Browse entries in the PDBbind-CN Database
HEADER 3NTP_COMPLEX COMPND 3NTP_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 33 LYS LEU PRO PRO GLY TRP GLU LYS ALA MET SER ARG SER SEQRES 2 A 33 SER GLY ARG VAL TYR TYR PHE ASN HIS ILE THR ASN ALA SEQRES 3 A 33 SER GLN TRP GLU ARG PRO SER SEQRES 1 A 114 GLY GLU PRO ALA ARG VAL ARG CYS SER HIS LEU LEU VAL SEQRES 2 A 114 LYS HIS SER GLN SER ARG ARG PRO SER SER TRP ARG GLN SEQRES 3 A 114 GLU LYS ILE THR ARG THR LYS GLU GLU ALA LEU GLU LEU SEQRES 4 A 114 ILE ASN GLY TYR ILE GLN LYS ILE LYS SER GLY GLU GLU SEQRES 5 A 114 ASP PHE GLU SER LEU ALA SER GLN PHE SER ASP CYS SER SEQRES 6 A 114 SER ALA LYS ALA ARG GLY ASP LEU GLY ALA PHE SER ARG SEQRES 7 A 114 GLY GLN MET GLN LYS PRO PHE GLU ASP ALA SER PHE ALA SEQRES 8 A 114 LEU ARG THR GLY GLU MET SER GLY PRO VAL PHE THR ASP SEQRES 9 A 114 SER GLY ILE HIS ILE ILE LEU ARG THR GLU HET RZD A 234 59 ATOM 1 N LYS A 6 4.060 12.841 68.997 1.00 58.31 N ATOM 2 CA LYS A 6 4.462 13.430 70.273 1.00 58.80 C ATOM 3 C LYS A 6 4.591 14.951 70.194 1.00 55.56 C ATOM 4 O LYS A 6 4.147 15.572 69.227 1.00 58.99 O ATOM 5 CB LYS A 6 5.769 12.803 70.771 1.00 60.04 C ATOM 6 CG LYS A 6 5.568 11.552 71.619 1.00 60.00 C ATOM 7 CD LYS A 6 6.863 10.770 71.755 1.00 60.78 C ATOM 8 CE LYS A 6 7.306 10.217 70.408 1.00 62.95 C ATOM 9 NZ LYS A 6 8.709 9.718 70.437 1.00 62.04 N ATOM 10 HA LYS A 6 3.671 13.211 70.990 1.00 0.00 H ATOM 11 HB2 LYS A 6 6.375 12.538 69.905 1.00 0.00 H ATOM 12 HB3 LYS A 6 6.299 13.543 71.370 1.00 0.00 H ATOM 13 HG2 LYS A 6 5.223 11.845 72.611 1.00 0.00 H ATOM 14 HG3 LYS A 6 4.817 10.918 71.147 1.00 0.00 H ATOM 15 HD2 LYS A 6 7.639 11.429 72.144 1.00 0.00 H ATOM 16 HD3 LYS A 6 6.710 9.943 72.448 1.00 0.00 H ATOM 17 HE2 LYS A 6 7.230 11.008 69.662 1.00 0.00 H ATOM 18 HE3 LYS A 6 6.646 9.394 70.132 1.00 0.00 H ATOM 19 HZ1 LYS A 6 9.348 10.498 70.692 1.00 0.00 H ATOM 20 HZ2 LYS A 6 8.791 8.957 71.141 1.00 0.00 H ATOM 21 HZ3 LYS A 6 8.965 9.352 69.498 1.00 0.00 H ATOM 22 HN3 LYS A 6 4.771 13.068 68.273 1.00 0.00 H ATOM 23 HN2 LYS A 6 3.138 13.229 68.713 1.00 0.00 H ATOM 24 HN1 LYS A 6 3.986 11.809 69.101 1.00 0.00 H ATOM 25 N LEU A 7 5.209 15.537 71.215 1.00 55.22 N ATOM 26 CA LEU A 7 5.269 16.989 71.367 1.00 45.67 C ATOM 27 C LEU A 7 3.911 17.546 71.776 1.00 44.40 C ATOM 28 O LEU A 7 2.927 17.410 71.050 1.00 44.12 O ATOM 29 CB LEU A 7 5.766 17.683 70.094 1.00 46.35 C ATOM 30 CG LEU A 7 7.247 17.544 69.736 1.00 44.65 C ATOM 31 CD1 LEU A 7 7.639 18.585 68.702 1.00 42.22 C ATOM 32 CD2 LEU A 7 8.114 17.669 70.979 1.00 45.79 C ATOM 33 HA LEU A 7 5.990 17.197 72.157 1.00 0.00 H ATOM 34 HB2 LEU A 7 5.191 17.282 69.259 1.00 0.00 H ATOM 35 HB3 LEU A 7 5.556 18.747 70.201 1.00 0.00 H ATOM 36 HG LEU A 7 7.408 16.554 69.309 1.00 0.00 H ATOM 37 HD21 LEU A 7 7.952 18.645 71.437 1.00 0.00 H ATOM 38 HD22 LEU A 7 7.847 16.885 71.687 1.00 0.00 H ATOM 39 HD23 LEU A 7 9.163 17.567 70.701 1.00 0.00 H ATOM 40 HD11 LEU A 7 7.040 18.445 67.802 1.00 0.00 H ATOM 41 HD12 LEU A 7 7.462 19.582 69.106 1.00 0.00 H ATOM 42 HD13 LEU A 7 8.695 18.473 68.458 1.00 0.00 H ATOM 43 H LEU A 7 5.667 14.939 71.932 1.00 0.00 H ATOM 44 N PRO A 8 3.861 18.176 72.953 1.00 41.73 N ATOM 45 CA PRO A 8 2.655 18.773 73.535 1.00 39.91 C ATOM 46 C PRO A 8 2.055 19.844 72.632 1.00 40.05 C ATOM 47 O PRO A 8 2.727 20.318 71.712 1.00 37.61 O ATOM 48 CB PRO A 8 3.173 19.403 74.832 1.00 39.80 C ATOM 49 CG PRO A 8 4.405 18.633 75.158 1.00 43.28 C ATOM 50 CD PRO A 8 5.028 18.318 73.837 1.00 44.45 C ATOM 51 HA PRO A 8 1.861 18.041 73.683 1.00 0.00 H ATOM 52 HD3 PRO A 8 5.676 19.129 73.505 1.00 0.00 H ATOM 53 HD2 PRO A 8 5.601 17.392 73.883 1.00 0.00 H ATOM 54 HG3 PRO A 8 4.154 17.716 75.691 1.00 0.00 H ATOM 55 HG2 PRO A 8 5.081 19.233 75.767 1.00 0.00 H ATOM 56 HB2 PRO A 8 3.406 20.457 74.682 1.00 0.00 H ATOM 57 HB3 PRO A 8 2.436 19.305 75.629 1.00 0.00 H ATOM 58 N PRO A 9 0.795 20.226 72.895 1.00 39.99 N ATOM 59 CA PRO A 9 0.055 21.205 72.091 1.00 38.72 C ATOM 60 C PRO A 9 0.846 22.475 71.781 1.00 37.39 C ATOM 61 O PRO A 9 1.365 23.129 72.692 1.00 33.98 O ATOM 62 CB PRO A 9 -1.148 21.541 72.980 1.00 38.39 C ATOM 63 CG PRO A 9 -1.383 20.295 73.750 1.00 39.17 C ATOM 64 CD PRO A 9 -0.023 19.691 73.998 1.00 38.68 C ATOM 65 HA PRO A 9 -0.196 20.799 71.111 1.00 0.00 H ATOM 66 HD3 PRO A 9 0.373 20.004 74.964 1.00 0.00 H ATOM 67 HD2 PRO A 9 -0.066 18.603 73.959 1.00 0.00 H ATOM 68 HG3 PRO A 9 -2.003 19.607 73.176 1.00 0.00 H ATOM 69 HG2 PRO A 9 -1.874 20.522 74.696 1.00 0.00 H ATOM 70 HB2 PRO A 9 -0.917 22.372 73.647 1.00 0.00 H ATOM 71 HB3 PRO A 9 -2.019 21.793 72.375 1.00 0.00 H ATOM 72 N GLY A 10 0.927 22.814 70.497 1.00 34.35 N ATOM 73 CA GLY A 10 1.576 24.036 70.057 1.00 33.76 C ATOM 74 C GLY A 10 3.046 23.875 69.719 1.00 29.29 C ATOM 75 O GLY A 10 3.606 24.682 68.985 1.00 30.04 O ATOM 76 HA3 GLY A 10 1.487 24.776 70.853 1.00 0.00 H ATOM 77 HA2 GLY A 10 1.059 24.397 69.168 1.00 0.00 H ATOM 78 H GLY A 10 0.511 22.182 69.784 1.00 0.00 H ATOM 79 N TRP A 11 3.672 22.830 70.247 1.00 34.07 N ATOM 80 CA TRP A 11 5.113 22.658 70.090 1.00 32.46 C ATOM 81 C TRP A 11 5.493 22.158 68.706 1.00 33.59 C ATOM 82 O TRP A 11 4.801 21.326 68.115 1.00 38.55 O ATOM 83 CB TRP A 11 5.678 21.739 71.174 1.00 30.02 C ATOM 84 CG TRP A 11 5.787 22.408 72.512 1.00 32.73 C ATOM 85 CD1 TRP A 11 4.943 22.265 73.568 1.00 30.23 C ATOM 86 CD2 TRP A 11 6.796 23.339 72.924 1.00 32.48 C ATOM 87 NE1 TRP A 11 5.363 23.045 74.621 1.00 32.55 N ATOM 88 CE2 TRP A 11 6.500 23.713 74.253 1.00 30.37 C ATOM 89 CE3 TRP A 11 7.920 23.893 72.304 1.00 29.64 C ATOM 90 CZ2 TRP A 11 7.288 24.613 74.971 1.00 28.97 C ATOM 91 CZ3 TRP A 11 8.704 24.788 73.019 1.00 28.60 C ATOM 92 CH2 TRP A 11 8.383 25.136 74.341 1.00 28.68 C ATOM 93 HA TRP A 11 5.560 23.645 70.205 1.00 0.00 H ATOM 94 HB2 TRP A 11 5.024 20.873 71.271 1.00 0.00 H ATOM 95 HB3 TRP A 11 6.671 21.410 70.868 1.00 0.00 H ATOM 96 HE1 TRP A 11 4.893 23.116 75.546 1.00 0.00 H ATOM 97 HD1 TRP A 11 4.061 21.625 73.579 1.00 0.00 H ATOM 98 HZ2 TRP A 11 7.040 24.889 75.996 1.00 0.00 H ATOM 99 HH2 TRP A 11 9.021 25.839 74.877 1.00 0.00 H ATOM 100 HZ3 TRP A 11 9.583 25.228 72.547 1.00 0.00 H ATOM 101 HE3 TRP A 11 8.176 23.627 71.278 1.00 0.00 H ATOM 102 H TRP A 11 3.127 22.123 70.781 1.00 0.00 H ATOM 103 N GLU A 12 6.611 22.670 68.205 1.00 31.63 N ATOM 104 CA GLU A 12 7.052 22.422 66.842 1.00 34.42 C ATOM 105 C GLU A 12 8.574 22.348 66.808 1.00 36.39 C ATOM 106 O GLU A 12 9.253 23.034 67.572 1.00 32.20 O ATOM 107 CB GLU A 12 6.561 23.561 65.950 1.00 36.84 C ATOM 108 CG GLU A 12 7.083 23.565 64.539 1.00 45.69 C ATOM 109 CD GLU A 12 6.457 24.676 63.717 1.00 53.34 C ATOM 110 OE1 GLU A 12 6.654 25.863 64.067 1.00 50.93 O ATOM 111 OE2 GLU A 12 5.755 24.360 62.731 1.00 55.40 O ATOM 112 HA GLU A 12 6.645 21.477 66.481 1.00 0.00 H ATOM 113 HB2 GLU A 12 5.474 23.504 65.904 1.00 0.00 H ATOM 114 HB3 GLU A 12 6.854 24.501 66.417 1.00 0.00 H ATOM 115 HG2 GLU A 12 8.164 23.706 64.561 1.00 0.00 H ATOM 116 HG3 GLU A 12 6.853 22.607 64.073 1.00 0.00 H ATOM 117 H GLU A 12 7.197 23.275 68.815 1.00 0.00 H ATOM 118 N LYS A 13 9.111 21.505 65.935 1.00 35.01 N ATOM 119 CA LYS A 13 10.557 21.382 65.813 1.00 36.90 C ATOM 120 C LYS A 13 11.084 22.378 64.788 1.00 33.34 C ATOM 121 O LYS A 13 10.469 22.597 63.743 1.00 39.06 O ATOM 122 CB LYS A 13 10.955 19.945 65.458 1.00 39.70 C ATOM 123 CG LYS A 13 12.456 19.700 65.470 1.00 44.26 C ATOM 124 CD LYS A 13 12.804 18.213 65.365 1.00 47.47 C ATOM 125 CE LYS A 13 12.836 17.542 66.737 1.00 48.02 C ATOM 126 NZ LYS A 13 13.635 16.275 66.726 1.00 52.01 N ATOM 127 HA LYS A 13 11.011 21.616 66.776 1.00 0.00 H ATOM 128 HB2 LYS A 13 10.491 19.272 66.179 1.00 0.00 H ATOM 129 HB3 LYS A 13 10.578 19.721 64.460 1.00 0.00 H ATOM 130 HG2 LYS A 13 12.904 20.225 64.626 1.00 0.00 H ATOM 131 HG3 LYS A 13 12.868 20.092 66.400 1.00 0.00 H ATOM 132 HD2 LYS A 13 12.056 17.718 64.746 1.00 0.00 H ATOM 133 HD3 LYS A 13 13.784 18.111 64.899 1.00 0.00 H ATOM 134 HE2 LYS A 13 11.815 17.311 67.040 1.00 0.00 H ATOM 135 HE3 LYS A 13 13.279 18.231 67.455 1.00 0.00 H ATOM 136 HZ1 LYS A 13 13.215 15.608 66.048 1.00 0.00 H ATOM 137 HZ2 LYS A 13 14.614 16.486 66.445 1.00 0.00 H ATOM 138 HZ3 LYS A 13 13.629 15.855 67.677 1.00 0.00 H ATOM 139 H LYS A 13 8.493 20.926 65.332 1.00 0.00 H ATOM 140 N ALA A 14 12.216 23.000 65.097 1.00 32.57 N ATOM 141 CA ALA A 14 12.774 24.025 64.226 1.00 33.71 C ATOM 142 C ALA A 14 14.291 23.928 64.085 1.00 35.38 C ATOM 143 O ALA A 14 14.952 23.137 64.765 1.00 27.85 O ATOM 144 CB ALA A 14 12.376 25.408 64.714 1.00 35.38 C ATOM 145 HA ALA A 14 12.356 23.854 63.234 1.00 0.00 H ATOM 146 HB1 ALA A 14 11.289 25.493 64.713 1.00 0.00 H ATOM 147 HB2 ALA A 14 12.753 25.557 65.726 1.00 0.00 H ATOM 148 HB3 ALA A 14 12.801 26.162 64.052 1.00 0.00 H ATOM 149 H ALA A 14 12.713 22.751 65.976 1.00 0.00 H ATOM 150 N MET A 15 14.831 24.756 63.199 1.00 37.29 N ATOM 151 CA MET A 15 16.252 24.739 62.888 1.00 33.05 C ATOM 152 C MET A 15 16.918 26.060 63.264 1.00 35.42 C ATOM 153 O MET A 15 16.548 27.114 62.753 1.00 34.48 O ATOM 154 CB MET A 15 16.441 24.456 61.395 1.00 36.38 C ATOM 155 CG MET A 15 17.883 24.358 60.962 1.00 41.18 C ATOM 156 SD MET A 15 18.766 23.212 62.022 1.00 49.14 S ATOM 157 CE MET A 15 17.751 21.741 61.864 1.00 43.34 C ATOM 158 HA MET A 15 16.726 23.952 63.474 1.00 0.00 H ATOM 159 HB2 MET A 15 15.948 23.512 61.161 1.00 0.00 H ATOM 160 HB3 MET A 15 15.969 25.261 60.832 1.00 0.00 H ATOM 161 HG2 MET A 15 18.347 25.342 61.028 1.00 0.00 H ATOM 162 HG3 MET A 15 17.928 24.005 59.932 1.00 0.00 H ATOM 163 HE1 MET A 15 16.740 21.960 62.208 1.00 0.00 H ATOM 164 HE2 MET A 15 17.722 21.432 60.819 1.00 0.00 H ATOM 165 HE3 MET A 15 18.177 20.941 62.469 1.00 0.00 H ATOM 166 H MET A 15 14.218 25.440 62.711 1.00 0.00 H ATOM 167 N SER A 16 17.900 26.006 64.159 1.00 30.07 N ATOM 168 CA SER A 16 18.616 27.216 64.553 1.00 32.57 C ATOM 169 C SER A 16 19.389 27.819 63.384 1.00 36.63 C ATOM 170 O SER A 16 20.097 27.115 62.668 1.00 32.99 O ATOM 171 CB SER A 16 19.581 26.942 65.698 1.00 34.57 C ATOM 172 OG SER A 16 20.423 28.069 65.889 1.00 37.72 O ATOM 173 HA SER A 16 17.860 27.929 64.883 1.00 0.00 H ATOM 174 HB2 SER A 16 20.190 26.070 65.459 1.00 0.00 H ATOM 175 HB3 SER A 16 19.017 26.751 66.611 1.00 0.00 H ATOM 176 HG SER A 16 21.050 27.889 66.634 1.00 0.00 H ATOM 177 H SER A 16 18.161 25.093 64.583 1.00 0.00 H ATOM 178 N ARG A 17 19.265 29.129 63.214 1.00 35.99 N ATOM 179 CA ARG A 17 19.875 29.816 62.083 1.00 41.48 C ATOM 180 C ARG A 17 21.342 30.133 62.346 1.00 43.27 C ATOM 181 O ARG A 17 22.111 30.387 61.420 1.00 39.47 O ATOM 182 CB ARG A 17 19.098 31.094 61.766 1.00 40.56 C ATOM 183 CG ARG A 17 19.409 31.690 60.411 1.00 42.67 C ATOM 184 CD ARG A 17 18.187 32.391 59.851 1.00 45.43 C ATOM 185 NE ARG A 17 17.058 31.471 59.738 1.00 47.59 N ATOM 186 CZ ARG A 17 15.867 31.805 59.252 1.00 41.91 C ATOM 187 NH1 ARG A 17 15.643 33.044 58.828 1.00 40.34 N ATOM 188 NH2 ARG A 17 14.899 30.900 59.192 1.00 41.15 N ATOM 189 HA ARG A 17 19.833 29.150 61.221 1.00 0.00 H ATOM 190 HB2 ARG A 17 18.033 30.865 61.802 1.00 0.00 H ATOM 191 HB3 ARG A 17 19.335 31.836 62.528 1.00 0.00 H ATOM 192 HG2 ARG A 17 20.222 32.409 60.512 1.00 0.00 H ATOM 193 HG3 ARG A 17 19.712 30.895 59.729 1.00 0.00 H ATOM 194 HD2 ARG A 17 18.424 32.786 58.863 1.00 0.00 H ATOM 195 HD3 ARG A 17 17.913 33.212 60.513 1.00 0.00 H ATOM 196 HE ARG A 17 17.195 30.491 60.059 1.00 0.00 H ATOM 197 HH12 ARG A 17 14.710 33.303 58.448 1.00 0.00 H ATOM 198 HH11 ARG A 17 16.401 33.755 58.876 1.00 0.00 H ATOM 199 HH22 ARG A 17 13.967 31.160 58.812 1.00 0.00 H ATOM 200 HH21 ARG A 17 15.072 29.930 59.525 1.00 0.00 H ATOM 201 H ARG A 17 18.718 29.680 63.906 1.00 0.00 H ATOM 202 N SER A 18 21.722 30.123 63.617 1.00 38.83 N ATOM 203 CA SER A 18 23.103 30.375 64.003 1.00 42.35 C ATOM 204 C SER A 18 23.885 29.071 64.121 1.00 42.66 C ATOM 205 O SER A 18 24.991 28.951 63.590 1.00 46.13 O ATOM 206 CB SER A 18 23.158 31.126 65.341 1.00 44.98 C ATOM 207 OG SER A 18 22.741 32.477 65.208 1.00 52.42 O ATOM 208 HA SER A 18 23.558 30.988 63.225 1.00 0.00 H ATOM 209 HB2 SER A 18 24.182 31.108 65.714 1.00 0.00 H ATOM 210 HB3 SER A 18 22.504 30.624 66.054 1.00 0.00 H ATOM 211 HG SER A 18 22.791 32.925 66.090 1.00 0.00 H ATOM 212 H SER A 18 21.016 29.930 64.356 1.00 0.00 H ATOM 213 N SER A 19 23.293 28.091 64.801 1.00 40.20 N ATOM 214 CA SER A 19 23.998 26.871 65.191 1.00 38.22 C ATOM 215 C SER A 19 23.804 25.721 64.220 1.00 34.90 C ATOM 216 O SER A 19 24.684 24.876 64.064 1.00 36.58 O ATOM 217 CB SER A 19 23.505 26.403 66.562 1.00 33.80 C ATOM 218 OG SER A 19 22.804 27.440 67.226 1.00 39.88 O ATOM 219 HA SER A 19 25.056 27.131 65.203 1.00 0.00 H ATOM 220 HB2 SER A 19 24.361 26.106 67.167 1.00 0.00 H ATOM 221 HB3 SER A 19 22.840 25.549 66.431 1.00 0.00 H ATOM 222 HG SER A 19 23.406 28.216 67.351 1.00 0.00 H ATOM 223 H SER A 19 22.293 28.197 65.064 1.00 0.00 H ATOM 224 N GLY A 20 22.635 25.674 63.589 1.00 38.61 N ATOM 225 CA GLY A 20 22.240 24.515 62.811 1.00 32.88 C ATOM 226 C GLY A 20 21.616 23.457 63.708 1.00 34.73 C ATOM 227 O GLY A 20 21.122 22.433 63.238 1.00 33.31 O ATOM 228 HA3 GLY A 20 23.118 24.096 62.320 1.00 0.00 H ATOM 229 HA2 GLY A 20 21.514 24.819 62.057 1.00 0.00 H ATOM 230 H GLY A 20 21.989 26.486 63.655 1.00 0.00 H ATOM 231 N ARG A 21 21.647 23.697 65.014 1.00 31.06 N ATOM 232 CA ARG A 21 21.046 22.765 65.959 1.00 29.72 C ATOM 233 C ARG A 21 19.526 22.864 65.993 1.00 25.04 C ATOM 234 O ARG A 21 18.947 23.938 65.854 1.00 27.66 O ATOM 235 CB ARG A 21 21.601 22.972 67.368 1.00 30.63 C ATOM 236 CG ARG A 21 22.492 21.846 67.864 1.00 31.45 C ATOM 237 CD ARG A 21 22.738 22.018 69.355 1.00 33.38 C ATOM 238 NE ARG A 21 23.253 23.356 69.616 1.00 32.13 N ATOM 239 CZ ARG A 21 22.903 24.116 70.645 1.00 31.87 C ATOM 240 NH1 ARG A 21 22.021 23.686 71.541 1.00 32.80 N ATOM 241 NH2 ARG A 21 23.440 25.319 70.771 1.00 35.69 N ATOM 242 HA ARG A 21 21.310 21.767 65.608 1.00 0.00 H ATOM 243 HB2 ARG A 21 22.182 23.894 67.374 1.00 0.00 H ATOM 244 HB3 ARG A 21 20.760 23.069 68.055 1.00 0.00 H ATOM 245 HG2 ARG A 21 22.003 20.888 67.683 1.00 0.00 H ATOM 246 HG3 ARG A 21 23.443 21.873 67.332 1.00 0.00 H ATOM 247 HD2 ARG A 21 23.464 21.278 69.691 1.00 0.00 H ATOM 248 HD3 ARG A 21 21.802 21.878 69.896 1.00 0.00 H ATOM 249 HE ARG A 21 23.947 23.744 68.945 1.00 0.00 H ATOM 250 HH12 ARG A 21 21.756 24.293 72.343 1.00 0.00 H ATOM 251 HH11 ARG A 21 21.596 22.742 71.440 1.00 0.00 H ATOM 252 HH22 ARG A 21 23.175 25.926 71.573 1.00 0.00 H ATOM 253 HH21 ARG A 21 24.127 25.658 70.068 1.00 0.00 H ATOM 254 H ARG A 21 22.106 24.561 65.367 1.00 0.00 H ATOM 255 N VAL A 22 18.889 21.721 66.184 1.00 25.93 N ATOM 256 CA VAL A 22 17.444 21.665 66.311 1.00 25.30 C ATOM 257 C VAL A 22 17.021 22.366 67.601 1.00 24.30 C ATOM 258 O VAL A 22 17.734 22.330 68.598 1.00 25.28 O ATOM 259 CB VAL A 22 16.971 20.201 66.336 1.00 31.36 C ATOM 260 CG1 VAL A 22 15.566 20.089 66.902 1.00 37.49 C ATOM 261 CG2 VAL A 22 17.055 19.598 64.936 1.00 35.44 C ATOM 262 HA VAL A 22 16.990 22.167 65.457 1.00 0.00 H ATOM 263 HB VAL A 22 17.631 19.635 66.993 1.00 0.00 H ATOM 264 HG11 VAL A 22 15.554 20.477 67.921 1.00 0.00 H ATOM 265 HG12 VAL A 22 14.879 20.667 66.284 1.00 0.00 H ATOM 266 HG13 VAL A 22 15.260 19.043 66.907 1.00 0.00 H ATOM 267 HG21 VAL A 22 16.420 20.168 64.258 1.00 0.00 H ATOM 268 HG22 VAL A 22 18.087 19.635 64.587 1.00 0.00 H ATOM 269 HG23 VAL A 22 16.718 18.562 64.967 1.00 0.00 H ATOM 270 H VAL A 22 19.437 20.839 66.245 1.00 0.00 H ATOM 271 N TYR A 23 15.877 23.035 67.568 1.00 24.12 N ATOM 272 CA TYR A 23 15.274 23.539 68.795 1.00 24.43 C ATOM 273 C TYR A 23 13.766 23.405 68.695 1.00 26.89 C ATOM 274 O TYR A 23 13.246 22.916 67.695 1.00 26.94 O ATOM 275 CB TYR A 23 15.682 24.983 69.081 1.00 22.59 C ATOM 276 CG TYR A 23 15.089 26.011 68.148 1.00 25.31 C ATOM 277 CD1 TYR A 23 15.597 26.186 66.866 1.00 30.05 C ATOM 278 CD2 TYR A 23 14.035 26.826 68.553 1.00 26.08 C ATOM 279 CE1 TYR A 23 15.068 27.129 66.011 1.00 31.34 C ATOM 280 CE2 TYR A 23 13.500 27.781 67.697 1.00 29.71 C ATOM 281 CZ TYR A 23 14.023 27.925 66.427 1.00 32.89 C ATOM 282 OH TYR A 23 13.502 28.862 65.562 1.00 36.71 O ATOM 283 HA TYR A 23 15.638 22.945 69.633 1.00 0.00 H ATOM 284 HB3 TYR A 23 16.768 25.048 69.010 1.00 0.00 H ATOM 285 HB2 TYR A 23 15.370 25.228 70.096 1.00 0.00 H ATOM 286 HD2 TYR A 23 13.624 26.713 69.556 1.00 0.00 H ATOM 287 HE2 TYR A 23 12.674 28.412 68.025 1.00 0.00 H ATOM 288 HE1 TYR A 23 15.476 27.245 65.007 1.00 0.00 H ATOM 289 HD1 TYR A 23 16.429 25.566 66.531 1.00 0.00 H ATOM 290 HH TYR A 23 13.994 28.827 64.704 1.00 0.00 H ATOM 291 H TYR A 23 15.405 23.202 66.657 1.00 0.00 H ATOM 292 N TYR A 24 13.069 23.825 69.743 1.00 25.25 N ATOM 293 CA TYR A 24 11.626 23.659 69.805 1.00 26.42 C ATOM 294 C TYR A 24 10.952 25.002 70.050 1.00 26.03 C ATOM 295 O TYR A 24 11.430 25.822 70.835 1.00 21.70 O ATOM 296 CB TYR A 24 11.259 22.649 70.892 1.00 29.22 C ATOM 297 CG TYR A 24 11.865 21.288 70.641 1.00 29.47 C ATOM 298 CD1 TYR A 24 13.140 20.976 71.102 1.00 31.78 C ATOM 299 CD2 TYR A 24 11.173 20.324 69.918 1.00 33.36 C ATOM 300 CE1 TYR A 24 13.703 19.733 70.861 1.00 33.75 C ATOM 301 CE2 TYR A 24 11.721 19.081 69.674 1.00 35.94 C ATOM 302 CZ TYR A 24 12.984 18.789 70.144 1.00 38.96 C ATOM 303 OH TYR A 24 13.526 17.551 69.897 1.00 43.17 O ATOM 304 HA TYR A 24 11.269 23.273 68.850 1.00 0.00 H ATOM 305 HB3 TYR A 24 10.174 22.549 70.925 1.00 0.00 H ATOM 306 HB2 TYR A 24 11.618 23.021 71.852 1.00 0.00 H ATOM 307 HD2 TYR A 24 10.178 20.554 69.536 1.00 0.00 H ATOM 308 HE2 TYR A 24 11.159 18.335 69.113 1.00 0.00 H ATOM 309 HE1 TYR A 24 14.701 19.500 71.231 1.00 0.00 H ATOM 310 HD1 TYR A 24 13.705 21.721 71.662 1.00 0.00 H ATOM 311 HH TYR A 24 14.430 17.502 70.298 1.00 0.00 H ATOM 312 H TYR A 24 13.564 24.282 70.535 1.00 0.00 H ATOM 313 N PHE A 25 9.844 25.216 69.357 1.00 25.02 N ATOM 314 CA PHE A 25 9.129 26.480 69.377 1.00 25.83 C ATOM 315 C PHE A 25 7.649 26.161 69.531 1.00 26.71 C ATOM 316 O PHE A 25 7.161 25.171 68.992 1.00 28.78 O ATOM 317 CB PHE A 25 9.386 27.235 68.065 1.00 31.39 C ATOM 318 CG PHE A 25 8.498 28.433 67.859 1.00 30.16 C ATOM 319 CD1 PHE A 25 8.664 29.580 68.628 1.00 29.05 C ATOM 320 CD2 PHE A 25 7.506 28.418 66.890 1.00 30.80 C ATOM 321 CE1 PHE A 25 7.849 30.690 68.439 1.00 29.00 C ATOM 322 CE2 PHE A 25 6.690 29.524 66.696 1.00 32.72 C ATOM 323 CZ PHE A 25 6.860 30.659 67.479 1.00 31.88 C ATOM 324 HA PHE A 25 9.465 27.111 70.200 1.00 0.00 H ATOM 325 HB2 PHE A 25 10.422 27.573 68.062 1.00 0.00 H ATOM 326 HB3 PHE A 25 9.227 26.545 67.236 1.00 0.00 H ATOM 327 HD2 PHE A 25 7.366 27.529 66.275 1.00 0.00 H ATOM 328 HE2 PHE A 25 5.916 29.502 65.929 1.00 0.00 H ATOM 329 HZ PHE A 25 6.212 31.524 67.335 1.00 0.00 H ATOM 330 HE1 PHE A 25 7.991 31.583 69.048 1.00 0.00 H ATOM 331 HD1 PHE A 25 9.444 29.609 69.389 1.00 0.00 H ATOM 332 H PHE A 25 9.468 24.443 68.771 1.00 0.00 H ATOM 333 N ASN A 26 6.941 26.990 70.284 1.00 25.92 N ATOM 334 CA ASN A 26 5.514 26.795 70.501 1.00 25.15 C ATOM 335 C ASN A 26 4.746 27.957 69.887 1.00 23.20 C ATOM 336 O ASN A 26 4.958 29.112 70.254 1.00 22.48 O ATOM 337 CB ASN A 26 5.219 26.662 72.000 1.00 26.47 C ATOM 338 CG ASN A 26 3.799 26.207 72.272 1.00 24.66 C ATOM 339 OD1 ASN A 26 2.840 26.879 71.897 1.00 25.77 O ATOM 340 ND2 ASN A 26 3.658 25.058 72.917 1.00 25.60 N ATOM 341 HA ASN A 26 5.192 25.873 70.017 1.00 0.00 H ATOM 342 HB2 ASN A 26 5.908 25.935 72.429 1.00 0.00 H ATOM 343 HB3 ASN A 26 5.373 27.631 72.475 1.00 0.00 H ATOM 344 HD22 ASN A 26 4.498 24.523 73.216 1.00 0.00 H ATOM 345 HD21 ASN A 26 2.707 24.692 73.125 1.00 0.00 H ATOM 346 H ASN A 26 7.416 27.800 70.731 1.00 0.00 H ATOM 347 N HIS A 27 3.872 27.667 68.926 1.00 22.45 N ATOM 348 CA HIS A 27 3.245 28.750 68.174 1.00 24.32 C ATOM 349 C HIS A 27 2.027 29.341 68.882 1.00 25.22 C ATOM 350 O HIS A 27 1.419 30.290 68.380 1.00 25.28 O ATOM 351 CB HIS A 27 2.880 28.310 66.748 1.00 24.29 C ATOM 352 CG HIS A 27 1.831 27.246 66.698 1.00 26.84 C ATOM 353 ND1 HIS A 27 2.122 25.933 66.387 1.00 33.12 N ATOM 354 CD2 HIS A 27 0.496 27.294 66.920 1.00 30.22 C ATOM 355 CE1 HIS A 27 1.004 25.219 66.421 1.00 33.73 C ATOM 356 NE2 HIS A 27 0.009 26.024 66.743 1.00 32.07 N ATOM 357 HA HIS A 27 3.992 29.541 68.112 1.00 0.00 H ATOM 358 HB2 HIS A 27 2.515 29.180 66.202 1.00 0.00 H ATOM 359 HB3 HIS A 27 3.780 27.930 66.264 1.00 0.00 H ATOM 360 HD2 HIS A 27 -0.083 28.177 67.189 1.00 0.00 H ATOM 361 HE1 HIS A 27 0.922 24.151 66.218 1.00 0.00 H ATOM 362 H HIS A 27 3.638 26.677 68.712 1.00 0.00 H ATOM 363 N ILE A 28 1.676 28.773 70.034 1.00 26.00 N ATOM 364 CA ILE A 28 0.601 29.307 70.869 1.00 24.76 C ATOM 365 C ILE A 28 1.179 30.242 71.935 1.00 23.16 C ATOM 366 O ILE A 28 0.632 31.307 72.196 1.00 24.34 O ATOM 367 CB ILE A 28 -0.193 28.192 71.592 1.00 27.07 C ATOM 368 CG1 ILE A 28 -0.644 27.101 70.620 1.00 29.96 C ATOM 369 CG2 ILE A 28 -1.402 28.785 72.321 1.00 25.63 C ATOM 370 CD1 ILE A 28 -1.602 27.594 69.569 1.00 39.81 C ATOM 371 HA ILE A 28 -0.075 29.842 70.202 1.00 0.00 H ATOM 372 HB ILE A 28 0.473 27.733 72.322 1.00 0.00 H ATOM 373 HG12 ILE A 28 0.237 26.696 70.122 1.00 0.00 H ATOM 374 HG13 ILE A 28 -1.133 26.311 71.190 1.00 0.00 H ATOM 375 HD11 ILE A 28 -2.495 27.993 70.051 1.00 0.00 H ATOM 376 HD12 ILE A 28 -1.124 28.378 68.982 1.00 0.00 H ATOM 377 HD13 ILE A 28 -1.879 26.767 68.915 1.00 0.00 H ATOM 378 HG21 ILE A 28 -1.060 29.513 73.057 1.00 0.00 H ATOM 379 HG22 ILE A 28 -2.055 29.276 71.599 1.00 0.00 H ATOM 380 HG23 ILE A 28 -1.949 27.987 72.824 1.00 0.00 H ATOM 381 H ILE A 28 2.183 27.922 70.350 1.00 0.00 H ATOM 382 N THR A 29 2.293 29.839 72.540 1.00 22.30 N ATOM 383 CA THR A 29 2.889 30.603 73.641 1.00 21.74 C ATOM 384 C THR A 29 4.089 31.451 73.223 1.00 23.98 C ATOM 385 O THR A 29 4.554 32.283 74.000 1.00 21.72 O ATOM 386 CB THR A 29 3.364 29.676 74.762 1.00 22.75 C ATOM 387 OG1 THR A 29 4.433 28.865 74.265 1.00 20.07 O ATOM 388 CG2 THR A 29 2.237 28.775 75.239 1.00 24.49 C ATOM 389 HA THR A 29 2.091 31.264 73.979 1.00 0.00 H ATOM 390 HB THR A 29 3.699 30.284 75.603 1.00 0.00 H ATOM 391 HG1 THR A 29 4.748 28.261 74.983 1.00 0.00 H ATOM 392 HG23 THR A 29 1.420 29.388 75.619 1.00 0.00 H ATOM 393 HG21 THR A 29 1.881 28.168 74.406 1.00 0.00 H ATOM 394 HG22 THR A 29 2.605 28.125 76.033 1.00 0.00 H ATOM 395 H THR A 29 2.752 28.961 72.225 1.00 0.00 H ATOM 396 N ASN A 30 4.591 31.224 72.007 1.00 20.56 N ATOM 397 CA ASN A 30 5.829 31.845 71.521 1.00 20.03 C ATOM 398 C ASN A 30 7.067 31.507 72.357 1.00 20.71 C ATOM 399 O ASN A 30 8.095 32.178 72.260 1.00 20.93 O ATOM 400 CB ASN A 30 5.672 33.360 71.347 1.00 19.10 C ATOM 401 CG ASN A 30 4.755 33.718 70.183 1.00 22.81 C ATOM 402 OD1 ASN A 30 4.016 34.710 70.226 1.00 21.76 O ATOM 403 ND2 ASN A 30 4.797 32.907 69.136 1.00 18.30 N ATOM 404 HA ASN A 30 6.006 31.403 70.541 1.00 0.00 H ATOM 405 HB2 ASN A 30 5.254 33.777 72.263 1.00 0.00 H ATOM 406 HB3 ASN A 30 6.655 33.796 71.166 1.00 0.00 H ATOM 407 HD22 ASN A 30 5.433 32.084 69.141 1.00 0.00 H ATOM 408 HD21 ASN A 30 4.194 33.094 68.309 1.00 0.00 H ATOM 409 H ASN A 30 4.080 30.576 71.374 1.00 0.00 H ATOM 410 N ALA A 31 6.966 30.459 73.165 1.00 18.73 N ATOM 411 CA ALA A 31 8.135 29.936 73.867 1.00 20.79 C ATOM 412 C ALA A 31 9.084 29.248 72.888 1.00 22.58 C ATOM 413 O ALA A 31 8.666 28.679 71.876 1.00 22.24 O ATOM 414 CB ALA A 31 7.726 28.969 74.956 1.00 23.16 C ATOM 415 HA ALA A 31 8.652 30.777 74.329 1.00 0.00 H ATOM 416 HB1 ALA A 31 7.087 29.482 75.674 1.00 0.00 H ATOM 417 HB2 ALA A 31 7.181 28.135 74.514 1.00 0.00 H ATOM 418 HB3 ALA A 31 8.616 28.596 75.462 1.00 0.00 H ATOM 419 H ALA A 31 6.041 30.004 73.300 1.00 0.00 H ATOM 420 N SER A 32 10.370 29.321 73.185 1.00 20.81 N ATOM 421 CA SER A 32 11.356 28.573 72.421 1.00 20.30 C ATOM 422 C SER A 32 12.453 28.068 73.354 1.00 25.64 C ATOM 423 O SER A 32 12.796 28.726 74.339 1.00 23.43 O ATOM 424 CB SER A 32 11.919 29.409 71.269 1.00 23.08 C ATOM 425 OG SER A 32 12.438 30.640 71.719 1.00 27.50 O ATOM 426 HA SER A 32 10.872 27.709 71.966 1.00 0.00 H ATOM 427 HB2 SER A 32 11.122 29.603 70.551 1.00 0.00 H ATOM 428 HB3 SER A 32 12.716 28.847 70.782 1.00 0.00 H ATOM 429 HG SER A 32 13.167 30.472 72.367 1.00 0.00 H ATOM 430 H SER A 32 10.681 29.921 73.975 1.00 0.00 H ATOM 431 N GLN A 33 12.980 26.884 73.062 1.00 22.63 N ATOM 432 CA GLN A 33 13.989 26.282 73.924 1.00 24.13 C ATOM 433 C GLN A 33 14.745 25.196 73.173 1.00 25.98 C ATOM 434 O GLN A 33 14.242 24.650 72.192 1.00 23.39 O ATOM 435 CB GLN A 33 13.335 25.697 75.175 1.00 23.36 C ATOM 436 CG GLN A 33 12.342 24.583 74.896 1.00 24.92 C ATOM 437 CD GLN A 33 11.567 24.190 76.133 1.00 29.89 C ATOM 438 OE1 GLN A 33 11.371 23.007 76.415 1.00 32.91 O ATOM 439 NE2 GLN A 33 11.127 25.188 76.887 1.00 27.02 N ATOM 440 HA GLN A 33 14.695 27.056 74.226 1.00 0.00 H ATOM 441 HB2 GLN A 33 14.121 25.301 75.819 1.00 0.00 H ATOM 442 HB3 GLN A 33 12.811 26.500 75.694 1.00 0.00 H ATOM 443 HG2 GLN A 33 11.640 24.920 74.133 1.00 0.00 H ATOM 444 HG3 GLN A 33 12.885 23.712 74.529 1.00 0.00 H ATOM 445 HE22 GLN A 33 11.316 26.172 76.609 1.00 0.00 H ATOM 446 HE21 GLN A 33 10.593 24.987 77.756 1.00 0.00 H ATOM 447 H GLN A 33 12.668 26.380 72.207 1.00 0.00 H ATOM 448 N TRP A 34 15.952 24.888 73.634 1.00 24.24 N ATOM 449 CA TRP A 34 16.752 23.832 73.018 1.00 24.46 C ATOM 450 C TRP A 34 16.201 22.466 73.382 1.00 26.92 C ATOM 451 O TRP A 34 16.154 21.555 72.551 1.00 26.59 O ATOM 452 CB TRP A 34 18.213 23.919 73.473 1.00 23.46 C ATOM 453 CG TRP A 34 18.907 25.155 72.998 1.00 24.41 C ATOM 454 CD1 TRP A 34 19.375 26.174 73.767 1.00 24.31 C ATOM 455 CD2 TRP A 34 19.202 25.510 71.640 1.00 23.27 C ATOM 456 NE1 TRP A 34 19.953 27.137 72.978 1.00 24.54 N ATOM 457 CE2 TRP A 34 19.854 26.754 71.667 1.00 25.85 C ATOM 458 CE3 TRP A 34 18.983 24.886 70.406 1.00 26.09 C ATOM 459 CZ2 TRP A 34 20.289 27.394 70.512 1.00 28.93 C ATOM 460 CZ3 TRP A 34 19.413 25.523 69.262 1.00 27.08 C ATOM 461 CH2 TRP A 34 20.058 26.765 69.321 1.00 29.21 C ATOM 462 HA TRP A 34 16.704 23.968 71.938 1.00 0.00 H ATOM 463 HB2 TRP A 34 18.238 23.905 74.563 1.00 0.00 H ATOM 464 HB3 TRP A 34 18.748 23.051 73.087 1.00 0.00 H ATOM 465 HE1 TRP A 34 20.394 28.014 73.320 1.00 0.00 H ATOM 466 HD1 TRP A 34 19.302 26.220 74.854 1.00 0.00 H ATOM 467 HZ2 TRP A 34 20.794 28.359 70.555 1.00 0.00 H ATOM 468 HH2 TRP A 34 20.383 27.241 68.396 1.00 0.00 H ATOM 469 HZ3 TRP A 34 19.248 25.052 68.293 1.00 0.00 H ATOM 470 HE3 TRP A 34 18.484 23.919 70.351 1.00 0.00 H ATOM 471 H TRP A 34 16.335 25.408 74.449 1.00 0.00 H ATOM 472 N GLU A 35 15.789 22.329 74.638 1.00 27.55 N ATOM 473 CA GLU A 35 15.360 21.045 75.172 1.00 28.28 C ATOM 474 C GLU A 35 13.985 20.633 74.664 1.00 31.40 C ATOM 475 O GLU A 35 13.096 21.471 74.498 1.00 30.52 O ATOM 476 CB GLU A 35 15.361 21.087 76.707 1.00 31.75 C ATOM 477 CG GLU A 35 16.694 21.499 77.338 1.00 34.56 C ATOM 478 CD GLU A 35 16.955 23.003 77.286 1.00 32.15 C ATOM 479 OE1 GLU A 35 15.999 23.776 77.036 1.00 29.89 O ATOM 480 OE2 GLU A 35 18.121 23.413 77.500 1.00 32.32 O ATOM 481 HA GLU A 35 16.071 20.297 74.822 1.00 0.00 H ATOM 482 HB2 GLU A 35 14.600 21.798 77.027 1.00 0.00 H ATOM 483 HB3 GLU A 35 15.105 20.093 77.074 1.00 0.00 H ATOM 484 HG2 GLU A 35 16.693 21.185 78.382 1.00 0.00 H ATOM 485 HG3 GLU A 35 17.499 20.991 76.807 1.00 0.00 H ATOM 486 H GLU A 35 15.773 23.164 75.258 1.00 0.00 H ATOM 487 N ARG A 36 13.812 19.334 74.432 1.00 31.47 N ATOM 488 CA ARG A 36 12.519 18.788 74.027 1.00 37.18 C ATOM 489 C ARG A 36 11.485 18.987 75.137 1.00 37.90 C ATOM 490 O ARG A 36 11.729 18.598 76.280 1.00 42.96 O ATOM 491 CB ARG A 36 12.650 17.302 73.682 1.00 40.70 C ATOM 492 CG ARG A 36 11.567 16.803 72.738 1.00 45.41 C ATOM 493 CD ARG A 36 11.944 15.483 72.078 1.00 48.65 C ATOM 494 NE ARG A 36 11.116 15.192 70.906 1.00 53.42 N ATOM 495 CZ ARG A 36 9.947 14.558 70.950 1.00 56.90 C ATOM 496 NH1 ARG A 36 9.456 14.148 72.114 1.00 59.67 N ATOM 497 NH2 ARG A 36 9.264 14.337 69.832 1.00 56.14 N ATOM 498 HA ARG A 36 12.182 19.322 73.138 1.00 0.00 H ATOM 499 HB2 ARG A 36 13.620 17.140 73.212 1.00 0.00 H ATOM 500 HB3 ARG A 36 12.595 16.726 74.606 1.00 0.00 H ATOM 501 HG2 ARG A 36 10.645 16.663 73.303 1.00 0.00 H ATOM 502 HG3 ARG A 36 11.406 17.551 71.962 1.00 0.00 H ATOM 503 HD2 ARG A 36 11.819 14.679 72.804 1.00 0.00 H ATOM 504 HD3 ARG A 36 12.988 15.532 71.767 1.00 0.00 H ATOM 505 HE ARG A 36 11.465 15.502 69.977 1.00 0.00 H ATOM 506 HH12 ARG A 36 8.542 13.653 72.147 1.00 0.00 H ATOM 507 HH11 ARG A 36 9.985 14.322 72.992 1.00 0.00 H ATOM 508 HH22 ARG A 36 8.351 13.841 69.870 1.00 0.00 H ATOM 509 HH21 ARG A 36 9.643 14.660 68.919 1.00 0.00 H ATOM 510 H ARG A 36 14.620 18.689 74.542 1.00 0.00 H ATOM 511 N PRO A 37 10.331 19.585 74.792 1.00 40.09 N ATOM 512 CA PRO A 37 9.248 20.058 75.670 1.00 42.65 C ATOM 513 C PRO A 37 8.956 19.202 76.906 1.00 50.24 C ATOM 514 O PRO A 37 9.457 19.521 77.987 1.00 53.20 O ATOM 515 CB PRO A 37 8.038 20.057 74.741 1.00 41.96 C ATOM 516 CG PRO A 37 8.598 20.334 73.409 1.00 38.89 C ATOM 517 CD PRO A 37 9.975 19.722 73.368 1.00 39.08 C ATOM 518 HA PRO A 37 9.519 21.020 76.105 1.00 0.00 H ATOM 519 HD3 PRO A 37 9.956 18.750 72.875 1.00 0.00 H ATOM 520 HD2 PRO A 37 10.677 20.376 72.851 1.00 0.00 H ATOM 521 HG3 PRO A 37 8.662 21.410 73.247 1.00 0.00 H ATOM 522 HG2 PRO A 37 7.968 19.889 72.639 1.00 0.00 H ATOM 523 HB2 PRO A 37 7.540 19.087 74.756 1.00 0.00 H ATOM 524 HB3 PRO A 37 7.329 20.832 75.030 1.00 0.00 H ATOM 525 N SER A 38 8.139 18.164 76.736 1.00 49.49 N ATOM 526 CA SER A 38 7.643 17.344 77.840 1.00 54.16 C ATOM 527 C SER A 38 6.294 17.839 78.329 1.00 47.45 C ATOM 528 O SER A 38 5.271 17.553 77.727 1.00 51.59 O ATOM 529 CB SER A 38 8.611 17.335 79.019 1.00 51.48 C ATOM 530 OG SER A 38 8.283 18.354 79.957 1.00 56.94 O ATOM 531 HA SER A 38 7.545 16.331 77.449 1.00 0.00 H ATOM 532 HB2 SER A 38 9.623 17.502 78.651 1.00 0.00 H ATOM 533 HB3 SER A 38 8.561 16.365 79.514 1.00 0.00 H ATOM 534 HG SER A 38 8.331 19.238 79.513 1.00 0.00 H ATOM 535 H SER A 38 7.839 17.925 75.769 1.00 0.00 H TER 536 SER A 38 ATOM 537 N GLY A 50 -3.710 16.331 79.811 1.00 69.38 N ATOM 538 CA GLY A 50 -4.874 17.009 79.275 1.00 67.12 C ATOM 539 C GLY A 50 -5.099 18.367 79.908 1.00 66.11 C ATOM 540 O GLY A 50 -4.671 18.615 81.031 1.00 67.22 O ATOM 541 HA3 GLY A 50 -5.753 16.390 79.455 1.00 0.00 H ATOM 542 HA2 GLY A 50 -4.738 17.142 78.202 1.00 0.00 H ATOM 543 HN3 GLY A 50 -3.832 16.191 80.834 1.00 0.00 H ATOM 544 HN2 GLY A 50 -2.863 16.909 79.638 1.00 0.00 H ATOM 545 HN1 GLY A 50 -3.602 15.408 79.344 1.00 0.00 H ATOM 546 N GLU A 51 -5.787 19.247 79.189 1.00 64.98 N ATOM 547 CA GLU A 51 -5.983 20.621 79.653 1.00 61.02 C ATOM 548 C GLU A 51 -6.926 20.670 80.856 1.00 59.88 C ATOM 549 O GLU A 51 -8.000 20.070 80.832 1.00 60.07 O ATOM 550 CB GLU A 51 -6.467 21.531 78.516 1.00 54.53 C ATOM 551 CG GLU A 51 -7.879 22.066 78.644 1.00 54.11 C ATOM 552 CD GLU A 51 -8.062 23.334 77.828 1.00 48.63 C ATOM 553 OE1 GLU A 51 -7.229 23.581 76.926 1.00 46.91 O ATOM 554 OE2 GLU A 51 -9.021 24.090 78.089 1.00 48.32 O ATOM 555 HA GLU A 51 -5.016 21.001 79.982 1.00 0.00 H ATOM 556 HB2 GLU A 51 -5.791 22.384 78.462 1.00 0.00 H ATOM 557 HB3 GLU A 51 -6.409 20.963 77.587 1.00 0.00 H ATOM 558 HG2 GLU A 51 -8.579 21.310 78.289 1.00 0.00 H ATOM 559 HG3 GLU A 51 -8.083 22.285 79.692 1.00 0.00 H ATOM 560 H GLU A 51 -6.194 18.954 78.278 1.00 0.00 H ATOM 561 N PRO A 52 -6.509 21.378 81.918 1.00 58.29 N ATOM 562 CA PRO A 52 -7.206 21.462 83.207 1.00 53.16 C ATOM 563 C PRO A 52 -8.378 22.425 83.160 1.00 48.41 C ATOM 564 O PRO A 52 -8.528 23.157 82.185 1.00 52.58 O ATOM 565 CB PRO A 52 -6.135 22.009 84.148 1.00 52.71 C ATOM 566 CG PRO A 52 -5.208 22.769 83.275 1.00 49.51 C ATOM 567 CD PRO A 52 -5.257 22.153 81.907 1.00 54.68 C ATOM 568 HA PRO A 52 -7.621 20.500 83.508 1.00 0.00 H ATOM 569 HD3 PRO A 52 -5.282 22.922 81.135 1.00 0.00 H ATOM 570 HD2 PRO A 52 -4.398 21.502 81.742 1.00 0.00 H ATOM 571 HG3 PRO A 52 -4.194 22.712 83.672 1.00 0.00 H ATOM 572 HG2 PRO A 52 -5.519 23.813 83.223 1.00 0.00 H ATOM 573 HB2 PRO A 52 -6.581 22.664 84.896 1.00 0.00 H ATOM 574 HB3 PRO A 52 -5.610 21.194 84.647 1.00 0.00 H ATOM 575 N ALA A 53 -9.186 22.423 84.215 1.00 48.75 N ATOM 576 CA ALA A 53 -10.349 23.295 84.307 1.00 47.38 C ATOM 577 C ALA A 53 -9.925 24.747 84.495 1.00 44.03 C ATOM 578 O ALA A 53 -10.452 25.653 83.846 1.00 40.61 O ATOM 579 CB ALA A 53 -11.242 22.852 85.459 1.00 47.96 C ATOM 580 HA ALA A 53 -10.909 23.223 83.375 1.00 0.00 H ATOM 581 HB1 ALA A 53 -11.573 21.828 85.287 1.00 0.00 H ATOM 582 HB2 ALA A 53 -10.681 22.902 86.392 1.00 0.00 H ATOM 583 HB3 ALA A 53 -12.109 23.510 85.519 1.00 0.00 H ATOM 584 H ALA A 53 -8.981 21.776 85.003 1.00 0.00 H ATOM 585 N ARG A 54 -8.967 24.958 85.393 1.00 41.31 N ATOM 586 CA ARG A 54 -8.475 26.294 85.692 1.00 37.08 C ATOM 587 C ARG A 54 -6.953 26.313 85.720 1.00 34.05 C ATOM 588 O ARG A 54 -6.307 25.290 85.954 1.00 36.24 O ATOM 589 CB ARG A 54 -9.016 26.777 87.045 1.00 40.19 C ATOM 590 CG ARG A 54 -10.508 27.084 87.052 1.00 42.79 C ATOM 591 CD ARG A 54 -11.052 27.258 88.464 1.00 47.63 C ATOM 592 NE ARG A 54 -10.814 28.596 89.002 1.00 50.16 N ATOM 593 CZ ARG A 54 -11.473 29.687 88.613 1.00 50.06 C ATOM 594 NH1 ARG A 54 -12.403 29.605 87.669 1.00 46.90 N ATOM 595 NH2 ARG A 54 -11.197 30.864 89.161 1.00 49.18 N ATOM 596 HA ARG A 54 -8.825 26.963 84.906 1.00 0.00 H ATOM 597 HB2 ARG A 54 -8.824 26.001 87.786 1.00 0.00 H ATOM 598 HB3 ARG A 54 -8.480 27.684 87.323 1.00 0.00 H ATOM 599 HG2 ARG A 54 -10.680 28.004 86.493 1.00 0.00 H ATOM 600 HG3 ARG A 54 -11.038 26.263 86.570 1.00 0.00 H ATOM 601 HD2 ARG A 54 -10.570 26.529 89.116 1.00 0.00 H ATOM 602 HD3 ARG A 54 -12.126 27.075 88.449 1.00 0.00 H ATOM 603 HE ARG A 54 -10.084 28.703 89.735 1.00 0.00 H ATOM 604 HH12 ARG A 54 -12.915 30.459 87.368 1.00 0.00 H ATOM 605 HH11 ARG A 54 -12.619 28.687 87.230 1.00 0.00 H ATOM 606 HH22 ARG A 54 -11.713 31.714 88.855 1.00 0.00 H ATOM 607 HH21 ARG A 54 -10.465 30.937 89.896 1.00 0.00 H ATOM 608 H ARG A 54 -8.558 24.145 85.896 1.00 0.00 H ATOM 609 N VAL A 55 -6.386 27.486 85.476 1.00 32.07 N ATOM 610 CA VAL A 55 -4.958 27.688 85.643 1.00 29.79 C ATOM 611 C VAL A 55 -4.745 28.976 86.415 1.00 29.51 C ATOM 612 O VAL A 55 -5.631 29.833 86.479 1.00 31.01 O ATOM 613 CB VAL A 55 -4.208 27.778 84.288 1.00 28.81 C ATOM 614 CG1 VAL A 55 -4.442 26.519 83.456 1.00 32.50 C ATOM 615 CG2 VAL A 55 -4.622 29.028 83.518 1.00 30.36 C ATOM 616 HA VAL A 55 -4.556 26.829 86.179 1.00 0.00 H ATOM 617 HB VAL A 55 -3.140 27.852 84.495 1.00 0.00 H ATOM 618 HG11 VAL A 55 -4.077 25.650 84.004 1.00 0.00 H ATOM 619 HG12 VAL A 55 -5.509 26.406 83.262 1.00 0.00 H ATOM 620 HG13 VAL A 55 -3.906 26.605 82.511 1.00 0.00 H ATOM 621 HG21 VAL A 55 -5.694 28.995 83.324 1.00 0.00 H ATOM 622 HG22 VAL A 55 -4.385 29.913 84.109 1.00 0.00 H ATOM 623 HG23 VAL A 55 -4.081 29.066 82.572 1.00 0.00 H ATOM 624 H VAL A 55 -6.978 28.280 85.158 1.00 0.00 H ATOM 625 N ARG A 56 -3.568 29.107 87.010 1.00 25.85 N ATOM 626 CA ARG A 56 -3.193 30.344 87.664 1.00 25.92 C ATOM 627 C ARG A 56 -1.935 30.868 86.996 1.00 26.49 C ATOM 628 O ARG A 56 -0.973 30.126 86.826 1.00 24.70 O ATOM 629 CB ARG A 56 -2.940 30.103 89.147 1.00 26.22 C ATOM 630 CG ARG A 56 -2.487 31.338 89.886 1.00 27.40 C ATOM 631 CD ARG A 56 -2.253 31.037 91.353 1.00 28.34 C ATOM 632 NE ARG A 56 -1.980 32.251 92.109 1.00 29.47 N ATOM 633 CZ ARG A 56 -1.791 32.267 93.426 1.00 34.41 C ATOM 634 NH1 ARG A 56 -1.848 31.133 94.112 1.00 33.26 N ATOM 635 NH2 ARG A 56 -1.541 33.409 94.053 1.00 33.22 N ATOM 636 HA ARG A 56 -3.998 31.073 87.575 1.00 0.00 H ATOM 637 HB2 ARG A 56 -3.864 29.747 89.602 1.00 0.00 H ATOM 638 HB3 ARG A 56 -2.170 29.338 89.247 1.00 0.00 H ATOM 639 HG2 ARG A 56 -1.559 31.698 89.443 1.00 0.00 H ATOM 640 HG3 ARG A 56 -3.253 32.108 89.797 1.00 0.00 H ATOM 641 HD2 ARG A 56 -1.402 30.363 91.445 1.00 0.00 H ATOM 642 HD3 ARG A 56 -3.141 30.556 91.763 1.00 0.00 H ATOM 643 HE ARG A 56 -1.930 33.152 91.593 1.00 0.00 H ATOM 644 HH12 ARG A 56 -1.701 31.140 95.142 1.00 0.00 H ATOM 645 HH11 ARG A 56 -2.040 30.237 93.620 1.00 0.00 H ATOM 646 HH22 ARG A 56 -1.394 33.416 95.083 1.00 0.00 H ATOM 647 HH21 ARG A 56 -1.492 34.298 93.515 1.00 0.00 H ATOM 648 H ARG A 56 -2.902 28.308 87.007 1.00 0.00 H ATOM 649 N CYS A 57 -1.948 32.135 86.597 1.00 24.31 N ATOM 650 CA CYS A 57 -0.782 32.729 85.957 1.00 23.62 C ATOM 651 C CYS A 57 -0.412 34.074 86.540 1.00 23.42 C ATOM 652 O CYS A 57 -1.238 34.756 87.148 1.00 22.71 O ATOM 653 CB CYS A 57 -0.998 32.880 84.447 1.00 23.12 C ATOM 654 SG CYS A 57 -1.271 31.325 83.592 1.00 25.82 S ATOM 655 HA CYS A 57 0.043 32.042 86.147 1.00 0.00 H ATOM 656 HB2 CYS A 57 -0.116 33.357 84.020 1.00 0.00 H ATOM 657 HB3 CYS A 57 -1.867 33.518 84.286 1.00 0.00 H ATOM 658 HG CYS A 57 -1.454 31.568 82.246 1.00 0.00 H ATOM 659 H CYS A 57 -2.802 32.710 86.743 1.00 0.00 H ATOM 660 N SER A 58 0.850 34.442 86.349 1.00 19.71 N ATOM 661 CA SER A 58 1.297 35.804 86.532 1.00 19.68 C ATOM 662 C SER A 58 1.688 36.314 85.154 1.00 20.60 C ATOM 663 O SER A 58 1.941 35.526 84.239 1.00 21.75 O ATOM 664 CB SER A 58 2.501 35.851 87.464 1.00 22.15 C ATOM 665 OG SER A 58 2.188 35.271 88.716 1.00 20.58 O ATOM 666 HA SER A 58 0.513 36.416 86.979 1.00 0.00 H ATOM 667 HB2 SER A 58 2.797 36.889 87.614 1.00 0.00 H ATOM 668 HB3 SER A 58 3.326 35.301 87.011 1.00 0.00 H ATOM 669 HG SER A 58 2.983 35.312 89.305 1.00 0.00 H ATOM 670 H SER A 58 1.542 33.723 86.057 1.00 0.00 H ATOM 671 N HIS A 59 1.743 37.627 84.999 1.00 20.30 N ATOM 672 CA HIS A 59 2.189 38.188 83.743 1.00 22.44 C ATOM 673 C HIS A 59 2.927 39.501 83.931 1.00 22.38 C ATOM 674 O HIS A 59 2.862 40.136 84.989 1.00 21.78 O ATOM 675 CB HIS A 59 1.022 38.311 82.742 1.00 19.24 C ATOM 676 CG HIS A 59 0.180 39.541 82.913 1.00 23.66 C ATOM 677 ND1 HIS A 59 -0.367 39.920 84.121 1.00 25.74 N ATOM 678 CD2 HIS A 59 -0.243 40.457 82.008 1.00 20.92 C ATOM 679 CE1 HIS A 59 -1.068 41.029 83.958 1.00 20.91 C ATOM 680 NE2 HIS A 59 -1.011 41.373 82.686 1.00 28.15 N ATOM 681 HA HIS A 59 2.911 37.493 83.314 1.00 0.00 H ATOM 682 HB2 HIS A 59 1.437 38.320 81.734 1.00 0.00 H ATOM 683 HB3 HIS A 59 0.379 37.439 82.860 1.00 0.00 H ATOM 684 HD2 HIS A 59 -0.016 40.466 80.942 1.00 0.00 H ATOM 685 HE1 HIS A 59 -1.602 41.567 84.741 1.00 0.00 H ATOM 686 H HIS A 59 1.466 38.255 85.780 1.00 0.00 H ATOM 687 N LEU A 60 3.669 39.877 82.902 1.00 18.39 N ATOM 688 CA LEU A 60 4.322 41.170 82.861 1.00 18.07 C ATOM 689 C LEU A 60 3.835 41.775 81.559 1.00 23.59 C ATOM 690 O LEU A 60 4.011 41.186 80.499 1.00 20.26 O ATOM 691 CB LEU A 60 5.841 41.003 82.830 1.00 18.62 C ATOM 692 CG LEU A 60 6.687 42.274 82.958 1.00 20.72 C ATOM 693 CD1 LEU A 60 8.125 41.927 83.341 1.00 21.95 C ATOM 694 CD2 LEU A 60 6.651 43.102 81.681 1.00 19.61 C ATOM 695 HA LEU A 60 4.095 41.786 83.731 1.00 0.00 H ATOM 696 HB2 LEU A 60 6.115 40.342 83.652 1.00 0.00 H ATOM 697 HB3 LEU A 60 6.100 40.530 81.883 1.00 0.00 H ATOM 698 HG LEU A 60 6.255 42.881 83.753 1.00 0.00 H ATOM 699 HD21 LEU A 60 7.042 42.509 80.854 1.00 0.00 H ATOM 700 HD22 LEU A 60 5.623 43.393 81.467 1.00 0.00 H ATOM 701 HD23 LEU A 60 7.263 43.995 81.811 1.00 0.00 H ATOM 702 HD11 LEU A 60 8.129 41.402 84.296 1.00 0.00 H ATOM 703 HD12 LEU A 60 8.560 41.288 82.572 1.00 0.00 H ATOM 704 HD13 LEU A 60 8.708 42.844 83.427 1.00 0.00 H ATOM 705 H LEU A 60 3.787 39.226 82.100 1.00 0.00 H ATOM 706 N LEU A 61 3.210 42.941 81.645 1.00 18.22 N ATOM 707 CA LEU A 61 2.628 43.565 80.470 1.00 21.31 C ATOM 708 C LEU A 61 3.376 44.834 80.111 1.00 21.30 C ATOM 709 O LEU A 61 3.649 45.666 80.966 1.00 20.96 O ATOM 710 CB LEU A 61 1.149 43.870 80.723 1.00 21.31 C ATOM 711 CG LEU A 61 0.455 44.863 79.781 1.00 23.10 C ATOM 712 CD1 LEU A 61 0.365 44.282 78.381 1.00 22.44 C ATOM 713 CD2 LEU A 61 -0.920 45.212 80.318 1.00 26.42 C ATOM 714 HA LEU A 61 2.710 42.875 79.630 1.00 0.00 H ATOM 715 HB2 LEU A 61 0.606 42.927 80.660 1.00 0.00 H ATOM 716 HB3 LEU A 61 1.067 44.268 81.734 1.00 0.00 H ATOM 717 HG LEU A 61 1.043 45.779 79.728 1.00 0.00 H ATOM 718 HD21 LEU A 61 -1.521 44.306 80.391 1.00 0.00 H ATOM 719 HD22 LEU A 61 -0.819 45.663 81.305 1.00 0.00 H ATOM 720 HD23 LEU A 61 -1.404 45.917 79.642 1.00 0.00 H ATOM 721 HD11 LEU A 61 1.369 44.078 78.009 1.00 0.00 H ATOM 722 HD12 LEU A 61 -0.209 43.356 78.410 1.00 0.00 H ATOM 723 HD13 LEU A 61 -0.129 44.997 77.723 1.00 0.00 H ATOM 724 H LEU A 61 3.135 43.416 82.567 1.00 0.00 H ATOM 725 N VAL A 62 3.727 44.977 78.836 1.00 20.42 N ATOM 726 CA VAL A 62 4.325 46.213 78.367 1.00 21.60 C ATOM 727 C VAL A 62 3.365 46.798 77.335 1.00 25.59 C ATOM 728 O VAL A 62 3.120 46.197 76.294 1.00 21.91 O ATOM 729 CB VAL A 62 5.723 45.986 77.745 1.00 22.72 C ATOM 730 CG1 VAL A 62 6.304 47.301 77.228 1.00 23.40 C ATOM 731 CG2 VAL A 62 6.658 45.366 78.771 1.00 26.14 C ATOM 732 HA VAL A 62 4.477 46.895 79.204 1.00 0.00 H ATOM 733 HB VAL A 62 5.619 45.302 76.903 1.00 0.00 H ATOM 734 HG11 VAL A 62 5.642 47.715 76.467 1.00 0.00 H ATOM 735 HG12 VAL A 62 6.396 48.006 78.054 1.00 0.00 H ATOM 736 HG13 VAL A 62 7.287 47.117 76.795 1.00 0.00 H ATOM 737 HG21 VAL A 62 6.751 46.035 79.627 1.00 0.00 H ATOM 738 HG22 VAL A 62 6.252 44.409 79.099 1.00 0.00 H ATOM 739 HG23 VAL A 62 7.638 45.211 78.321 1.00 0.00 H ATOM 740 H VAL A 62 3.571 44.195 78.168 1.00 0.00 H ATOM 741 N LYS A 63 2.786 47.949 77.655 1.00 25.25 N ATOM 742 CA LYS A 63 1.817 48.572 76.758 1.00 28.19 C ATOM 743 C LYS A 63 2.505 49.405 75.681 1.00 28.93 C ATOM 744 O LYS A 63 3.695 49.722 75.792 1.00 25.58 O ATOM 745 CB LYS A 63 0.825 49.428 77.556 1.00 25.63 C ATOM 746 CG LYS A 63 -0.200 48.617 78.347 1.00 28.48 C ATOM 747 CD LYS A 63 -1.268 49.526 78.959 1.00 29.79 C ATOM 748 CE LYS A 63 -2.402 48.722 79.574 1.00 31.65 C ATOM 749 NZ LYS A 63 -3.444 49.600 80.178 1.00 36.24 N ATOM 750 HA LYS A 63 1.267 47.777 76.255 1.00 0.00 H ATOM 751 HB2 LYS A 63 1.389 50.044 78.256 1.00 0.00 H ATOM 752 HB3 LYS A 63 0.289 50.072 76.859 1.00 0.00 H ATOM 753 HG2 LYS A 63 -0.681 47.902 77.679 1.00 0.00 H ATOM 754 HG3 LYS A 63 0.311 48.079 79.146 1.00 0.00 H ATOM 755 HD2 LYS A 63 -0.809 50.140 79.734 1.00 0.00 H ATOM 756 HD3 LYS A 63 -1.673 50.171 78.179 1.00 0.00 H ATOM 757 HE2 LYS A 63 -1.994 48.074 80.350 1.00 0.00 H ATOM 758 HE3 LYS A 63 -2.863 48.111 78.797 1.00 0.00 H ATOM 759 HZ1 LYS A 63 -3.015 50.182 80.925 1.00 0.00 H ATOM 760 HZ2 LYS A 63 -3.844 50.218 79.443 1.00 0.00 H ATOM 761 HZ3 LYS A 63 -4.198 49.011 80.586 1.00 0.00 H ATOM 762 H LYS A 63 3.025 48.412 78.555 1.00 0.00 H ATOM 763 N HIS A 64 1.749 49.742 74.637 1.00 30.11 N ATOM 764 CA HIS A 64 2.230 50.589 73.549 1.00 33.20 C ATOM 765 C HIS A 64 1.129 51.522 73.047 1.00 33.93 C ATOM 766 O HIS A 64 -0.019 51.434 73.485 1.00 33.59 O ATOM 767 CB HIS A 64 2.781 49.751 72.382 1.00 28.26 C ATOM 768 CG HIS A 64 1.887 48.628 71.962 1.00 29.90 C ATOM 769 ND1 HIS A 64 0.778 48.818 71.171 1.00 29.85 N ATOM 770 CD2 HIS A 64 1.950 47.299 72.215 1.00 26.28 C ATOM 771 CE1 HIS A 64 0.187 47.652 70.961 1.00 33.59 C ATOM 772 NE2 HIS A 64 0.877 46.719 71.584 1.00 29.27 N ATOM 773 HA HIS A 64 3.043 51.193 73.951 1.00 0.00 H ATOM 774 HB2 HIS A 64 2.928 50.410 71.526 1.00 0.00 H ATOM 775 HB3 HIS A 64 3.740 49.331 72.685 1.00 0.00 H ATOM 776 HD2 HIS A 64 2.708 46.787 72.807 1.00 0.00 H ATOM 777 HE1 HIS A 64 -0.717 47.492 70.373 1.00 0.00 H ATOM 778 H HIS A 64 0.773 49.386 74.595 1.00 0.00 H ATOM 779 N SER A 65 1.483 52.404 72.117 1.00 35.10 N ATOM 780 CA SER A 65 0.543 53.398 71.600 1.00 35.38 C ATOM 781 C SER A 65 -0.716 52.783 71.008 1.00 35.65 C ATOM 782 O SER A 65 -1.761 53.431 70.943 1.00 39.01 O ATOM 783 CB SER A 65 1.211 54.257 70.539 1.00 34.60 C ATOM 784 OG SER A 65 1.659 53.458 69.458 1.00 37.03 O ATOM 785 HA SER A 65 0.246 54.003 72.456 1.00 0.00 H ATOM 786 HB2 SER A 65 2.064 54.773 70.980 1.00 0.00 H ATOM 787 HB3 SER A 65 0.495 54.991 70.169 1.00 0.00 H ATOM 788 HG SER A 65 2.312 52.792 69.790 1.00 0.00 H ATOM 789 H SER A 65 2.455 52.387 71.747 1.00 0.00 H ATOM 790 N GLN A 66 -0.617 51.536 70.568 1.00 32.96 N ATOM 791 CA GLN A 66 -1.759 50.864 69.962 1.00 35.25 C ATOM 792 C GLN A 66 -2.541 49.989 70.940 1.00 32.42 C ATOM 793 O GLN A 66 -3.478 49.295 70.544 1.00 35.31 O ATOM 794 CB GLN A 66 -1.303 50.056 68.749 1.00 35.71 C ATOM 795 CG GLN A 66 -0.908 50.931 67.578 1.00 40.13 C ATOM 796 CD GLN A 66 -1.960 50.935 66.492 1.00 49.35 C ATOM 797 OE1 GLN A 66 -2.100 49.959 65.748 1.00 36.22 O ATOM 798 NE2 GLN A 66 -2.713 52.031 66.394 1.00 50.63 N ATOM 799 HA GLN A 66 -2.452 51.643 69.644 1.00 0.00 H ATOM 800 HB2 GLN A 66 -0.444 49.449 69.037 1.00 0.00 H ATOM 801 HB3 GLN A 66 -2.119 49.404 68.438 1.00 0.00 H ATOM 802 HG2 GLN A 66 -0.765 51.951 67.934 1.00 0.00 H ATOM 803 HG3 GLN A 66 0.028 50.559 67.160 1.00 0.00 H ATOM 804 HE22 GLN A 66 -2.558 52.828 67.044 1.00 0.00 H ATOM 805 HE21 GLN A 66 -3.455 52.089 65.668 1.00 0.00 H ATOM 806 H GLN A 66 0.288 51.031 70.657 1.00 0.00 H ATOM 807 N SER A 67 -2.168 50.033 72.218 1.00 32.16 N ATOM 808 CA SER A 67 -2.922 49.328 73.248 1.00 33.15 C ATOM 809 C SER A 67 -4.324 49.914 73.361 1.00 34.29 C ATOM 810 O SER A 67 -4.507 51.119 73.209 1.00 35.36 O ATOM 811 CB SER A 67 -2.213 49.421 74.603 1.00 31.87 C ATOM 812 OG SER A 67 -0.979 48.728 74.589 1.00 29.27 O ATOM 813 HA SER A 67 -2.990 48.278 72.963 1.00 0.00 H ATOM 814 HB2 SER A 67 -2.855 48.987 75.370 1.00 0.00 H ATOM 815 HB3 SER A 67 -2.028 50.470 74.836 1.00 0.00 H ATOM 816 HG SER A 67 -1.140 47.773 74.383 1.00 0.00 H ATOM 817 H SER A 67 -1.325 50.579 72.486 1.00 0.00 H ATOM 818 N ARG A 68 -5.305 49.061 73.641 1.00 35.13 N ATOM 819 CA ARG A 68 -6.692 49.498 73.755 1.00 37.68 C ATOM 820 C ARG A 68 -6.860 50.551 74.840 1.00 40.19 C ATOM 821 O ARG A 68 -7.778 51.370 74.778 1.00 40.69 O ATOM 822 CB ARG A 68 -7.620 48.312 74.018 1.00 38.85 C ATOM 823 CG ARG A 68 -7.519 47.728 75.421 1.00 38.95 C ATOM 824 CD ARG A 68 -8.467 46.541 75.581 1.00 41.46 C ATOM 825 NE ARG A 68 -8.427 45.987 76.931 1.00 41.96 N ATOM 826 CZ ARG A 68 -9.117 44.919 77.323 1.00 43.86 C ATOM 827 NH1 ARG A 68 -9.908 44.287 76.467 1.00 48.42 N ATOM 828 NH2 ARG A 68 -9.015 44.483 78.575 1.00 46.82 N ATOM 829 HA ARG A 68 -6.967 49.950 72.802 1.00 0.00 H ATOM 830 HB2 ARG A 68 -8.647 48.642 73.859 1.00 0.00 H ATOM 831 HB3 ARG A 68 -7.378 47.525 73.304 1.00 0.00 H ATOM 832 HG2 ARG A 68 -6.496 47.396 75.598 1.00 0.00 H ATOM 833 HG3 ARG A 68 -7.781 48.496 76.148 1.00 0.00 H ATOM 834 HD2 ARG A 68 -8.181 45.764 74.873 1.00 0.00 H ATOM 835 HD3 ARG A 68 -9.483 46.871 75.366 1.00 0.00 H ATOM 836 HE ARG A 68 -7.820 46.458 77.632 1.00 0.00 H ATOM 837 HH12 ARG A 68 -10.446 43.452 76.775 1.00 0.00 H ATOM 838 HH11 ARG A 68 -9.990 44.626 75.487 1.00 0.00 H ATOM 839 HH22 ARG A 68 -9.555 43.648 78.880 1.00 0.00 H ATOM 840 HH21 ARG A 68 -8.396 44.977 79.249 1.00 0.00 H ATOM 841 H ARG A 68 -5.077 48.056 73.782 1.00 0.00 H ATOM 842 N ARG A 69 -5.969 50.529 75.829 1.00 40.52 N ATOM 843 CA ARG A 69 -5.953 51.536 76.889 1.00 36.22 C ATOM 844 C ARG A 69 -4.517 51.979 77.181 1.00 37.89 C ATOM 845 O ARG A 69 -3.852 51.419 78.060 1.00 35.91 O ATOM 846 CB ARG A 69 -6.616 50.991 78.152 1.00 38.32 C ATOM 847 CG ARG A 69 -6.628 51.970 79.309 1.00 43.99 C ATOM 848 CD ARG A 69 -7.064 51.306 80.609 1.00 42.45 C ATOM 849 NE ARG A 69 -6.628 52.083 81.767 1.00 49.21 N ATOM 850 CZ ARG A 69 -5.721 51.675 82.653 1.00 50.69 C ATOM 851 NH1 ARG A 69 -5.155 50.479 82.530 1.00 44.10 N ATOM 852 NH2 ARG A 69 -5.388 52.460 83.674 1.00 48.97 N ATOM 853 HA ARG A 69 -6.519 52.405 76.553 1.00 0.00 H ATOM 854 HB2 ARG A 69 -7.647 50.728 77.913 1.00 0.00 H ATOM 855 HB3 ARG A 69 -6.077 50.096 78.464 1.00 0.00 H ATOM 856 HG2 ARG A 69 -5.624 52.375 79.439 1.00 0.00 H ATOM 857 HG3 ARG A 69 -7.319 52.781 79.078 1.00 0.00 H ATOM 858 HD2 ARG A 69 -6.627 50.309 80.664 1.00 0.00 H ATOM 859 HD3 ARG A 69 -8.151 51.227 80.622 1.00 0.00 H ATOM 860 HE ARG A 69 -7.056 53.020 81.909 1.00 0.00 H ATOM 861 HH12 ARG A 69 -4.447 50.165 83.224 1.00 0.00 H ATOM 862 HH11 ARG A 69 -5.420 49.857 81.739 1.00 0.00 H ATOM 863 HH22 ARG A 69 -4.680 52.141 84.366 1.00 0.00 H ATOM 864 HH21 ARG A 69 -5.836 53.393 83.781 1.00 0.00 H ATOM 865 H ARG A 69 -5.259 49.769 75.848 1.00 0.00 H ATOM 866 N PRO A 70 -4.037 52.991 76.440 1.00 36.54 N ATOM 867 CA PRO A 70 -2.643 53.457 76.409 1.00 36.00 C ATOM 868 C PRO A 70 -2.208 54.234 77.646 1.00 36.87 C ATOM 869 O PRO A 70 -1.634 55.320 77.520 1.00 38.52 O ATOM 870 CB PRO A 70 -2.609 54.393 75.190 1.00 35.39 C ATOM 871 CG PRO A 70 -3.878 54.139 74.451 1.00 35.86 C ATOM 872 CD PRO A 70 -4.871 53.728 75.478 1.00 38.35 C ATOM 873 HA PRO A 70 -1.963 52.606 76.367 1.00 0.00 H ATOM 874 HD3 PRO A 70 -5.340 54.595 75.944 1.00 0.00 H ATOM 875 HD2 PRO A 70 -5.641 53.086 75.049 1.00 0.00 H ATOM 876 HG3 PRO A 70 -3.738 53.344 73.719 1.00 0.00 H ATOM 877 HG2 PRO A 70 -4.210 55.045 73.943 1.00 0.00 H ATOM 878 HB2 PRO A 70 -2.557 55.433 75.511 1.00 0.00 H ATOM 879 HB3 PRO A 70 -1.750 54.165 74.559 1.00 0.00 H ATOM 880 N SER A 71 -2.457 53.678 78.825 1.00 33.84 N ATOM 881 CA SER A 71 -2.036 54.308 80.067 1.00 36.28 C ATOM 882 C SER A 71 -1.908 53.252 81.154 1.00 32.65 C ATOM 883 O SER A 71 -2.485 52.168 81.042 1.00 34.77 O ATOM 884 CB SER A 71 -3.039 55.375 80.502 1.00 40.93 C ATOM 885 OG SER A 71 -4.163 54.784 81.128 1.00 44.09 O ATOM 886 HA SER A 71 -1.071 54.788 79.904 1.00 0.00 H ATOM 887 HB2 SER A 71 -3.370 55.933 79.626 1.00 0.00 H ATOM 888 HB3 SER A 71 -2.556 56.055 81.203 1.00 0.00 H ATOM 889 HG SER A 71 -4.798 55.493 81.401 1.00 0.00 H ATOM 890 H SER A 71 -2.965 52.771 78.862 1.00 0.00 H ATOM 891 N SER A 72 -1.155 53.568 82.201 1.00 31.63 N ATOM 892 CA SER A 72 -0.990 52.639 83.320 1.00 36.01 C ATOM 893 C SER A 72 -0.496 53.354 84.571 1.00 33.49 C ATOM 894 O SER A 72 -0.204 54.550 84.544 1.00 32.33 O ATOM 895 CB SER A 72 0.003 51.534 82.953 1.00 31.19 C ATOM 896 OG SER A 72 1.336 52.003 83.081 1.00 27.77 O ATOM 897 HA SER A 72 -1.968 52.205 83.528 1.00 0.00 H ATOM 898 HB2 SER A 72 -0.171 51.222 81.923 1.00 0.00 H ATOM 899 HB3 SER A 72 -0.144 50.683 83.618 1.00 0.00 H ATOM 900 HG SER A 72 1.965 51.277 82.840 1.00 0.00 H ATOM 901 H SER A 72 -0.675 54.490 82.226 1.00 0.00 H ATOM 902 N TRP A 73 -0.382 52.609 85.666 1.00 35.00 N ATOM 903 CA TRP A 73 0.138 53.163 86.907 1.00 33.43 C ATOM 904 C TRP A 73 1.566 53.680 86.729 1.00 34.49 C ATOM 905 O TRP A 73 2.021 54.532 87.491 1.00 34.17 O ATOM 906 CB TRP A 73 0.078 52.121 88.032 1.00 31.09 C ATOM 907 CG TRP A 73 1.079 51.012 87.884 1.00 31.82 C ATOM 908 CD1 TRP A 73 0.883 49.807 87.270 1.00 29.28 C ATOM 909 CD2 TRP A 73 2.433 51.005 88.359 1.00 33.46 C ATOM 910 NE1 TRP A 73 2.032 49.051 87.335 1.00 29.33 N ATOM 911 CE2 TRP A 73 2.997 49.765 87.996 1.00 30.70 C ATOM 912 CE3 TRP A 73 3.222 51.929 89.055 1.00 34.47 C ATOM 913 CZ2 TRP A 73 4.312 49.425 88.306 1.00 30.66 C ATOM 914 CZ3 TRP A 73 4.531 51.588 89.361 1.00 32.13 C ATOM 915 CH2 TRP A 73 5.062 50.347 88.984 1.00 31.07 C ATOM 916 HA TRP A 73 -0.492 54.009 87.184 1.00 0.00 H ATOM 917 HB2 TRP A 73 0.263 52.627 88.980 1.00 0.00 H ATOM 918 HB3 TRP A 73 -0.920 51.684 88.043 1.00 0.00 H ATOM 919 HE1 TRP A 73 2.149 48.094 86.946 1.00 0.00 H ATOM 920 HD1 TRP A 73 -0.047 49.491 86.798 1.00 0.00 H ATOM 921 HZ2 TRP A 73 4.728 48.459 88.019 1.00 0.00 H ATOM 922 HH2 TRP A 73 6.096 50.111 89.237 1.00 0.00 H ATOM 923 HZ3 TRP A 73 5.157 52.297 89.903 1.00 0.00 H ATOM 924 HE3 TRP A 73 2.816 52.896 89.350 1.00 0.00 H ATOM 925 H TRP A 73 -0.670 51.610 85.635 1.00 0.00 H ATOM 926 N ARG A 74 2.269 53.171 85.717 1.00 32.98 N ATOM 927 CA ARG A 74 3.661 53.562 85.480 1.00 34.30 C ATOM 928 C ARG A 74 3.762 54.919 84.800 1.00 35.70 C ATOM 929 O ARG A 74 4.649 55.715 85.108 1.00 35.75 O ATOM 930 CB ARG A 74 4.394 52.523 84.622 1.00 32.74 C ATOM 931 CG ARG A 74 4.502 51.150 85.248 1.00 31.65 C ATOM 932 CD ARG A 74 5.680 50.378 84.673 1.00 27.71 C ATOM 933 NE ARG A 74 6.954 50.957 85.087 1.00 28.92 N ATOM 934 CZ ARG A 74 7.928 51.295 84.251 1.00 33.00 C ATOM 935 NH1 ARG A 74 7.785 51.090 82.947 1.00 35.65 N ATOM 936 NH2 ARG A 74 9.055 51.814 84.720 1.00 38.53 N ATOM 937 HA ARG A 74 4.132 53.623 86.461 1.00 0.00 H ATOM 938 HB2 ARG A 74 3.860 52.425 83.677 1.00 0.00 H ATOM 939 HB3 ARG A 74 5.403 52.890 84.431 1.00 0.00 H ATOM 940 HG2 ARG A 74 4.638 51.259 86.324 1.00 0.00 H ATOM 941 HG3 ARG A 74 3.584 50.596 85.053 1.00 0.00 H ATOM 942 HD2 ARG A 74 5.619 50.397 83.585 1.00 0.00 H ATOM 943 HD3 ARG A 74 5.630 49.346 85.020 1.00 0.00 H ATOM 944 HE ARG A 74 7.109 51.115 86.103 1.00 0.00 H ATOM 945 HH12 ARG A 74 8.548 51.355 82.292 1.00 0.00 H ATOM 946 HH11 ARG A 74 6.910 50.665 82.580 1.00 0.00 H ATOM 947 HH22 ARG A 74 9.818 52.079 84.065 1.00 0.00 H ATOM 948 HH21 ARG A 74 9.176 51.956 85.743 1.00 0.00 H ATOM 949 H ARG A 74 1.819 52.481 85.082 1.00 0.00 H ATOM 950 N GLN A 75 2.869 55.170 83.851 1.00 37.51 N ATOM 951 CA GLN A 75 2.862 56.451 83.162 1.00 37.29 C ATOM 952 C GLN A 75 1.488 56.772 82.593 1.00 35.78 C ATOM 953 O GLN A 75 0.795 55.910 82.053 1.00 34.63 O ATOM 954 CB GLN A 75 3.950 56.519 82.086 1.00 41.36 C ATOM 955 CG GLN A 75 3.837 55.474 81.000 1.00 40.48 C ATOM 956 CD GLN A 75 4.877 55.657 79.908 1.00 41.39 C ATOM 957 OE1 GLN A 75 5.258 54.702 79.233 1.00 39.18 O ATOM 958 NE2 GLN A 75 5.345 56.887 79.734 1.00 43.07 N ATOM 959 HA GLN A 75 3.093 57.218 83.901 1.00 0.00 H ATOM 960 HB2 GLN A 75 3.902 57.502 81.617 1.00 0.00 H ATOM 961 HB3 GLN A 75 4.917 56.398 82.574 1.00 0.00 H ATOM 962 HG2 GLN A 75 3.969 54.489 81.447 1.00 0.00 H ATOM 963 HG3 GLN A 75 2.845 55.539 80.553 1.00 0.00 H ATOM 964 HE22 GLN A 75 4.994 57.666 80.328 1.00 0.00 H ATOM 965 HE21 GLN A 75 6.062 57.072 79.004 1.00 0.00 H ATOM 966 H GLN A 75 2.168 54.445 83.598 1.00 0.00 H ATOM 967 N GLU A 76 1.102 58.031 82.748 1.00 40.37 N ATOM 968 CA GLU A 76 -0.232 58.486 82.402 1.00 38.52 C ATOM 969 C GLU A 76 -0.478 58.344 80.906 1.00 36.65 C ATOM 970 O GLU A 76 -1.543 57.892 80.490 1.00 32.46 O ATOM 971 CB GLU A 76 -0.413 59.935 82.856 1.00 39.03 C ATOM 972 CG GLU A 76 -1.854 60.406 82.909 1.00 39.94 C ATOM 973 CD GLU A 76 -1.987 61.736 83.616 1.00 40.91 C ATOM 974 OE1 GLU A 76 -0.942 62.317 83.981 1.00 39.00 O ATOM 975 OE2 GLU A 76 -3.133 62.194 83.814 1.00 42.74 O ATOM 976 HA GLU A 76 -0.966 57.865 82.915 1.00 0.00 H ATOM 977 HB2 GLU A 76 0.014 60.035 83.854 1.00 0.00 H ATOM 978 HB3 GLU A 76 0.130 60.579 82.164 1.00 0.00 H ATOM 979 HG2 GLU A 76 -2.229 60.509 81.891 1.00 0.00 H ATOM 980 HG3 GLU A 76 -2.449 59.663 83.441 1.00 0.00 H ATOM 981 H GLU A 76 1.781 58.719 83.132 1.00 0.00 H ATOM 982 N LYS A 77 0.513 58.720 80.104 1.00 38.18 N ATOM 983 CA LYS A 77 0.424 58.557 78.656 1.00 40.23 C ATOM 984 C LYS A 77 1.537 57.661 78.125 1.00 36.82 C ATOM 985 O LYS A 77 2.708 58.045 78.111 1.00 36.88 O ATOM 986 CB LYS A 77 0.471 59.909 77.945 1.00 41.93 C ATOM 987 CG LYS A 77 0.413 59.791 76.434 1.00 43.83 C ATOM 988 CD LYS A 77 0.370 61.148 75.763 1.00 45.05 C ATOM 989 CE LYS A 77 -0.112 61.012 74.327 1.00 45.59 C ATOM 990 NZ LYS A 77 -1.403 60.263 74.271 1.00 50.81 N ATOM 991 HA LYS A 77 -0.534 58.081 78.448 1.00 0.00 H ATOM 992 HB2 LYS A 77 -0.377 60.506 78.279 1.00 0.00 H ATOM 993 HB3 LYS A 77 1.398 60.413 78.218 1.00 0.00 H ATOM 994 HG2 LYS A 77 1.296 59.254 76.088 1.00 0.00 H ATOM 995 HG3 LYS A 77 -0.481 59.232 76.158 1.00 0.00 H ATOM 996 HD2 LYS A 77 -0.311 61.799 76.311 1.00 0.00 H ATOM 997 HD3 LYS A 77 1.369 61.583 75.767 1.00 0.00 H ATOM 998 HE2 LYS A 77 0.639 60.475 73.747 1.00 0.00 H ATOM 999 HE3 LYS A 77 -0.256 62.005 73.902 1.00 0.00 H ATOM 1000 HZ1 LYS A 77 -1.269 59.313 74.672 1.00 0.00 H ATOM 1001 HZ2 LYS A 77 -2.123 60.774 74.820 1.00 0.00 H ATOM 1002 HZ3 LYS A 77 -1.713 60.182 73.282 1.00 0.00 H ATOM 1003 H LYS A 77 1.370 59.139 80.517 1.00 0.00 H ATOM 1004 N ILE A 78 1.171 56.468 77.680 1.00 33.90 N ATOM 1005 CA ILE A 78 2.157 55.552 77.126 1.00 33.92 C ATOM 1006 C ILE A 78 2.336 55.822 75.639 1.00 35.14 C ATOM 1007 O ILE A 78 1.380 55.760 74.865 1.00 34.69 O ATOM 1008 CB ILE A 78 1.771 54.093 77.370 1.00 34.60 C ATOM 1009 CG1 ILE A 78 1.858 53.786 78.868 1.00 32.20 C ATOM 1010 CG2 ILE A 78 2.677 53.164 76.563 1.00 34.02 C ATOM 1011 CD1 ILE A 78 1.113 52.556 79.287 1.00 34.28 C ATOM 1012 HA ILE A 78 3.105 55.724 77.636 1.00 0.00 H ATOM 1013 HB ILE A 78 0.746 53.927 77.040 1.00 0.00 H ATOM 1014 HG12 ILE A 78 2.908 53.656 79.130 1.00 0.00 H ATOM 1015 HG13 ILE A 78 1.451 54.636 79.416 1.00 0.00 H ATOM 1016 HD11 ILE A 78 0.057 52.672 79.045 1.00 0.00 H ATOM 1017 HD12 ILE A 78 1.515 51.692 78.759 1.00 0.00 H ATOM 1018 HD13 ILE A 78 1.227 52.412 80.361 1.00 0.00 H ATOM 1019 HG21 ILE A 78 2.572 53.388 75.501 1.00 0.00 H ATOM 1020 HG22 ILE A 78 3.713 53.315 76.867 1.00 0.00 H ATOM 1021 HG23 ILE A 78 2.390 52.129 76.747 1.00 0.00 H ATOM 1022 H ILE A 78 0.172 56.184 77.727 1.00 0.00 H ATOM 1023 N THR A 79 3.575 56.114 75.257 1.00 31.90 N ATOM 1024 CA THR A 79 3.879 56.627 73.928 1.00 37.55 C ATOM 1025 C THR A 79 4.848 55.759 73.123 1.00 40.20 C ATOM 1026 O THR A 79 5.083 56.020 71.942 1.00 35.67 O ATOM 1027 CB THR A 79 4.495 58.023 74.038 1.00 37.39 C ATOM 1028 OG1 THR A 79 5.666 57.956 74.865 1.00 39.11 O ATOM 1029 CG2 THR A 79 3.500 58.985 74.664 1.00 39.27 C ATOM 1030 HA THR A 79 2.925 56.635 73.400 1.00 0.00 H ATOM 1031 HB THR A 79 4.758 58.377 73.041 1.00 0.00 H ATOM 1032 HG1 THR A 79 6.068 58.858 74.939 1.00 0.00 H ATOM 1033 HG23 THR A 79 2.608 59.040 74.040 1.00 0.00 H ATOM 1034 HG21 THR A 79 3.228 58.629 75.658 1.00 0.00 H ATOM 1035 HG22 THR A 79 3.952 59.974 74.742 1.00 0.00 H ATOM 1036 H THR A 79 4.355 55.971 75.930 1.00 0.00 H ATOM 1037 N ARG A 80 5.429 54.742 73.748 1.00 37.11 N ATOM 1038 CA ARG A 80 6.363 53.887 73.022 1.00 32.65 C ATOM 1039 C ARG A 80 5.627 53.118 71.934 1.00 32.02 C ATOM 1040 O ARG A 80 4.435 52.841 72.054 1.00 32.17 O ATOM 1041 CB ARG A 80 7.101 52.935 73.972 1.00 33.60 C ATOM 1042 CG ARG A 80 6.195 52.099 74.844 1.00 33.59 C ATOM 1043 CD ARG A 80 6.963 50.996 75.567 1.00 32.24 C ATOM 1044 NE ARG A 80 7.434 51.454 76.864 1.00 31.23 N ATOM 1045 CZ ARG A 80 6.720 51.369 77.982 1.00 30.52 C ATOM 1046 NH1 ARG A 80 5.507 50.832 77.955 1.00 26.70 N ATOM 1047 NH2 ARG A 80 7.220 51.818 79.124 1.00 28.35 N ATOM 1048 HA ARG A 80 7.116 54.520 72.551 1.00 0.00 H ATOM 1049 HB2 ARG A 80 7.714 52.262 73.373 1.00 0.00 H ATOM 1050 HB3 ARG A 80 7.744 53.530 74.620 1.00 0.00 H ATOM 1051 HG2 ARG A 80 5.724 52.745 75.585 1.00 0.00 H ATOM 1052 HG3 ARG A 80 5.426 51.643 74.220 1.00 0.00 H ATOM 1053 HD2 ARG A 80 7.819 50.701 74.960 1.00 0.00 H ATOM 1054 HD3 ARG A 80 6.306 50.138 75.709 1.00 0.00 H ATOM 1055 HE ARG A 80 8.384 51.872 76.920 1.00 0.00 H ATOM 1056 HH12 ARG A 80 4.948 50.765 78.830 1.00 0.00 H ATOM 1057 HH11 ARG A 80 5.115 50.478 77.059 1.00 0.00 H ATOM 1058 HH22 ARG A 80 6.661 51.751 79.998 1.00 0.00 H ATOM 1059 HH21 ARG A 80 8.172 52.237 79.146 1.00 0.00 H ATOM 1060 H ARG A 80 5.220 54.556 74.750 1.00 0.00 H ATOM 1061 N THR A 81 6.338 52.791 70.859 1.00 32.32 N ATOM 1062 CA THR A 81 5.751 52.047 69.758 1.00 32.92 C ATOM 1063 C THR A 81 5.660 50.567 70.093 1.00 31.08 C ATOM 1064 O THR A 81 6.356 50.080 70.981 1.00 30.58 O ATOM 1065 CB THR A 81 6.586 52.200 68.479 1.00 33.91 C ATOM 1066 OG1 THR A 81 7.835 51.515 68.642 1.00 34.97 O ATOM 1067 CG2 THR A 81 6.851 53.673 68.188 1.00 34.10 C ATOM 1068 HA THR A 81 4.753 52.454 69.595 1.00 0.00 H ATOM 1069 HB THR A 81 6.033 51.771 67.644 1.00 0.00 H ATOM 1070 HG1 THR A 81 8.374 51.613 67.817 1.00 0.00 H ATOM 1071 HG23 THR A 81 5.902 54.194 68.064 1.00 0.00 H ATOM 1072 HG21 THR A 81 7.402 54.113 69.019 1.00 0.00 H ATOM 1073 HG22 THR A 81 7.438 53.762 67.274 1.00 0.00 H ATOM 1074 H THR A 81 7.337 53.074 70.805 1.00 0.00 H ATOM 1075 N LYS A 82 4.799 49.858 69.374 1.00 32.42 N ATOM 1076 CA LYS A 82 4.692 48.413 69.507 1.00 33.33 C ATOM 1077 C LYS A 82 6.054 47.738 69.324 1.00 34.67 C ATOM 1078 O LYS A 82 6.361 46.746 69.984 1.00 30.69 O ATOM 1079 CB LYS A 82 3.682 47.874 68.495 1.00 36.27 C ATOM 1080 CG LYS A 82 3.425 46.382 68.583 1.00 37.99 C ATOM 1081 CD LYS A 82 2.283 45.993 67.659 1.00 42.99 C ATOM 1082 CE LYS A 82 1.999 44.497 67.683 1.00 47.86 C ATOM 1083 NZ LYS A 82 0.933 44.116 66.703 1.00 41.80 N ATOM 1084 HA LYS A 82 4.344 48.183 70.514 1.00 0.00 H ATOM 1085 HB2 LYS A 82 2.735 48.391 68.653 1.00 0.00 H ATOM 1086 HB3 LYS A 82 4.053 48.096 67.494 1.00 0.00 H ATOM 1087 HG2 LYS A 82 4.326 45.843 68.290 1.00 0.00 H ATOM 1088 HG3 LYS A 82 3.164 46.121 69.609 1.00 0.00 H ATOM 1089 HD2 LYS A 82 1.384 46.525 67.970 1.00 0.00 H ATOM 1090 HD3 LYS A 82 2.542 46.284 66.641 1.00 0.00 H ATOM 1091 HE2 LYS A 82 1.674 44.216 68.685 1.00 0.00 H ATOM 1092 HE3 LYS A 82 2.915 43.960 67.435 1.00 0.00 H ATOM 1093 HZ1 LYS A 82 0.053 44.619 66.937 1.00 0.00 H ATOM 1094 HZ2 LYS A 82 1.238 44.375 65.743 1.00 0.00 H ATOM 1095 HZ3 LYS A 82 0.770 43.090 66.751 1.00 0.00 H ATOM 1096 H LYS A 82 4.183 50.350 68.696 1.00 0.00 H ATOM 1097 N GLU A 83 6.872 48.287 68.432 1.00 33.86 N ATOM 1098 CA GLU A 83 8.204 47.749 68.189 1.00 32.91 C ATOM 1099 C GLU A 83 9.119 47.946 69.398 1.00 30.78 C ATOM 1100 O GLU A 83 9.895 47.057 69.759 1.00 29.46 O ATOM 1101 CB GLU A 83 8.813 48.400 66.943 1.00 36.04 C ATOM 1102 CG GLU A 83 8.119 48.017 65.633 1.00 42.90 C ATOM 1103 CD GLU A 83 6.704 48.588 65.490 1.00 45.22 C ATOM 1104 OE1 GLU A 83 6.404 49.650 66.084 1.00 36.43 O ATOM 1105 OE2 GLU A 83 5.893 47.971 64.761 1.00 51.30 O ATOM 1106 HA GLU A 83 8.109 46.676 68.021 1.00 0.00 H ATOM 1107 HB2 GLU A 83 8.753 49.482 67.058 1.00 0.00 H ATOM 1108 HB3 GLU A 83 9.859 48.100 66.877 1.00 0.00 H ATOM 1109 HG2 GLU A 83 8.723 48.385 64.804 1.00 0.00 H ATOM 1110 HG3 GLU A 83 8.058 46.930 65.582 1.00 0.00 H ATOM 1111 H GLU A 83 6.554 49.119 67.895 1.00 0.00 H ATOM 1112 N GLU A 84 9.022 49.112 70.026 1.00 29.55 N ATOM 1113 CA GLU A 84 9.814 49.413 71.213 1.00 31.21 C ATOM 1114 C GLU A 84 9.363 48.570 72.409 1.00 28.11 C ATOM 1115 O GLU A 84 10.181 48.150 73.218 1.00 28.05 O ATOM 1116 CB GLU A 84 9.734 50.902 71.554 1.00 32.89 C ATOM 1117 CG GLU A 84 10.304 51.807 70.473 1.00 39.44 C ATOM 1118 CD GLU A 84 10.038 53.277 70.743 1.00 43.19 C ATOM 1119 OE1 GLU A 84 8.978 53.596 71.326 1.00 39.35 O ATOM 1120 OE2 GLU A 84 10.885 54.113 70.359 1.00 45.51 O ATOM 1121 HA GLU A 84 10.851 49.161 70.991 1.00 0.00 H ATOM 1122 HB2 GLU A 84 8.687 51.165 71.707 1.00 0.00 H ATOM 1123 HB3 GLU A 84 10.289 51.075 72.476 1.00 0.00 H ATOM 1124 HG2 GLU A 84 11.381 51.651 70.419 1.00 0.00 H ATOM 1125 HG3 GLU A 84 9.851 51.539 69.518 1.00 0.00 H ATOM 1126 H GLU A 84 8.364 49.830 69.662 1.00 0.00 H ATOM 1127 N ALA A 85 8.061 48.319 72.498 1.00 25.54 N ATOM 1128 CA ALA A 85 7.515 47.454 73.537 1.00 28.38 C ATOM 1129 C ALA A 85 8.055 46.033 73.401 1.00 26.82 C ATOM 1130 O ALA A 85 8.372 45.380 74.398 1.00 24.10 O ATOM 1131 CB ALA A 85 5.995 47.452 73.486 1.00 27.54 C ATOM 1132 HA ALA A 85 7.829 47.847 74.504 1.00 0.00 H ATOM 1133 HB1 ALA A 85 5.626 48.466 73.640 1.00 0.00 H ATOM 1134 HB2 ALA A 85 5.666 47.088 72.513 1.00 0.00 H ATOM 1135 HB3 ALA A 85 5.607 46.801 74.269 1.00 0.00 H ATOM 1136 H ALA A 85 7.414 48.751 71.808 1.00 0.00 H ATOM 1137 N LEU A 86 8.144 45.556 72.165 1.00 27.25 N ATOM 1138 CA LEU A 86 8.631 44.204 71.911 1.00 27.32 C ATOM 1139 C LEU A 86 10.100 44.074 72.304 1.00 25.26 C ATOM 1140 O LEU A 86 10.514 43.040 72.826 1.00 24.24 O ATOM 1141 CB LEU A 86 8.434 43.815 70.444 1.00 22.80 C ATOM 1142 CG LEU A 86 8.810 42.373 70.084 1.00 24.03 C ATOM 1143 CD1 LEU A 86 8.200 41.382 71.070 1.00 26.01 C ATOM 1144 CD2 LEU A 86 8.385 42.041 68.648 1.00 25.27 C ATOM 1145 HA LEU A 86 8.047 43.519 72.526 1.00 0.00 H ATOM 1146 HB2 LEU A 86 7.382 43.959 70.197 1.00 0.00 H ATOM 1147 HB3 LEU A 86 9.044 44.483 69.835 1.00 0.00 H ATOM 1148 HG LEU A 86 9.895 42.285 70.149 1.00 0.00 H ATOM 1149 HD21 LEU A 86 7.305 42.157 68.554 1.00 0.00 H ATOM 1150 HD22 LEU A 86 8.886 42.718 67.956 1.00 0.00 H ATOM 1151 HD23 LEU A 86 8.663 41.013 68.417 1.00 0.00 H ATOM 1152 HD11 LEU A 86 8.567 41.598 72.074 1.00 0.00 H ATOM 1153 HD12 LEU A 86 7.114 41.474 71.051 1.00 0.00 H ATOM 1154 HD13 LEU A 86 8.485 40.368 70.788 1.00 0.00 H ATOM 1155 H LEU A 86 7.862 46.156 71.364 1.00 0.00 H ATOM 1156 N GLU A 87 10.883 45.121 72.061 1.00 25.61 N ATOM 1157 CA GLU A 87 12.291 45.115 72.451 1.00 27.40 C ATOM 1158 C GLU A 87 12.453 45.012 73.957 1.00 27.69 C ATOM 1159 O GLU A 87 13.330 44.296 74.450 1.00 26.39 O ATOM 1160 CB GLU A 87 13.017 46.356 71.930 1.00 29.11 C ATOM 1161 CG GLU A 87 13.218 46.340 70.431 1.00 37.90 C ATOM 1162 CD GLU A 87 13.750 45.005 69.951 1.00 43.54 C ATOM 1163 OE1 GLU A 87 14.734 44.510 70.548 1.00 48.52 O ATOM 1164 OE2 GLU A 87 13.182 44.447 68.985 1.00 50.31 O ATOM 1165 HA GLU A 87 12.742 44.232 71.997 1.00 0.00 H ATOM 1166 HB2 GLU A 87 12.431 47.237 72.192 1.00 0.00 H ATOM 1167 HB3 GLU A 87 13.994 46.414 72.411 1.00 0.00 H ATOM 1168 HG2 GLU A 87 12.263 46.536 69.944 1.00 0.00 H ATOM 1169 HG3 GLU A 87 13.928 47.121 70.161 1.00 0.00 H ATOM 1170 H GLU A 87 10.487 45.957 71.586 1.00 0.00 H ATOM 1171 N LEU A 88 11.616 45.744 74.686 1.00 25.45 N ATOM 1172 CA LEU A 88 11.606 45.686 76.143 1.00 25.76 C ATOM 1173 C LEU A 88 11.249 44.286 76.622 1.00 22.14 C ATOM 1174 O LEU A 88 11.934 43.714 77.480 1.00 23.28 O ATOM 1175 CB LEU A 88 10.606 46.702 76.711 1.00 27.56 C ATOM 1176 CG LEU A 88 11.018 48.173 76.552 1.00 30.69 C ATOM 1177 CD1 LEU A 88 9.879 49.102 76.945 1.00 31.24 C ATOM 1178 CD2 LEU A 88 12.269 48.477 77.364 1.00 31.25 C ATOM 1179 HA LEU A 88 12.606 45.934 76.500 1.00 0.00 H ATOM 1180 HB2 LEU A 88 9.653 46.560 76.202 1.00 0.00 H ATOM 1181 HB3 LEU A 88 10.482 46.498 77.775 1.00 0.00 H ATOM 1182 HG LEU A 88 11.247 48.346 75.500 1.00 0.00 H ATOM 1183 HD21 LEU A 88 12.074 48.279 78.418 1.00 0.00 H ATOM 1184 HD22 LEU A 88 13.087 47.844 77.020 1.00 0.00 H ATOM 1185 HD23 LEU A 88 12.539 49.525 77.234 1.00 0.00 H ATOM 1186 HD11 LEU A 88 9.017 48.908 76.307 1.00 0.00 H ATOM 1187 HD12 LEU A 88 9.609 48.924 77.986 1.00 0.00 H ATOM 1188 HD13 LEU A 88 10.198 50.137 76.823 1.00 0.00 H ATOM 1189 H LEU A 88 10.948 46.377 74.202 1.00 0.00 H ATOM 1190 N ILE A 89 10.176 43.737 76.064 1.00 22.43 N ATOM 1191 CA ILE A 89 9.736 42.390 76.406 1.00 22.59 C ATOM 1192 C ILE A 89 10.865 41.384 76.171 1.00 24.44 C ATOM 1193 O ILE A 89 11.143 40.534 77.016 1.00 21.83 O ATOM 1194 CB ILE A 89 8.486 41.990 75.604 1.00 23.84 C ATOM 1195 CG1 ILE A 89 7.234 42.668 76.178 1.00 20.62 C ATOM 1196 CG2 ILE A 89 8.288 40.488 75.629 1.00 22.65 C ATOM 1197 CD1 ILE A 89 6.799 42.109 77.533 1.00 20.89 C ATOM 1198 HA ILE A 89 9.472 42.382 77.464 1.00 0.00 H ATOM 1199 HB ILE A 89 8.637 42.317 74.575 1.00 0.00 H ATOM 1200 HG12 ILE A 89 7.441 43.732 76.295 1.00 0.00 H ATOM 1201 HG13 ILE A 89 6.415 42.534 75.471 1.00 0.00 H ATOM 1202 HD11 ILE A 89 6.576 41.047 77.432 1.00 0.00 H ATOM 1203 HD12 ILE A 89 7.603 42.246 78.256 1.00 0.00 H ATOM 1204 HD13 ILE A 89 5.909 42.638 77.874 1.00 0.00 H ATOM 1205 HG21 ILE A 89 9.159 40.001 75.190 1.00 0.00 H ATOM 1206 HG22 ILE A 89 8.166 40.156 76.660 1.00 0.00 H ATOM 1207 HG23 ILE A 89 7.398 40.231 75.055 1.00 0.00 H ATOM 1208 H ILE A 89 9.635 44.283 75.364 1.00 0.00 H ATOM 1209 N ASN A 90 11.517 41.496 75.019 1.00 22.72 N ATOM 1210 CA ASN A 90 12.611 40.596 74.672 1.00 23.07 C ATOM 1211 C ASN A 90 13.760 40.710 75.669 1.00 23.36 C ATOM 1212 O ASN A 90 14.345 39.703 76.072 1.00 22.87 O ATOM 1213 CB ASN A 90 13.099 40.872 73.244 1.00 22.98 C ATOM 1214 CG ASN A 90 12.163 40.317 72.186 1.00 25.68 C ATOM 1215 OD1 ASN A 90 11.346 39.441 72.464 1.00 29.56 O ATOM 1216 ND2 ASN A 90 12.280 40.823 70.963 1.00 31.89 N ATOM 1217 HA ASN A 90 12.234 39.574 74.718 1.00 0.00 H ATOM 1218 HB2 ASN A 90 13.181 41.950 73.106 1.00 0.00 H ATOM 1219 HB3 ASN A 90 14.080 40.415 73.116 1.00 0.00 H ATOM 1220 HD22 ASN A 90 12.985 41.563 70.772 1.00 0.00 H ATOM 1221 HD21 ASN A 90 11.667 40.479 70.197 1.00 0.00 H ATOM 1222 H ASN A 90 11.241 42.242 74.349 1.00 0.00 H ATOM 1223 N GLY A 91 14.068 41.942 76.067 1.00 23.65 N ATOM 1224 CA GLY A 91 15.076 42.209 77.078 1.00 22.36 C ATOM 1225 C GLY A 91 14.765 41.595 78.430 1.00 25.99 C ATOM 1226 O GLY A 91 15.654 41.061 79.092 1.00 23.43 O ATOM 1227 HA3 GLY A 91 15.161 43.289 77.202 1.00 0.00 H ATOM 1228 HA2 GLY A 91 16.028 41.808 76.729 1.00 0.00 H ATOM 1229 H GLY A 91 13.567 42.746 75.637 1.00 0.00 H ATOM 1230 N TYR A 92 13.505 41.663 78.849 1.00 21.98 N ATOM 1231 CA TYR A 92 13.112 41.093 80.133 1.00 21.78 C ATOM 1232 C TYR A 92 13.210 39.577 80.073 1.00 19.95 C ATOM 1233 O TYR A 92 13.631 38.938 81.030 1.00 20.37 O ATOM 1234 CB TYR A 92 11.682 41.489 80.505 1.00 21.94 C ATOM 1235 CG TYR A 92 11.454 42.974 80.678 1.00 22.69 C ATOM 1236 CD1 TYR A 92 12.425 43.785 81.249 1.00 22.04 C ATOM 1237 CD2 TYR A 92 10.249 43.554 80.308 1.00 21.63 C ATOM 1238 CE1 TYR A 92 12.211 45.144 81.423 1.00 26.57 C ATOM 1239 CE2 TYR A 92 10.028 44.908 80.470 1.00 24.49 C ATOM 1240 CZ TYR A 92 11.006 45.696 81.028 1.00 25.98 C ATOM 1241 OH TYR A 92 10.782 47.043 81.191 1.00 28.73 O ATOM 1242 HA TYR A 92 13.788 41.484 80.894 1.00 0.00 H ATOM 1243 HB3 TYR A 92 11.428 40.996 81.443 1.00 0.00 H ATOM 1244 HB2 TYR A 92 11.017 41.134 79.718 1.00 0.00 H ATOM 1245 HD2 TYR A 92 9.463 42.930 79.882 1.00 0.00 H ATOM 1246 HE2 TYR A 92 9.082 45.349 80.157 1.00 0.00 H ATOM 1247 HE1 TYR A 92 12.985 45.771 81.867 1.00 0.00 H ATOM 1248 HD1 TYR A 92 13.371 43.346 81.566 1.00 0.00 H ATOM 1249 HH TYR A 92 11.579 47.461 81.603 1.00 0.00 H ATOM 1250 H TYR A 92 12.790 42.129 78.254 1.00 0.00 H ATOM 1251 N ILE A 93 12.801 39.003 78.948 1.00 18.10 N ATOM 1252 CA ILE A 93 12.886 37.559 78.776 1.00 20.36 C ATOM 1253 C ILE A 93 14.343 37.103 78.879 1.00 21.16 C ATOM 1254 O ILE A 93 14.636 36.089 79.508 1.00 18.93 O ATOM 1255 CB ILE A 93 12.269 37.107 77.438 1.00 22.06 C ATOM 1256 CG1 ILE A 93 10.743 37.224 77.499 1.00 19.72 C ATOM 1257 CG2 ILE A 93 12.657 35.672 77.119 1.00 22.15 C ATOM 1258 CD1 ILE A 93 10.064 36.922 76.188 1.00 22.99 C ATOM 1259 HA ILE A 93 12.309 37.091 79.574 1.00 0.00 H ATOM 1260 HB ILE A 93 12.653 37.755 76.650 1.00 0.00 H ATOM 1261 HG12 ILE A 93 10.373 36.525 78.249 1.00 0.00 H ATOM 1262 HG13 ILE A 93 10.486 38.241 77.795 1.00 0.00 H ATOM 1263 HD11 ILE A 93 10.415 37.621 75.429 1.00 0.00 H ATOM 1264 HD12 ILE A 93 10.302 35.903 75.883 1.00 0.00 H ATOM 1265 HD13 ILE A 93 8.985 37.025 76.307 1.00 0.00 H ATOM 1266 HG21 ILE A 93 13.742 35.598 77.048 1.00 0.00 H ATOM 1267 HG22 ILE A 93 12.297 35.015 77.911 1.00 0.00 H ATOM 1268 HG23 ILE A 93 12.209 35.378 76.170 1.00 0.00 H ATOM 1269 H ILE A 93 12.416 39.591 78.181 1.00 0.00 H ATOM 1270 N GLN A 94 15.251 37.860 78.269 1.00 19.65 N ATOM 1271 CA GLN A 94 16.677 37.543 78.339 1.00 23.62 C ATOM 1272 C GLN A 94 17.177 37.573 79.777 1.00 24.26 C ATOM 1273 O GLN A 94 17.908 36.682 80.203 1.00 22.95 O ATOM 1274 CB GLN A 94 17.498 38.498 77.468 1.00 23.22 C ATOM 1275 CG GLN A 94 17.439 38.181 75.989 1.00 27.71 C ATOM 1276 CD GLN A 94 18.345 39.081 75.162 1.00 37.54 C ATOM 1277 OE1 GLN A 94 18.460 40.280 75.427 1.00 39.67 O ATOM 1278 NE2 GLN A 94 18.992 38.504 74.154 1.00 37.66 N ATOM 1279 HA GLN A 94 16.807 36.532 77.954 1.00 0.00 H ATOM 1280 HB2 GLN A 94 17.121 39.510 77.618 1.00 0.00 H ATOM 1281 HB3 GLN A 94 18.538 38.448 77.789 1.00 0.00 H ATOM 1282 HG2 GLN A 94 17.745 37.146 75.841 1.00 0.00 H ATOM 1283 HG3 GLN A 94 16.412 38.307 75.645 1.00 0.00 H ATOM 1284 HE22 GLN A 94 18.865 37.489 73.967 1.00 0.00 H ATOM 1285 HE21 GLN A 94 19.626 39.068 73.552 1.00 0.00 H ATOM 1286 H GLN A 94 14.940 38.694 77.731 1.00 0.00 H ATOM 1287 N LYS A 95 16.763 38.593 80.522 1.00 20.06 N ATOM 1288 CA LYS A 95 17.144 38.742 81.918 1.00 26.44 C ATOM 1289 C LYS A 95 16.617 37.589 82.771 1.00 22.55 C ATOM 1290 O LYS A 95 17.297 37.108 83.682 1.00 23.92 O ATOM 1291 CB LYS A 95 16.605 40.071 82.454 1.00 28.31 C ATOM 1292 CG LYS A 95 17.544 40.781 83.396 1.00 42.09 C ATOM 1293 CD LYS A 95 18.812 41.184 82.668 1.00 39.37 C ATOM 1294 CE LYS A 95 18.529 42.257 81.632 1.00 46.18 C ATOM 1295 NZ LYS A 95 18.139 43.555 82.257 1.00 50.76 N ATOM 1296 HA LYS A 95 18.232 38.729 81.976 1.00 0.00 H ATOM 1297 HB2 LYS A 95 16.408 40.728 81.607 1.00 0.00 H ATOM 1298 HB3 LYS A 95 15.673 39.874 82.983 1.00 0.00 H ATOM 1299 HG2 LYS A 95 17.055 41.673 83.788 1.00 0.00 H ATOM 1300 HG3 LYS A 95 17.798 40.115 84.221 1.00 0.00 H ATOM 1301 HD2 LYS A 95 19.532 41.568 83.391 1.00 0.00 H ATOM 1302 HD3 LYS A 95 19.230 40.309 82.170 1.00 0.00 H ATOM 1303 HE2 LYS A 95 17.717 41.919 80.989 1.00 0.00 H ATOM 1304 HE3 LYS A 95 19.426 42.411 81.032 1.00 0.00 H ATOM 1305 HZ1 LYS A 95 17.279 43.420 82.826 1.00 0.00 H ATOM 1306 HZ2 LYS A 95 18.911 43.890 82.868 1.00 0.00 H ATOM 1307 HZ3 LYS A 95 17.956 44.256 81.511 1.00 0.00 H ATOM 1308 H LYS A 95 16.145 39.310 80.092 1.00 0.00 H ATOM 1309 N ILE A 96 15.395 37.156 82.482 1.00 20.90 N ATOM 1310 CA ILE A 96 14.769 36.074 83.230 1.00 21.62 C ATOM 1311 C ILE A 96 15.458 34.748 82.917 1.00 19.93 C ATOM 1312 O ILE A 96 15.841 34.013 83.825 1.00 20.89 O ATOM 1313 CB ILE A 96 13.256 35.985 82.925 1.00 18.42 C ATOM 1314 CG1 ILE A 96 12.515 37.194 83.508 1.00 18.40 C ATOM 1315 CG2 ILE A 96 12.657 34.699 83.465 1.00 20.75 C ATOM 1316 CD1 ILE A 96 11.148 37.406 82.877 1.00 21.89 C ATOM 1317 HA ILE A 96 14.882 36.287 84.293 1.00 0.00 H ATOM 1318 HB ILE A 96 13.139 35.986 81.841 1.00 0.00 H ATOM 1319 HG12 ILE A 96 12.385 37.040 84.579 1.00 0.00 H ATOM 1320 HG13 ILE A 96 13.118 38.086 83.341 1.00 0.00 H ATOM 1321 HD11 ILE A 96 11.265 37.571 81.806 1.00 0.00 H ATOM 1322 HD12 ILE A 96 10.531 36.523 83.045 1.00 0.00 H ATOM 1323 HD13 ILE A 96 10.671 38.275 83.330 1.00 0.00 H ATOM 1324 HG21 ILE A 96 13.154 33.846 83.003 1.00 0.00 H ATOM 1325 HG22 ILE A 96 12.796 34.661 84.545 1.00 0.00 H ATOM 1326 HG23 ILE A 96 11.592 34.670 83.233 1.00 0.00 H ATOM 1327 H ILE A 96 14.871 37.601 81.701 1.00 0.00 H ATOM 1328 N LYS A 97 15.649 34.466 81.633 1.00 18.47 N ATOM 1329 CA LYS A 97 16.281 33.215 81.219 1.00 20.59 C ATOM 1330 C LYS A 97 17.729 33.068 81.696 1.00 20.69 C ATOM 1331 O LYS A 97 18.181 31.961 81.961 1.00 24.00 O ATOM 1332 CB LYS A 97 16.215 33.047 79.705 1.00 20.21 C ATOM 1333 CG LYS A 97 14.852 32.616 79.211 1.00 21.83 C ATOM 1334 CD LYS A 97 14.962 32.008 77.832 1.00 23.15 C ATOM 1335 CE LYS A 97 13.639 31.435 77.389 1.00 25.10 C ATOM 1336 NZ LYS A 97 13.725 30.812 76.036 1.00 22.57 N ATOM 1337 HA LYS A 97 15.709 32.424 81.704 1.00 0.00 H ATOM 1338 HB2 LYS A 97 16.467 34.000 79.239 1.00 0.00 H ATOM 1339 HB3 LYS A 97 16.945 32.294 79.408 1.00 0.00 H ATOM 1340 HG2 LYS A 97 14.437 31.878 79.898 1.00 0.00 H ATOM 1341 HG3 LYS A 97 14.193 33.483 79.170 1.00 0.00 H ATOM 1342 HD2 LYS A 97 15.272 32.778 77.126 1.00 0.00 H ATOM 1343 HD3 LYS A 97 15.707 31.213 77.851 1.00 0.00 H ATOM 1344 HE2 LYS A 97 12.900 32.236 77.362 1.00 0.00 H ATOM 1345 HE3 LYS A 97 13.325 30.677 78.107 1.00 0.00 H ATOM 1346 HZ1 LYS A 97 14.017 31.530 75.343 1.00 0.00 H ATOM 1347 HZ2 LYS A 97 14.424 30.042 76.054 1.00 0.00 H ATOM 1348 HZ3 LYS A 97 12.794 30.431 75.771 1.00 0.00 H ATOM 1349 H LYS A 97 15.343 35.148 80.909 1.00 0.00 H ATOM 1350 N SER A 98 18.448 34.177 81.798 1.00 22.97 N ATOM 1351 CA SER A 98 19.840 34.134 82.246 1.00 23.48 C ATOM 1352 C SER A 98 19.946 34.082 83.769 1.00 24.14 C ATOM 1353 O SER A 98 21.024 33.851 84.316 1.00 25.37 O ATOM 1354 CB SER A 98 20.594 35.350 81.724 1.00 26.12 C ATOM 1355 OG SER A 98 20.154 36.527 82.371 1.00 27.29 O ATOM 1356 HA SER A 98 20.284 33.223 81.846 1.00 0.00 H ATOM 1357 HB2 SER A 98 20.422 35.445 80.652 1.00 0.00 H ATOM 1358 HB3 SER A 98 21.660 35.217 81.909 1.00 0.00 H ATOM 1359 HG SER A 98 20.656 37.304 82.018 1.00 0.00 H ATOM 1360 H SER A 98 18.016 35.092 81.556 1.00 0.00 H ATOM 1361 N GLY A 99 18.829 34.307 84.452 1.00 23.50 N ATOM 1362 CA GLY A 99 18.809 34.297 85.906 1.00 24.47 C ATOM 1363 C GLY A 99 19.276 35.608 86.503 1.00 27.78 C ATOM 1364 O GLY A 99 19.339 35.755 87.727 1.00 28.24 O ATOM 1365 HA3 GLY A 99 19.463 33.500 86.259 1.00 0.00 H ATOM 1366 HA2 GLY A 99 17.790 34.104 86.240 1.00 0.00 H ATOM 1367 H GLY A 99 17.947 34.495 83.934 1.00 0.00 H ATOM 1368 N GLU A 100 19.592 36.568 85.639 1.00 24.39 N ATOM 1369 CA GLU A 100 20.060 37.880 86.073 1.00 31.08 C ATOM 1370 C GLU A 100 19.000 38.599 86.911 1.00 31.89 C ATOM 1371 O GLU A 100 19.321 39.285 87.881 1.00 33.52 O ATOM 1372 CB GLU A 100 20.478 38.727 84.863 1.00 31.05 C ATOM 1373 CG GLU A 100 21.739 38.207 84.162 1.00 38.83 C ATOM 1374 CD GLU A 100 22.142 39.015 82.928 1.00 46.15 C ATOM 1375 OE1 GLU A 100 21.440 38.949 81.890 1.00 42.37 O ATOM 1376 OE2 GLU A 100 23.187 39.700 82.991 1.00 53.73 O ATOM 1377 HA GLU A 100 20.934 37.736 86.708 1.00 0.00 H ATOM 1378 HB2 GLU A 100 19.659 38.730 84.144 1.00 0.00 H ATOM 1379 HB3 GLU A 100 20.666 39.746 85.202 1.00 0.00 H ATOM 1380 HG2 GLU A 100 22.564 38.234 84.874 1.00 0.00 H ATOM 1381 HG3 GLU A 100 21.560 37.177 83.854 1.00 0.00 H ATOM 1382 H GLU A 100 19.503 36.377 84.621 1.00 0.00 H ATOM 1383 N GLU A 101 17.737 38.424 86.534 1.00 27.49 N ATOM 1384 CA GLU A 101 16.609 38.970 87.279 1.00 31.94 C ATOM 1385 C GLU A 101 15.494 37.941 87.281 1.00 30.78 C ATOM 1386 O GLU A 101 15.358 37.163 86.340 1.00 32.99 O ATOM 1387 CB GLU A 101 16.108 40.262 86.635 1.00 35.61 C ATOM 1388 CG GLU A 101 16.804 41.524 87.111 1.00 41.39 C ATOM 1389 CD GLU A 101 16.044 42.225 88.218 1.00 42.21 C ATOM 1390 OE1 GLU A 101 15.601 41.540 89.164 1.00 50.02 O ATOM 1391 OE2 GLU A 101 15.886 43.464 88.142 1.00 46.57 O ATOM 1392 HA GLU A 101 16.925 39.197 88.297 1.00 0.00 H ATOM 1393 HB2 GLU A 101 16.251 40.182 85.557 1.00 0.00 H ATOM 1394 HB3 GLU A 101 15.044 40.359 86.852 1.00 0.00 H ATOM 1395 HG2 GLU A 101 17.795 41.259 87.481 1.00 0.00 H ATOM 1396 HG3 GLU A 101 16.903 42.208 86.268 1.00 0.00 H ATOM 1397 H GLU A 101 17.546 37.875 85.672 1.00 0.00 H ATOM 1398 N ASP A 102 14.697 37.926 88.337 1.00 26.75 N ATOM 1399 CA ASP A 102 13.589 36.989 88.395 1.00 28.21 C ATOM 1400 C ASP A 102 12.319 37.630 87.842 1.00 25.57 C ATOM 1401 O ASP A 102 12.165 38.856 87.857 1.00 24.38 O ATOM 1402 CB ASP A 102 13.365 36.518 89.821 1.00 34.23 C ATOM 1403 CG ASP A 102 12.784 37.593 90.696 1.00 37.28 C ATOM 1404 OD1 ASP A 102 13.549 38.478 91.138 1.00 44.84 O ATOM 1405 OD2 ASP A 102 11.563 37.545 90.960 1.00 43.52 O ATOM 1406 HA ASP A 102 13.837 36.124 87.780 1.00 0.00 H ATOM 1407 HB2 ASP A 102 12.680 35.670 89.806 1.00 0.00 H ATOM 1408 HB3 ASP A 102 14.321 36.204 90.240 1.00 0.00 H ATOM 1409 H ASP A 102 14.864 38.584 89.125 1.00 0.00 H ATOM 1410 N PHE A 103 11.417 36.789 87.357 1.00 22.24 N ATOM 1411 CA PHE A 103 10.174 37.256 86.757 1.00 23.32 C ATOM 1412 C PHE A 103 9.428 38.204 87.699 1.00 23.84 C ATOM 1413 O PHE A 103 9.051 39.311 87.317 1.00 20.58 O ATOM 1414 CB PHE A 103 9.281 36.070 86.397 1.00 24.37 C ATOM 1415 CG PHE A 103 7.902 36.465 85.964 1.00 25.94 C ATOM 1416 CD1 PHE A 103 6.897 36.654 86.905 1.00 28.06 C ATOM 1417 CD2 PHE A 103 7.614 36.671 84.623 1.00 29.14 C ATOM 1418 CE1 PHE A 103 5.629 37.028 86.513 1.00 28.91 C ATOM 1419 CE2 PHE A 103 6.348 37.042 84.222 1.00 26.40 C ATOM 1420 CZ PHE A 103 5.354 37.224 85.174 1.00 24.16 C ATOM 1421 HA PHE A 103 10.425 37.804 85.849 1.00 0.00 H ATOM 1422 HB2 PHE A 103 9.753 35.518 85.584 1.00 0.00 H ATOM 1423 HB3 PHE A 103 9.196 35.425 87.271 1.00 0.00 H ATOM 1424 HD2 PHE A 103 8.398 36.538 83.877 1.00 0.00 H ATOM 1425 HE2 PHE A 103 6.129 37.191 83.165 1.00 0.00 H ATOM 1426 HZ PHE A 103 4.353 37.523 84.863 1.00 0.00 H ATOM 1427 HE1 PHE A 103 4.846 37.169 87.258 1.00 0.00 H ATOM 1428 HD1 PHE A 103 7.113 36.505 87.963 1.00 0.00 H ATOM 1429 H PHE A 103 11.602 35.767 87.406 1.00 0.00 H ATOM 1430 N GLU A 104 9.227 37.759 88.933 1.00 25.73 N ATOM 1431 CA GLU A 104 8.463 38.520 89.923 1.00 25.74 C ATOM 1432 C GLU A 104 8.998 39.934 90.141 1.00 24.29 C ATOM 1433 O GLU A 104 8.225 40.881 90.301 1.00 22.98 O ATOM 1434 CB GLU A 104 8.431 37.769 91.260 1.00 25.23 C ATOM 1435 CG GLU A 104 7.662 36.456 91.229 1.00 26.93 C ATOM 1436 CD GLU A 104 8.529 35.258 90.877 1.00 29.03 C ATOM 1437 OE1 GLU A 104 9.634 35.444 90.317 1.00 27.16 O ATOM 1438 OE2 GLU A 104 8.098 34.123 91.170 1.00 32.09 O ATOM 1439 HA GLU A 104 7.454 38.619 89.522 1.00 0.00 H ATOM 1440 HB2 GLU A 104 9.458 37.555 91.555 1.00 0.00 H ATOM 1441 HB3 GLU A 104 7.968 38.417 92.004 1.00 0.00 H ATOM 1442 HG2 GLU A 104 7.223 36.289 92.213 1.00 0.00 H ATOM 1443 HG3 GLU A 104 6.867 36.538 90.487 1.00 0.00 H ATOM 1444 H GLU A 104 9.626 36.838 89.206 1.00 0.00 H ATOM 1445 N SER A 105 10.320 40.066 90.167 1.00 24.84 N ATOM 1446 CA SER A 105 10.971 41.352 90.386 1.00 27.86 C ATOM 1447 C SER A 105 10.737 42.283 89.204 1.00 24.58 C ATOM 1448 O SER A 105 10.455 43.470 89.381 1.00 22.79 O ATOM 1449 CB SER A 105 12.472 41.160 90.610 1.00 32.71 C ATOM 1450 OG SER A 105 13.151 42.405 90.667 1.00 36.67 O ATOM 1451 HA SER A 105 10.536 41.805 91.277 1.00 0.00 H ATOM 1452 HB2 SER A 105 12.881 40.570 89.789 1.00 0.00 H ATOM 1453 HB3 SER A 105 12.626 40.629 91.549 1.00 0.00 H ATOM 1454 HG SER A 105 13.020 42.890 89.814 1.00 0.00 H ATOM 1455 H SER A 105 10.911 39.222 90.026 1.00 0.00 H ATOM 1456 N LEU A 106 10.850 41.743 87.997 1.00 22.57 N ATOM 1457 CA LEU A 106 10.610 42.540 86.798 1.00 22.17 C ATOM 1458 C LEU A 106 9.139 42.933 86.680 1.00 17.62 C ATOM 1459 O LEU A 106 8.825 44.049 86.277 1.00 22.35 O ATOM 1460 CB LEU A 106 11.078 41.795 85.545 1.00 20.28 C ATOM 1461 CG LEU A 106 12.581 41.505 85.474 1.00 22.14 C ATOM 1462 CD1 LEU A 106 12.934 40.722 84.214 1.00 21.79 C ATOM 1463 CD2 LEU A 106 13.381 42.794 85.541 1.00 23.07 C ATOM 1464 HA LEU A 106 11.193 43.457 86.886 1.00 0.00 H ATOM 1465 HB2 LEU A 106 10.549 40.843 85.503 1.00 0.00 H ATOM 1466 HB3 LEU A 106 10.810 42.397 84.676 1.00 0.00 H ATOM 1467 HG LEU A 106 12.842 40.891 86.336 1.00 0.00 H ATOM 1468 HD21 LEU A 106 13.106 43.435 84.703 1.00 0.00 H ATOM 1469 HD22 LEU A 106 13.165 43.306 86.479 1.00 0.00 H ATOM 1470 HD23 LEU A 106 14.445 42.563 85.489 1.00 0.00 H ATOM 1471 HD11 LEU A 106 12.396 39.774 84.214 1.00 0.00 H ATOM 1472 HD12 LEU A 106 12.650 41.302 83.336 1.00 0.00 H ATOM 1473 HD13 LEU A 106 14.007 40.533 84.194 1.00 0.00 H ATOM 1474 H LEU A 106 11.112 40.741 87.904 1.00 0.00 H ATOM 1475 N ALA A 107 8.239 42.017 87.022 1.00 20.07 N ATOM 1476 CA ALA A 107 6.814 42.312 86.942 1.00 21.39 C ATOM 1477 C ALA A 107 6.445 43.450 87.889 1.00 23.33 C ATOM 1478 O ALA A 107 5.716 44.371 87.511 1.00 19.33 O ATOM 1479 CB ALA A 107 5.979 41.075 87.224 1.00 19.37 C ATOM 1480 HA ALA A 107 6.594 42.632 85.924 1.00 0.00 H ATOM 1481 HB1 ALA A 107 6.216 40.303 86.492 1.00 0.00 H ATOM 1482 HB2 ALA A 107 6.203 40.708 88.226 1.00 0.00 H ATOM 1483 HB3 ALA A 107 4.921 41.329 87.156 1.00 0.00 H ATOM 1484 H ALA A 107 8.554 41.082 87.350 1.00 0.00 H ATOM 1485 N SER A 108 6.962 43.395 89.114 1.00 21.20 N ATOM 1486 CA SER A 108 6.694 44.448 90.090 1.00 21.93 C ATOM 1487 C SER A 108 7.191 45.803 89.610 1.00 25.03 C ATOM 1488 O SER A 108 6.538 46.822 89.825 1.00 24.99 O ATOM 1489 CB SER A 108 7.342 44.117 91.441 1.00 22.22 C ATOM 1490 OG SER A 108 6.840 42.890 91.951 1.00 27.95 O ATOM 1491 HA SER A 108 5.612 44.501 90.210 1.00 0.00 H ATOM 1492 HB2 SER A 108 7.122 44.916 92.149 1.00 0.00 H ATOM 1493 HB3 SER A 108 8.421 44.036 91.310 1.00 0.00 H ATOM 1494 HG SER A 108 7.041 42.161 91.312 1.00 0.00 H ATOM 1495 H SER A 108 7.565 42.591 89.380 1.00 0.00 H ATOM 1496 N GLN A 109 8.350 45.822 88.962 1.00 21.97 N ATOM 1497 CA GLN A 109 8.949 47.090 88.566 1.00 25.92 C ATOM 1498 C GLN A 109 8.395 47.630 87.256 1.00 25.06 C ATOM 1499 O GLN A 109 8.238 48.837 87.103 1.00 29.23 O ATOM 1500 CB GLN A 109 10.465 46.954 88.445 1.00 29.22 C ATOM 1501 CG GLN A 109 11.171 46.688 89.754 1.00 31.01 C ATOM 1502 CD GLN A 109 12.637 46.359 89.556 1.00 34.03 C ATOM 1503 OE1 GLN A 109 13.055 45.210 89.712 1.00 37.32 O ATOM 1504 NE2 GLN A 109 13.425 47.365 89.209 1.00 29.98 N ATOM 1505 HA GLN A 109 8.693 47.800 89.352 1.00 0.00 H ATOM 1506 HB2 GLN A 109 10.681 46.129 87.766 1.00 0.00 H ATOM 1507 HB3 GLN A 109 10.859 47.880 88.026 1.00 0.00 H ATOM 1508 HG2 GLN A 109 11.092 47.575 90.383 1.00 0.00 H ATOM 1509 HG3 GLN A 109 10.686 45.848 90.250 1.00 0.00 H ATOM 1510 HE22 GLN A 109 13.028 48.319 89.089 1.00 0.00 H ATOM 1511 HE21 GLN A 109 14.441 47.201 89.057 1.00 0.00 H ATOM 1512 H GLN A 109 8.832 44.929 88.736 1.00 0.00 H ATOM 1513 N PHE A 110 8.087 46.741 86.317 1.00 23.05 N ATOM 1514 CA PHE A 110 7.923 47.173 84.931 1.00 24.61 C ATOM 1515 C PHE A 110 6.600 46.853 84.239 1.00 25.25 C ATOM 1516 O PHE A 110 6.344 47.344 83.137 1.00 27.62 O ATOM 1517 CB PHE A 110 9.101 46.663 84.088 1.00 23.70 C ATOM 1518 CG PHE A 110 10.447 47.072 84.626 1.00 26.47 C ATOM 1519 CD1 PHE A 110 10.782 48.410 84.741 1.00 28.10 C ATOM 1520 CD2 PHE A 110 11.378 46.118 85.014 1.00 27.69 C ATOM 1521 CE1 PHE A 110 12.018 48.794 85.244 1.00 32.62 C ATOM 1522 CE2 PHE A 110 12.619 46.493 85.510 1.00 27.04 C ATOM 1523 CZ PHE A 110 12.939 47.834 85.625 1.00 28.08 C ATOM 1524 HA PHE A 110 7.906 48.261 85.000 1.00 0.00 H ATOM 1525 HB2 PHE A 110 9.058 45.574 84.057 1.00 0.00 H ATOM 1526 HB3 PHE A 110 8.999 47.058 83.077 1.00 0.00 H ATOM 1527 HD2 PHE A 110 11.131 45.060 84.928 1.00 0.00 H ATOM 1528 HE2 PHE A 110 13.340 45.732 85.808 1.00 0.00 H ATOM 1529 HZ PHE A 110 13.912 48.133 86.014 1.00 0.00 H ATOM 1530 HE1 PHE A 110 12.263 49.852 85.339 1.00 0.00 H ATOM 1531 HD1 PHE A 110 10.066 49.172 84.433 1.00 0.00 H ATOM 1532 H PHE A 110 7.963 45.740 86.569 1.00 0.00 H ATOM 1533 N SER A 111 5.756 46.039 84.854 1.00 22.80 N ATOM 1534 CA SER A 111 4.485 45.700 84.226 1.00 22.19 C ATOM 1535 C SER A 111 3.513 46.881 84.252 1.00 27.10 C ATOM 1536 O SER A 111 3.343 47.534 85.284 1.00 23.96 O ATOM 1537 CB SER A 111 3.857 44.473 84.874 1.00 19.19 C ATOM 1538 OG SER A 111 2.659 44.107 84.212 1.00 21.56 O ATOM 1539 HA SER A 111 4.695 45.462 83.183 1.00 0.00 H ATOM 1540 HB2 SER A 111 3.634 44.695 85.918 1.00 0.00 H ATOM 1541 HB3 SER A 111 4.561 43.643 84.823 1.00 0.00 H ATOM 1542 HG SER A 111 2.271 43.309 84.651 1.00 0.00 H ATOM 1543 H SER A 111 6.000 45.642 85.784 1.00 0.00 H ATOM 1544 N ASP A 112 2.887 47.138 83.103 1.00 25.00 N ATOM 1545 CA ASP A 112 1.926 48.231 82.935 1.00 24.91 C ATOM 1546 C ASP A 112 0.528 47.776 83.333 1.00 28.30 C ATOM 1547 O ASP A 112 -0.471 48.160 82.718 1.00 31.44 O ATOM 1548 CB ASP A 112 1.914 48.718 81.479 1.00 22.84 C ATOM 1549 CG ASP A 112 3.083 49.638 81.155 1.00 25.20 C ATOM 1550 OD1 ASP A 112 3.339 50.576 81.928 1.00 25.49 O ATOM 1551 OD2 ASP A 112 3.737 49.445 80.107 1.00 26.11 O ATOM 1552 HA ASP A 112 2.231 49.053 83.582 1.00 0.00 H ATOM 1553 HB2 ASP A 112 1.960 47.850 80.821 1.00 0.00 H ATOM 1554 HB3 ASP A 112 0.985 49.259 81.300 1.00 0.00 H ATOM 1555 H ASP A 112 3.092 46.531 82.284 1.00 0.00 H ATOM 1556 N CYS A 113 0.467 46.936 84.356 1.00 27.83 N ATOM 1557 CA CYS A 113 -0.794 46.425 84.854 1.00 26.59 C ATOM 1558 C CYS A 113 -0.798 46.585 86.369 1.00 28.61 C ATOM 1559 O CYS A 113 0.265 46.607 87.000 1.00 27.44 O ATOM 1560 CB CYS A 113 -0.945 44.956 84.469 1.00 25.69 C ATOM 1561 SG CYS A 113 -2.555 44.227 84.823 1.00 37.01 S ATOM 1562 HA CYS A 113 -1.630 46.974 84.421 1.00 0.00 H ATOM 1563 HB2 CYS A 113 -0.191 44.386 85.012 1.00 0.00 H ATOM 1564 HB3 CYS A 113 -0.764 44.868 83.398 1.00 0.00 H ATOM 1565 HG CYS A 113 -3.532 44.915 84.133 1.00 0.00 H ATOM 1566 H CYS A 113 1.350 46.635 84.815 1.00 0.00 H ATOM 1567 N SER A 114 -1.987 46.712 86.949 1.00 28.90 N ATOM 1568 CA SER A 114 -2.119 46.867 88.396 1.00 29.16 C ATOM 1569 C SER A 114 -1.671 45.611 89.132 1.00 27.48 C ATOM 1570 O SER A 114 -1.329 45.663 90.322 1.00 25.40 O ATOM 1571 CB SER A 114 -3.561 47.216 88.782 1.00 35.68 C ATOM 1572 OG SER A 114 -4.483 46.294 88.216 1.00 40.84 O ATOM 1573 HA SER A 114 -1.469 47.689 88.695 1.00 0.00 H ATOM 1574 HB2 SER A 114 -3.793 48.218 88.421 1.00 0.00 H ATOM 1575 HB3 SER A 114 -3.654 47.191 89.868 1.00 0.00 H ATOM 1576 HG SER A 114 -4.406 46.316 87.229 1.00 0.00 H ATOM 1577 H SER A 114 -2.844 46.701 86.359 1.00 0.00 H ATOM 1578 N SER A 115 -1.670 44.487 88.419 1.00 24.40 N ATOM 1579 CA SER A 115 -1.232 43.219 88.989 1.00 24.71 C ATOM 1580 C SER A 115 0.260 43.225 89.304 1.00 23.17 C ATOM 1581 O SER A 115 0.763 42.306 89.957 1.00 24.07 O ATOM 1582 CB SER A 115 -1.584 42.048 88.067 1.00 26.91 C ATOM 1583 OG SER A 115 -0.951 42.183 86.805 1.00 25.52 O ATOM 1584 HA SER A 115 -1.768 43.088 89.929 1.00 0.00 H ATOM 1585 HB2 SER A 115 -2.664 42.020 87.923 1.00 0.00 H ATOM 1586 HB3 SER A 115 -1.257 41.118 88.532 1.00 0.00 H ATOM 1587 HG SER A 115 0.031 42.204 86.930 1.00 0.00 H ATOM 1588 H SER A 115 -1.990 44.514 87.430 1.00 0.00 H ATOM 1589 N ALA A 116 0.958 44.264 88.852 1.00 20.97 N ATOM 1590 CA ALA A 116 2.355 44.471 89.212 1.00 20.38 C ATOM 1591 C ALA A 116 2.539 44.500 90.732 1.00 24.08 C ATOM 1592 O ALA A 116 3.533 43.999 91.252 1.00 18.81 O ATOM 1593 CB ALA A 116 2.874 45.772 88.603 1.00 23.76 C ATOM 1594 HA ALA A 116 2.928 43.634 88.813 1.00 0.00 H ATOM 1595 HB1 ALA A 116 2.790 45.722 87.517 1.00 0.00 H ATOM 1596 HB2 ALA A 116 2.283 46.608 88.977 1.00 0.00 H ATOM 1597 HB3 ALA A 116 3.919 45.911 88.882 1.00 0.00 H ATOM 1598 H ALA A 116 0.493 44.949 88.223 1.00 0.00 H ATOM 1599 N LYS A 117 1.581 45.095 91.438 1.00 21.16 N ATOM 1600 CA LYS A 117 1.652 45.197 92.897 1.00 21.69 C ATOM 1601 C LYS A 117 1.587 43.827 93.580 1.00 19.81 C ATOM 1602 O LYS A 117 1.902 43.710 94.767 1.00 20.70 O ATOM 1603 CB LYS A 117 0.527 46.092 93.439 1.00 22.13 C ATOM 1604 CG LYS A 117 0.360 47.410 92.723 1.00 30.02 C ATOM 1605 CD LYS A 117 1.637 48.225 92.746 1.00 33.57 C ATOM 1606 CE LYS A 117 1.734 49.103 91.497 1.00 34.47 C ATOM 1607 NZ LYS A 117 2.984 49.901 91.488 1.00 37.10 N ATOM 1608 HA LYS A 117 2.618 45.645 93.129 1.00 0.00 H ATOM 1609 HB2 LYS A 117 -0.411 45.542 93.359 1.00 0.00 H ATOM 1610 HB3 LYS A 117 0.736 46.301 94.488 1.00 0.00 H ATOM 1611 HG2 LYS A 117 0.082 47.217 91.687 1.00 0.00 H ATOM 1612 HG3 LYS A 117 -0.432 47.979 93.210 1.00 0.00 H ATOM 1613 HD2 LYS A 117 1.642 48.859 93.632 1.00 0.00 H ATOM 1614 HD3 LYS A 117 2.493 47.551 92.778 1.00 0.00 H ATOM 1615 HE2 LYS A 117 0.881 49.781 91.473 1.00 0.00 H ATOM 1616 HE3 LYS A 117 1.714 48.465 90.613 1.00 0.00 H ATOM 1617 HZ1 LYS A 117 3.007 50.517 92.326 1.00 0.00 H ATOM 1618 HZ2 LYS A 117 3.803 49.260 91.505 1.00 0.00 H ATOM 1619 HZ3 LYS A 117 3.016 50.484 90.627 1.00 0.00 H ATOM 1620 H LYS A 117 0.761 45.498 90.941 1.00 0.00 H ATOM 1621 N ALA A 118 1.152 42.811 92.834 1.00 18.81 N ATOM 1622 CA ALA A 118 1.131 41.433 93.312 1.00 21.74 C ATOM 1623 C ALA A 118 2.142 40.540 92.582 1.00 20.99 C ATOM 1624 O ALA A 118 1.889 39.351 92.378 1.00 19.61 O ATOM 1625 CB ALA A 118 -0.269 40.851 93.182 1.00 22.70 C ATOM 1626 HA ALA A 118 1.422 41.457 94.362 1.00 0.00 H ATOM 1627 HB1 ALA A 118 -0.964 41.445 93.775 1.00 0.00 H ATOM 1628 HB2 ALA A 118 -0.573 40.870 92.136 1.00 0.00 H ATOM 1629 HB3 ALA A 118 -0.268 39.822 93.543 1.00 0.00 H ATOM 1630 H ALA A 118 0.813 43.009 91.871 1.00 0.00 H ATOM 1631 N ARG A 119 3.275 41.118 92.195 1.00 19.12 N ATOM 1632 CA ARG A 119 4.325 40.401 91.468 1.00 24.74 C ATOM 1633 C ARG A 119 3.779 39.760 90.191 1.00 22.97 C ATOM 1634 O ARG A 119 4.275 38.724 89.741 1.00 21.59 O ATOM 1635 CB ARG A 119 4.993 39.335 92.348 1.00 22.69 C ATOM 1636 CG ARG A 119 5.893 39.869 93.472 1.00 27.37 C ATOM 1637 CD ARG A 119 5.971 38.874 94.628 1.00 29.03 C ATOM 1638 NE ARG A 119 4.614 38.610 95.091 1.00 41.07 N ATOM 1639 CZ ARG A 119 3.919 39.436 95.874 1.00 29.61 C ATOM 1640 NH1 ARG A 119 4.464 40.573 96.311 1.00 35.61 N ATOM 1641 NH2 ARG A 119 2.677 39.132 96.216 1.00 26.76 N ATOM 1642 HA ARG A 119 5.079 41.138 91.191 1.00 0.00 H ATOM 1643 HB2 ARG A 119 4.205 38.736 92.805 1.00 0.00 H ATOM 1644 HB3 ARG A 119 5.602 38.701 91.703 1.00 0.00 H ATOM 1645 HG2 ARG A 119 6.895 40.037 93.078 1.00 0.00 H ATOM 1646 HG3 ARG A 119 5.485 40.811 93.839 1.00 0.00 H ATOM 1647 HD2 ARG A 119 6.563 39.296 95.440 1.00 0.00 H ATOM 1648 HD3 ARG A 119 6.432 37.947 94.287 1.00 0.00 H ATOM 1649 HE ARG A 119 4.160 37.723 94.792 1.00 0.00 H ATOM 1650 HH12 ARG A 119 3.915 41.212 96.921 1.00 0.00 H ATOM 1651 HH11 ARG A 119 5.437 40.820 96.041 1.00 0.00 H ATOM 1652 HH22 ARG A 119 2.134 39.775 96.827 1.00 0.00 H ATOM 1653 HH21 ARG A 119 2.245 38.250 95.874 1.00 0.00 H ATOM 1654 H ARG A 119 3.422 42.123 92.418 1.00 0.00 H ATOM 1655 N GLY A 120 2.742 40.372 89.618 1.00 21.51 N ATOM 1656 CA GLY A 120 2.209 39.938 88.337 1.00 22.29 C ATOM 1657 C GLY A 120 1.094 38.919 88.438 1.00 22.28 C ATOM 1658 O GLY A 120 0.496 38.550 87.434 1.00 21.01 O ATOM 1659 HA3 GLY A 120 3.022 39.498 87.760 1.00 0.00 H ATOM 1660 HA2 GLY A 120 1.825 40.813 87.813 1.00 0.00 H ATOM 1661 H GLY A 120 2.303 41.182 90.101 1.00 0.00 H ATOM 1662 N ASP A 121 0.788 38.481 89.657 1.00 18.78 N ATOM 1663 CA ASP A 121 -0.218 37.439 89.869 1.00 21.30 C ATOM 1664 C ASP A 121 -1.617 37.895 89.461 1.00 24.94 C ATOM 1665 O ASP A 121 -2.083 38.947 89.896 1.00 26.92 O ATOM 1666 CB ASP A 121 -0.238 36.996 91.342 1.00 22.27 C ATOM 1667 CG ASP A 121 -1.223 35.869 91.600 1.00 27.16 C ATOM 1668 OD1 ASP A 121 -1.362 34.980 90.734 1.00 25.71 O ATOM 1669 OD2 ASP A 121 -1.855 35.858 92.680 1.00 31.32 O ATOM 1670 HA ASP A 121 0.063 36.599 89.234 1.00 0.00 H ATOM 1671 HB2 ASP A 121 0.760 36.657 91.619 1.00 0.00 H ATOM 1672 HB3 ASP A 121 -0.515 37.850 91.960 1.00 0.00 H ATOM 1673 H ASP A 121 1.276 38.889 90.480 1.00 0.00 H ATOM 1674 N LEU A 122 -2.274 37.094 88.629 1.00 23.68 N ATOM 1675 CA LEU A 122 -3.650 37.345 88.214 1.00 26.95 C ATOM 1676 C LEU A 122 -4.631 36.444 88.946 1.00 29.00 C ATOM 1677 O LEU A 122 -5.842 36.603 88.813 1.00 30.61 O ATOM 1678 CB LEU A 122 -3.801 37.098 86.713 1.00 26.88 C ATOM 1679 CG LEU A 122 -3.002 38.027 85.809 1.00 23.27 C ATOM 1680 CD1 LEU A 122 -3.079 37.527 84.374 1.00 24.55 C ATOM 1681 CD2 LEU A 122 -3.506 39.459 85.923 1.00 27.06 C ATOM 1682 HA LEU A 122 -3.873 38.384 88.456 1.00 0.00 H ATOM 1683 HB2 LEU A 122 -3.484 36.076 86.508 1.00 0.00 H ATOM 1684 HB3 LEU A 122 -4.855 37.208 86.459 1.00 0.00 H ATOM 1685 HG LEU A 122 -1.959 38.025 86.125 1.00 0.00 H ATOM 1686 HD21 LEU A 122 -4.555 39.498 85.629 1.00 0.00 H ATOM 1687 HD22 LEU A 122 -3.404 39.798 86.954 1.00 0.00 H ATOM 1688 HD23 LEU A 122 -2.919 40.103 85.268 1.00 0.00 H ATOM 1689 HD11 LEU A 122 -2.665 36.520 84.319 1.00 0.00 H ATOM 1690 HD12 LEU A 122 -4.120 37.511 84.051 1.00 0.00 H ATOM 1691 HD13 LEU A 122 -2.507 38.192 83.728 1.00 0.00 H ATOM 1692 H LEU A 122 -1.787 36.253 88.258 1.00 0.00 H ATOM 1693 N GLY A 123 -4.111 35.486 89.703 1.00 29.90 N ATOM 1694 CA GLY A 123 -4.951 34.495 90.348 1.00 28.62 C ATOM 1695 C GLY A 123 -5.383 33.428 89.368 1.00 32.68 C ATOM 1696 O GLY A 123 -4.867 33.358 88.244 1.00 32.79 O ATOM 1697 HA3 GLY A 123 -5.836 34.987 90.753 1.00 0.00 H ATOM 1698 HA2 GLY A 123 -4.393 34.029 91.160 1.00 0.00 H ATOM 1699 H GLY A 123 -3.080 35.445 89.836 1.00 0.00 H ATOM 1700 N ALA A 124 -6.333 32.594 89.780 1.00 29.47 N ATOM 1701 CA ALA A 124 -6.796 31.498 88.938 1.00 31.47 C ATOM 1702 C ALA A 124 -7.932 31.943 88.028 1.00 35.64 C ATOM 1703 O ALA A 124 -8.721 32.816 88.389 1.00 36.00 O ATOM 1704 CB ALA A 124 -7.228 30.304 89.793 1.00 34.52 C ATOM 1705 HA ALA A 124 -5.963 31.188 88.307 1.00 0.00 H ATOM 1706 HB1 ALA A 124 -6.382 29.959 90.387 1.00 0.00 H ATOM 1707 HB2 ALA A 124 -8.039 30.607 90.455 1.00 0.00 H ATOM 1708 HB3 ALA A 124 -7.570 29.498 89.143 1.00 0.00 H ATOM 1709 H ALA A 124 -6.754 32.726 90.722 1.00 0.00 H ATOM 1710 N PHE A 125 -7.999 31.350 86.840 1.00 29.96 N ATOM 1711 CA PHE A 125 -9.061 31.655 85.886 1.00 35.46 C ATOM 1712 C PHE A 125 -9.363 30.458 84.990 1.00 33.86 C ATOM 1713 O PHE A 125 -8.575 29.518 84.892 1.00 33.38 O ATOM 1714 CB PHE A 125 -8.720 32.901 85.055 1.00 34.88 C ATOM 1715 CG PHE A 125 -7.409 32.805 84.313 1.00 33.36 C ATOM 1716 CD1 PHE A 125 -6.222 33.175 84.927 1.00 34.29 C ATOM 1717 CD2 PHE A 125 -7.369 32.358 83.000 1.00 36.24 C ATOM 1718 CE1 PHE A 125 -5.016 33.093 84.249 1.00 34.20 C ATOM 1719 CE2 PHE A 125 -6.166 32.272 82.313 1.00 32.72 C ATOM 1720 CZ PHE A 125 -4.988 32.638 82.939 1.00 33.55 C ATOM 1721 HA PHE A 125 -9.964 31.874 86.456 1.00 0.00 H ATOM 1722 HB2 PHE A 125 -9.516 33.056 84.326 1.00 0.00 H ATOM 1723 HB3 PHE A 125 -8.672 33.758 85.726 1.00 0.00 H ATOM 1724 HD2 PHE A 125 -8.295 32.071 82.501 1.00 0.00 H ATOM 1725 HE2 PHE A 125 -6.150 31.917 81.283 1.00 0.00 H ATOM 1726 HZ PHE A 125 -4.041 32.569 82.404 1.00 0.00 H ATOM 1727 HE1 PHE A 125 -4.090 33.386 84.745 1.00 0.00 H ATOM 1728 HD1 PHE A 125 -6.238 33.535 85.956 1.00 0.00 H ATOM 1729 H PHE A 125 -7.275 30.649 86.583 1.00 0.00 H ATOM 1730 N SER A 126 -10.527 30.482 84.356 1.00 34.12 N ATOM 1731 CA SER A 126 -10.917 29.402 83.467 1.00 38.40 C ATOM 1732 C SER A 126 -11.011 29.951 82.056 1.00 36.76 C ATOM 1733 O SER A 126 -10.947 31.165 81.848 1.00 38.27 O ATOM 1734 CB SER A 126 -12.258 28.803 83.897 1.00 41.13 C ATOM 1735 OG SER A 126 -13.302 29.741 83.707 1.00 42.53 O ATOM 1736 HA SER A 126 -10.172 28.607 83.508 1.00 0.00 H ATOM 1737 HB2 SER A 126 -12.208 28.530 84.951 1.00 0.00 H ATOM 1738 HB3 SER A 126 -12.462 27.913 83.301 1.00 0.00 H ATOM 1739 HG SER A 126 -13.351 29.989 82.750 1.00 0.00 H ATOM 1740 H SER A 126 -11.171 31.287 84.497 1.00 0.00 H ATOM 1741 N ARG A 127 -11.158 29.062 81.083 1.00 37.35 N ATOM 1742 CA ARG A 127 -11.337 29.506 79.712 1.00 37.38 C ATOM 1743 C ARG A 127 -12.573 30.391 79.647 1.00 43.80 C ATOM 1744 O ARG A 127 -13.509 30.212 80.427 1.00 45.01 O ATOM 1745 CB ARG A 127 -11.468 28.315 78.764 1.00 36.43 C ATOM 1746 CG ARG A 127 -10.152 27.615 78.458 1.00 36.33 C ATOM 1747 CD ARG A 127 -10.210 26.979 77.087 1.00 34.97 C ATOM 1748 NE ARG A 127 -8.973 26.300 76.715 1.00 39.56 N ATOM 1749 CZ ARG A 127 -8.000 26.852 75.996 1.00 33.79 C ATOM 1750 NH1 ARG A 127 -8.105 28.106 75.584 1.00 29.83 N ATOM 1751 NH2 ARG A 127 -6.917 26.148 75.696 1.00 31.07 N ATOM 1752 HA ARG A 127 -10.463 30.074 79.395 1.00 0.00 H ATOM 1753 HB2 ARG A 127 -12.144 27.590 79.217 1.00 0.00 H ATOM 1754 HB3 ARG A 127 -11.893 28.670 77.825 1.00 0.00 H ATOM 1755 HG2 ARG A 127 -9.341 28.343 78.484 1.00 0.00 H ATOM 1756 HG3 ARG A 127 -9.971 26.844 79.207 1.00 0.00 H ATOM 1757 HD2 ARG A 127 -10.412 27.758 76.352 1.00 0.00 H ATOM 1758 HD3 ARG A 127 -11.022 26.251 77.076 1.00 0.00 H ATOM 1759 HE ARG A 127 -8.844 25.318 77.034 1.00 0.00 H ATOM 1760 HH12 ARG A 127 -7.342 28.534 75.022 1.00 0.00 H ATOM 1761 HH11 ARG A 127 -8.950 28.663 75.823 1.00 0.00 H ATOM 1762 HH22 ARG A 127 -6.156 26.579 75.134 1.00 0.00 H ATOM 1763 HH21 ARG A 127 -6.829 25.165 76.023 1.00 0.00 H ATOM 1764 H ARG A 127 -11.145 28.045 81.302 1.00 0.00 H ATOM 1765 N GLY A 128 -12.558 31.363 78.740 1.00 40.81 N ATOM 1766 CA GLY A 128 -13.683 32.261 78.562 1.00 42.92 C ATOM 1767 C GLY A 128 -13.664 33.496 79.446 1.00 44.31 C ATOM 1768 O GLY A 128 -14.654 34.222 79.511 1.00 44.48 O ATOM 1769 HA3 GLY A 128 -14.596 31.706 78.776 1.00 0.00 H ATOM 1770 HA2 GLY A 128 -13.693 32.589 77.523 1.00 0.00 H ATOM 1771 H GLY A 128 -11.716 31.483 78.141 1.00 0.00 H ATOM 1772 N GLN A 129 -12.544 33.743 80.120 1.00 41.42 N ATOM 1773 CA GLN A 129 -12.430 34.900 81.008 1.00 38.87 C ATOM 1774 C GLN A 129 -11.479 35.970 80.474 1.00 38.51 C ATOM 1775 O GLN A 129 -11.772 37.162 80.545 1.00 41.56 O ATOM 1776 CB GLN A 129 -11.986 34.467 82.408 1.00 40.07 C ATOM 1777 CG GLN A 129 -12.896 33.450 83.080 1.00 41.29 C ATOM 1778 CD GLN A 129 -12.501 33.194 84.529 1.00 41.65 C ATOM 1779 OE1 GLN A 129 -11.795 33.996 85.141 1.00 46.75 O ATOM 1780 NE2 GLN A 129 -12.952 32.074 85.079 1.00 40.35 N ATOM 1781 HA GLN A 129 -13.424 35.345 81.058 1.00 0.00 H ATOM 1782 HB2 GLN A 129 -10.990 34.031 82.328 1.00 0.00 H ATOM 1783 HB3 GLN A 129 -11.943 35.354 83.040 1.00 0.00 H ATOM 1784 HG2 GLN A 129 -13.920 33.824 83.056 1.00 0.00 H ATOM 1785 HG3 GLN A 129 -12.840 32.511 82.529 1.00 0.00 H ATOM 1786 HE22 GLN A 129 -13.546 31.425 84.525 1.00 0.00 H ATOM 1787 HE21 GLN A 129 -12.712 31.845 86.065 1.00 0.00 H ATOM 1788 H GLN A 129 -11.733 33.101 80.013 1.00 0.00 H ATOM 1789 N MET A 130 -10.337 35.543 79.942 1.00 37.14 N ATOM 1790 CA MET A 130 -9.325 36.475 79.458 1.00 34.10 C ATOM 1791 C MET A 130 -9.435 36.690 77.953 1.00 34.10 C ATOM 1792 O MET A 130 -10.136 35.950 77.265 1.00 35.40 O ATOM 1793 CB MET A 130 -7.924 35.939 79.769 1.00 34.06 C ATOM 1794 CG MET A 130 -7.691 35.599 81.227 1.00 35.71 C ATOM 1795 SD MET A 130 -7.695 37.080 82.238 1.00 41.92 S ATOM 1796 CE MET A 130 -7.161 36.408 83.812 1.00 40.24 C ATOM 1797 HA MET A 130 -9.491 37.425 79.965 1.00 0.00 H ATOM 1798 HB2 MET A 130 -7.766 35.036 79.179 1.00 0.00 H ATOM 1799 HB3 MET A 130 -7.197 36.696 79.475 1.00 0.00 H ATOM 1800 HG2 MET A 130 -6.727 35.100 81.328 1.00 0.00 H ATOM 1801 HG3 MET A 130 -8.482 34.931 81.569 1.00 0.00 H ATOM 1802 HE1 MET A 130 -7.872 35.650 84.142 1.00 0.00 H ATOM 1803 HE2 MET A 130 -6.175 35.958 83.698 1.00 0.00 H ATOM 1804 HE3 MET A 130 -7.113 37.209 84.550 1.00 0.00 H ATOM 1805 H MET A 130 -10.162 34.520 79.870 1.00 0.00 H ATOM 1806 N GLN A 131 -8.736 37.705 77.453 1.00 28.74 N ATOM 1807 CA GLN A 131 -8.556 37.879 76.014 1.00 31.66 C ATOM 1808 C GLN A 131 -7.989 36.592 75.444 1.00 30.36 C ATOM 1809 O GLN A 131 -7.134 35.949 76.054 1.00 27.16 O ATOM 1810 CB GLN A 131 -7.611 39.037 75.710 1.00 31.41 C ATOM 1811 CG GLN A 131 -8.096 40.383 76.226 1.00 35.70 C ATOM 1812 CD GLN A 131 -7.225 41.529 75.762 1.00 36.78 C ATOM 1813 OE1 GLN A 131 -6.952 41.676 74.568 1.00 41.22 O ATOM 1814 NE2 GLN A 131 -6.794 42.359 76.700 1.00 36.47 N ATOM 1815 HA GLN A 131 -9.520 38.109 75.560 1.00 0.00 H ATOM 1816 HB2 GLN A 131 -6.646 38.821 76.168 1.00 0.00 H ATOM 1817 HB3 GLN A 131 -7.491 39.107 74.629 1.00 0.00 H ATOM 1818 HG2 GLN A 131 -9.112 40.549 75.869 1.00 0.00 H ATOM 1819 HG3 GLN A 131 -8.094 40.361 77.316 1.00 0.00 H ATOM 1820 HE22 GLN A 131 -7.049 42.197 77.695 1.00 0.00 H ATOM 1821 HE21 GLN A 131 -6.201 43.173 76.441 1.00 0.00 H ATOM 1822 H GLN A 131 -8.306 38.393 78.104 1.00 0.00 H ATOM 1823 N LYS A 132 -8.457 36.222 74.261 1.00 27.47 N ATOM 1824 CA LYS A 132 -8.192 34.897 73.719 1.00 28.21 C ATOM 1825 C LYS A 132 -6.711 34.512 73.573 1.00 23.76 C ATOM 1826 O LYS A 132 -6.339 33.386 73.896 1.00 27.63 O ATOM 1827 CB LYS A 132 -8.920 34.719 72.385 1.00 30.60 C ATOM 1828 CG LYS A 132 -8.920 33.292 71.895 1.00 31.52 C ATOM 1829 CD LYS A 132 -9.644 32.366 72.848 1.00 31.55 C ATOM 1830 CE LYS A 132 -9.501 30.932 72.370 1.00 39.80 C ATOM 1831 NZ LYS A 132 -10.193 29.950 73.240 1.00 42.01 N ATOM 1832 HA LYS A 132 -8.579 34.210 74.471 1.00 0.00 H ATOM 1833 HB2 LYS A 132 -9.953 35.044 72.508 1.00 0.00 H ATOM 1834 HB3 LYS A 132 -8.431 35.343 71.637 1.00 0.00 H ATOM 1835 HG2 LYS A 132 -9.413 33.253 70.923 1.00 0.00 H ATOM 1836 HG3 LYS A 132 -7.889 32.955 71.792 1.00 0.00 H ATOM 1837 HD2 LYS A 132 -9.213 32.461 73.845 1.00 0.00 H ATOM 1838 HD3 LYS A 132 -10.700 32.634 72.883 1.00 0.00 H ATOM 1839 HE2 LYS A 132 -8.441 30.681 72.341 1.00 0.00 H ATOM 1840 HE3 LYS A 132 -9.918 30.859 71.366 1.00 0.00 H ATOM 1841 HZ1 LYS A 132 -9.798 30.001 74.201 1.00 0.00 H ATOM 1842 HZ2 LYS A 132 -11.209 30.170 73.270 1.00 0.00 H ATOM 1843 HZ3 LYS A 132 -10.056 28.993 72.858 1.00 0.00 H ATOM 1844 H LYS A 132 -9.026 36.893 73.707 1.00 0.00 H ATOM 1845 N PRO A 133 -5.871 35.424 73.055 1.00 26.11 N ATOM 1846 CA PRO A 133 -4.461 35.046 72.895 1.00 27.04 C ATOM 1847 C PRO A 133 -3.822 34.744 74.248 1.00 26.45 C ATOM 1848 O PRO A 133 -3.019 33.814 74.355 1.00 25.48 O ATOM 1849 CB PRO A 133 -3.826 36.297 72.274 1.00 29.33 C ATOM 1850 CG PRO A 133 -4.965 37.022 71.625 1.00 31.77 C ATOM 1851 CD PRO A 133 -6.146 36.768 72.517 1.00 28.91 C ATOM 1852 HA PRO A 133 -4.330 34.149 72.290 1.00 0.00 H ATOM 1853 HD3 PRO A 133 -6.200 37.507 73.316 1.00 0.00 H ATOM 1854 HD2 PRO A 133 -7.076 36.780 71.949 1.00 0.00 H ATOM 1855 HG3 PRO A 133 -5.149 36.630 70.625 1.00 0.00 H ATOM 1856 HG2 PRO A 133 -4.754 38.090 71.563 1.00 0.00 H ATOM 1857 HB2 PRO A 133 -3.365 36.916 73.043 1.00 0.00 H ATOM 1858 HB3 PRO A 133 -3.075 36.020 71.534 1.00 0.00 H ATOM 1859 N PHE A 134 -4.196 35.516 75.264 1.00 25.21 N ATOM 1860 CA PHE A 134 -3.686 35.314 76.627 1.00 24.22 C ATOM 1861 C PHE A 134 -4.163 33.979 77.174 1.00 24.97 C ATOM 1862 O PHE A 134 -3.376 33.186 77.704 1.00 24.70 O ATOM 1863 CB PHE A 134 -4.118 36.460 77.550 1.00 22.17 C ATOM 1864 CG PHE A 134 -3.382 36.486 78.874 1.00 20.42 C ATOM 1865 CD1 PHE A 134 -3.766 35.652 79.911 1.00 27.08 C ATOM 1866 CD2 PHE A 134 -2.305 37.337 79.071 1.00 22.95 C ATOM 1867 CE1 PHE A 134 -3.090 35.664 81.126 1.00 22.83 C ATOM 1868 CE2 PHE A 134 -1.625 37.360 80.296 1.00 22.04 C ATOM 1869 CZ PHE A 134 -2.016 36.519 81.311 1.00 21.90 C ATOM 1870 HA PHE A 134 -2.597 35.307 76.588 1.00 0.00 H ATOM 1871 HB2 PHE A 134 -3.936 37.404 77.036 1.00 0.00 H ATOM 1872 HB3 PHE A 134 -5.184 36.357 77.751 1.00 0.00 H ATOM 1873 HD2 PHE A 134 -1.984 37.995 78.264 1.00 0.00 H ATOM 1874 HE2 PHE A 134 -0.788 38.043 80.444 1.00 0.00 H ATOM 1875 HZ PHE A 134 -1.481 36.525 82.261 1.00 0.00 H ATOM 1876 HE1 PHE A 134 -3.405 35.001 81.932 1.00 0.00 H ATOM 1877 HD1 PHE A 134 -4.610 34.977 79.773 1.00 0.00 H ATOM 1878 H PHE A 134 -4.871 36.287 75.088 1.00 0.00 H ATOM 1879 N GLU A 135 -5.457 33.720 77.034 1.00 24.09 N ATOM 1880 CA GLU A 135 -6.037 32.460 77.477 1.00 22.93 C ATOM 1881 C GLU A 135 -5.388 31.236 76.828 1.00 24.12 C ATOM 1882 O GLU A 135 -4.997 30.287 77.512 1.00 21.92 O ATOM 1883 CB GLU A 135 -7.537 32.462 77.195 1.00 26.30 C ATOM 1884 CG GLU A 135 -8.203 31.120 77.375 1.00 31.81 C ATOM 1885 CD GLU A 135 -9.651 31.153 76.932 1.00 38.43 C ATOM 1886 OE1 GLU A 135 -10.365 32.103 77.323 1.00 34.79 O ATOM 1887 OE2 GLU A 135 -10.060 30.243 76.179 1.00 38.51 O ATOM 1888 HA GLU A 135 -5.849 32.382 78.548 1.00 0.00 H ATOM 1889 HB2 GLU A 135 -8.011 33.173 77.872 1.00 0.00 H ATOM 1890 HB3 GLU A 135 -7.691 32.785 76.165 1.00 0.00 H ATOM 1891 HG2 GLU A 135 -7.668 30.377 76.783 1.00 0.00 H ATOM 1892 HG3 GLU A 135 -8.161 30.842 78.428 1.00 0.00 H ATOM 1893 H GLU A 135 -6.073 34.435 76.597 1.00 0.00 H ATOM 1894 N ASP A 136 -5.290 31.249 75.503 1.00 21.41 N ATOM 1895 CA ASP A 136 -4.690 30.135 74.781 1.00 24.91 C ATOM 1896 C ASP A 136 -3.255 29.889 75.247 1.00 22.47 C ATOM 1897 O ASP A 136 -2.856 28.747 75.486 1.00 23.87 O ATOM 1898 CB ASP A 136 -4.730 30.385 73.272 1.00 24.85 C ATOM 1899 CG ASP A 136 -6.102 30.118 72.671 1.00 32.36 C ATOM 1900 OD1 ASP A 136 -6.938 29.466 73.338 1.00 30.64 O ATOM 1901 OD2 ASP A 136 -6.344 30.556 71.527 1.00 29.92 O ATOM 1902 HA ASP A 136 -5.274 29.240 74.998 1.00 0.00 H ATOM 1903 HB2 ASP A 136 -4.462 31.424 73.083 1.00 0.00 H ATOM 1904 HB3 ASP A 136 -4.004 29.730 72.790 1.00 0.00 H ATOM 1905 H ASP A 136 -5.648 32.069 74.972 1.00 0.00 H ATOM 1906 N ALA A 137 -2.484 30.963 75.376 1.00 22.66 N ATOM 1907 CA ALA A 137 -1.104 30.844 75.833 1.00 21.30 C ATOM 1908 C ALA A 137 -1.070 30.271 77.254 1.00 21.21 C ATOM 1909 O ALA A 137 -0.336 29.326 77.535 1.00 21.64 O ATOM 1910 CB ALA A 137 -0.398 32.201 75.763 1.00 19.44 C ATOM 1911 HA ALA A 137 -0.569 30.158 75.176 1.00 0.00 H ATOM 1912 HB1 ALA A 137 -0.401 32.558 74.733 1.00 0.00 H ATOM 1913 HB2 ALA A 137 -0.922 32.915 76.398 1.00 0.00 H ATOM 1914 HB3 ALA A 137 0.630 32.092 76.108 1.00 0.00 H ATOM 1915 H ALA A 137 -2.870 31.902 75.148 1.00 0.00 H ATOM 1916 N SER A 138 -1.900 30.816 78.139 1.00 23.09 N ATOM 1917 CA SER A 138 -1.937 30.354 79.521 1.00 23.27 C ATOM 1918 C SER A 138 -2.242 28.867 79.628 1.00 24.64 C ATOM 1919 O SER A 138 -1.600 28.153 80.389 1.00 28.67 O ATOM 1920 CB SER A 138 -2.949 31.158 80.338 1.00 21.00 C ATOM 1921 OG SER A 138 -2.605 32.526 80.355 1.00 23.04 O ATOM 1922 HA SER A 138 -0.940 30.514 79.930 1.00 0.00 H ATOM 1923 HB2 SER A 138 -2.964 30.780 81.360 1.00 0.00 H ATOM 1924 HB3 SER A 138 -3.938 31.043 79.895 1.00 0.00 H ATOM 1925 HG SER A 138 -2.594 32.874 79.428 1.00 0.00 H ATOM 1926 H SER A 138 -2.533 31.585 77.840 1.00 0.00 H ATOM 1927 N PHE A 139 -3.218 28.395 78.859 1.00 24.09 N ATOM 1928 CA PHE A 139 -3.618 26.993 78.932 1.00 27.03 C ATOM 1929 C PHE A 139 -2.686 26.032 78.192 1.00 28.89 C ATOM 1930 O PHE A 139 -2.728 24.826 78.424 1.00 29.99 O ATOM 1931 CB PHE A 139 -5.072 26.821 78.464 1.00 30.97 C ATOM 1932 CG PHE A 139 -6.079 27.065 79.549 1.00 30.14 C ATOM 1933 CD1 PHE A 139 -6.524 28.344 79.823 1.00 27.48 C ATOM 1934 CD2 PHE A 139 -6.559 26.014 80.311 1.00 34.73 C ATOM 1935 CE1 PHE A 139 -7.441 28.573 80.841 1.00 31.55 C ATOM 1936 CE2 PHE A 139 -7.476 26.233 81.324 1.00 33.63 C ATOM 1937 CZ PHE A 139 -7.917 27.517 81.587 1.00 30.13 C ATOM 1938 HA PHE A 139 -3.539 26.717 79.983 1.00 0.00 H ATOM 1939 HB2 PHE A 139 -5.260 27.525 77.653 1.00 0.00 H ATOM 1940 HB3 PHE A 139 -5.199 25.803 78.097 1.00 0.00 H ATOM 1941 HD2 PHE A 139 -6.210 25.001 80.111 1.00 0.00 H ATOM 1942 HE2 PHE A 139 -7.850 25.396 81.913 1.00 0.00 H ATOM 1943 HZ PHE A 139 -8.640 27.693 82.383 1.00 0.00 H ATOM 1944 HE1 PHE A 139 -7.783 29.587 81.049 1.00 0.00 H ATOM 1945 HD1 PHE A 139 -6.152 29.182 79.234 1.00 0.00 H ATOM 1946 H PHE A 139 -3.703 29.033 78.196 1.00 0.00 H ATOM 1947 N ALA A 140 -1.843 26.567 77.314 1.00 26.02 N ATOM 1948 CA ALA A 140 -0.860 25.753 76.604 1.00 26.15 C ATOM 1949 C ALA A 140 0.423 25.568 77.420 1.00 27.56 C ATOM 1950 O ALA A 140 1.186 24.632 77.188 1.00 28.57 O ATOM 1951 CB ALA A 140 -0.547 26.367 75.246 1.00 23.70 C ATOM 1952 HA ALA A 140 -1.295 24.765 76.454 1.00 0.00 H ATOM 1953 HB1 ALA A 140 -1.460 26.420 74.654 1.00 0.00 H ATOM 1954 HB2 ALA A 140 -0.144 27.370 75.386 1.00 0.00 H ATOM 1955 HB3 ALA A 140 0.187 25.749 74.730 1.00 0.00 H ATOM 1956 H ALA A 140 -1.885 27.589 77.128 1.00 0.00 H ATOM 1957 N LEU A 141 0.653 26.459 78.381 1.00 26.09 N ATOM 1958 CA LEU A 141 1.782 26.323 79.297 1.00 27.85 C ATOM 1959 C LEU A 141 1.532 25.211 80.303 1.00 28.73 C ATOM 1960 O LEU A 141 0.396 24.970 80.710 1.00 30.87 O ATOM 1961 CB LEU A 141 2.027 27.631 80.054 1.00 21.87 C ATOM 1962 CG LEU A 141 2.460 28.852 79.247 1.00 22.77 C ATOM 1963 CD1 LEU A 141 2.328 30.118 80.094 1.00 21.34 C ATOM 1964 CD2 LEU A 141 3.879 28.702 78.697 1.00 24.68 C ATOM 1965 HA LEU A 141 2.660 26.079 78.700 1.00 0.00 H ATOM 1966 HB2 LEU A 141 1.099 27.890 80.563 1.00 0.00 H ATOM 1967 HB3 LEU A 141 2.804 27.438 80.794 1.00 0.00 H ATOM 1968 HG LEU A 141 1.796 28.935 78.387 1.00 0.00 H ATOM 1969 HD21 LEU A 141 4.577 28.576 79.525 1.00 0.00 H ATOM 1970 HD22 LEU A 141 3.924 27.829 78.046 1.00 0.00 H ATOM 1971 HD23 LEU A 141 4.144 29.594 78.130 1.00 0.00 H ATOM 1972 HD11 LEU A 141 1.289 30.242 80.400 1.00 0.00 H ATOM 1973 HD12 LEU A 141 2.961 30.030 80.977 1.00 0.00 H ATOM 1974 HD13 LEU A 141 2.640 30.981 79.506 1.00 0.00 H ATOM 1975 H LEU A 141 0.013 27.272 78.482 1.00 0.00 H ATOM 1976 N ARG A 142 2.595 24.528 80.704 1.00 28.27 N ATOM 1977 CA ARG A 142 2.497 23.634 81.846 1.00 31.87 C ATOM 1978 C ARG A 142 2.918 24.411 83.074 1.00 29.62 C ATOM 1979 O ARG A 142 3.562 25.455 82.961 1.00 24.71 O ATOM 1980 CB ARG A 142 3.389 22.413 81.667 1.00 32.22 C ATOM 1981 CG ARG A 142 3.026 21.580 80.452 1.00 39.73 C ATOM 1982 CD ARG A 142 4.260 20.913 79.915 1.00 42.08 C ATOM 1983 NE ARG A 142 4.324 21.025 78.467 1.00 43.10 N ATOM 1984 CZ ARG A 142 5.451 20.990 77.769 1.00 43.18 C ATOM 1985 NH1 ARG A 142 6.613 20.848 78.389 1.00 46.27 N ATOM 1986 NH2 ARG A 142 5.415 21.102 76.448 1.00 48.52 N ATOM 1987 HA ARG A 142 1.473 23.275 81.947 1.00 0.00 H ATOM 1988 HB2 ARG A 142 4.420 22.750 81.561 1.00 0.00 H ATOM 1989 HB3 ARG A 142 3.302 21.787 82.555 1.00 0.00 H ATOM 1990 HG2 ARG A 142 2.297 20.821 80.736 1.00 0.00 H ATOM 1991 HG3 ARG A 142 2.598 22.224 79.684 1.00 0.00 H ATOM 1992 HD2 ARG A 142 4.245 19.859 80.191 1.00 0.00 H ATOM 1993 HD3 ARG A 142 5.140 21.388 80.349 1.00 0.00 H ATOM 1994 HE ARG A 142 3.431 21.140 77.946 1.00 0.00 H ATOM 1995 HH12 ARG A 142 7.496 20.821 77.840 1.00 0.00 H ATOM 1996 HH11 ARG A 142 6.643 20.764 79.425 1.00 0.00 H ATOM 1997 HH22 ARG A 142 6.298 21.075 75.900 1.00 0.00 H ATOM 1998 HH21 ARG A 142 4.504 21.217 75.961 1.00 0.00 H ATOM 1999 H ARG A 142 3.500 24.632 80.201 1.00 0.00 H ATOM 2000 N THR A 143 2.542 23.907 84.242 1.00 31.60 N ATOM 2001 CA THR A 143 2.918 24.536 85.493 1.00 27.90 C ATOM 2002 C THR A 143 4.421 24.760 85.533 1.00 28.37 C ATOM 2003 O THR A 143 5.201 23.835 85.309 1.00 28.62 O ATOM 2004 CB THR A 143 2.500 23.676 86.701 1.00 31.94 C ATOM 2005 OG1 THR A 143 1.071 23.607 86.760 1.00 37.48 O ATOM 2006 CG2 THR A 143 3.015 24.292 87.988 1.00 31.04 C ATOM 2007 HA THR A 143 2.399 25.493 85.552 1.00 0.00 H ATOM 2008 HB THR A 143 2.922 22.678 86.586 1.00 0.00 H ATOM 2009 HG1 THR A 143 0.800 23.055 87.536 1.00 0.00 H ATOM 2010 HG23 THR A 143 4.103 24.349 87.952 1.00 0.00 H ATOM 2011 HG21 THR A 143 2.601 25.294 88.101 1.00 0.00 H ATOM 2012 HG22 THR A 143 2.710 23.674 88.833 1.00 0.00 H ATOM 2013 H THR A 143 1.965 23.042 84.261 1.00 0.00 H ATOM 2014 N GLY A 144 4.821 25.996 85.801 1.00 25.36 N ATOM 2015 CA GLY A 144 6.227 26.328 85.901 1.00 27.21 C ATOM 2016 C GLY A 144 6.784 26.965 84.645 1.00 25.03 C ATOM 2017 O GLY A 144 7.787 27.674 84.713 1.00 24.76 O ATOM 2018 HA3 GLY A 144 6.785 25.414 86.102 1.00 0.00 H ATOM 2019 HA2 GLY A 144 6.360 27.023 86.730 1.00 0.00 H ATOM 2020 H GLY A 144 4.110 26.742 85.942 1.00 0.00 H ATOM 2021 N GLU A 145 6.129 26.733 83.506 1.00 23.07 N ATOM 2022 CA GLU A 145 6.601 27.242 82.218 1.00 24.47 C ATOM 2023 C GLU A 145 6.278 28.711 81.968 1.00 23.04 C ATOM 2024 O GLU A 145 5.313 29.258 82.505 1.00 22.79 O ATOM 2025 CB GLU A 145 6.042 26.409 81.056 1.00 24.19 C ATOM 2026 CG GLU A 145 6.530 24.973 81.009 1.00 27.80 C ATOM 2027 CD GLU A 145 6.091 24.253 79.739 1.00 36.72 C ATOM 2028 OE1 GLU A 145 4.964 24.514 79.254 1.00 29.70 O ATOM 2029 OE2 GLU A 145 6.877 23.428 79.227 1.00 36.27 O ATOM 2030 HA GLU A 145 7.686 27.154 82.267 1.00 0.00 H ATOM 2031 HB2 GLU A 145 4.955 26.395 81.140 1.00 0.00 H ATOM 2032 HB3 GLU A 145 6.327 26.895 80.123 1.00 0.00 H ATOM 2033 HG2 GLU A 145 7.619 24.971 81.055 1.00 0.00 H ATOM 2034 HG3 GLU A 145 6.131 24.439 81.871 1.00 0.00 H ATOM 2035 H GLU A 145 5.254 26.172 83.535 1.00 0.00 H ATOM 2036 N MET A 146 7.095 29.335 81.130 1.00 18.90 N ATOM 2037 CA MET A 146 6.922 30.732 80.780 1.00 20.23 C ATOM 2038 C MET A 146 6.767 30.874 79.275 1.00 19.94 C ATOM 2039 O MET A 146 7.374 30.123 78.499 1.00 20.25 O ATOM 2040 CB MET A 146 8.114 31.551 81.267 1.00 20.95 C ATOM 2041 CG MET A 146 7.978 33.051 81.069 1.00 21.82 C ATOM 2042 SD MET A 146 9.425 33.957 81.654 1.00 24.09 S ATOM 2043 CE MET A 146 10.595 33.607 80.336 1.00 24.67 C ATOM 2044 HA MET A 146 6.021 31.108 81.265 1.00 0.00 H ATOM 2045 HB2 MET A 146 8.245 31.359 82.332 1.00 0.00 H ATOM 2046 HB3 MET A 146 9.000 31.216 80.727 1.00 0.00 H ATOM 2047 HG2 MET A 146 7.102 33.399 81.617 1.00 0.00 H ATOM 2048 HG3 MET A 146 7.844 33.253 80.006 1.00 0.00 H ATOM 2049 HE1 MET A 146 10.751 32.530 80.267 1.00 0.00 H ATOM 2050 HE2 MET A 146 10.198 33.979 79.391 1.00 0.00 H ATOM 2051 HE3 MET A 146 11.543 34.100 80.553 1.00 0.00 H ATOM 2052 H MET A 146 7.885 28.805 80.710 1.00 0.00 H ATOM 2053 N SER A 147 5.964 31.848 78.864 1.00 17.71 N ATOM 2054 CA SER A 147 5.740 32.108 77.444 1.00 19.00 C ATOM 2055 C SER A 147 6.825 33.003 76.871 1.00 18.11 C ATOM 2056 O SER A 147 7.649 33.544 77.609 1.00 18.58 O ATOM 2057 CB SER A 147 4.399 32.817 77.262 1.00 19.16 C ATOM 2058 OG SER A 147 4.499 34.178 77.674 1.00 18.88 O ATOM 2059 HA SER A 147 5.751 31.150 76.924 1.00 0.00 H ATOM 2060 HB2 SER A 147 3.641 32.314 77.863 1.00 0.00 H ATOM 2061 HB3 SER A 147 4.112 32.779 76.211 1.00 0.00 H ATOM 2062 HG SER A 147 5.185 34.637 77.128 1.00 0.00 H ATOM 2063 H SER A 147 5.483 32.440 79.570 1.00 0.00 H ATOM 2064 N GLY A 148 6.822 33.158 75.546 1.00 18.54 N ATOM 2065 CA GLY A 148 7.508 34.267 74.913 1.00 21.86 C ATOM 2066 C GLY A 148 6.559 35.454 74.839 1.00 20.58 C ATOM 2067 O GLY A 148 5.543 35.485 75.542 1.00 21.41 O ATOM 2068 HA3 GLY A 148 7.817 33.981 73.907 1.00 0.00 H ATOM 2069 HA2 GLY A 148 8.387 34.536 75.499 1.00 0.00 H ATOM 2070 H GLY A 148 6.316 32.468 74.954 1.00 0.00 H ATOM 2071 N PRO A 149 6.879 36.448 74.001 1.00 23.48 N ATOM 2072 CA PRO A 149 5.963 37.582 73.849 1.00 21.73 C ATOM 2073 C PRO A 149 4.610 37.115 73.337 1.00 22.00 C ATOM 2074 O PRO A 149 4.540 36.440 72.304 1.00 24.59 O ATOM 2075 CB PRO A 149 6.650 38.457 72.792 1.00 24.31 C ATOM 2076 CG PRO A 149 8.093 38.034 72.811 1.00 27.22 C ATOM 2077 CD PRO A 149 8.066 36.571 73.138 1.00 25.07 C ATOM 2078 HA PRO A 149 5.777 38.102 74.788 1.00 0.00 H ATOM 2079 HD3 PRO A 149 7.959 35.969 72.236 1.00 0.00 H ATOM 2080 HD2 PRO A 149 8.970 36.271 73.668 1.00 0.00 H ATOM 2081 HG3 PRO A 149 8.644 38.587 73.572 1.00 0.00 H ATOM 2082 HG2 PRO A 149 8.554 38.201 71.837 1.00 0.00 H ATOM 2083 HB2 PRO A 149 6.213 38.284 71.809 1.00 0.00 H ATOM 2084 HB3 PRO A 149 6.557 39.512 73.049 1.00 0.00 H ATOM 2085 N VAL A 150 3.551 37.471 74.057 1.00 19.62 N ATOM 2086 CA VAL A 150 2.184 37.138 73.663 1.00 20.55 C ATOM 2087 C VAL A 150 1.403 38.429 73.421 1.00 24.11 C ATOM 2088 O VAL A 150 1.345 39.302 74.284 1.00 22.36 O ATOM 2089 CB VAL A 150 1.481 36.267 74.708 1.00 23.65 C ATOM 2090 CG1 VAL A 150 -0.002 36.144 74.395 1.00 22.77 C ATOM 2091 CG2 VAL A 150 2.131 34.888 74.773 1.00 25.57 C ATOM 2092 HA VAL A 150 2.224 36.554 72.743 1.00 0.00 H ATOM 2093 HB VAL A 150 1.585 36.746 75.682 1.00 0.00 H ATOM 2094 HG11 VAL A 150 -0.456 37.135 74.398 1.00 0.00 H ATOM 2095 HG12 VAL A 150 -0.128 35.688 73.413 1.00 0.00 H ATOM 2096 HG13 VAL A 150 -0.481 35.521 75.150 1.00 0.00 H ATOM 2097 HG21 VAL A 150 2.055 34.406 73.798 1.00 0.00 H ATOM 2098 HG22 VAL A 150 3.181 34.995 75.046 1.00 0.00 H ATOM 2099 HG23 VAL A 150 1.620 34.282 75.520 1.00 0.00 H ATOM 2100 H VAL A 150 3.701 38.008 74.935 1.00 0.00 H ATOM 2101 N PHE A 151 0.812 38.548 72.233 1.00 19.75 N ATOM 2102 CA PHE A 151 0.177 39.791 71.803 1.00 23.40 C ATOM 2103 C PHE A 151 -1.332 39.796 72.041 1.00 24.34 C ATOM 2104 O PHE A 151 -2.038 38.863 71.651 1.00 25.46 O ATOM 2105 CB PHE A 151 0.460 40.036 70.313 1.00 21.92 C ATOM 2106 CG PHE A 151 1.913 40.207 69.994 1.00 19.06 C ATOM 2107 CD1 PHE A 151 2.726 39.102 69.826 1.00 21.79 C ATOM 2108 CD2 PHE A 151 2.467 41.463 69.871 1.00 25.21 C ATOM 2109 CE1 PHE A 151 4.068 39.245 69.531 1.00 23.13 C ATOM 2110 CE2 PHE A 151 3.812 41.615 69.581 1.00 25.79 C ATOM 2111 CZ PHE A 151 4.609 40.505 69.411 1.00 24.18 C ATOM 2112 HA PHE A 151 0.606 40.591 72.407 1.00 0.00 H ATOM 2113 HB2 PHE A 151 0.081 39.185 69.747 1.00 0.00 H ATOM 2114 HB3 PHE A 151 -0.068 40.939 70.007 1.00 0.00 H ATOM 2115 HD2 PHE A 151 1.840 42.345 70.003 1.00 0.00 H ATOM 2116 HE2 PHE A 151 4.240 42.613 69.487 1.00 0.00 H ATOM 2117 HZ PHE A 151 5.668 40.624 69.182 1.00 0.00 H ATOM 2118 HE1 PHE A 151 4.695 38.364 69.394 1.00 0.00 H ATOM 2119 HD1 PHE A 151 2.302 38.103 69.928 1.00 0.00 H ATOM 2120 H PHE A 151 0.802 37.730 71.591 1.00 0.00 H ATOM 2121 N THR A 152 -1.814 40.855 72.680 1.00 23.80 N ATOM 2122 CA THR A 152 -3.247 41.068 72.859 1.00 25.48 C ATOM 2123 C THR A 152 -3.560 42.535 72.596 1.00 26.06 C ATOM 2124 O THR A 152 -2.654 43.355 72.443 1.00 27.08 O ATOM 2125 CB THR A 152 -3.702 40.769 74.318 1.00 27.55 C ATOM 2126 OG1 THR A 152 -3.168 41.772 75.187 1.00 25.25 O ATOM 2127 CG2 THR A 152 -3.259 39.380 74.782 1.00 24.76 C ATOM 2128 HA THR A 152 -3.765 40.399 72.172 1.00 0.00 H ATOM 2129 HB THR A 152 -4.791 40.786 74.348 1.00 0.00 H ATOM 2130 HG1 THR A 152 -3.454 41.588 76.117 1.00 0.00 H ATOM 2131 HG23 THR A 152 -3.672 38.626 74.112 1.00 0.00 H ATOM 2132 HG21 THR A 152 -2.171 39.324 74.768 1.00 0.00 H ATOM 2133 HG22 THR A 152 -3.620 39.205 75.795 1.00 0.00 H ATOM 2134 H THR A 152 -1.149 41.556 73.066 1.00 0.00 H ATOM 2135 N ASP A 153 -4.844 42.878 72.574 1.00 29.20 N ATOM 2136 CA ASP A 153 -5.231 44.288 72.507 1.00 31.47 C ATOM 2137 C ASP A 153 -4.698 45.149 73.649 1.00 33.44 C ATOM 2138 O ASP A 153 -4.565 46.366 73.500 1.00 34.46 O ATOM 2139 CB ASP A 153 -6.746 44.437 72.409 1.00 32.92 C ATOM 2140 CG ASP A 153 -7.224 44.472 70.974 1.00 44.55 C ATOM 2141 OD1 ASP A 153 -7.469 45.587 70.464 1.00 49.06 O ATOM 2142 OD2 ASP A 153 -7.325 43.392 70.352 1.00 47.07 O ATOM 2143 HA ASP A 153 -4.759 44.663 71.599 1.00 0.00 H ATOM 2144 HB2 ASP A 153 -7.216 43.594 72.916 1.00 0.00 H ATOM 2145 HB3 ASP A 153 -7.041 45.364 72.900 1.00 0.00 H ATOM 2146 H ASP A 153 -5.577 42.141 72.605 1.00 0.00 H ATOM 2147 N SER A 154 -4.402 44.534 74.793 1.00 31.00 N ATOM 2148 CA SER A 154 -3.882 45.291 75.926 1.00 30.03 C ATOM 2149 C SER A 154 -2.433 45.713 75.732 1.00 27.28 C ATOM 2150 O SER A 154 -2.024 46.772 76.211 1.00 25.54 O ATOM 2151 CB SER A 154 -4.006 44.490 77.220 1.00 28.78 C ATOM 2152 OG SER A 154 -5.367 44.328 77.573 1.00 36.99 O ATOM 2153 HA SER A 154 -4.488 46.194 75.993 1.00 0.00 H ATOM 2154 HB2 SER A 154 -3.488 45.018 78.020 1.00 0.00 H ATOM 2155 HB3 SER A 154 -3.552 43.509 77.080 1.00 0.00 H ATOM 2156 HG SER A 154 -5.781 45.218 77.704 1.00 0.00 H ATOM 2157 H SER A 154 -4.543 43.507 74.879 1.00 0.00 H ATOM 2158 N GLY A 155 -1.665 44.879 75.034 1.00 25.77 N ATOM 2159 CA GLY A 155 -0.246 45.115 74.837 1.00 24.72 C ATOM 2160 C GLY A 155 0.493 43.809 74.602 1.00 24.11 C ATOM 2161 O GLY A 155 -0.059 42.871 74.029 1.00 26.00 O ATOM 2162 HA3 GLY A 155 0.162 45.602 75.723 1.00 0.00 H ATOM 2163 HA2 GLY A 155 -0.109 45.764 73.972 1.00 0.00 H ATOM 2164 H GLY A 155 -2.096 44.030 74.616 1.00 0.00 H ATOM 2165 N ILE A 156 1.746 43.746 75.045 1.00 23.35 N ATOM 2166 CA ILE A 156 2.558 42.537 74.889 1.00 18.66 C ATOM 2167 C ILE A 156 2.851 41.939 76.267 1.00 18.68 C ATOM 2168 O ILE A 156 3.298 42.648 77.169 1.00 20.10 O ATOM 2169 CB ILE A 156 3.874 42.825 74.148 1.00 19.53 C ATOM 2170 CG1 ILE A 156 3.606 43.610 72.856 1.00 24.13 C ATOM 2171 CG2 ILE A 156 4.605 41.522 73.806 1.00 21.24 C ATOM 2172 CD1 ILE A 156 4.870 44.047 72.136 1.00 25.14 C ATOM 2173 HA ILE A 156 1.993 41.825 74.288 1.00 0.00 H ATOM 2174 HB ILE A 156 4.502 43.422 74.809 1.00 0.00 H ATOM 2175 HG12 ILE A 156 3.027 42.978 72.183 1.00 0.00 H ATOM 2176 HG13 ILE A 156 3.027 44.499 73.106 1.00 0.00 H ATOM 2177 HD11 ILE A 156 5.457 44.690 72.792 1.00 0.00 H ATOM 2178 HD12 ILE A 156 5.456 43.168 71.868 1.00 0.00 H ATOM 2179 HD13 ILE A 156 4.601 44.596 71.233 1.00 0.00 H ATOM 2180 HG21 ILE A 156 4.831 40.981 74.725 1.00 0.00 H ATOM 2181 HG22 ILE A 156 3.970 40.907 73.168 1.00 0.00 H ATOM 2182 HG23 ILE A 156 5.532 41.754 73.282 1.00 0.00 H ATOM 2183 H ILE A 156 2.160 44.577 75.514 1.00 0.00 H ATOM 2184 N HIS A 157 2.599 40.642 76.418 1.00 18.43 N ATOM 2185 CA HIS A 157 2.728 39.968 77.713 1.00 19.83 C ATOM 2186 C HIS A 157 3.873 38.954 77.745 1.00 20.04 C ATOM 2187 O HIS A 157 4.193 38.329 76.736 1.00 21.62 O ATOM 2188 CB HIS A 157 1.461 39.176 78.044 1.00 19.19 C ATOM 2189 CG HIS A 157 0.200 39.984 78.059 1.00 22.99 C ATOM 2190 ND1 HIS A 157 -0.446 40.389 76.907 1.00 26.34 N ATOM 2191 CD2 HIS A 157 -0.576 40.402 79.088 1.00 19.21 C ATOM 2192 CE1 HIS A 157 -1.545 41.048 77.228 1.00 21.24 C ATOM 2193 NE2 HIS A 157 -1.649 41.067 78.545 1.00 29.75 N ATOM 2194 HA HIS A 157 2.914 40.767 78.430 1.00 0.00 H ATOM 2195 HB2 HIS A 157 1.350 38.387 77.300 1.00 0.00 H ATOM 2196 HB3 HIS A 157 1.589 38.728 79.030 1.00 0.00 H ATOM 2197 HD2 HIS A 157 -0.385 40.241 80.149 1.00 0.00 H ATOM 2198 HE1 HIS A 157 -2.246 41.499 76.526 1.00 0.00 H ATOM 2199 H HIS A 157 2.301 40.088 75.590 1.00 0.00 H ATOM 2200 N ILE A 158 4.472 38.790 78.921 1.00 16.92 N ATOM 2201 CA ILE A 158 5.192 37.571 79.254 1.00 18.46 C ATOM 2202 C ILE A 158 4.340 36.868 80.301 1.00 22.40 C ATOM 2203 O ILE A 158 3.950 37.478 81.299 1.00 19.78 O ATOM 2204 CB ILE A 158 6.579 37.866 79.865 1.00 20.73 C ATOM 2205 CG1 ILE A 158 7.429 38.691 78.902 1.00 24.58 C ATOM 2206 CG2 ILE A 158 7.293 36.563 80.204 1.00 23.60 C ATOM 2207 CD1 ILE A 158 8.630 39.330 79.561 1.00 19.35 C ATOM 2208 HA ILE A 158 5.356 36.975 78.356 1.00 0.00 H ATOM 2209 HB ILE A 158 6.435 38.441 80.780 1.00 0.00 H ATOM 2210 HG12 ILE A 158 7.779 38.038 78.103 1.00 0.00 H ATOM 2211 HG13 ILE A 158 6.806 39.479 78.479 1.00 0.00 H ATOM 2212 HD11 ILE A 158 8.295 39.995 80.357 1.00 0.00 H ATOM 2213 HD12 ILE A 158 9.269 38.553 79.980 1.00 0.00 H ATOM 2214 HD13 ILE A 158 9.189 39.901 78.819 1.00 0.00 H ATOM 2215 HG21 ILE A 158 6.698 36.001 80.924 1.00 0.00 H ATOM 2216 HG22 ILE A 158 7.421 35.973 79.296 1.00 0.00 H ATOM 2217 HG23 ILE A 158 8.269 36.786 80.634 1.00 0.00 H ATOM 2218 H ILE A 158 4.424 39.556 79.623 1.00 0.00 H ATOM 2219 N ILE A 159 4.042 35.596 80.086 1.00 17.99 N ATOM 2220 CA ILE A 159 3.134 34.877 80.977 1.00 20.71 C ATOM 2221 C ILE A 159 3.851 33.740 81.689 1.00 20.13 C ATOM 2222 O ILE A 159 4.552 32.955 81.053 1.00 18.82 O ATOM 2223 CB ILE A 159 1.932 34.284 80.202 1.00 21.70 C ATOM 2224 CG1 ILE A 159 1.187 35.383 79.452 1.00 20.70 C ATOM 2225 CG2 ILE A 159 0.988 33.540 81.159 1.00 19.09 C ATOM 2226 CD1 ILE A 159 0.123 34.847 78.510 1.00 22.11 C ATOM 2227 HA ILE A 159 2.774 35.602 81.707 1.00 0.00 H ATOM 2228 HB ILE A 159 2.310 33.568 79.472 1.00 0.00 H ATOM 2229 HG12 ILE A 159 0.708 36.037 80.181 1.00 0.00 H ATOM 2230 HG13 ILE A 159 1.909 35.957 78.870 1.00 0.00 H ATOM 2231 HD11 ILE A 159 0.589 34.199 77.768 1.00 0.00 H ATOM 2232 HD12 ILE A 159 -0.612 34.279 79.080 1.00 0.00 H ATOM 2233 HD13 ILE A 159 -0.369 35.680 78.008 1.00 0.00 H ATOM 2234 HG21 ILE A 159 1.531 32.730 81.646 1.00 0.00 H ATOM 2235 HG22 ILE A 159 0.616 34.234 81.913 1.00 0.00 H ATOM 2236 HG23 ILE A 159 0.150 33.131 80.595 1.00 0.00 H ATOM 2237 H ILE A 159 4.460 35.102 79.272 1.00 0.00 H ATOM 2238 N LEU A 160 3.688 33.668 83.009 1.00 19.61 N ATOM 2239 CA LEU A 160 4.227 32.564 83.792 1.00 19.35 C ATOM 2240 C LEU A 160 3.091 31.767 84.430 1.00 21.39 C ATOM 2241 O LEU A 160 2.294 32.312 85.190 1.00 20.42 O ATOM 2242 CB LEU A 160 5.167 33.096 84.881 1.00 17.17 C ATOM 2243 CG LEU A 160 5.754 32.067 85.864 1.00 23.21 C ATOM 2244 CD1 LEU A 160 6.759 31.140 85.167 1.00 23.87 C ATOM 2245 CD2 LEU A 160 6.402 32.765 87.055 1.00 27.58 C ATOM 2246 HA LEU A 160 4.790 31.908 83.128 1.00 0.00 H ATOM 2247 HB2 LEU A 160 6.002 33.588 84.383 1.00 0.00 H ATOM 2248 HB3 LEU A 160 4.611 33.829 85.466 1.00 0.00 H ATOM 2249 HG LEU A 160 4.932 31.452 86.231 1.00 0.00 H ATOM 2250 HD21 LEU A 160 7.205 33.413 86.702 1.00 0.00 H ATOM 2251 HD22 LEU A 160 5.654 33.362 87.576 1.00 0.00 H ATOM 2252 HD23 LEU A 160 6.809 32.017 87.735 1.00 0.00 H ATOM 2253 HD11 LEU A 160 6.258 30.604 84.361 1.00 0.00 H ATOM 2254 HD12 LEU A 160 7.576 31.734 84.757 1.00 0.00 H ATOM 2255 HD13 LEU A 160 7.154 30.426 85.889 1.00 0.00 H ATOM 2256 H LEU A 160 3.161 34.422 83.495 1.00 0.00 H ATOM 2257 N ARG A 161 3.003 30.481 84.117 1.00 21.07 N ATOM 2258 CA ARG A 161 1.985 29.647 84.742 1.00 24.15 C ATOM 2259 C ARG A 161 2.470 29.105 86.085 1.00 22.78 C ATOM 2260 O ARG A 161 3.506 28.446 86.164 1.00 24.52 O ATOM 2261 CB ARG A 161 1.534 28.506 83.828 1.00 24.00 C ATOM 2262 CG ARG A 161 0.460 27.665 84.504 1.00 28.02 C ATOM 2263 CD ARG A 161 -0.088 26.542 83.636 1.00 29.24 C ATOM 2264 NE ARG A 161 -0.904 25.646 84.449 1.00 28.33 N ATOM 2265 CZ ARG A 161 -1.336 24.452 84.054 1.00 34.49 C ATOM 2266 NH1 ARG A 161 -1.035 24.000 82.844 1.00 36.54 N ATOM 2267 NH2 ARG A 161 -2.071 23.707 84.870 1.00 38.15 N ATOM 2268 HA ARG A 161 1.117 30.282 84.919 1.00 0.00 H ATOM 2269 HB2 ARG A 161 1.133 28.924 82.905 1.00 0.00 H ATOM 2270 HB3 ARG A 161 2.391 27.873 83.596 1.00 0.00 H ATOM 2271 HG2 ARG A 161 0.887 27.224 85.405 1.00 0.00 H ATOM 2272 HG3 ARG A 161 -0.367 28.321 84.778 1.00 0.00 H ATOM 2273 HD2 ARG A 161 0.740 25.983 83.200 1.00 0.00 H ATOM 2274 HD3 ARG A 161 -0.699 26.965 82.838 1.00 0.00 H ATOM 2275 HE ARG A 161 -1.166 25.963 85.404 1.00 0.00 H ATOM 2276 HH12 ARG A 161 -1.375 23.066 82.539 1.00 0.00 H ATOM 2277 HH11 ARG A 161 -0.459 24.580 82.201 1.00 0.00 H ATOM 2278 HH22 ARG A 161 -2.408 22.773 84.560 1.00 0.00 H ATOM 2279 HH21 ARG A 161 -2.310 24.057 85.820 1.00 0.00 H ATOM 2280 H ARG A 161 3.661 30.068 83.425 1.00 0.00 H ATOM 2281 N THR A 162 1.719 29.393 87.142 1.00 22.75 N ATOM 2282 CA THR A 162 2.145 29.034 88.493 1.00 25.27 C ATOM 2283 C THR A 162 1.362 27.854 89.080 1.00 28.09 C ATOM 2284 O THR A 162 1.847 27.164 89.979 1.00 29.13 O ATOM 2285 CB THR A 162 2.071 30.247 89.442 1.00 24.83 C ATOM 2286 OG1 THR A 162 0.758 30.816 89.400 1.00 26.93 O ATOM 2287 CG2 THR A 162 3.083 31.301 89.031 1.00 24.47 C ATOM 2288 HA THR A 162 3.183 28.713 88.403 1.00 0.00 H ATOM 2289 HB THR A 162 2.295 29.910 90.454 1.00 0.00 H ATOM 2290 HG1 THR A 162 0.717 31.594 90.011 1.00 0.00 H ATOM 2291 HG23 THR A 162 4.085 30.872 89.061 1.00 0.00 H ATOM 2292 HG21 THR A 162 2.862 31.640 88.019 1.00 0.00 H ATOM 2293 HG22 THR A 162 3.026 32.145 89.719 1.00 0.00 H ATOM 2294 H THR A 162 0.812 29.883 87.006 1.00 0.00 H ATOM 2295 N GLU A 163 0.154 27.632 88.571 1.00 29.26 N ATOM 2296 CA GLU A 163 -0.672 26.498 88.981 1.00 32.10 C ATOM 2297 C GLU A 163 -1.534 26.005 87.822 1.00 33.91 C ATOM 2298 O GLU A 163 -1.835 26.749 86.883 1.00 31.30 O ATOM 2299 CB GLU A 163 -1.590 26.875 90.148 1.00 31.21 C ATOM 2300 CG GLU A 163 -0.894 27.189 91.461 1.00 35.16 C ATOM 2301 CD GLU A 163 -1.875 27.669 92.521 1.00 38.68 C ATOM 2302 OE1 GLU A 163 -3.096 27.463 92.336 1.00 45.42 O ATOM 2303 OE2 GLU A 163 -1.432 28.255 93.531 1.00 39.25 O ATOM 2304 HA GLU A 163 0.007 25.706 89.296 1.00 0.00 H ATOM 2305 OXT GLU A 163 -1.971 24.851 87.811 1.00 35.26 O ATOM 2306 HB2 GLU A 163 -2.162 27.755 89.853 1.00 0.00 H ATOM 2307 HB3 GLU A 163 -2.271 26.042 90.321 1.00 0.00 H ATOM 2308 HG2 GLU A 163 -0.398 26.288 91.822 1.00 0.00 H ATOM 2309 HG3 GLU A 163 -0.151 27.968 91.289 1.00 0.00 H ATOM 2310 H GLU A 163 -0.217 28.289 87.855 1.00 0.00 H TER 2311 GLU A 163 HETATM 2312 O HOH 1 5.154 26.777 75.796 1.00 27.57 O HETATM 2313 O HOH 2 -4.396 48.419 77.093 1.00 33.46 O HETATM 2314 O HOH 3 1.781 42.461 86.055 1.00 22.91 O HETATM 2315 O HOH 4 15.116 31.171 71.538 1.00 29.96 O HETATM 2316 O HOH 5 14.783 33.609 86.346 1.00 22.68 O HETATM 2317 O HOH 6 -4.352 47.091 84.992 1.00 38.97 O HETATM 2318 O HOH 7 4.502 47.350 91.623 1.00 24.14 O HETATM 2319 O HOH 8 16.719 26.310 76.175 1.00 24.26 O HETATM 2320 O HOH 9 5.271 52.361 81.101 1.00 32.69 O HETATM 2321 O HOH 10 20.566 23.030 75.842 1.00 30.31 O HETATM 2322 O HOH 11 4.867 45.875 94.077 1.00 25.20 O HETATM 2323 O HOH 12 6.066 55.051 76.722 1.00 37.80 O HETATM 2324 O HOH 13 6.218 48.618 80.873 1.00 30.69 O HETATM 2325 O HOH 14 8.321 28.557 87.575 1.00 31.00 O HETATM 2326 O HOH 15 7.018 27.589 77.835 1.00 26.50 O HETATM 2327 O HOH 16 9.706 51.853 66.735 1.00 38.83 O HETATM 2328 O HOH 17 9.331 27.734 80.305 1.00 29.02 O HETATM 2329 O HOH 18 0.707 33.508 89.876 1.00 26.81 O HETATM 2330 O HOH 19 -9.545 44.373 81.924 1.00 49.18 O HETATM 2331 O HOH 20 4.084 36.164 90.416 1.00 23.25 O HETATM 2332 O HOH 21 11.356 36.912 73.058 1.00 32.42 O HETATM 2333 O HOH 22 5.673 29.001 88.222 1.00 35.81 O HETATM 2334 O HOH 23 15.231 28.536 76.902 1.00 26.86 O HETATM 2335 O HOH 24 2.518 42.183 96.956 1.00 23.90 O HETATM 2336 O HOH 25 -9.928 32.811 79.879 1.00 36.78 O HETATM 2337 O HOH 26 8.951 48.695 80.339 1.00 30.91 O HETATM 2338 O HOH 27 4.917 43.080 94.024 1.00 28.58 O HETATM 2339 O HOH 28 -3.520 22.751 79.700 1.00 53.46 O HETATM 2340 O HOH 29 -4.371 26.480 74.554 1.00 27.74 O HETATM 2341 O HOH 30 16.849 29.768 81.082 1.00 23.99 O HETATM 2342 O HOH 31 -6.640 40.229 72.320 1.00 34.53 O HETATM 2343 O HOH 32 14.325 37.374 74.394 1.00 27.16 O HETATM 2344 O HOH 33 2.485 60.432 80.845 1.00 41.92 O HETATM 2345 O HOH 34 14.459 45.187 78.513 1.00 31.73 O HETATM 2346 O HOH 35 0.647 46.569 65.518 1.00 50.84 O HETATM 2347 O HOH 36 2.651 51.377 68.077 1.00 38.44 O HETATM 2348 O HOH 37 10.305 32.701 70.887 1.00 28.81 O HETATM 2349 O HOH 38 12.912 48.728 81.732 1.00 35.53 O HETATM 2350 O HOH 39 12.782 49.745 73.586 1.00 39.94 O HETATM 2351 O HOH 40 18.272 20.837 70.796 1.00 27.20 O HETATM 2352 O HOH 41 3.997 25.657 64.594 1.00 46.46 O HETATM 2353 O HOH 42 14.639 42.097 70.436 1.00 41.86 O HETATM 2354 O HOH 43 17.621 30.867 64.743 1.00 41.18 O HETATM 2355 O HOH 44 20.476 39.622 79.331 1.00 45.14 O HETATM 2356 O HOH 45 8.977 25.544 78.419 1.00 30.68 O HETATM 2357 O HOH 46 -2.922 49.117 83.282 1.00 37.08 O HETATM 2358 O HOH 47 10.385 51.212 80.547 1.00 41.12 O HETATM 2359 O HOH 48 8.356 16.832 74.562 1.00 50.16 O HETATM 2360 O HOH 49 15.904 16.639 70.642 1.00 42.93 O HETATM 2361 O HOH 50 -10.798 41.522 78.337 1.00 46.60 O HETATM 2362 O HOH 51 15.771 35.381 66.799 1.00 50.37 O HETATM 2363 O HOH 52 3.402 42.790 65.756 1.00 48.01 O HETATM 2364 O HOH 53 -1.756 49.241 90.350 1.00 46.55 O HETATM 2365 O HOH 54 0.938 21.134 84.199 1.00 40.75 O HETATM 2366 O HOH 55 7.225 22.509 84.378 1.00 37.87 O HETATM 2367 O HOH 56 -1.938 50.146 85.724 1.00 33.64 O HETATM 2368 O HOH 57 -2.705 57.831 76.956 1.00 47.76 O HETATM 2369 O HOH 58 20.697 19.091 66.761 1.00 40.11 O HETATM 2370 O HOH 59 21.469 41.652 84.068 1.00 48.51 O HETATM 2371 O HOH 60 18.473 42.342 78.718 1.00 48.43 O HETATM 2372 O HOH 61 4.950 50.656 73.311 1.00 42.60 O HETATM 2373 O HOH 62 2.070 22.618 66.419 1.00 45.37 O HETATM 2374 O HOH 63 -8.229 35.554 89.451 1.00 41.14 O HETATM 2375 O HOH 64 -3.622 31.661 70.146 1.00 35.68 O HETATM 2376 O HOH 65 -11.639 26.378 81.446 1.00 42.13 O HETATM 2377 O HOH 66 -0.733 61.158 80.267 1.00 47.24 O HETATM 2378 O HOH 67 -3.195 23.843 73.961 1.00 45.11 O HETATM 2379 O HOH 68 -5.019 26.934 71.402 1.00 43.70 O HETATM 2380 O HOH 69 15.815 39.488 90.690 1.00 39.71 O HETATM 2381 O HOH 70 24.324 29.391 67.096 1.00 47.15 O HETATM 2382 O HOH 71 10.246 38.460 69.411 1.00 38.80 O HETATM 2383 O HOH 72 -1.763 32.713 72.197 1.00 26.72 O HETATM 2384 O HOH 73 9.002 50.757 88.378 1.00 41.82 O HETATM 2385 O HOH 74 3.406 55.530 70.614 1.00 45.46 O HETATM 2386 O HOH 75 -8.717 28.108 71.757 1.00 44.45 O HETATM 2387 O HOH 76 1.339 22.570 75.474 1.00 33.49 O HETATM 2388 O HOH 77 -8.615 41.885 85.737 1.00 58.74 O HETATM 2389 O HOH 78 22.306 33.761 86.966 1.00 40.38 O HETATM 2390 O HOH 79 -14.195 35.540 84.745 1.00 56.89 O HETATM 2391 O HOH 80 23.653 27.428 69.552 1.00 38.05 O HETATM 2392 O HOH 81 12.189 30.067 80.759 1.00 35.74 O HETATM 2393 O HOH 82 2.737 59.914 83.656 1.00 47.63 O HETATM 2394 O HOH 83 22.630 31.981 59.085 1.00 39.75 O HETATM 2395 O HOH 84 22.291 28.739 58.322 1.00 42.62 O HETATM 2396 O HOH 85 -12.596 39.494 76.469 1.00 45.66 O HETATM 2397 O HOH 86 5.071 40.931 65.657 1.00 40.82 O HETATM 2398 P RZD A 87 -6.245 46.798 79.989 1.00 0.20 P HETATM 2399 O1P RZD A 87 -6.351 46.827 78.483 1.00 -0.55 O HETATM 2400 O2P RZD A 87 -5.618 48.043 80.572 1.00 -0.55 O HETATM 2401 O3P RZD A 87 -7.483 46.292 80.685 1.00 -0.55 O HETATM 2402 O4P RZD A 87 -5.158 45.640 80.290 1.00 -0.27 O HETATM 2403 C10 RZD A 87 -4.843 45.216 81.619 1.00 0.11 C HETATM 2404 C9 RZD A 87 -5.482 43.857 81.892 1.00 0.11 C HETATM 2405 N4 RZD A 87 -5.152 43.547 83.281 1.00 -0.28 N HETATM 2406 C11 RZD A 87 -6.071 43.582 84.246 1.00 0.17 C HETATM 2407 O2 RZD A 87 -5.810 43.318 85.415 1.00 -0.40 O HETATM 2408 C12 RZD A 87 -7.450 43.975 83.808 1.00 0.03 C HETATM 2409 H21 RZD A 87 -7.450 44.164 82.724 1.00 0.05 H HETATM 2410 H22 RZD A 87 -7.758 44.888 84.340 1.00 0.05 H HETATM 2411 H23 RZD A 87 -8.154 43.161 84.038 1.00 0.05 H HETATM 2412 H11 RZD A 87 -4.211 43.302 83.514 1.00 0.19 H HETATM 2413 C5 RZD A 87 -4.795 42.758 81.081 1.00 -0.00 C HETATM 2414 N1 RZD A 87 -5.485 41.486 81.332 1.00 0.26 N HETATM 2415 C1 RZD A 87 -5.997 40.908 80.076 1.00 0.07 C HETATM 2416 C4 RZD A 87 -5.227 39.624 79.795 1.00 0.01 C HETATM 2417 C3 RZD A 87 -4.325 39.385 80.997 1.00 -0.01 C HETATM 2418 C2 RZD A 87 -4.572 40.528 81.973 1.00 -0.03 C HETATM 2419 H3 RZD A 87 -5.027 40.139 82.895 1.00 0.08 H HETATM 2420 H4 RZD A 87 -3.620 41.024 82.215 1.00 0.08 H HETATM 2421 H6 RZD A 87 -4.573 38.424 81.470 1.00 0.03 H HETATM 2422 H7 RZD A 87 -3.271 39.378 80.683 1.00 0.03 H HETATM 2423 H9 RZD A 87 -4.622 39.736 78.883 1.00 0.03 H HETATM 2424 H10 RZD A 87 -5.925 38.783 79.671 1.00 0.03 H HETATM 2425 C6 RZD A 87 -7.438 40.539 80.230 1.00 0.22 C HETATM 2426 O1 RZD A 87 -7.959 39.782 79.424 1.00 -0.39 O HETATM 2427 N2 RZD A 87 -8.082 41.068 81.265 1.00 -0.28 N HETATM 2428 C7 RZD A 87 -9.477 40.848 81.632 1.00 0.04 C HETATM 2429 C8 RZD A 87 -9.473 40.997 83.152 1.00 -0.02 C HETATM 2430 C21 RZD A 87 -10.050 39.771 83.823 1.00 -0.04 C HETATM 2431 C22 RZD A 87 -11.247 39.134 83.547 1.00 0.02 C HETATM 2432 N3 RZD A 87 -11.379 38.053 84.386 1.00 -0.29 N HETATM 2433 C23 RZD A 87 -10.290 37.969 85.196 1.00 0.06 C HETATM 2434 C24 RZD A 87 -9.416 38.998 84.908 1.00 -0.02 C HETATM 2435 C25 RZD A 87 -8.201 39.176 85.578 1.00 -0.07 C HETATM 2436 C26 RZD A 87 -7.911 38.230 86.582 1.00 -0.08 C HETATM 2437 C27 RZD A 87 -8.802 37.186 86.871 1.00 -0.08 C HETATM 2438 C28 RZD A 87 -10.008 37.037 86.183 1.00 -0.04 C HETATM 2439 H28 RZD A 87 -10.693 36.228 86.410 1.00 0.05 H HETATM 2440 H27 RZD A 87 -8.548 36.476 87.649 1.00 0.05 H HETATM 2441 H26 RZD A 87 -6.985 38.311 87.139 1.00 0.05 H HETATM 2442 H25 RZD A 87 -7.525 39.990 85.340 1.00 0.05 H HETATM 2443 H8 RZD A 87 -12.180 37.406 84.399 1.00 0.22 H HETATM 2444 H24 RZD A 87 -11.967 39.439 82.789 1.00 0.08 H HETATM 2445 H16 RZD A 87 -10.076 41.874 83.428 1.00 0.04 H HETATM 2446 H17 RZD A 87 -8.438 41.141 83.496 1.00 0.04 H HETATM 2447 H14 RZD A 87 -9.807 39.841 81.337 1.00 0.05 H HETATM 2448 H15 RZD A 87 -10.130 41.600 81.165 1.00 0.05 H HETATM 2449 H5 RZD A 87 -7.556 41.681 81.854 1.00 0.19 H HETATM 2450 H1 RZD A 87 -5.872 41.625 79.251 1.00 0.11 H HETATM 2451 H2 RZD A 87 -6.263 41.659 81.950 1.00 0.21 H HETATM 2452 H12 RZD A 87 -4.846 43.002 80.010 1.00 0.08 H HETATM 2453 H13 RZD A 87 -3.742 42.675 81.388 1.00 0.08 H HETATM 2454 H18 RZD A 87 -6.566 43.879 81.707 1.00 0.06 H HETATM 2455 H19 RZD A 87 -3.751 45.135 81.728 1.00 0.06 H HETATM 2456 H20 RZD A 87 -5.229 45.953 82.339 1.00 0.06 H CONECT 1 2 22 23 24 CONECT 22 1 CONECT 23 1 CONECT 24 1 CONECT 537 538 543 544 545 CONECT 543 537 CONECT 544 537 CONECT 545 537 CONECT 2398 2399 2400 2401 2402 CONECT 2399 2398 CONECT 2400 2398 CONECT 2401 2398 CONECT 2402 2398 2403 CONECT 2403 2402 2404 2455 2456 CONECT 2404 2403 2405 2413 2454 CONECT 2405 2404 2406 2412 CONECT 2406 2405 2407 2408 CONECT 2407 2406 CONECT 2408 2406 2409 2410 2411 CONECT 2409 2408 CONECT 2410 2408 CONECT 2411 2408 CONECT 2412 2405 CONECT 2413 2404 2414 2452 2453 CONECT 2414 2413 2415 2418 2451 CONECT 2415 2414 2416 2425 2450 CONECT 2416 2415 2417 2423 2424 CONECT 2417 2416 2418 2421 2422 CONECT 2418 2414 2417 2419 2420 CONECT 2419 2418 CONECT 2420 2418 CONECT 2421 2417 CONECT 2422 2417 CONECT 2423 2416 CONECT 2424 2416 CONECT 2425 2415 2426 2427 CONECT 2426 2425 CONECT 2427 2425 2428 2449 CONECT 2428 2427 2429 2447 2448 CONECT 2429 2428 2430 2445 2446 CONECT 2430 2429 2431 2434 CONECT 2431 2430 2432 2444 CONECT 2432 2431 2433 2443 CONECT 2433 2432 2434 2438 CONECT 2434 2430 2433 2435 CONECT 2435 2434 2436 2442 CONECT 2436 2435 2437 2441 CONECT 2437 2436 2438 2440 CONECT 2438 2433 2437 2439 CONECT 2439 2438 CONECT 2440 2437 CONECT 2441 2436 CONECT 2442 2435 CONECT 2443 2432 CONECT 2444 2431 CONECT 2445 2429 CONECT 2446 2429 CONECT 2447 2428 CONECT 2448 2428 CONECT 2449 2427 CONECT 2450 2415 CONECT 2451 2414 CONECT 2452 2413 CONECT 2453 2413 CONECT 2454 2404 CONECT 2455 2403 CONECT 2456 2403 MASTER 0 0 0 0 0 0 0 0 2454 2 67 12 END
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Related entries of code: 3ntp
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167aa, >1F8A_1|Chain... *
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RCSB PDB
PDBbind
167aa, >2XP7_1|Chain... at 99%
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167aa, >2XPA_1|Chain... at 99%
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RCSB PDB
PDBbind
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RCSB PDB
PDBbind
123aa, >3IKG_1|Chains... at 95%
3jyj
RCSB PDB
PDBbind
123aa, >3JYJ_1|Chains... at 95%
3kab
RCSB PDB
PDBbind
167aa, >3KAB_1|Chain... at 99%
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RCSB PDB
PDBbind
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3kad
RCSB PDB
PDBbind
167aa, >3KAD_1|Chain... at 98%
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RCSB PDB
PDBbind
167aa, >3KAF_1|Chain... at 98%
3kag
RCSB PDB
PDBbind
167aa, >3KAG_1|Chain... at 99%
3kah
RCSB PDB
PDBbind
167aa, >3KAH_1|Chain... at 99%
3kai
RCSB PDB
PDBbind
167aa, >3KAI_1|Chain... at 99%
3kce
RCSB PDB
PDBbind
167aa, >3KCE_1|Chain... at 99%
3odk
RCSB PDB
PDBbind
167aa, >3ODK_1|Chain... at 99%
3oob
RCSB PDB
PDBbind
163aa, >3OOB_1|Chain... at 99%
3tc5
RCSB PDB
PDBbind
166aa, >3TC5_1|Chain... at 97%
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
3ntp
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
Peptidyl-prolyl cis-trans isomerase NIMA-interacting 1
Ligand Name
RZD
EC.Number
E.C.5.2.1.8
Resolution
1.76(Å)
Affinity (Kd/Ki/IC50)
IC50=12uM
Release Year
2012
Protein/NA Sequence
Check fasta file
Primary Reference
(2011) Biochemistry Vol. 50: pp. 9545-9550
Ligand Properties
Formula
C
2
0
H
3
1
N
4
O
6
P
Molecular Weight
454.457
Exact Mass
454.198
No. of atoms
62
No. of bonds
64
Polar Surface Area
161.94
LOGP Value
-2.63 (
Computed with XLOGP3
)
1.40 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 4
No. of Hydrogen Bond Acceptors: 5
No. of Rotatable Bonds: 11
No. of Nitrogen and Oxygen Atoms: 10
No. of Rings: 3
Canonical SMILES
CC(=O)N[C@H](C[N@@H+]1CCC[C@H]1C(=O)NCCc1c[nH]c2c1cccc2)COP(O)(O)O
InChI String
InChI=1S/C20H31N4O6P/c1-14(25)23-16(13-30-31(27,28)29)12-24-10-4-7-19(24)20(26)21-9-8-15-11-22-18-6-3-2-5-17(15)18/h2-3,5-6,11,16,19,22,27-29,31H,4,7-10,12-13H2,1H3,(H,21,26)(H,23,25)/p+1/t16-,19+/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):
Q13526
Entrez Gene ID
NCBI Entrez Gene ID:
5300
ASD
Information of known allosteric effects of PDB entries
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