1.00 0.00 H ATOM 1455 HH12 ARG A 142 28.543 15.407 6.373 1.00 0.00 H ATOM 1456 HH11 ARG A 142 27.231 14.233 5.993 1.00 0.00 H ATOM 1457 HH22 ARG A 142 30.719 14.874 5.946 1.00 0.00 H ATOM 1458 HH21 ARG A 142 31.141 13.277 5.227 1.00 0.00 H ATOM 1459 H ARG A 142 28.900 7.477 6.516 1.00 0.00 H ATOM 1460 N ASN A 143 28.810 6.942 3.598 1.00 42.22 N ATOM 1461 CA ASN A 143 29.230 6.357 2.320 1.00 45.68 C ATOM 1462 C ASN A 143 28.770 4.933 1.997 1.00 45.89 C ATOM 1463 O ASN A 143 28.702 4.559 0.826 1.00 46.23 O ATOM 1464 CB ASN A 143 30.752 6.418 2.208 1.00 46.97 C ATOM 1465 CG ASN A 143 31.304 7.786 2.545 1.00 50.31 C ATOM 1466 OD1 ASN A 143 30.888 8.796 1.971 1.00 52.13 O ATOM 1467 ND2 ASN A 143 32.249 7.827 3.478 1.00 50.53 N ATOM 1468 HA ASN A 143 28.716 6.974 1.583 1.00 0.00 H ATOM 1469 HB2 ASN A 143 31.183 5.688 2.894 1.00 0.00 H ATOM 1470 HB3 ASN A 143 31.038 6.167 1.186 1.00 0.00 H ATOM 1471 HD22 ASN A 143 32.568 6.948 3.934 1.00 0.00 H ATOM 1472 HD21 ASN A 143 32.670 8.738 3.752 1.00 0.00 H ATOM 1473 H ASN A 143 29.474 6.922 4.398 1.00 0.00 H ATOM 1474 N GLN A 144 28.486 4.128 3.017 1.00 45.56 N ATOM 1475 CA GLN A 144 28.027 2.760 2.780 1.00 45.18 C ATOM 1476 C GLN A 144 27.017 2.371 3.840 1.00 42.57 C ATOM 1477 O GLN A 144 26.914 3.018 4.880 1.00 41.94 O ATOM 1478 CB GLN A 144 29.173 1.739 2.850 1.00 46.78 C ATOM 1479 CG GLN A 144 30.505 2.160 2.274 1.00 50.57 C ATOM 1480 CD GLN A 144 31.460 2.627 3.352 1.00 53.67 C ATOM 1481 OE1 GLN A 144 32.638 2.876 3.093 1.00 56.80 O ATOM 1482 NE2 GLN A 144 30.954 2.750 4.573 1.00 54.45 N ATOM 1483 HA GLN A 144 27.594 2.744 1.780 1.00 0.00 H ATOM 1484 HB2 GLN A 144 29.332 1.494 3.900 1.00 0.00 H ATOM 1485 HB3 GLN A 144 28.851 0.846 2.315 1.00 0.00 H ATOM 1486 HG2 GLN A 144 30.948 1.312 1.752 1.00 0.00 H ATOM 1487 HG3 GLN A 144 30.343 2.975 1.568 1.00 0.00 H ATOM 1488 HE22 GLN A 144 29.953 2.528 4.746 1.00 0.00 H ATOM 1489 HE21 GLN A 144 31.559 3.068 5.357 1.00 0.00 H ATOM 1490 H GLN A 144 28.591 4.475 3.992 1.00 0.00 H ATOM 1491 N GLN A 145 26.279 1.300 3.577 1.00 40.02 N ATOM 1492 CA GLN A 145 25.312 0.813 4.538 1.00 38.87 C ATOM 1493 C GLN A 145 26.073 -0.106 5.490 1.00 36.80 C ATOM 1494 O GLN A 145 26.520 -1.185 5.104 1.00 36.21 O ATOM 1495 CB GLN A 145 24.195 0.036 3.840 1.00 40.10 C ATOM 1496 CG GLN A 145 23.046 -0.355 4.766 1.00 44.29 C ATOM 1497 CD GLN A 145 21.924 -1.075 4.035 1.00 48.42 C ATOM 1498 OE1 GLN A 145 21.948 -2.299 3.880 1.00 49.96 O ATOM 1499 NE2 GLN A 145 20.939 -0.310 3.566 1.00 48.65 N ATOM 1500 HA GLN A 145 24.845 1.642 5.070 1.00 0.00 H ATOM 1501 HB2 GLN A 145 23.795 0.655 3.037 1.00 0.00 H ATOM 1502 HB3 GLN A 145 24.621 -0.874 3.417 1.00 0.00 H ATOM 1503 HG2 GLN A 145 23.433 -1.012 5.545 1.00 0.00 H ATOM 1504 HG3 GLN A 145 22.642 0.549 5.222 1.00 0.00 H ATOM 1505 HE22 GLN A 145 20.961 0.718 3.721 1.00 0.00 H ATOM 1506 HE21 GLN A 145 20.149 -0.741 3.045 1.00 0.00 H ATOM 1507 H GLN A 145 26.397 0.805 2.670 1.00 0.00 H ATOM 1508 N ILE A 146 26.238 0.345 6.728 1.00 33.30 N ATOM 1509 CA ILE A 146 26.939 -0.421 7.751 1.00 29.80 C ATOM 1510 C ILE A 146 26.043 -0.476 8.984 1.00 29.80 C ATOM 1511 O ILE A 146 25.836 0.531 9.651 1.00 29.53 O ATOM 1512 CB ILE A 146 28.281 0.251 8.141 1.00 28.17 C ATOM 1513 CG1 ILE A 146 29.198 0.351 6.920 1.00 26.80 C ATOM 1514 CG2 ILE A 146 28.959 -0.540 9.249 1.00 26.27 C ATOM 1515 CD1 ILE A 146 30.523 1.013 7.203 1.00 27.86 C ATOM 1516 HA ILE A 146 27.158 -1.416 7.365 1.00 0.00 H ATOM 1517 HB ILE A 146 28.077 1.258 8.505 1.00 0.00 H ATOM 1518 HG12 ILE A 146 29.389 -0.657 6.551 1.00 0.00 H ATOM 1519 HG13 ILE A 146 28.684 0.927 6.151 1.00 0.00 H ATOM 1520 HD11 ILE A 146 30.351 2.028 7.562 1.00 0.00 H ATOM 1521 HD12 ILE A 146 31.058 0.443 7.963 1.00 0.00 H ATOM 1522 HD13 ILE A 146 31.114 1.045 6.288 1.00 0.00 H ATOM 1523 HG21 ILE A 146 28.307 -0.572 10.122 1.00 0.00 H ATOM 1524 HG22 ILE A 146 29.154 -1.555 8.902 1.00 0.00 H ATOM 1525 HG23 ILE A 146 29.900 -0.058 9.514 1.00 0.00 H ATOM 1526 H ILE A 146 25.853 1.279 6.977 1.00 0.00 H ATOM 1527 N PHE A 147 25.499 -1.651 9.274 1.00 29.95 N ATOM 1528 CA PHE A 147 24.628 -1.831 10.426 1.00 28.57 C ATOM 1529 C PHE A 147 25.410 -2.463 11.573 1.00 28.10 C ATOM 1530 O PHE A 147 26.119 -3.445 11.383 1.00 28.74 O ATOM 1531 CB PHE A 147 23.441 -2.726 10.048 1.00 31.01 C ATOM 1532 CG PHE A 147 22.412 -2.051 9.171 1.00 31.24 C ATOM 1533 CD1 PHE A 147 21.582 -2.807 8.355 1.00 33.56 C ATOM 1534 CD2 PHE A 147 22.261 -0.669 9.172 1.00 32.38 C ATOM 1535 CE1 PHE A 147 20.616 -2.197 7.550 1.00 34.46 C ATOM 1536 CE2 PHE A 147 21.299 -0.049 8.372 1.00 32.06 C ATOM 1537 CZ PHE A 147 20.478 -0.812 7.561 1.00 32.50 C ATOM 1538 HA PHE A 147 24.253 -0.858 10.744 1.00 0.00 H ATOM 1539 HB2 PHE A 147 23.825 -3.597 9.517 1.00 0.00 H ATOM 1540 HB3 PHE A 147 22.950 -3.049 10.966 1.00 0.00 H ATOM 1541 HD2 PHE A 147 22.904 -0.060 9.807 1.00 0.00 H ATOM 1542 HE2 PHE A 147 21.195 1.036 8.386 1.00 0.00 H ATOM 1543 HZ PHE A 147 19.727 -0.331 6.934 1.00 0.00 H ATOM 1544 HE1 PHE A 147 19.972 -2.805 6.915 1.00 0.00 H ATOM 1545 HD1 PHE A 147 21.685 -3.892 8.342 1.00 0.00 H ATOM 1546 H PHE A 147 25.701 -2.466 8.661 1.00 0.00 H ATOM 1547 N LEU A 148 25.284 -1.892 12.765 1.00 27.57 N ATOM 1548 CA LEU A 148 25.984 -2.412 13.932 1.00 26.42 C ATOM 1549 C LEU A 148 25.460 -3.782 14.354 1.00 25.86 C ATOM 1550 O LEU A 148 24.255 -4.009 14.396 1.00 24.28 O ATOM 1551 CB LEU A 148 25.843 -1.447 15.119 1.00 26.22 C ATOM 1552 CG LEU A 148 26.455 -0.048 15.032 1.00 26.24 C ATOM 1553 CD1 LEU A 148 26.305 0.663 16.376 1.00 25.67 C ATOM 1554 CD2 LEU A 148 27.921 -0.159 14.657 1.00 26.54 C ATOM 1555 HA LEU A 148 27.032 -2.512 13.648 1.00 0.00 H ATOM 1556 HB2 LEU A 148 24.775 -1.315 15.295 1.00 0.00 H ATOM 1557 HB3 LEU A 148 26.295 -1.937 15.981 1.00 0.00 H ATOM 1558 HG LEU A 148 25.936 0.531 14.268 1.00 0.00 H ATOM 1559 HD21 LEU A 148 28.446 -0.739 15.416 1.00 0.00 H ATOM 1560 HD22 LEU A 148 28.011 -0.656 13.691 1.00 0.00 H ATOM 1561 HD23 LEU A 148 28.356 0.839 14.595 1.00 0.00 H ATOM 1562 HD11 LEU A 148 25.247 0.745 16.626 1.00 0.00 H ATOM 1563 HD12 LEU A 148 26.819 0.090 17.148 1.00 0.00 H ATOM 1564 HD13 LEU A 148 26.742 1.659 16.309 1.00 0.00 H ATOM 1565 H LEU A 148 24.673 -1.057 12.868 1.00 0.00 H ATOM 1566 N ARG A 149 26.374 -4.697 14.650 1.00 25.65 N ATOM 1567 CA ARG A 149 26.003 -6.025 15.123 1.00 26.95 C ATOM 1568 C ARG A 149 26.990 -6.410 16.214 1.00 27.66 C ATOM 1569 O ARG A 149 28.146 -5.985 16.194 1.00 28.79 O ATOM 1570 CB ARG A 149 26.001 -7.056 13.983 1.00 27.55 C ATOM 1571 CG ARG A 149 27.271 -7.134 13.147 1.00 30.48 C ATOM 1572 CD ARG A 149 27.122 -8.213 12.076 1.00 28.82 C ATOM 1573 NE ARG A 149 26.937 -9.529 12.680 1.00 30.63 N ATOM 1574 CZ ARG A 149 26.140 -10.479 12.197 1.00 30.74 C ATOM 1575 NH1 ARG A 149 25.441 -10.271 11.089 1.00 31.02 N ATOM 1576 NH2 ARG A 149 26.024 -11.635 12.835 1.00 31.99 N ATOM 1577 HA ARG A 149 24.986 -6.010 15.516 1.00 0.00 H ATOM 1578 HB2 ARG A 149 25.831 -8.039 14.423 1.00 0.00 H ATOM 1579 HB3 ARG A 149 25.176 -6.811 13.314 1.00 0.00 H ATOM 1580 HG2 ARG A 149 27.449 -6.171 12.668 1.00 0.00 H ATOM 1581 HG3 ARG A 149 28.115 -7.379 13.792 1.00 0.00 H ATOM 1582 HD2 ARG A 149 28.019 -8.228 11.457 1.00 0.00 H ATOM 1583 HD3 ARG A 149 26.257 -7.981 11.454 1.00 0.00 H ATOM 1584 HE ARG A 149 27.466 -9.739 13.550 1.00 0.00 H ATOM 1585 HH12 ARG A 149 24.820 -11.018 10.718 1.00 0.00 H ATOM 1586 HH11 ARG A 149 25.514 -9.361 10.592 1.00 0.00 H ATOM 1587 HH22 ARG A 149 25.401 -12.377 12.457 1.00 0.00 H ATOM 1588 HH21 ARG A 149 26.556 -11.800 13.713 1.00 0.00 H ATOM 1589 H ARG A 149 27.381 -4.461 14.542 1.00 0.00 H ATOM 1590 N ASP A 150 26.524 -7.201 17.174 1.00 27.85 N ATOM 1591 CA ASP A 150 27.347 -7.611 18.305 1.00 28.48 C ATOM 1592 C ASP A 150 28.563 -8.463 17.959 1.00 28.96 C ATOM 1593 O ASP A 150 28.532 -9.282 17.045 1.00 27.45 O ATOM 1594 CB ASP A 150 26.473 -8.338 19.336 1.00 29.48 C ATOM 1595 CG ASP A 150 25.427 -7.427 19.956 1.00 31.28 C ATOM 1596 OD1 ASP A 150 24.529 -7.930 20.650 1.00 36.64 O ATOM 1597 OD2 ASP A 150 25.501 -6.198 19.761 1.00 32.08 O ATOM 1598 HA ASP A 150 27.760 -6.688 18.712 1.00 0.00 H ATOM 1599 HB2 ASP A 150 25.967 -9.168 18.843 1.00 0.00 H ATOM 1600 HB3 ASP A 150 27.114 -8.725 20.128 1.00 0.00 H ATOM 1601 H ASP A 150 25.542 -7.538 17.117 1.00 0.00 H ATOM 1602 N ILE A 151 29.640 -8.253 18.708 1.00 30.75 N ATOM 1603 CA ILE A 151 30.873 -9.001 18.513 1.00 32.04 C ATOM 1604 C ILE A 151 30.655 -10.467 18.878 1.00 33.04 C ATOM 1605 O ILE A 151 29.753 -10.794 19.651 1.00 31.68 O ATOM 1606 CB ILE A 151 32.006 -8.424 19.380 1.00 32.07 C ATOM 1607 CG1 ILE A 151 31.516 -8.248 20.822 1.00 32.82 C ATOM 1608 CG2 ILE A 151 32.475 -7.106 18.796 1.00 30.98 C ATOM 1609 CD1 ILE A 151 32.568 -7.729 21.785 1.00 33.22 C ATOM 1610 HA ILE A 151 31.157 -8.921 17.464 1.00 0.00 H ATOM 1611 HB ILE A 151 32.850 -9.113 19.389 1.00 0.00 H ATOM 1612 HG12 ILE A 151 30.683 -7.545 20.816 1.00 0.00 H ATOM 1613 HG13 ILE A 151 31.170 -9.216 21.185 1.00 0.00 H ATOM 1614 HD11 ILE A 151 33.405 -8.426 21.817 1.00 0.00 H ATOM 1615 HD12 ILE A 151 32.918 -6.754 21.447 1.00 0.00 H ATOM 1616 HD13 ILE A 151 32.133 -7.636 22.780 1.00 0.00 H ATOM 1617 HG21 ILE A 151 32.842 -7.269 17.783 1.00 0.00 H ATOM 1618 HG22 ILE A 151 31.642 -6.403 18.774 1.00 0.00 H ATOM 1619 HG23 ILE A 151 33.277 -6.701 19.413 1.00 0.00 H ATOM 1620 H ILE A 151 29.601 -7.532 19.457 1.00 0.00 H ATOM 1621 N GLU A 152 31.484 -11.343 18.313 1.00 34.74 N ATOM 1622 CA GLU A 152 31.378 -12.777 18.563 1.00 36.07 C ATOM 1623 C GLU A 152 32.736 -13.467 18.517 1.00 36.38 C ATOM 1624 O GLU A 152 33.772 -12.842 18.748 1.00 37.31 O ATOM 1625 CB GLU A 152 30.448 -13.417 17.531 1.00 36.74 C ATOM 1626 CG GLU A 152 30.871 -13.211 16.088 1.00 38.47 C ATOM 1627 CD GLU A 152 29.912 -13.855 15.107 1.00 41.12 C ATOM 1628 OE1 GLU A 152 29.753 -15.093 15.142 1.00 44.58 O ATOM 1629 OE2 GLU A 152 29.311 -13.129 14.298 1.00 42.43 O ATOM 1630 HA GLU A 152 30.971 -12.904 19.566 1.00 0.00 H ATOM 1631 OXT GLU A 152 32.755 -14.698 18.288 1.00 31.51 O ATOM 1632 HB2 GLU A 152 30.410 -14.489 17.725 1.00 0.00 H ATOM 1633 HB3 GLU A 152 29.453 -12.991 17.658 1.00 0.00 H ATOM 1634 HG2 GLU A 152 30.914 -12.141 15.885 1.00 0.00 H ATOM 1635 HG3 GLU A 152 31.860 -13.646 15.947 1.00 0.00 H ATOM 1636 H GLU A 152 32.228 -10.995 17.675 1.00 0.00 H TER 1637 GLU A 152 HETATM 1638 O HOH 1 21.533 11.375 11.842 1.00 24.65 O HETATM 1639 O HOH 2 24.435 8.490 29.418 1.00 21.43 O HETATM 1640 O HOH 3 31.769 -10.358 14.144 1.00 25.79 O HETATM 1641 O HOH 4 31.825 9.649 5.011 1.00 54.62 O HETATM 1642 O HOH 5 22.620 -3.108 22.738 1.00 18.57 O HETATM 1643 O HOH 6 23.331 10.878 15.118 1.00 17.88 O HETATM 1644 O HOH 7 19.439 -2.544 24.603 1.00 26.11 O HETATM 1645 O HOH 8 17.089 2.603 13.247 1.00 23.40 O HETATM 1646 O HOH 9 42.318 16.051 23.286 1.00 39.04 O HETATM 1647 O HOH 10 29.209 -5.366 4.408 1.00 36.78 O HETATM 1648 O HOH 11 37.896 -10.305 17.921 1.00 33.63 O HETATM 1649 O HOH 12 29.184 -9.401 14.491 1.00 40.11 O HETATM 1650 O HOH 13 29.420 -5.365 20.037 1.00 27.15 O HETATM 1651 O HOH 14 30.500 7.680 6.460 1.00 24.81 O HETATM 1652 O HOH 15 27.912 -3.229 6.033 1.00 37.56 O HETATM 1653 O HOH 16 23.748 -8.458 16.944 1.00 30.68 O HETATM 1654 O HOH 17 38.247 -5.402 2.256 1.00 39.85 O HETATM 1655 O HOH 18 22.954 8.999 13.633 1.00 27.71 O HETATM 1656 O HOH 19 17.122 8.718 22.887 1.00 28.96 O HETATM 1657 O HOH 20 32.604 14.289 21.972 1.00 58.25 O HETATM 1658 O HOH 21 14.812 8.374 25.568 1.00 36.70 O HETATM 1659 O HOH 22 40.004 4.871 23.416 1.00 26.72 O HETATM 1660 O HOH 23 16.281 5.665 9.809 1.00 43.74 O HETATM 1661 O HOH 24 20.280 3.078 6.662 1.00 37.05 O HETATM 1662 O HOH 25 14.496 18.473 15.587 1.00 33.30 O HETATM 1663 O HOH 26 34.353 -12.815 15.209 1.00 33.31 O HETATM 1664 O HOH 27 30.852 9.442 -1.497 1.00 41.41 O HETATM 1665 O HOH 28 34.245 -8.346 6.083 1.00 37.77 O HETATM 1666 O HOH 29 23.427 -8.137 27.140 1.00 43.86 O HETATM 1667 O HOH 30 29.066 10.451 1.219 1.00 40.35 O HETATM 1668 O HOH 31 31.351 13.013 25.900 1.00 33.31 O HETATM 1669 O HOH 32 15.824 8.635 12.116 1.00 34.81 O HETATM 1670 O HOH 33 18.023 1.106 23.377 1.00 27.72 O HETATM 1671 O HOH 34 36.659 -8.013 3.380 1.00 55.20 O HETATM 1672 O HOH 35 19.209 -4.793 21.268 1.00 45.08 O HETATM 1673 O HOH 36 21.322 -6.857 27.875 1.00 44.86 O HETATM 1674 O HOH 37 26.460 -10.720 15.921 1.00 51.26 O HETATM 1675 O HOH 38 36.275 10.076 21.365 1.00 41.66 O HETATM 1676 O HOH 39 30.724 -4.614 1.502 1.00 44.96 O HETATM 1677 O HOH 40 18.300 16.123 15.520 1.00 41.15 O HETATM 1678 O HOH 41 19.894 -15.819 33.152 1.00 42.81 O HETATM 1679 O HOH 42 37.252 8.998 28.153 1.00 28.87 O HETATM 1680 O HOH 43 12.471 11.161 27.267 1.00 42.03 O HETATM 1681 O HOH 44 26.172 -3.759 7.849 1.00 20.96 O HETATM 1682 O HOH 45 32.187 5.198 6.910 1.00 41.22 O HETATM 1683 O HOH 46 26.377 -5.681 9.820 1.00 28.65 O HETATM 1684 O HOH 47 16.895 14.443 17.135 1.00 27.93 O HETATM 1685 O HOH 48 31.365 11.372 23.905 1.00 30.46 O HETATM 1686 O HOH 49 43.341 3.952 14.132 1.00 31.30 O HETATM 1687 O HOH 50 47.495 -3.499 18.412 1.00 55.04 O HETATM 1688 O HOH 51 17.555 1.730 7.486 1.00 41.72 O HETATM 1689 O HOH 52 19.857 11.611 9.785 1.00 37.36 O HETATM 1690 O HOH 53 18.231 -5.493 24.510 1.00 47.69 O HETATM 1691 O HOH 54 33.087 -6.293 3.488 1.00 47.97 O HETATM 1692 O HOH 55 39.737 -8.591 7.662 1.00 42.25 O HETATM 1693 O HOH 56 15.519 14.461 26.910 1.00 41.73 O HETATM 1694 O HOH 57 25.650 6.195 0.844 1.00 42.02 O HETATM 1695 O HOH 58 43.457 9.683 29.342 1.00 41.04 O HETATM 1696 O HOH 59 30.546 11.662 28.854 1.00 70.37 O HETATM 1697 O HOH 60 28.067 -11.279 14.159 1.00 48.17 O HETATM 1698 O HOH 61 16.942 16.015 13.264 1.00 55.51 O HETATM 1699 O HOH 62 30.644 16.848 21.524 1.00 31.79 O HETATM 1700 O HOH 63 30.419 -16.093 12.591 1.00 42.91 O HETATM 1701 O HOH 64 42.701 -8.309 20.528 1.00 48.73 O HETATM 1702 O HOH 65 39.410 -5.077 9.739 1.00 50.50 O HETATM 1703 O HOH 66 34.848 5.144 2.910 1.00 59.47 O HETATM 1704 O HOH 67 46.941 -9.406 22.504 1.00 31.31 O HETATM 1705 O HOH 68 16.849 3.291 20.478 1.00 42.56 O HETATM 1706 O HOH 69 14.143 6.687 11.164 1.00 61.24 O HETATM 1707 O HOH 70 21.995 -10.319 19.093 1.00 41.02 O HETATM 1708 O HOH 71 21.791 8.483 11.222 1.00 33.68 O HETATM 1709 O HOH 72 41.622 -4.277 3.165 1.00 67.08 O HETATM 1710 O HOH 73 41.576 2.838 10.935 1.00 36.24 O HETATM 1711 O HOH 74 38.470 -13.727 12.072 1.00 58.63 O HETATM 1712 O HOH 75 17.550 -0.584 15.680 1.00 45.62 O HETATM 1713 O HOH 76 15.182 13.122 15.600 1.00 36.02 O HETATM 1714 O HOH 77 27.637 -0.094 1.460 1.00 67.54 O HETATM 1715 O HOH 78 16.251 16.045 19.744 1.00 47.76 O HETATM 1716 O HOH 79 19.784 8.458 9.706 1.00 43.51 O HETATM 1717 O HOH 80 32.751 11.070 -1.693 1.00 61.40 O HETATM 1718 O HOH 81 30.875 11.882 3.519 1.00 49.00 O HETATM 1719 O HOH 82 40.978 -14.109 13.882 1.00 33.48 O HETATM 1720 O HOH 83 20.669 -13.016 34.356 1.00 50.26 O HETATM 1721 O HOH 84 23.834 -6.668 9.675 1.00 43.95 O HETATM 1722 O HOH 85 41.292 -4.503 0.723 1.00 59.76 O HETATM 1723 O HOH 86 30.663 12.576 0.295 1.00 32.99 O HETATM 1724 O HOH 87 15.867 6.750 20.754 1.00 41.01 O HETATM 1725 O HOH 88 13.632 13.652 24.408 1.00 39.73 O HETATM 1726 O HOH 89 36.769 -16.374 12.635 1.00 59.28 O HETATM 1727 O HOH 90 18.285 -11.335 33.578 1.00 59.41 O HETATM 1728 O HOH 91 41.168 -9.431 22.191 1.00 51.26 O HETATM 1729 O HOH 92 12.710 15.058 22.364 1.00 57.23 O HETATM 1730 O HOH 93 18.822 18.246 22.320 1.00 46.90 O HETATM 1731 O HOH 94 17.235 -6.885 21.531 1.00 67.99 O HETATM 1732 O HOH 95 16.994 18.599 15.059 1.00 52.06 O HETATM 1733 O HOH 96 44.174 5.656 21.900 1.00 49.82 O HETATM 1734 O HOH 97 38.007 -3.856 28.061 1.00 59.11 O HETATM 1735 O HOH 98 18.311 -13.776 32.274 1.00 63.76 O HETATM 1736 O HOH 99 24.082 -2.357 0.649 1.00 61.98 O HETATM 1737 O HOH 100 20.010 -5.469 10.817 1.00 53.98 O HETATM 1738 O HOH 101 38.488 -13.068 17.078 1.00 54.85 O HETATM 1739 O HOH 102 14.414 4.479 23.209 1.00 53.80 O HETATM 1740 O HOH 103 39.784 -11.061 20.408 1.00 55.77 O HETATM 1741 O HOH 104 36.236 1.268 5.624 1.00 55.02 O HETATM 1742 O HOH 105 46.493 -1.235 15.601 1.00 48.81 O HETATM 1743 O HOH 106 46.232 4.065 20.001 1.00 52.55 O HETATM 1744 O HOH 107 47.081 7.445 23.068 1.00 61.95 O HETATM 1745 O HOH 108 14.734 -9.887 32.794 1.00 53.32 O HETATM 1746 O HOH 109 26.759 -6.705 22.132 1.00 56.65 O HETATM 1747 O HOH 110 15.970 -6.390 25.085 1.00 49.60 O HETATM 1748 O HOH 111 37.386 16.562 17.553 1.00 52.51 O HETATM 1749 O HOH 112 34.058 17.651 19.045 1.00 45.91 O HETATM 1750 O HOH 113 29.265 14.683 12.479 1.00 24.24 O HETATM 1751 O HOH 114 36.262 19.196 16.776 1.00 46.80 O HETATM 1752 O HOH 115 36.233 16.206 19.712 1.00 56.15 O HETATM 1753 O HOH 116 36.241 14.625 11.741 1.00 39.72 O HETATM 1754 O HOH 117 38.525 13.889 12.659 1.00 68.39 O HETATM 1755 O HOH 118 40.407 14.282 16.148 1.00 45.99 O HETATM 1756 O HOH 119 29.934 18.234 14.008 1.00 41.95 O HETATM 1757 O HOH 120 41.142 12.792 10.623 1.00 54.36 O HETATM 1758 O HOH 121 41.469 7.372 22.226 1.00 34.81 O HETATM 1759 O HOH 122 34.411 20.029 11.809 1.00 57.81 O HETATM 1760 N GLY A 123 41.910 10.392 13.587 1.00 0.24 N HETATM 1761 CA GLY A 123 40.754 11.068 13.018 1.00 0.05 C HETATM 1762 C GLY A 123 39.502 10.227 13.152 1.00 0.22 C HETATM 1763 O GLY A 123 39.573 9.054 13.517 1.00 -0.39 O HETATM 1764 N GLY A 123 38.349 10.817 12.858 1.00 -0.26 N HETATM 1765 CA GLY A 123 37.084 10.099 12.958 1.00 0.15 C HETATM 1766 C GLY A 123 36.285 10.246 11.656 1.00 0.21 C HETATM 1767 O GLY A 123 36.410 11.251 10.958 1.00 -0.39 O HETATM 1768 N GLY A 123 35.476 9.244 11.322 1.00 -0.26 N HETATM 1769 CA GLY A 123 34.691 9.281 10.088 1.00 0.13 C HETATM 1770 C GLY A 123 33.714 10.446 10.014 1.00 0.20 C HETATM 1771 O GLY A 123 33.555 11.060 8.963 1.00 -0.39 O HETATM 1772 N GLY A 123 33.065 10.751 11.130 1.00 -0.26 N HETATM 1773 CA GLY A 123 32.103 11.838 11.180 1.00 0.15 C HETATM 1774 C GLY A 123 32.739 13.159 11.623 1.00 0.21 C HETATM 1775 O GLY A 123 33.640 13.176 12.460 1.00 -0.39 O HETATM 1776 N GLY A 123 32.297 14.285 11.035 1.00 -0.25 N HETATM 1777 CA GLY A 123 32.850 15.588 11.412 1.00 0.13 C HETATM 1778 C GLY A 123 32.570 15.856 12.895 1.00 0.20 C HETATM 1779 O GLY A 123 31.459 15.627 13.370 1.00 -0.39 O HETATM 1780 N GLY A 123 33.582 16.337 13.615 1.00 -0.26 N HETATM 1781 CA GLY A 123 33.461 16.583 15.049 1.00 0.16 C HETATM 1782 C GLY A 123 33.010 17.985 15.465 1.00 0.21 C HETATM 1783 O GLY A 123 32.836 18.253 16.657 1.00 -0.39 O HETATM 1784 N GLY A 123 32.848 18.877 14.490 1.00 -0.27 N HETATM 1785 CA GLY A 123 32.353 20.237 14.730 1.00 0.10 C HETATM 1786 C GLY A 123 31.840 20.809 13.417 1.00 0.06 C HETATM 1787 O GLY A 123 32.578 21.481 12.697 1.00 -0.57 O HETATM 1788 OXT GLY A 123 30.663 20.532 13.104 1.00 -0.57 O HETATM 1789 CB GLY A 123 33.421 21.192 15.290 1.00 0.01 C HETATM 1790 CG GLY A 123 32.815 22.515 15.761 1.00 -0.05 C HETATM 1791 CD1 GLY A 123 31.966 22.553 16.871 1.00 -0.07 C HETATM 1792 CE1 GLY A 123 31.347 23.741 17.276 1.00 -0.04 C HETATM 1793 CZ GLY A 123 31.573 24.911 16.571 1.00 0.08 C HETATM 1794 CE2 GLY A 123 32.418 24.909 15.467 1.00 -0.04 C HETATM 1795 CD2 GLY A 123 33.036 23.711 15.066 1.00 -0.07 C HETATM 1796 H GLY A 123 33.698 23.713 14.200 1.00 0.05 H HETATM 1797 H GLY A 123 32.601 25.831 14.915 1.00 0.05 H HETATM 1798 OH GLY A 123 30.940 26.073 16.967 1.00 -0.34 O HETATM 1799 H GLY A 123 30.399 25.894 17.740 1.00 0.25 H HETATM 1800 H GLY A 123 30.688 23.745 18.145 1.00 0.05 H HETATM 1801 H GLY A 123 31.782 21.637 17.433 1.00 0.05 H HETATM 1802 H GLY A 123 34.136 21.408 14.496 1.00 0.04 H HETATM 1803 H GLY A 123 33.895 20.710 16.145 1.00 0.04 H HETATM 1804 H GLY A 123 31.567 20.158 15.480 1.00 0.07 H HETATM 1805 H GLY A 123 33.078 18.603 13.535 1.00 0.19 H HETATM 1806 CB GLY A 123 34.783 16.227 15.769 1.00 0.09 C HETATM 1807 OG1 GLY A 123 35.810 17.148 15.380 1.00 -0.39 O HETATM 1808 H GLY A 123 35.547 18.039 15.620 1.00 0.21 H HETATM 1809 CG2 GLY A 123 35.223 14.808 15.393 1.00 -0.03 C HETATM 1810 H GLY A 123 34.451 14.099 15.691 1.00 0.03 H HETATM 1811 H GLY A 123 35.375 14.750 14.315 1.00 0.03 H HETATM 1812 H GLY A 123 36.155 14.570 15.906 1.00 0.03 H HETATM 1813 H GLY A 123 34.620 16.285 16.845 1.00 0.06 H HETATM 1814 H GLY A 123 32.647 15.928 15.359 1.00 0.08 H HETATM 1815 H GLY A 123 34.468 16.539 13.151 1.00 0.19 H HETATM 1816 CB GLY A 123 32.130 16.558 10.471 1.00 -0.01 C HETATM 1817 CG GLY A 123 30.854 15.845 10.133 1.00 -0.03 C HETATM 1818 CD GLY A 123 31.300 14.426 9.959 1.00 0.04 C HETATM 1819 H GLY A 123 30.485 13.706 10.028 1.00 0.05 H HETATM 1820 H GLY A 123 31.702 14.218 8.967 1.00 0.05 H HETATM 1821 H GLY A 123 30.367 16.247 9.245 1.00 0.03 H HETATM 1822 H GLY A 123 30.090 15.957 10.902 1.00 0.03 H HETATM 1823 H GLY A 123 32.721 16.794 9.586 1.00 0.03 H HETATM 1824 H GLY A 123 31.954 17.530 10.932 1.00 0.03 H HETATM 1825 H GLY A 123 33.932 15.673 11.312 1.00 0.08 H HETATM 1826 CB GLY A 123 30.951 11.457 12.117 1.00 0.08 C HETATM 1827 CG GLY A 123 31.414 11.156 13.538 1.00 0.18 C HETATM 1828 OD1 GLY A 123 32.446 10.525 13.754 1.00 -0.40 O HETATM 1829 ND2 GLY A 123 30.632 11.591 14.514 1.00 -0.30 N HETATM 1830 H GLY A 123 30.879 11.405 15.486 1.00 0.18 H HETATM 1831 H GLY A 123 29.783 12.112 14.294 1.00 0.18 H HETATM 1832 H GLY A 123 30.485 10.554 11.721 1.00 0.06 H HETATM 1833 H GLY A 123 30.266 12.304 12.163 1.00 0.06 H HETATM 1834 H GLY A 123 31.723 11.995 10.171 1.00 0.08 H HETATM 1835 H GLY A 123 33.246 10.208 11.975 1.00 0.19 H HETATM 1836 CB GLY A 123 33.909 7.966 9.875 1.00 -0.01 C HETATM 1837 CG1 GLY A 123 32.925 8.117 8.716 1.00 -0.06 C HETATM 1838 H GLY A 123 32.221 8.918 8.941 1.00 0.02 H HETATM 1839 H GLY A 123 33.473 8.358 7.805 1.00 0.02 H HETATM 1840 H GLY A 123 32.382 7.182 8.578 1.00 0.02 H HETATM 1841 CG2 GLY A 123 34.883 6.832 9.574 1.00 -0.06 C HETATM 1842 H GLY A 123 35.446 7.069 8.671 1.00 0.02 H HETATM 1843 H GLY A 123 35.570 6.713 10.412 1.00 0.02 H HETATM 1844 H GLY A 123 34.326 5.907 9.425 1.00 0.02 H HETATM 1845 H GLY A 123 33.352 7.737 10.784 1.00 0.03 H HETATM 1846 H GLY A 123 35.428 9.415 9.296 1.00 0.08 H HETATM 1847 H GLY A 123 35.402 8.434 11.938 1.00 0.19 H HETATM 1848 CB GLY A 123 36.289 10.618 14.174 1.00 0.04 C HETATM 1849 CG GLY A 123 36.948 10.325 15.521 1.00 -0.00 C HETATM 1850 CD1 GLY A 123 37.865 11.216 16.099 1.00 -0.02 C HETATM 1851 CE1 GLY A 123 38.526 10.903 17.312 1.00 0.01 C HETATM 1852 CZ GLY A 123 38.271 9.684 17.951 1.00 0.17 C HETATM 1853 CE2 GLY A 123 37.349 8.800 17.390 1.00 0.01 C HETATM 1854 CD2 GLY A 123 36.699 9.122 16.189 1.00 -0.02 C HETATM 1855 H GLY A 123 35.983 8.417 15.767 1.00 0.07 H HETATM 1856 H GLY A 123 37.133 7.854 17.887 1.00 0.07 H HETATM 1857 OH GLY A 123 38.992 9.288 19.087 1.00 -0.20 O HETATM 1858 P GLY A 123 40.281 8.422 19.340 1.00 0.13 P HETATM 1859 O1P GLY A 123 41.499 9.239 19.323 1.00 -0.67 O HETATM 1860 O2P GLY A 123 40.232 7.389 18.233 1.00 -0.67 O HETATM 1861 O3P GLY A 123 39.985 7.812 20.678 1.00 -0.67 O HETATM 1862 H GLY A 123 39.232 11.610 17.747 1.00 0.07 H HETATM 1863 H GLY A 123 38.072 12.166 15.606 1.00 0.07 H HETATM 1864 H GLY A 123 35.325 10.110 14.169 1.00 0.06 H HETATM 1865 H GLY A 123 36.222 11.702 14.077 1.00 0.06 H HETATM 1866 H GLY A 123 37.277 9.037 13.106 1.00 0.08 H HETATM 1867 H GLY A 123 38.349 11.791 12.556 1.00 0.19 H HETATM 1868 H GLY A 123 40.942 11.243 11.959 1.00 0.11 H HETATM 1869 H GLY A 123 40.601 12.004 13.555 1.00 0.11 H HETATM 1870 H GLY A 123 42.734 10.983 13.481 1.00 0.20 H HETATM 1871 H GLY A 123 41.744 10.213 14.577 1.00 0.20 H HETATM 1872 H GLY A 123 42.059 9.508 13.100 1.00 0.20 H CONECT 1 2 7 8 9 CONECT 7 1 CONECT 8 1 CONECT 9 1 CONECT 1760 1761 1870 1871 1872 CONECT 1761 1760 1762 1868 1869 CONECT 1762 1761 1763 1764 CONECT 1763 1762 CONECT 1764 1762 1765 1867 CONECT 1765 1764 1766 1848 1866 CONECT 1766 1765 1767 1768 CONECT 1767 1766 CONECT 1768 1766 1769 1847 CONECT 1769 1768 1770 1836 1846 CONECT 1770 1769 1771 1772 CONECT 1771 1770 CONECT 1772 1770 1773 1835 CONECT 1773 1772 1774 1826 1834 CONECT 1774 1773 1775 1776 CONECT 1775 1774 CONECT 1776 1774 1777 1818 CONECT 1777 1776 1778 1816 1825 CONECT 1778 1777 1779 1780 CONECT 1779 1778 CONECT 1780 1778 1781 1815 CONECT 1781 1780 1782 1806 1814 CONECT 1782 1781 1783 1784 CONECT 1783 1782 CONECT 1784 1782 1785 1805 CONECT 1785 1784 1786 1789 1804 CONECT 1786 1785 1787 1788 CONECT 1787 1786 CONECT 1788 1786 CONECT 1789 1785 1790 1802 1803 CONECT 1790 1789 1791 1795 CONECT 1791 1790 1792 1801 CONECT 1792 1791 1793 1800 CONECT 1793 1792 1794 1798 CONECT 1794 1793 1795 1797 CONECT 1795 1790 1794 1796 CONECT 1796 1795 CONECT 1797 1794 CONECT 1798 1793 1799 CONECT 1799 1798 CONECT 1800 1792 CONECT 1801 1791 CONECT 1802 1789 CONECT 1803 1789 CONECT 1804 1785 CONECT 1805 1784 CONECT 1806 1781 1807 1809 1813 CONECT 1807 1806 1808 CONECT 1808 1807 CONECT 1809 1806 1810 1811 1812 CONECT 1810 1809 CONECT 1811 1809 CONECT 1812 1809 CONECT 1813 1806 CONECT 1814 1781 CONECT 1815 1780 CONECT 1816 1777 1817 1823 1824 CONECT 1817 1816 1818 1821 1822 CONECT 1818 1776 1817 1819 1820 CONECT 1819 1818 CONECT 1820 1818 CONECT 1821 1817 CONECT 1822 1817 CONECT 1823 1816 CONECT 1824 1816 CONECT 1825 1777 CONECT 1826 1773 1827 1832 1833 CONECT 1827 1826 1828 1829 CONECT 1828 1827 CONECT 1829 1827 1830 1831 CONECT 1830 1829 CONECT 1831 1829 CONECT 1832 1826 CONECT 1833 1826 CONECT 1834 1773 CONECT 1835 1772 CONECT 1836 1769 1837 1841 1845 CONECT 1837 1836 1838 1839 1840 CONECT 1838 1837 CONECT 1839 1837 CONECT 1840 1837 CONECT 1841 1836 1842 1843 1844 CONECT 1842 1841 CONECT 1843 1841 CONECT 1844 1841 CONECT 1845 1836 CONECT 1846 1769 CONECT 1847 1768 CONECT 1848 1765 1849 1864 1865 CONECT 1849 1848 1850 1854 CONECT 1850 1849 1851 1863 CONECT 1851 1850 1852 1862 CONECT 1852 1851 1853 1857 CONECT 1853 1852 1854 1856 CONECT 1854 1849 1853 1855 CONECT 1855 1854 CONECT 1856 1853 CONECT 1857 1852 1858 CONECT 1858 1857 1859 1860 1861 CONECT 1859 1858 CONECT 1860 1858 CONECT 1861 1858 CONECT 1862 1851 CONECT 1863 1850 CONECT 1864 1848 CONECT 1865 1848 CONECT 1866 1765 CONECT 1867 1764 CONECT 1868 1761 CONECT 1869 1761 CONECT 1870 1760 CONECT 1871 1760 CONECT 1872 1760 MASTER 0 0 0 0 0 0 0 0 1871 1 117 8 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Related entries of code: 3mxy
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%
3mxc
RCSB PDB
PDBbind
101aa, >3MXC_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
3mxc
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
3mxy
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
2.3(Å)
Affinity (Kd/Ki/IC50)
Kd=384.8nM
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
8
H
5
5
N
8
O
1
5
P
Molecular Weight
894.862
Exact Mass
894.352
No. of atoms
117
No. of bonds
119
Polar Surface Area
397.81
LOGP Value
-3.90 (
Computed with XLOGP3
)
-1.54 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 9
No. of Hydrogen Bond Acceptors: 14
No. of Rotatable Bonds: 28
No. of Nitrogen and Oxygen Atoms: 23
No. of Rings: 3
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)Cc1ccc(cc1)O)[C@H](O)C)CC(=O)N)C(C)C)Cc1ccc(cc1)OP(O)(O)O
InChI String
InChI=1S/C38H55N8O15P/c1-19(2)31(44-33(51)25(41-30(50)18-39)15-22-8-12-24(13-9-22)61-62(58,59)60)35(53)42-26(17-29(40)49)37(55)46-14-4-5-28(46)34(52)45-32(20(3)47)36(54)43-27(38(56)57)16-21-6-10-23(48)11-7-21/h6-13,19-20,25-28,31-32,47-48,58-60,62H,4-5,14-18,39H2,1-3H3,(H2,40,49)(H,41,50)(H,42,53)(H,43,54)(H,44,51)(H,45,52)(H,56,57)/p+1/t20-,25+,26+,27+,28+,31+,32+/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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times since Nov 2007.
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